data_18053
save_entry_information
_Entry.Sf_category entry_information
_Entry.NMR_STAR_version 3.0.9.13
_Entry.Entry_ID 18053
_Entry.PDB_ID 2LLL
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 18053
_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 20 20 ALA N N 450 125.180 125.180 125.528 -0.348 18053
2 1 1 . 1 1 20 20 ALA HA H 450 4.706 4.706 4.496 0.210 18053
3 1 1 . 1 1 20 20 ALA C C 450 177.226 177.226 176.971 0.255 18053
4 1 1 . 1 1 20 20 ALA CA C 450 52.757 52.757 51.849 0.908 18053
5 1 1 . 1 1 20 20 ALA CB C 450 20.411 20.411 18.302 2.109 18053
6 1 1 . 1 1 20 20 ALA H H 450 8.484 8.484 8.814 -0.330 18053
7 1 1 . 1 1 21 21 SER N N 451 115.714 115.714 119.888 -4.174 18053
8 1 1 . 1 1 21 21 SER HA H 451 4.513 4.513 4.346 0.167 18053
9 1 1 . 1 1 21 21 SER C C 451 174.742 174.742 174.999 -0.257 18053
10 1 1 . 1 1 21 21 SER CA C 451 58.516 58.516 58.824 -0.308 18053
11 1 1 . 1 1 21 21 SER CB C 451 64.159 64.159 62.029 2.130 18053
12 1 1 . 1 1 21 21 SER H H 451 8.487 8.487 8.116 0.371 18053
13 1 1 . 1 1 22 22 GLY N N 452 111.509 111.509 115.765 -4.256 18053
14 1 1 . 1 1 22 22 GLY C C 452 174.401 174.401 174.978 -0.577 18053
15 1 1 . 1 1 22 22 GLY CA C 452 45.059 45.059 45.398 -0.339 18053
16 1 1 . 1 1 22 22 GLY H H 452 8.198 8.198 8.410 -0.212 18053
17 1 1 . 1 1 23 23 SER N N 453 116.191 116.191 115.166 1.025 18053
18 1 1 . 1 1 23 23 SER HA H 453 4.364 4.364 4.293 0.071 18053
19 1 1 . 1 1 23 23 SER C C 453 173.432 173.432 174.709 -1.277 18053
20 1 1 . 1 1 23 23 SER CA C 453 59.744 59.744 60.382 -0.638 18053
21 1 1 . 1 1 23 23 SER CB C 453 64.335 64.335 63.986 0.349 18053
22 1 1 . 1 1 23 23 SER H H 453 8.494 8.494 8.003 0.491 18053
23 1 1 . 1 1 24 24 VAL N N 454 121.656 121.656 120.379 1.277 18053
24 1 1 . 1 1 24 24 VAL HA H 454 5.035 5.035 4.450 0.585 18053
25 1 1 . 1 1 24 24 VAL C C 454 174.606 174.606 175.623 -1.017 18053
26 1 1 . 1 1 24 24 VAL CA C 454 61.055 61.055 62.786 -1.731 18053
27 1 1 . 1 1 24 24 VAL CB C 454 32.503 32.503 32.896 -0.393 18053
28 1 1 . 1 1 24 24 VAL H H 454 7.830 7.830 7.821 0.009 18053
29 1 1 . 1 1 25 25 SER N N 455 119.323 119.323 119.864 -0.541 18053
30 1 1 . 1 1 25 25 SER HA H 455 4.672 4.672 4.813 -0.141 18053
31 1 1 . 1 1 25 25 SER C C 455 174.426 174.426 173.389 1.037 18053
32 1 1 . 1 1 25 25 SER CA C 455 55.268 55.268 56.225 -0.957 18053
33 1 1 . 1 1 25 25 SER CB C 455 65.162 65.162 65.722 -0.560 18053
34 1 1 . 1 1 25 25 SER H H 455 9.065 9.065 8.862 0.203 18053
35 1 1 . 1 1 26 26 ILE N N 456 119.468 119.468 121.250 -1.782 18053
36 1 1 . 1 1 26 26 ILE HA H 456 4.180 4.180 4.199 -0.019 18053
37 1 1 . 1 1 26 26 ILE C C 456 175.506 175.506 176.342 -0.836 18053
38 1 1 . 1 1 26 26 ILE CA C 456 61.328 61.328 61.143 0.185 18053
39 1 1 . 1 1 26 26 ILE CB C 456 37.962 37.962 36.204 1.758 18053
40 1 1 . 1 1 26 26 ILE H H 456 8.295 8.295 8.537 -0.242 18053
41 1 1 . 1 1 27 27 GLU N N 457 129.726 129.726 130.095 -0.369 18053
42 1 1 . 1 1 27 27 GLU HA H 457 4.228 4.228 4.379 -0.151 18053
43 1 1 . 1 1 27 27 GLU C C 457 175.179 175.179 176.006 -0.827 18053
44 1 1 . 1 1 27 27 GLU CA C 457 55.432 55.432 56.878 -1.446 18053
45 1 1 . 1 1 27 27 GLU CB C 457 30.142 30.142 32.215 -2.074 18053
46 1 1 . 1 1 27 27 GLU H H 457 8.393 8.393 8.637 -0.244 18053
47 1 1 . 1 1 28 28 GLU N N 458 117.076 117.076 116.128 0.948 18053
48 1 1 . 1 1 28 28 GLU HA H 458 4.168 4.168 4.705 -0.537 18053
49 1 1 . 1 1 28 28 GLU C C 458 174.701 174.701 174.644 0.057 18053
50 1 1 . 1 1 28 28 GLU CA C 458 56.906 56.906 54.806 2.100 18053
51 1 1 . 1 1 28 28 GLU CB C 458 31.848 31.848 33.632 -1.784 18053
52 1 1 . 1 1 28 28 GLU H H 458 7.489 7.489 7.826 -0.337 18053
53 1 1 . 1 1 29 29 ILE N N 459 122.183 122.183 119.564 2.619 18053
54 1 1 . 1 1 29 29 ILE HA H 459 3.764 3.764 3.945 -0.181 18053
55 1 1 . 1 1 29 29 ILE C C 459 174.169 174.169 174.403 -0.234 18053
56 1 1 . 1 1 29 29 ILE CA C 459 59.526 59.526 59.456 0.070 18053
57 1 1 . 1 1 29 29 ILE CB C 459 40.309 40.309 41.669 -1.360 18053
58 1 1 . 1 1 29 29 ILE H H 459 8.126 8.126 8.256 -0.130 18053
59 1 1 . 1 1 30 30 ASP N N 460 123.205 123.205 124.114 -0.909 18053
60 1 1 . 1 1 30 30 ASP HA H 460 4.183 4.183 4.270 -0.087 18053
61 1 1 . 1 1 30 30 ASP C C 460 178.318 178.318 177.592 0.726 18053
62 1 1 . 1 1 30 30 ASP CA C 460 53.930 53.930 53.487 0.443 18053
63 1 1 . 1 1 30 30 ASP CB C 460 42.807 42.807 42.237 0.570 18053
64 1 1 . 1 1 30 30 ASP H H 460 6.704 6.704 7.314 -0.610 18053
65 1 1 . 1 1 31 31 LEU N N 461 128.551 128.551 119.061 9.490 18053
66 1 1 . 1 1 31 31 LEU HA H 461 4.064 4.064 4.144 -0.080 18053
67 1 1 . 1 1 31 31 LEU C C 461 177.513 177.513 177.240 0.273 18053
68 1 1 . 1 1 31 31 LEU CA C 461 57.124 57.124 57.126 -0.002 18053
69 1 1 . 1 1 31 31 LEU CB C 461 41.237 41.237 42.087 -0.850 18053
70 1 1 . 1 1 31 31 LEU H H 461 9.012 9.012 8.116 0.896 18053
71 1 1 . 1 1 32 32 GLU N N 462 115.101 115.101 116.027 -0.926 18053
72 1 1 . 1 1 32 32 GLU HA H 462 4.283 4.283 4.885 -0.602 18053
73 1 1 . 1 1 32 32 GLU C C 462 177.062 177.062 176.571 0.491 18053
74 1 1 . 1 1 32 32 GLU CA C 462 55.759 55.759 55.537 0.222 18053
75 1 1 . 1 1 32 32 GLU CB C 462 29.569 29.569 30.884 -1.315 18053
76 1 1 . 1 1 32 32 GLU H H 462 7.588 7.588 7.947 -0.359 18053
77 1 1 . 1 1 33 33 GLY N N 463 106.299 106.299 107.033 -0.734 18053
78 1 1 . 1 1 33 33 GLY C C 463 174.824 174.824 174.887 -0.063 18053
79 1 1 . 1 1 33 33 GLY CA C 463 46.806 46.806 45.202 1.604 18053
80 1 1 . 1 1 33 33 GLY H H 463 7.372 7.372 7.780 -0.408 18053
81 1 1 . 1 1 34 34 LYS N N 464 118.744 118.744 117.798 0.946 18053
82 1 1 . 1 1 34 34 LYS HA H 464 4.562 4.562 4.280 0.282 18053
83 1 1 . 1 1 34 34 LYS C C 464 177.076 177.076 175.519 1.557 18053
84 1 1 . 1 1 34 34 LYS CA C 464 59.963 59.963 56.573 3.390 18053
85 1 1 . 1 1 34 34 LYS CB C 464 33.111 33.111 33.170 -0.059 18053
86 1 1 . 1 1 34 34 LYS H H 464 9.547 9.547 8.004 1.543 18053
87 1 1 . 1 1 35 35 PHE N N 465 109.125 109.125 112.015 -2.890 18053
88 1 1 . 1 1 35 35 PHE HA H 465 5.514 5.514 5.082 0.432 18053
89 1 1 . 1 1 35 35 PHE C C 465 174.183 174.183 173.341 0.842 18053
90 1 1 . 1 1 35 35 PHE CA C 465 56.632 56.632 55.149 1.483 18053
91 1 1 . 1 1 35 35 PHE CB C 465 40.599 40.599 40.741 -0.142 18053
92 1 1 . 1 1 35 35 PHE H H 465 6.740 6.740 6.955 -0.215 18053
93 1 1 . 1 1 36 36 VAL N N 466 119.579 119.579 119.199 0.380 18053
94 1 1 . 1 1 36 36 VAL HA H 466 3.709 3.709 4.056 -0.347 18053
95 1 1 . 1 1 36 36 VAL C C 466 172.668 172.668 174.197 -1.529 18053
96 1 1 . 1 1 36 36 VAL CA C 466 62.692 62.692 60.997 1.695 18053
97 1 1 . 1 1 36 36 VAL CB C 466 36.215 36.215 34.320 1.895 18053
98 1 1 . 1 1 36 36 VAL H H 466 7.628 7.628 8.633 -1.005 18053
99 1 1 . 1 1 37 37 GLN N N 467 126.831 126.831 124.556 2.275 18053
100 1 1 . 1 1 37 37 GLN HA H 467 5.449 5.449 5.087 0.362 18053
101 1 1 . 1 1 37 37 GLN C C 467 174.797 174.797 174.295 0.502 18053
102 1 1 . 1 1 37 37 GLN CA C 467 54.121 54.121 54.429 -0.308 18053
103 1 1 . 1 1 37 37 GLN CB C 467 34.623 34.623 31.310 3.313 18053
104 1 1 . 1 1 37 37 GLN H H 467 8.392 8.392 8.599 -0.207 18053
105 1 1 . 1 1 38 38 LEU N N 468 123.018 123.018 127.142 -4.124 18053
106 1 1 . 1 1 38 38 LEU HA H 468 5.422 5.422 5.275 0.147 18053
107 1 1 . 1 1 38 38 LEU C C 468 175.588 175.588 175.796 -0.208 18053
108 1 1 . 1 1 38 38 LEU CA C 468 52.702 52.702 53.618 -0.916 18053
109 1 1 . 1 1 38 38 LEU CB C 468 45.046 45.046 45.270 -0.224 18053
110 1 1 . 1 1 38 38 LEU H H 468 9.103 9.103 8.963 0.140 18053
111 1 1 . 1 1 39 39 LYS N N 469 118.983 118.983 120.138 -1.155 18053
112 1 1 . 1 1 39 39 LYS HA H 469 4.852 4.852 4.839 0.013 18053
113 1 1 . 1 1 39 39 LYS C C 469 173.309 173.309 174.494 -1.185 18053
114 1 1 . 1 1 39 39 LYS CA C 469 54.994 54.994 54.845 0.149 18053
115 1 1 . 1 1 39 39 LYS CB C 469 38.246 38.246 36.136 2.110 18053
116 1 1 . 1 1 39 39 LYS H H 469 8.496 8.496 8.634 -0.138 18053
117 1 1 . 1 1 40 40 ASN N N 470 121.758 121.758 124.883 -3.125 18053
118 1 1 . 1 1 40 40 ASN HA H 470 4.788 4.788 5.094 -0.306 18053
119 1 1 . 1 1 40 40 ASN C C 470 174.496 174.496 175.077 -0.581 18053
120 1 1 . 1 1 40 40 ASN CA C 470 51.119 51.119 52.193 -1.074 18053
121 1 1 . 1 1 40 40 ASN CB C 470 37.559 37.559 39.348 -1.789 18053
122 1 1 . 1 1 40 40 ASN H H 470 8.283 8.283 8.805 -0.522 18053
123 1 1 . 1 1 41 41 ASN N N 471 122.422 122.422 124.326 -1.904 18053
124 1 1 . 1 1 41 41 ASN HA H 471 4.588 4.588 4.687 -0.099 18053
125 1 1 . 1 1 41 41 ASN C C 471 174.810 174.810 175.255 -0.445 18053
126 1 1 . 1 1 41 41 ASN CA C 471 53.985 53.985 53.918 0.067 18053
127 1 1 . 1 1 41 41 ASN CB C 471 39.600 39.600 39.155 0.445 18053
128 1 1 . 1 1 41 41 ASN H H 471 8.681 8.681 8.575 0.106 18053
129 1 1 . 1 1 42 42 SER N N 472 116.446 116.446 116.167 0.279 18053
130 1 1 . 1 1 42 42 SER HA H 472 4.719 4.719 4.506 0.213 18053
131 1 1 . 1 1 42 42 SER C C 472 172.804 172.804 174.605 -1.801 18053
132 1 1 . 1 1 42 42 SER CA C 472 57.288 57.288 57.991 -0.703 18053
133 1 1 . 1 1 42 42 SER CB C 472 66.241 66.241 64.580 1.661 18053
134 1 1 . 1 1 42 42 SER H H 472 8.370 8.370 7.736 0.634 18053
135 1 1 . 1 1 43 43 ASP N N 473 117.706 117.706 122.201 -4.495 18053
136 1 1 . 1 1 43 43 ASP HA H 473 4.474 4.474 4.705 -0.231 18053
137 1 1 . 1 1 43 43 ASP C C 473 175.343 175.343 175.610 -0.267 18053
138 1 1 . 1 1 43 43 ASP CA C 473 53.521 53.521 54.653 -1.132 18053
139 1 1 . 1 1 43 43 ASP CB C 473 40.322 40.322 40.843 -0.521 18053
140 1 1 . 1 1 43 43 ASP H H 473 8.254 8.254 8.564 -0.310 18053
141 1 1 . 1 1 44 44 LYS N N 474 120.209 120.209 119.494 0.715 18053
142 1 1 . 1 1 44 44 LYS HA H 474 4.569 4.569 4.569 0.000 18053
143 1 1 . 1 1 44 44 LYS C C 474 175.397 175.397 174.593 0.804 18053
144 1 1 . 1 1 44 44 LYS CA C 474 54.012 54.012 54.200 -0.188 18053
145 1 1 . 1 1 44 44 LYS CB C 474 35.383 35.383 34.539 0.844 18053
146 1 1 . 1 1 44 44 LYS H H 474 8.305 8.305 7.383 0.922 18053
147 1 1 . 1 1 45 45 ASP N N 475 124.993 124.993 121.035 3.958 18053
148 1 1 . 1 1 45 45 ASP HA H 475 3.975 3.975 4.464 -0.489 18053
149 1 1 . 1 1 45 45 ASP C C 475 174.810 174.810 176.173 -1.363 18053
150 1 1 . 1 1 45 45 ASP CA C 475 54.995 54.995 55.278 -0.283 18053
151 1 1 . 1 1 45 45 ASP CB C 475 40.364 40.364 40.746 -0.382 18053
152 1 1 . 1 1 45 45 ASP H H 475 8.722 8.722 8.472 0.250 18053
153 1 1 . 1 1 46 46 GLN N N 476 120.549 120.549 126.186 -5.637 18053
154 1 1 . 1 1 46 46 GLN HA H 476 4.436 4.436 4.300 0.136 18053
155 1 1 . 1 1 46 46 GLN C C 476 174.019 174.019 175.066 -1.047 18053
156 1 1 . 1 1 46 46 GLN CA C 476 53.138 53.138 54.817 -1.679 18053
157 1 1 . 1 1 46 46 GLN CB C 476 31.466 31.466 29.075 2.392 18053
158 1 1 . 1 1 46 46 GLN H H 476 7.878 7.878 8.312 -0.434 18053
159 1 1 . 1 1 47 47 SER N N 477 121.537 121.537 121.355 0.182 18053
160 1 1 . 1 1 47 47 SER HA H 477 4.229 4.229 4.231 -0.002 18053
161 1 1 . 1 1 47 47 SER C C 477 174.565 174.565 173.593 0.972 18053
162 1 1 . 1 1 47 47 SER CA C 477 58.706 58.706 58.978 -0.272 18053
163 1 1 . 1 1 47 47 SER CB C 477 62.965 62.965 63.129 -0.164 18053
164 1 1 . 1 1 47 47 SER H H 477 8.748 8.748 8.613 0.135 18053
165 1 1 . 1 1 48 48 LEU N N 478 127.751 127.751 125.800 1.951 18053
166 1 1 . 1 1 48 48 LEU HA H 478 2.631 2.631 4.396 -1.765 18053
167 1 1 . 1 1 48 48 LEU C C 478 176.789 176.789 176.882 -0.093 18053
168 1 1 . 1 1 48 48 LEU CA C 478 52.102 52.102 53.475 -1.373 18053
169 1 1 . 1 1 48 48 LEU CB C 478 42.343 42.343 44.466 -2.123 18053
170 1 1 . 1 1 48 48 LEU H H 478 7.856 7.856 7.659 0.197 18053
171 1 1 . 1 1 49 49 GLY N N 479 107.525 107.525 110.500 -2.975 18053
172 1 1 . 1 1 49 49 GLY C C 479 176.653 176.653 175.313 1.340 18053
173 1 1 . 1 1 49 49 GLY CA C 479 48.062 48.062 45.877 2.185 18053
174 1 1 . 1 1 49 49 GLY H H 479 7.728 7.728 8.524 -0.796 18053
175 1 1 . 1 1 50 50 ASN N N 480 117.059 117.059 119.729 -2.670 18053
176 1 1 . 1 1 50 50 ASN HA H 480 4.255 4.255 4.584 -0.329 18053
177 1 1 . 1 1 50 50 ASN C C 480 174.961 174.961 175.356 -0.395 18053
178 1 1 . 1 1 50 50 ASN CA C 480 56.360 56.360 54.914 1.446 18053
179 1 1 . 1 1 50 50 ASN CB C 480 37.416 37.416 38.728 -1.312 18053
180 1 1 . 1 1 50 50 ASN H H 480 7.552 7.552 8.709 -1.157 18053
181 1 1 . 1 1 51 51 TRP N N 481 122.166 122.166 118.458 3.708 18053
182 1 1 . 1 1 51 51 TRP HA H 481 4.477 4.477 4.752 -0.275 18053
183 1 1 . 1 1 51 51 TRP C C 481 175.575 175.575 175.927 -0.352 18053
184 1 1 . 1 1 51 51 TRP CA C 481 58.762 58.762 58.823 -0.061 18053
185 1 1 . 1 1 51 51 TRP CB C 481 28.041 28.041 29.946 -1.905 18053
186 1 1 . 1 1 51 51 TRP H H 481 8.914 8.914 7.885 1.029 18053
187 1 1 . 1 1 52 52 ARG N N 482 116.480 116.480 117.135 -0.655 18053
188 1 1 . 1 1 52 52 ARG HA H 482 5.968 5.968 5.411 0.557 18053
189 1 1 . 1 1 52 52 ARG C C 482 175.807 175.807 174.822 0.985 18053
190 1 1 . 1 1 52 52 ARG CA C 482 54.121 54.121 54.916 -0.795 18053
191 1 1 . 1 1 52 52 ARG CB C 482 35.124 35.124 34.191 0.933 18053
192 1 1 . 1 1 52 52 ARG H H 482 9.147 9.147 8.908 0.239 18053
193 1 1 . 1 1 53 53 ILE N N 483 119.579 119.579 124.523 -4.944 18053
194 1 1 . 1 1 53 53 ILE HA H 483 4.985 4.985 5.027 -0.042 18053
195 1 1 . 1 1 53 53 ILE C C 483 175.670 175.670 175.906 -0.236 18053
196 1 1 . 1 1 53 53 ILE CA C 483 60.400 60.400 60.524 -0.124 18053
197 1 1 . 1 1 53 53 ILE CB C 483 40.227 40.227 38.841 1.386 18053
198 1 1 . 1 1 53 53 ILE H H 483 9.000 9.000 8.651 0.349 18053
199 1 1 . 1 1 54 54 LYS N N 484 124.737 124.737 128.935 -4.198 18053
200 1 1 . 1 1 54 54 LYS HA H 484 5.463 5.463 4.920 0.543 18053
201 1 1 . 1 1 54 54 LYS C C 484 175.575 175.575 175.889 -0.314 18053
202 1 1 . 1 1 54 54 LYS CA C 484 54.613 54.613 55.829 -1.216 18053
203 1 1 . 1 1 54 54 LYS CB C 484 35.041 35.041 32.257 2.784 18053
204 1 1 . 1 1 54 54 LYS H H 484 9.678 9.678 8.666 1.012 18053
205 1 1 . 1 1 55 55 ARG N N 485 124.090 124.090 128.399 -4.309 18053
206 1 1 . 1 1 55 55 ARG HA H 485 5.525 5.525 4.829 0.696 18053
207 1 1 . 1 1 55 55 ARG C C 485 174.155 174.155 175.156 -1.001 18053
208 1 1 . 1 1 55 55 ARG CA C 485 53.903 53.903 55.082 -1.179 18053
209 1 1 . 1 1 55 55 ARG H H 485 9.314 9.314 8.879 0.435 18053
210 1 1 . 1 1 56 56 GLN N N 486 126.576 126.576 126.420 0.156 18053
211 1 1 . 1 1 56 56 GLN HA H 486 4.842 4.842 4.734 0.108 18053
212 1 1 . 1 1 56 56 GLN C C 486 174.991 174.991 174.371 0.620 18053
213 1 1 . 1 1 56 56 GLN CA C 486 54.831 54.831 54.188 0.644 18053
214 1 1 . 1 1 56 56 GLN CB C 486 31.465 31.465 29.970 1.495 18053
215 1 1 . 1 1 56 56 GLN H H 486 8.831 8.831 8.780 0.051 18053
216 1 1 . 1 1 57 57 VAL N N 487 126.712 126.712 125.231 1.481 18053
217 1 1 . 1 1 57 57 VAL HA H 487 4.266 4.266 4.365 -0.099 18053
218 1 1 . 1 1 57 57 VAL C C 487 175.916 175.916 177.341 -1.425 18053
219 1 1 . 1 1 57 57 VAL CA C 487 61.820 61.820 61.581 0.239 18053
220 1 1 . 1 1 57 57 VAL CB C 487 32.803 32.803 32.956 -0.152 18053
221 1 1 . 1 1 57 57 VAL H H 487 8.786 8.786 8.548 0.238 18053
222 1 1 . 1 1 58 58 LEU N N 488 127.274 127.274 125.523 1.751 18053
223 1 1 . 1 1 58 58 LEU HA H 488 4.085 4.085 4.267 -0.182 18053
224 1 1 . 1 1 58 58 LEU C C 488 177.158 177.158 178.502 -1.344 18053
225 1 1 . 1 1 58 58 LEU CA C 488 56.906 56.906 57.580 -0.673 18053
226 1 1 . 1 1 58 58 LEU CB C 488 41.374 41.374 41.574 -0.200 18053
227 1 1 . 1 1 58 58 LEU H H 488 8.316 8.316 8.499 -0.183 18053
228 1 1 . 1 1 59 59 GLU N N 489 119.647 119.647 118.438 1.209 18053
229 1 1 . 1 1 59 59 GLU HA H 489 4.112 4.112 4.175 -0.063 18053
230 1 1 . 1 1 59 59 GLU C C 489 176.230 176.230 177.308 -1.078 18053
231 1 1 . 1 1 59 59 GLU CA C 489 57.015 57.015 57.233 -0.218 18053
232 1 1 . 1 1 59 59 GLU CB C 489 28.149 28.149 29.621 -1.472 18053
233 1 1 . 1 1 59 59 GLU H H 489 8.636 8.636 8.323 0.313 18053
234 1 1 . 1 1 60 60 GLY N N 490 108.819 108.819 107.373 1.446 18053
235 1 1 . 1 1 60 60 GLY C C 490 173.568 173.568 173.423 0.145 18053
236 1 1 . 1 1 60 60 GLY CA C 490 44.773 44.773 44.944 -0.171 18053
237 1 1 . 1 1 60 60 GLY H H 490 8.160 8.160 7.870 0.290 18053
238 1 1 . 1 1 61 61 GLU N N 491 121.009 121.009 122.413 -1.404 18053
239 1 1 . 1 1 61 61 GLU HA H 491 4.323 4.323 4.404 -0.081 18053
240 1 1 . 1 1 61 61 GLU C C 491 175.725 175.725 175.153 0.572 18053
241 1 1 . 1 1 61 61 GLU CA C 491 56.196 56.196 55.313 0.883 18053
242 1 1 . 1 1 61 61 GLU CB C 491 30.865 30.865 29.431 1.434 18053
243 1 1 . 1 1 61 61 GLU H H 491 8.320 8.320 8.332 -0.012 18053
244 1 1 . 1 1 62 62 GLU N N 492 123.426 123.426 123.622 -0.196 18053
245 1 1 . 1 1 62 62 GLU HA H 492 5.054 5.054 5.275 -0.221 18053
246 1 1 . 1 1 62 62 GLU C C 492 175.930 175.930 175.720 0.210 18053
247 1 1 . 1 1 62 62 GLU CA C 492 55.650 55.650 54.834 0.816 18053
248 1 1 . 1 1 62 62 GLU CB C 492 32.312 32.312 32.007 0.305 18053
249 1 1 . 1 1 62 62 GLU H H 492 8.594 8.594 8.515 0.078 18053
250 1 1 . 1 1 63 63 ILE N N 493 119.732 119.732 118.478 1.254 18053
251 1 1 . 1 1 63 63 ILE HA H 493 4.788 4.788 4.787 0.001 18053
252 1 1 . 1 1 63 63 ILE C C 493 174.647 174.647 174.088 0.559 18053
253 1 1 . 1 1 63 63 ILE CA C 493 60.181 60.181 60.104 0.077 18053
254 1 1 . 1 1 63 63 ILE CB C 493 41.183 41.183 42.253 -1.070 18053
255 1 1 . 1 1 63 63 ILE H H 493 8.523 8.523 8.365 0.158 18053
256 1 1 . 1 1 64 64 ALA N N 494 122.166 122.166 125.498 -3.332 18053
257 1 1 . 1 1 64 64 ALA HA H 494 5.521 5.521 4.913 0.608 18053
258 1 1 . 1 1 64 64 ALA C C 494 174.606 174.606 176.177 -1.571 18053
259 1 1 . 1 1 64 64 ALA CA C 494 51.528 51.528 50.489 1.038 18053
260 1 1 . 1 1 64 64 ALA CB C 494 22.239 22.239 20.638 1.601 18053
261 1 1 . 1 1 64 64 ALA H H 494 8.741 8.741 8.382 0.359 18053
262 1 1 . 1 1 65 65 TYR N N 495 126.729 126.729 126.825 -0.096 18053
263 1 1 . 1 1 65 65 TYR HA H 495 3.094 3.094 3.385 -0.291 18053
264 1 1 . 1 1 65 65 TYR C C 495 173.036 173.036 173.974 -0.938 18053
265 1 1 . 1 1 65 65 TYR CA C 495 56.905 56.905 56.134 0.771 18053
266 1 1 . 1 1 65 65 TYR CB C 495 40.269 40.269 38.205 2.064 18053
267 1 1 . 1 1 65 65 TYR H H 495 8.462 8.462 8.498 -0.036 18053
268 1 1 . 1 1 66 66 LYS N N 496 128.108 128.108 127.313 0.795 18053
269 1 1 . 1 1 66 66 LYS HA H 496 4.822 4.822 4.331 0.491 18053
270 1 1 . 1 1 66 66 LYS C C 496 174.906 174.906 174.927 -0.021 18053
271 1 1 . 1 1 66 66 LYS CA C 496 53.739 53.739 55.142 -1.403 18053
272 1 1 . 1 1 66 66 LYS CB C 496 34.782 34.782 32.723 2.059 18053
273 1 1 . 1 1 66 66 LYS H H 496 7.010 7.010 7.236 -0.226 18053
274 1 1 . 1 1 67 67 PHE N N 497 125.299 125.299 123.371 1.928 18053
275 1 1 . 1 1 67 67 PHE HA H 497 3.932 3.932 4.018 -0.086 18053
276 1 1 . 1 1 67 67 PHE C C 497 177.990 177.990 175.954 2.036 18053
277 1 1 . 1 1 67 67 PHE CA C 497 59.007 59.007 58.199 0.808 18053
278 1 1 . 1 1 67 67 PHE CB C 497 40.981 40.981 40.103 0.878 18053
279 1 1 . 1 1 67 67 PHE H H 497 8.509 8.509 8.128 0.381 18053
280 1 1 . 1 1 68 68 THR N N 498 116.191 116.191 112.432 3.759 18053
281 1 1 . 1 1 68 68 THR HA H 498 4.417 4.417 4.706 -0.289 18053
282 1 1 . 1 1 68 68 THR CA C 498 60.855 60.855 59.085 1.770 18053
283 1 1 . 1 1 68 68 THR CB C 498 68.019 68.019 69.335 -1.316 18053
284 1 1 . 1 1 68 68 THR H H 498 8.688 8.688 8.494 0.194 18053
285 1 1 . 1 1 69 69 PRO HA H 499 3.948 3.948 4.718 -0.770 18053
286 1 1 . 1 1 69 69 PRO C C 499 177.444 177.444 177.243 0.201 18053
287 1 1 . 1 1 69 69 PRO CA C 499 66.077 66.077 64.253 1.824 18053
288 1 1 . 1 1 69 69 PRO CB C 499 32.776 32.776 31.772 1.004 18053
289 1 1 . 1 1 70 70 LYS N N 500 113.552 113.552 116.128 -2.576 18053
290 1 1 . 1 1 70 70 LYS HA H 500 4.385 4.385 4.158 0.227 18053
291 1 1 . 1 1 70 70 LYS C C 500 176.325 176.325 176.197 0.128 18053
292 1 1 . 1 1 70 70 LYS CA C 500 54.995 54.995 56.846 -1.851 18053
293 1 1 . 1 1 70 70 LYS CB C 500 31.793 31.793 32.269 -0.476 18053
294 1 1 . 1 1 70 70 LYS H H 500 8.016 8.016 8.182 -0.166 18053
295 1 1 . 1 1 71 71 TYR N N 501 121.860 121.860 121.124 0.736 18053
296 1 1 . 1 1 71 71 TYR HA H 501 3.730 3.730 4.498 -0.768 18053
297 1 1 . 1 1 71 71 TYR C C 501 174.838 174.838 173.820 1.018 18053
298 1 1 . 1 1 71 71 TYR CA C 501 62.310 62.310 58.643 3.667 18053
299 1 1 . 1 1 71 71 TYR CB C 501 38.781 38.781 39.950 -1.169 18053
300 1 1 . 1 1 71 71 TYR H H 501 7.460 7.460 7.776 -0.316 18053
301 1 1 . 1 1 72 72 ILE N N 502 129.487 129.487 126.408 3.079 18053
302 1 1 . 1 1 72 72 ILE HA H 502 3.928 3.928 4.397 -0.469 18053
303 1 1 . 1 1 72 72 ILE C C 502 172.968 172.968 173.972 -1.004 18053
304 1 1 . 1 1 72 72 ILE CA C 502 59.308 59.308 59.453 -0.145 18053
305 1 1 . 1 1 72 72 ILE CB C 502 40.910 40.910 40.840 0.070 18053
306 1 1 . 1 1 72 72 ILE H H 502 7.168 7.168 7.781 -0.613 18053
307 1 1 . 1 1 73 73 LEU N N 503 128.278 128.278 127.906 0.372 18053
308 1 1 . 1 1 73 73 LEU HA H 503 4.493 4.493 4.568 -0.075 18053
309 1 1 . 1 1 73 73 LEU C C 503 175.834 175.834 175.269 0.565 18053
310 1 1 . 1 1 73 73 LEU CA C 503 51.965 51.965 52.846 -0.881 18053
311 1 1 . 1 1 73 73 LEU CB C 503 42.548 42.548 44.826 -2.278 18053
312 1 1 . 1 1 73 73 LEU H H 503 8.483 8.483 8.444 0.039 18053
313 1 1 . 1 1 74 74 ARG N N 504 129.589 129.589 122.379 7.210 18053
314 1 1 . 1 1 74 74 ARG HA H 504 3.743 3.743 4.670 -0.927 18053
315 1 1 . 1 1 74 74 ARG C C 504 175.233 175.233 176.197 -0.964 18053
316 1 1 . 1 1 74 74 ARG CA C 504 56.851 56.851 54.442 2.409 18053
317 1 1 . 1 1 74 74 ARG CB C 504 30.292 30.292 31.142 -0.850 18053
318 1 1 . 1 1 74 74 ARG H H 504 8.673 8.673 8.292 0.381 18053
319 1 1 . 1 1 75 75 ALA N N 505 123.205 123.205 124.276 -1.071 18053
320 1 1 . 1 1 75 75 ALA HA H 505 3.522 3.522 4.118 -0.596 18053
321 1 1 . 1 1 75 75 ALA C C 505 178.441 178.441 178.194 0.247 18053
322 1 1 . 1 1 75 75 ALA CA C 505 53.794 53.794 53.046 0.748 18053
323 1 1 . 1 1 75 75 ALA CB C 505 18.910 18.910 18.322 0.588 18053
324 1 1 . 1 1 75 75 ALA H H 505 8.564 8.564 8.473 0.091 18053
325 1 1 . 1 1 76 76 GLY N N 506 112.241 112.241 112.692 -0.451 18053
326 1 1 . 1 1 76 76 GLY C C 506 174.278 174.278 174.106 0.172 18053
327 1 1 . 1 1 76 76 GLY CA C 506 46.725 46.725 45.210 1.515 18053
328 1 1 . 1 1 76 76 GLY H H 506 7.381 7.381 8.543 -1.162 18053
329 1 1 . 1 1 77 77 GLN N N 507 117.382 117.382 118.660 -1.278 18053
330 1 1 . 1 1 77 77 GLN HA H 507 4.364 4.364 4.728 -0.364 18053
331 1 1 . 1 1 77 77 GLN C C 507 173.937 173.937 174.507 -0.570 18053
332 1 1 . 1 1 77 77 GLN CA C 507 54.558 54.558 54.056 0.502 18053
333 1 1 . 1 1 77 77 GLN CB C 507 30.073 30.073 31.322 -1.249 18053
334 1 1 . 1 1 77 77 GLN H H 507 7.996 7.996 7.652 0.344 18053
335 1 1 . 1 1 78 78 MET N N 508 116.957 116.957 115.717 1.240 18053
336 1 1 . 1 1 78 78 MET HA H 508 5.388 5.388 4.901 0.487 18053
337 1 1 . 1 1 78 78 MET C C 508 175.807 175.807 173.947 1.860 18053
338 1 1 . 1 1 78 78 MET CA C 508 54.067 54.067 54.654 -0.586 18053
339 1 1 . 1 1 78 78 MET CB C 508 37.198 37.198 36.234 0.964 18053
340 1 1 . 1 1 78 78 MET H H 508 8.092 8.092 8.276 -0.184 18053
341 1 1 . 1 1 79 79 VAL N N 509 119.340 119.340 121.322 -1.982 18053
342 1 1 . 1 1 79 79 VAL HA H 509 4.956 4.956 4.923 0.033 18053
343 1 1 . 1 1 79 79 VAL C C 509 172.217 172.217 174.307 -2.090 18053
344 1 1 . 1 1 79 79 VAL CA C 509 59.471 59.471 59.943 -0.472 18053
345 1 1 . 1 1 79 79 VAL CB C 509 33.676 33.676 35.608 -1.932 18053
346 1 1 . 1 1 79 79 VAL H H 509 8.534 8.534 8.347 0.187 18053
347 1 1 . 1 1 80 80 THR N N 510 124.533 124.533 125.762 -1.229 18053
348 1 1 . 1 1 80 80 THR HA H 510 4.586 4.586 4.964 -0.378 18053
349 1 1 . 1 1 80 80 THR C C 510 172.215 172.215 173.600 -1.385 18053
350 1 1 . 1 1 80 80 THR CA C 510 62.119 62.119 61.565 0.554 18053
351 1 1 . 1 1 80 80 THR CB C 510 69.407 69.407 69.698 -0.292 18053
352 1 1 . 1 1 80 80 THR H H 510 8.301 8.301 8.699 -0.398 18053
353 1 1 . 1 1 81 81 VAL N N 511 127.002 127.002 127.721 -0.719 18053
354 1 1 . 1 1 81 81 VAL HA H 511 4.596 4.596 4.721 -0.125 18053
355 1 1 . 1 1 81 81 VAL C C 511 176.667 176.667 175.459 1.208 18053
356 1 1 . 1 1 81 81 VAL CA C 511 61.382 61.382 62.128 -0.746 18053
357 1 1 . 1 1 81 81 VAL CB C 511 30.945 30.945 31.562 -0.617 18053
358 1 1 . 1 1 81 81 VAL H H 511 8.796 8.796 8.737 0.059 18053
359 1 1 . 1 1 82 82 TRP N N 512 131.479 131.479 129.381 2.098 18053
360 1 1 . 1 1 82 82 TRP HA H 512 5.338 5.338 5.326 0.012 18053
361 1 1 . 1 1 82 82 TRP C C 512 176.885 176.885 175.513 1.372 18053
362 1 1 . 1 1 82 82 TRP CA C 512 56.442 56.442 57.085 -0.643 18053
363 1 1 . 1 1 82 82 TRP CB C 512 30.701 30.701 31.433 -0.732 18053
364 1 1 . 1 1 82 82 TRP H H 512 9.924 9.924 9.150 0.774 18053
365 1 1 . 1 1 83 83 ALA N N 513 123.954 123.954 120.949 3.005 18053
366 1 1 . 1 1 83 83 ALA HA H 513 4.308 4.308 4.759 -0.451 18053
367 1 1 . 1 1 83 83 ALA C C 513 178.140 178.140 178.498 -0.358 18053
368 1 1 . 1 1 83 83 ALA CA C 513 52.211 52.211 50.739 1.472 18053
369 1 1 . 1 1 83 83 ALA CB C 513 18.745 18.745 20.354 -1.609 18053
370 1 1 . 1 1 83 83 ALA H H 513 9.048 9.048 8.549 0.499 18053
371 1 1 . 1 1 84 84 ALA N N 514 125.146 125.146 125.734 -0.588 18053
372 1 1 . 1 1 84 84 ALA HA H 514 3.951 3.951 4.128 -0.177 18053
373 1 1 . 1 1 84 84 ALA C C 514 179.519 179.519 178.942 0.577 18053
374 1 1 . 1 1 84 84 ALA CA C 514 54.804 54.804 54.800 0.004 18053
375 1 1 . 1 1 84 84 ALA CB C 514 18.582 18.582 19.101 -0.519 18053
376 1 1 . 1 1 84 84 ALA H H 514 8.341 8.341 8.350 -0.009 18053
377 1 1 . 1 1 85 85 GLY N N 515 103.388 103.388 104.428 -1.040 18053
378 1 1 . 1 1 85 85 GLY C C 515 174.674 174.674 174.784 -0.110 18053
379 1 1 . 1 1 85 85 GLY CA C 515 45.878 45.878 45.011 0.867 18053
380 1 1 . 1 1 85 85 GLY H H 515 7.996 7.996 7.953 0.043 18053
381 1 1 . 1 1 86 86 ALA N N 516 120.140 120.140 123.633 -3.493 18053
382 1 1 . 1 1 86 86 ALA HA H 516 4.344 4.344 4.519 -0.175 18053
383 1 1 . 1 1 86 86 ALA C C 516 177.690 177.690 178.078 -0.388 18053
384 1 1 . 1 1 86 86 ALA CA C 516 53.139 53.139 51.872 1.267 18053
385 1 1 . 1 1 86 86 ALA CB C 516 20.547 20.547 19.159 1.388 18053
386 1 1 . 1 1 86 86 ALA H H 516 7.474 7.474 7.202 0.272 18053
387 1 1 . 1 1 87 87 GLY N N 517 105.720 105.720 108.258 -2.538 18053
388 1 1 . 1 1 87 87 GLY C C 517 173.650 173.650 174.780 -1.130 18053
389 1 1 . 1 1 87 87 GLY CA C 517 46.014 46.014 45.556 0.458 18053
390 1 1 . 1 1 87 87 GLY H H 517 7.779 7.779 7.714 0.065 18053
391 1 1 . 1 1 88 88 VAL N N 518 121.537 121.537 120.161 1.376 18053
392 1 1 . 1 1 88 88 VAL HA H 518 3.585 3.585 4.049 -0.464 18053
393 1 1 . 1 1 88 88 VAL C C 518 174.851 174.851 175.330 -0.479 18053
394 1 1 . 1 1 88 88 VAL CA C 518 61.274 61.274 61.368 -0.094 18053
395 1 1 . 1 1 88 88 VAL CB C 518 33.376 33.376 32.695 0.681 18053
396 1 1 . 1 1 88 88 VAL H H 518 7.499 7.499 7.794 -0.295 18053
397 1 1 . 1 1 89 89 ALA N N 519 128.295 128.295 130.032 -1.737 18053
398 1 1 . 1 1 89 89 ALA HA H 519 4.192 4.192 4.356 -0.164 18053
399 1 1 . 1 1 89 89 ALA C C 519 176.680 176.680 176.534 0.146 18053
400 1 1 . 1 1 89 89 ALA CA C 519 51.283 51.283 51.361 -0.078 18053
401 1 1 . 1 1 89 89 ALA CB C 519 19.292 19.292 19.073 0.219 18053
402 1 1 . 1 1 89 89 ALA H H 519 7.960 7.960 8.065 -0.105 18053
403 1 1 . 1 1 90 90 HIS N N 520 122.643 122.643 124.332 -1.689 18053
404 1 1 . 1 1 90 90 HIS HA H 520 4.033 4.033 4.371 -0.338 18053
405 1 1 . 1 1 90 90 HIS C C 520 175.793 175.793 174.574 1.219 18053
406 1 1 . 1 1 90 90 HIS CA C 520 58.653 58.653 56.060 2.593 18053
407 1 1 . 1 1 90 90 HIS CB C 520 32.285 32.285 30.018 2.267 18053
408 1 1 . 1 1 90 90 HIS H H 520 8.394 8.394 8.901 -0.507 18053
409 1 1 . 1 1 91 91 SER N N 521 121.247 121.247 124.267 -3.020 18053
410 1 1 . 1 1 91 91 SER HA H 521 4.629 4.629 4.880 -0.251 18053
411 1 1 . 1 1 91 91 SER CA C 521 55.843 55.843 55.787 0.056 18053
412 1 1 . 1 1 91 91 SER CB C 521 62.367 62.367 63.241 -0.874 18053
413 1 1 . 1 1 91 91 SER H H 521 8.569 8.569 8.399 0.170 18053
414 1 1 . 1 1 92 92 PRO HA H 522 4.002 4.002 4.917 -0.915 18053
415 1 1 . 1 1 92 92 PRO CA C 522 62.244 62.244 62.174 0.070 18053
416 1 1 . 1 1 92 92 PRO CB C 522 30.931 30.931 31.525 -0.594 18053
417 1 1 . 1 1 93 93 PRO HA H 523 4.672 4.672 4.899 -0.228 18053
418 1 1 . 1 1 93 93 PRO C C 523 177.786 177.786 177.534 0.252 18053
419 1 1 . 1 1 93 93 PRO CA C 523 64.003 64.003 63.336 0.667 18053
420 1 1 . 1 1 93 93 PRO CB C 523 34.905 34.905 32.872 2.033 18053
421 1 1 . 1 1 94 94 SER N N 524 117.212 117.212 117.522 -0.310 18053
422 1 1 . 1 1 94 94 SER HA H 524 4.678 4.678 4.508 0.170 18053
423 1 1 . 1 1 94 94 SER C C 524 174.851 174.851 174.287 0.564 18053
424 1 1 . 1 1 94 94 SER CA C 524 61.874 61.874 61.160 0.715 18053
425 1 1 . 1 1 94 94 SER CB C 524 64.057 64.057 64.015 0.042 18053
426 1 1 . 1 1 94 94 SER H H 524 8.463 8.463 7.998 0.465 18053
427 1 1 . 1 1 95 95 THR N N 525 121.588 121.588 118.989 2.599 18053
428 1 1 . 1 1 95 95 THR HA H 525 4.859 4.859 5.089 -0.230 18053
429 1 1 . 1 1 95 95 THR C C 525 172.094 172.094 173.163 -1.069 18053
430 1 1 . 1 1 95 95 THR CA C 525 62.309 62.309 62.296 0.013 18053
431 1 1 . 1 1 95 95 THR CB C 525 70.281 70.281 69.402 0.879 18053
432 1 1 . 1 1 95 95 THR H H 525 7.631 7.631 8.021 -0.390 18053
433 1 1 . 1 1 96 96 LEU N N 526 127.274 127.274 128.535 -1.261 18053
434 1 1 . 1 1 96 96 LEU HA H 526 5.131 5.131 4.591 0.540 18053
435 1 1 . 1 1 96 96 LEU C C 526 175.916 175.916 175.811 0.105 18053
436 1 1 . 1 1 96 96 LEU CA C 526 52.075 52.075 54.472 -2.397 18053
437 1 1 . 1 1 96 96 LEU CB C 526 43.790 43.790 43.666 0.124 18053
438 1 1 . 1 1 96 96 LEU H H 526 8.977 8.977 8.141 0.836 18053
439 1 1 . 1 1 97 97 VAL N N 527 124.056 124.056 120.271 3.785 18053
440 1 1 . 1 1 97 97 VAL HA H 527 4.869 4.869 4.390 0.479 18053
441 1 1 . 1 1 97 97 VAL C C 527 176.230 176.230 175.154 1.076 18053
442 1 1 . 1 1 97 97 VAL CA C 527 61.519 61.519 61.272 0.248 18053
443 1 1 . 1 1 97 97 VAL CB C 527 33.704 33.704 33.785 -0.081 18053
444 1 1 . 1 1 97 97 VAL H H 527 10.724 10.724 7.181 3.543 18053
445 1 1 . 1 1 98 98 TRP N N 528 132.586 132.586 131.417 1.169 18053
446 1 1 . 1 1 98 98 TRP HA H 528 4.965 4.965 4.332 0.633 18053
447 1 1 . 1 1 98 98 TRP C C 528 173.391 173.391 174.483 -1.092 18053
448 1 1 . 1 1 98 98 TRP CA C 528 53.303 53.303 55.335 -2.032 18053
449 1 1 . 1 1 98 98 TRP CB C 528 28.245 28.245 28.308 -0.063 18053
450 1 1 . 1 1 98 98 TRP H H 528 9.400 9.400 8.888 0.512 18053
451 1 1 . 1 1 99 99 LYS N N 529 126.644 126.644 128.878 -2.234 18053
452 1 1 . 1 1 99 99 LYS HA H 529 3.839 3.839 4.214 -0.375 18053
453 1 1 . 1 1 99 99 LYS C C 529 177.581 177.581 177.186 0.395 18053
454 1 1 . 1 1 99 99 LYS CA C 529 58.543 58.543 57.171 1.372 18053
455 1 1 . 1 1 99 99 LYS CB C 529 32.176 32.176 32.513 -0.337 18053
456 1 1 . 1 1 99 99 LYS H H 529 8.153 8.153 8.058 0.095 18053
457 1 1 . 1 1 100 100 GLY N N 530 110.385 110.385 113.529 -3.144 18053
458 1 1 . 1 1 100 100 GLY C C 530 172.367 172.367 173.381 -1.014 18053
459 1 1 . 1 1 100 100 GLY CA C 530 45.278 45.278 44.635 0.643 18053
460 1 1 . 1 1 100 100 GLY H H 530 8.363 8.363 8.622 -0.259 18053
461 1 1 . 1 1 101 101 GLN N N 531 121.162 121.162 119.895 1.267 18053
462 1 1 . 1 1 101 101 GLN HA H 531 3.972 3.972 4.279 -0.307 18053
463 1 1 . 1 1 101 101 GLN CA C 531 52.620 52.620 53.963 -1.343 18053
464 1 1 . 1 1 101 101 GLN CB C 531 27.595 27.595 29.467 -1.872 18053
465 1 1 . 1 1 101 101 GLN H H 531 6.815 6.815 7.201 -0.386 18053
466 1 1 . 1 1 102 102 SER N N 532 122.728 122.728 122.989 -0.261 18053
467 1 1 . 1 1 102 102 SER HA H 532 3.866 3.866 4.446 -0.580 18053
468 1 1 . 1 1 102 102 SER C C 532 174.537 174.537 175.739 -1.202 18053
469 1 1 . 1 1 102 102 SER CA C 532 61.983 61.983 61.009 0.974 18053
470 1 1 . 1 1 102 102 SER CB C 532 62.802 62.802 63.167 -0.365 18053
471 1 1 . 1 1 102 102 SER H H 532 8.662 8.662 8.698 -0.036 18053
472 1 1 . 1 1 103 103 SER N N 533 110.811 110.811 114.958 -4.147 18053
473 1 1 . 1 1 103 103 SER HA H 533 4.240 4.240 4.317 -0.077 18053
474 1 1 . 1 1 103 103 SER C C 533 174.087 174.087 174.838 -0.751 18053
475 1 1 . 1 1 103 103 SER CA C 533 56.633 56.633 59.097 -2.464 18053
476 1 1 . 1 1 103 103 SER CB C 533 64.658 64.658 63.224 1.434 18053
477 1 1 . 1 1 103 103 SER H H 533 7.134 7.134 8.089 -0.955 18053
478 1 1 . 1 1 104 104 TRP N N 534 126.133 126.133 121.674 4.459 18053
479 1 1 . 1 1 104 104 TRP HA H 534 4.098 4.098 4.105 -0.007 18053
480 1 1 . 1 1 104 104 TRP C C 534 176.066 176.066 175.516 0.550 18053
481 1 1 . 1 1 104 104 TRP CA C 534 60.127 60.127 57.175 2.952 18053
482 1 1 . 1 1 104 104 TRP CB C 534 28.764 28.764 28.662 0.102 18053
483 1 1 . 1 1 104 104 TRP H H 534 9.764 9.764 7.965 1.799 18053
484 1 1 . 1 1 105 105 GLY N N 535 105.907 105.907 105.940 -0.033 18053
485 1 1 . 1 1 105 105 GLY C C 535 172.217 172.217 173.401 -1.184 18053
486 1 1 . 1 1 105 105 GLY CA C 535 44.240 44.240 44.644 -0.404 18053
487 1 1 . 1 1 105 105 GLY H H 535 8.095 8.095 7.783 0.312 18053
488 1 1 . 1 1 106 106 THR N N 536 111.253 111.253 113.379 -2.126 18053
489 1 1 . 1 1 106 106 THR HA H 536 3.859 3.859 5.104 -1.245 18053
490 1 1 . 1 1 106 106 THR C C 536 172.872 172.872 174.195 -1.323 18053
491 1 1 . 1 1 106 106 THR CA C 536 59.635 59.635 60.874 -1.239 18053
492 1 1 . 1 1 106 106 THR CB C 536 70.526 70.526 69.620 0.906 18053
493 1 1 . 1 1 106 106 THR H H 536 7.913 7.913 7.803 0.110 18053
494 1 1 . 1 1 107 107 GLY N N 537 107.712 107.712 110.835 -3.123 18053
495 1 1 . 1 1 107 107 GLY C C 537 172.709 172.709 173.443 -0.734 18053
496 1 1 . 1 1 107 107 GLY CA C 537 45.166 45.166 45.573 -0.407 18053
497 1 1 . 1 1 107 107 GLY H H 537 7.533 7.533 7.575 -0.042 18053
498 1 1 . 1 1 108 108 GLU N N 538 118.864 118.864 118.078 0.786 18053
499 1 1 . 1 1 108 108 GLU HA H 538 4.136 4.136 4.394 -0.258 18053
500 1 1 . 1 1 108 108 GLU C C 538 176.353 176.353 176.139 0.214 18053
501 1 1 . 1 1 108 108 GLU CA C 538 58.352 58.352 57.407 0.945 18053
502 1 1 . 1 1 108 108 GLU CB C 538 30.156 30.156 30.730 -0.574 18053
503 1 1 . 1 1 108 108 GLU H H 538 8.558 8.558 8.728 -0.170 18053
504 1 1 . 1 1 109 109 SER N N 539 110.419 110.419 114.591 -4.172 18053
505 1 1 . 1 1 109 109 SER HA H 539 4.963 4.963 4.864 0.099 18053
506 1 1 . 1 1 109 109 SER C C 539 173.787 173.787 172.591 1.196 18053
507 1 1 . 1 1 109 109 SER CA C 539 57.125 57.125 58.149 -1.024 18053
508 1 1 . 1 1 109 109 SER CB C 539 64.439 64.439 66.223 -1.784 18053
509 1 1 . 1 1 109 109 SER H H 539 7.620 7.620 7.753 -0.133 18053
510 1 1 . 1 1 110 110 PHE N N 540 118.778 118.778 118.346 0.432 18053
511 1 1 . 1 1 110 110 PHE HA H 540 5.081 5.081 5.117 -0.036 18053
512 1 1 . 1 1 110 110 PHE C C 540 176.052 176.052 173.109 2.943 18053
513 1 1 . 1 1 110 110 PHE CA C 540 56.789 56.789 56.796 -0.007 18053
514 1 1 . 1 1 110 110 PHE CB C 540 40.760 40.760 41.626 -0.866 18053
515 1 1 . 1 1 110 110 PHE H H 540 8.318 8.318 8.258 0.061 18053
516 1 1 . 1 1 112 112 THR HA H 542 5.468 5.468 4.668 0.800 18053
517 1 1 . 1 1 112 112 THR C C 542 172.381 172.381 173.832 -1.451 18053
518 1 1 . 1 1 112 112 THR CA C 542 61.818 61.818 63.019 -1.201 18053
519 1 1 . 1 1 112 112 THR CB C 542 70.990 70.990 68.655 2.335 18053
520 1 1 . 1 1 113 113 VAL N N 543 124.771 124.771 128.343 -3.572 18053
521 1 1 . 1 1 113 113 VAL HA H 543 4.864 4.864 4.384 0.480 18053
522 1 1 . 1 1 113 113 VAL C C 543 173.132 173.132 174.106 -0.974 18053
523 1 1 . 1 1 113 113 VAL CA C 543 60.099 60.099 61.278 -1.179 18053
524 1 1 . 1 1 113 113 VAL CB C 543 36.433 36.433 33.564 2.869 18053
525 1 1 . 1 1 113 113 VAL H H 543 9.380 9.380 8.963 0.417 18053
526 1 1 . 1 1 114 114 LEU N N 544 128.789 128.789 129.308 -0.519 18053
527 1 1 . 1 1 114 114 LEU HA H 544 5.320 5.320 4.889 0.431 18053
528 1 1 . 1 1 114 114 LEU C C 544 174.237 174.237 174.966 -0.729 18053
529 1 1 . 1 1 114 114 LEU CA C 544 53.193 53.193 53.825 -0.632 18053
530 1 1 . 1 1 114 114 LEU CB C 544 45.879 45.879 44.208 1.671 18053
531 1 1 . 1 1 114 114 LEU H H 544 8.948 8.948 8.530 0.418 18053
532 1 1 . 1 1 115 115 VAL N N 545 127.002 127.002 126.675 0.327 18053
533 1 1 . 1 1 115 115 VAL HA H 545 4.854 4.854 4.735 0.119 18053
534 1 1 . 1 1 115 115 VAL C C 545 175.206 175.206 174.655 0.551 18053
535 1 1 . 1 1 115 115 VAL CA C 545 59.334 59.334 60.280 -0.946 18053
536 1 1 . 1 1 115 115 VAL CB C 545 34.495 34.495 34.690 -0.195 18053
537 1 1 . 1 1 115 115 VAL H H 545 9.564 9.564 8.726 0.838 18053
538 1 1 . 1 1 116 116 ASN N N 546 121.179 121.179 124.039 -2.860 18053
539 1 1 . 1 1 116 116 ASN HA H 546 2.897 2.897 2.871 0.026 18053
540 1 1 . 1 1 116 116 ASN C C 546 176.885 176.885 175.814 1.071 18053
541 1 1 . 1 1 116 116 ASN CA C 546 50.409 50.409 50.396 0.013 18053
542 1 1 . 1 1 116 116 ASN CB C 546 36.639 36.639 39.056 -2.417 18053
543 1 1 . 1 1 116 116 ASN H H 546 8.016 8.016 8.280 -0.264 18053
544 1 1 . 1 1 117 117 ALA N N 547 119.834 119.834 121.170 -1.336 18053
545 1 1 . 1 1 117 117 ALA HA H 547 3.866 3.866 4.004 -0.138 18053
546 1 1 . 1 1 117 117 ALA C C 547 177.772 177.772 178.253 -0.481 18053
547 1 1 . 1 1 117 117 ALA CA C 547 54.504 54.504 54.649 -0.145 18053
548 1 1 . 1 1 117 117 ALA CB C 547 18.200 18.200 18.468 -0.268 18053
549 1 1 . 1 1 117 117 ALA H H 547 6.444 6.444 8.199 -1.755 18053
550 1 1 . 1 1 118 118 ASP N N 548 115.646 115.646 116.990 -1.344 18053
551 1 1 . 1 1 118 118 ASP HA H 548 4.644 4.644 4.387 0.257 18053
552 1 1 . 1 1 118 118 ASP C C 548 176.052 176.052 177.257 -1.205 18053
553 1 1 . 1 1 118 118 ASP CA C 548 54.067 54.067 55.258 -1.191 18053
554 1 1 . 1 1 118 118 ASP CB C 548 41.674 41.674 41.370 0.305 18053
555 1 1 . 1 1 118 118 ASP H H 548 7.181 7.181 8.087 -0.906 18053
556 1 1 . 1 1 119 119 GLY N N 549 107.167 107.167 106.693 0.474 18053
557 1 1 . 1 1 119 119 GLY C C 549 173.841 173.841 172.992 0.849 18053
558 1 1 . 1 1 119 119 GLY CA C 549 45.455 45.455 44.869 0.586 18053
559 1 1 . 1 1 119 119 GLY H H 549 7.738 7.738 7.506 0.232 18053
560 1 1 . 1 1 120 120 GLU N N 550 121.196 121.196 118.786 2.410 18053
561 1 1 . 1 1 120 120 GLU HA H 550 4.112 4.112 4.539 -0.427 18053
562 1 1 . 1 1 120 120 GLU C C 550 175.588 175.588 175.403 0.185 18053
563 1 1 . 1 1 120 120 GLU CA C 550 54.831 54.831 54.938 -0.106 18053
564 1 1 . 1 1 120 120 GLU CB C 550 29.937 29.937 31.338 -1.401 18053
565 1 1 . 1 1 120 120 GLU H H 550 7.587 7.587 7.979 -0.392 18053
566 1 1 . 1 1 121 121 GLU N N 551 123.886 123.886 126.759 -2.873 18053
567 1 1 . 1 1 121 121 GLU HA H 551 4.276 4.276 4.318 -0.042 18053
568 1 1 . 1 1 121 121 GLU C C 551 176.817 176.817 176.497 0.320 18053
569 1 1 . 1 1 121 121 GLU CA C 551 56.796 56.796 56.724 0.072 18053
570 1 1 . 1 1 121 121 GLU CB C 551 28.955 28.955 28.093 0.862 18053
571 1 1 . 1 1 121 121 GLU H H 551 8.697 8.697 8.934 -0.237 18053
572 1 1 . 1 1 122 122 VAL N N 552 120.055 120.055 118.659 1.396 18053
573 1 1 . 1 1 122 122 VAL HA H 552 4.364 4.364 4.168 0.196 18053
574 1 1 . 1 1 122 122 VAL C C 552 175.998 175.998 175.492 0.506 18053
575 1 1 . 1 1 122 122 VAL CA C 552 61.655 61.655 62.125 -0.470 18053
576 1 1 . 1 1 122 122 VAL CB C 552 33.049 33.049 32.128 0.921 18053
577 1 1 . 1 1 122 122 VAL H H 552 8.845 8.845 8.065 0.780 18053
578 1 1 . 1 1 123 123 ALA N N 553 122.098 122.098 120.547 1.551 18053
579 1 1 . 1 1 123 123 ALA HA H 553 4.890 4.890 4.674 0.216 18053
580 1 1 . 1 1 123 123 ALA C C 553 175.261 175.261 174.902 0.359 18053
581 1 1 . 1 1 123 123 ALA CA C 553 52.757 52.757 51.166 1.591 18053
582 1 1 . 1 1 123 123 ALA CB C 553 22.267 22.267 22.267 -0.000 18053
583 1 1 . 1 1 123 123 ALA H H 553 7.788 7.788 7.803 -0.015 18053
584 1 1 . 1 1 124 124 MET N N 554 118.217 118.217 119.639 -1.422 18053
585 1 1 . 1 1 124 124 MET HA H 554 5.286 5.286 5.055 0.231 18053
586 1 1 . 1 1 124 124 MET C C 554 174.428 174.428 174.610 -0.182 18053
587 1 1 . 1 1 124 124 MET CA C 554 55.104 55.104 55.964 -0.860 18053
588 1 1 . 1 1 124 124 MET CB C 554 35.342 35.342 36.220 -0.878 18053
589 1 1 . 1 1 124 124 MET H H 554 8.693 8.693 8.365 0.328 18053
590 1 1 . 1 1 125 125 ARG N N 555 122.132 122.132 124.538 -2.406 18053
591 1 1 . 1 1 125 125 ARG HA H 555 4.900 4.900 4.803 0.097 18053
592 1 1 . 1 1 125 125 ARG CA C 555 56.388 56.388 55.239 1.149 18053
593 1 1 . 1 1 125 125 ARG CB C 555 34.378 34.378 33.734 0.643 18053
594 1 1 . 1 1 125 125 ARG H H 555 8.919 8.919 8.767 0.152 18053
595 1 1 . 1 1 126 126 THR HA H 556 4.685 4.685 4.602 0.083 18053
596 1 1 . 1 1 126 126 THR C C 556 172.436 172.436 173.881 -1.445 18053
597 1 1 . 1 1 126 126 THR CA C 556 61.382 61.382 62.567 -1.185 18053
598 1 1 . 1 1 126 126 THR CB C 556 70.444 70.444 68.830 1.614 18053
599 1 1 . 1 1 127 127 VAL N N 557 124.976 124.976 127.873 -2.897 18053
600 1 1 . 1 1 127 127 VAL HA H 557 4.146 4.146 4.057 0.089 18053
601 1 1 . 1 1 127 127 VAL C C 557 173.937 173.937 173.914 0.023 18053
602 1 1 . 1 1 127 127 VAL CA C 557 61.109 61.109 60.338 0.771 18053
603 1 1 . 1 1 127 127 VAL CB C 557 33.759 33.759 33.474 0.285 18053
604 1 1 . 1 1 127 127 VAL H H 557 8.127 8.127 8.046 0.082 18053
605 1 1 . 1 1 128 128 LYS N N 558 125.384 125.384 123.478 1.906 18053
606 1 1 . 1 1 128 128 LYS HA H 558 4.706 4.706 4.276 0.430 18053
607 1 1 . 1 1 128 128 LYS C C 558 175.534 175.534 175.253 0.281 18053
608 1 1 . 1 1 128 128 LYS CA C 558 54.886 54.886 53.897 0.989 18053
609 1 1 . 1 1 128 128 LYS CB C 558 34.673 34.673 35.390 -0.717 18053
610 1 1 . 1 1 128 128 LYS H H 558 8.289 8.289 8.205 0.084 18053
611 1 1 . 1 1 129 129 LYS N N 559 124.005 124.005 123.927 0.078 18053
612 1 1 . 1 1 129 129 LYS HA H 559 4.310 4.310 4.239 0.071 18053
613 1 1 . 1 1 129 129 LYS C C 559 176.571 176.571 176.113 0.458 18053
614 1 1 . 1 1 129 129 LYS CA C 559 56.742 56.742 57.109 -0.367 18053
615 1 1 . 1 1 129 129 LYS CB C 559 33.362 33.362 31.723 1.639 18053
616 1 1 . 1 1 129 129 LYS H H 559 8.461 8.461 8.326 0.135 18053
617 1 1 . 1 1 130 130 SER N N 560 117.195 117.195 119.117 -1.922 18053
618 1 1 . 1 1 130 130 SER HA H 560 4.384 4.384 4.558 -0.174 18053
619 1 1 . 1 1 130 130 SER C C 560 174.565 174.565 173.117 1.448 18053
620 1 1 . 1 1 130 130 SER CA C 560 58.434 58.434 57.997 0.437 18053
621 1 1 . 1 1 130 130 SER CB C 560 63.812 63.812 63.820 -0.008 18053
622 1 1 . 1 1 130 130 SER H H 560 8.465 8.465 8.057 0.408 18053
623 1 1 . 1 1 131 131 SER N N 561 118.149 118.149 116.308 1.841 18053
624 1 1 . 1 1 131 131 SER HA H 561 4.412 4.412 4.309 0.103 18053
625 1 1 . 1 1 131 131 SER C C 561 174.456 174.456 174.144 0.312 18053
626 1 1 . 1 1 131 131 SER CA C 561 58.489 58.489 58.490 -0.001 18053
627 1 1 . 1 1 131 131 SER CB C 561 63.811 63.811 63.510 0.301 18053
628 1 1 . 1 1 131 131 SER H H 561 8.336 8.336 7.872 0.464 18053
629 1 1 . 1 1 132 132 VAL N N 562 121.332 121.332 117.170 4.162 18053
630 1 1 . 1 1 132 132 VAL HA H 562 4.035 4.035 4.083 -0.048 18053
631 1 1 . 1 1 132 132 VAL C C 562 176.066 176.066 176.061 0.005 18053
632 1 1 . 1 1 132 132 VAL CA C 562 62.446 62.446 63.635 -1.189 18053
633 1 1 . 1 1 132 132 VAL CB C 562 32.394 32.394 32.091 0.303 18053
634 1 1 . 1 1 132 132 VAL H H 562 7.982 7.982 7.913 0.069 18053
635 1 1 . 1 1 133 133 MET N N 563 124.022 124.022 122.217 1.805 18053
636 1 1 . 1 1 133 133 MET HA H 563 4.385 4.385 4.557 -0.172 18053
637 1 1 . 1 1 133 133 MET C C 563 176.039 176.039 175.655 0.384 18053
638 1 1 . 1 1 133 133 MET CA C 563 55.350 55.350 54.882 0.468 18053
639 1 1 . 1 1 133 133 MET CB C 563 32.503 32.503 31.724 0.779 18053
640 1 1 . 1 1 133 133 MET H H 563 8.295 8.295 7.765 0.530 18053
641 1 1 . 1 1 134 134 ARG N N 564 122.677 122.677 124.205 -1.528 18053
642 1 1 . 1 1 134 134 ARG HA H 564 4.262 4.262 4.435 -0.173 18053
643 1 1 . 1 1 134 134 ARG C C 564 176.298 176.298 176.615 -0.317 18053
644 1 1 . 1 1 134 134 ARG CA C 564 56.087 56.087 56.323 -0.236 18053
645 1 1 . 1 1 134 134 ARG CB C 564 30.702 30.702 31.087 -0.385 18053
646 1 1 . 1 1 134 134 ARG H H 564 8.295 8.295 8.609 -0.314 18053
647 1 1 . 1 1 135 135 GLU N N 565 121.945 121.945 120.550 1.395 18053
648 1 1 . 1 1 135 135 GLU HA H 565 4.160 4.160 4.153 0.007 18053
649 1 1 . 1 1 135 135 GLU C C 565 176.080 176.080 176.384 -0.304 18053
650 1 1 . 1 1 135 135 GLU CA C 565 56.906 56.906 57.119 -0.213 18053
651 1 1 . 1 1 135 135 GLU CB C 565 29.774 29.774 28.668 1.106 18053
652 1 1 . 1 1 135 135 GLU H H 565 8.470 8.470 8.955 -0.485 18053
653 1 1 . 1 1 136 136 ASN N N 566 118.761 118.761 116.609 2.152 18053
654 1 1 . 1 1 136 136 ASN HA H 566 4.617 4.617 4.600 0.017 18053
655 1 1 . 1 1 136 136 ASN C C 566 175.315 175.315 175.735 -0.420 18053
656 1 1 . 1 1 136 136 ASN CA C 566 53.193 53.193 53.465 -0.272 18053
657 1 1 . 1 1 136 136 ASN CB C 566 38.836 38.836 38.328 0.508 18053
658 1 1 . 1 1 136 136 ASN H H 566 8.341 8.341 8.561 -0.220 18053
659 1 1 . 1 1 137 137 GLU N N 567 121.349 121.349 117.304 4.045 18053
660 1 1 . 1 1 137 137 GLU HA H 567 4.152 4.152 4.150 0.002 18053
661 1 1 . 1 1 137 137 GLU C C 567 176.243 176.243 176.289 -0.046 18053
662 1 1 . 1 1 137 137 GLU CA C 567 56.906 56.906 57.518 -0.612 18053
663 1 1 . 1 1 137 137 GLU CB C 567 29.992 29.992 29.067 0.925 18053
664 1 1 . 1 1 137 137 GLU H H 567 8.349 8.349 8.444 -0.095 18053
665 1 1 . 1 1 138 138 ASN N N 568 118.761 118.761 117.886 0.875 18053
666 1 1 . 1 1 138 138 ASN HA H 568 4.712 4.712 4.872 -0.160 18053
667 1 1 . 1 1 138 138 ASN C C 568 174.551 174.551 174.615 -0.064 18053
668 1 1 . 1 1 138 138 ASN CA C 568 53.193 53.193 52.238 0.955 18053
669 1 1 . 1 1 138 138 ASN CB C 568 39.327 39.327 38.129 1.198 18053
670 1 1 . 1 1 138 138 ASN H H 568 8.397 8.397 7.905 0.491 18053
671 1 2 . 1 1 20 20 ALA N N 450 125.180 125.180 126.141 -0.961 18053
672 1 2 . 1 1 20 20 ALA HA H 450 4.706 4.706 4.462 0.244 18053
673 1 2 . 1 1 20 20 ALA C C 450 177.226 177.226 176.930 0.296 18053
674 1 2 . 1 1 20 20 ALA CA C 450 52.757 52.757 52.280 0.477 18053
675 1 2 . 1 1 20 20 ALA CB C 450 20.411 20.411 18.380 2.031 18053
676 1 2 . 1 1 20 20 ALA H H 450 8.484 8.484 8.641 -0.157 18053
677 1 2 . 1 1 21 21 SER N N 451 115.714 115.714 118.340 -2.626 18053
678 1 2 . 1 1 21 21 SER HA H 451 4.513 4.513 4.412 0.101 18053
679 1 2 . 1 1 21 21 SER C C 451 174.742 174.742 175.094 -0.352 18053
680 1 2 . 1 1 21 21 SER CA C 451 58.516 58.516 57.876 0.640 18053
681 1 2 . 1 1 21 21 SER CB C 451 64.159 64.159 62.948 1.211 18053
682 1 2 . 1 1 21 21 SER H H 451 8.487 8.487 8.036 0.451 18053
683 1 2 . 1 1 22 22 GLY N N 452 111.509 111.509 115.738 -4.229 18053
684 1 2 . 1 1 22 22 GLY C C 452 174.401 174.401 175.556 -1.155 18053
685 1 2 . 1 1 22 22 GLY CA C 452 45.059 45.059 45.285 -0.226 18053
686 1 2 . 1 1 22 22 GLY H H 452 8.198 8.198 8.666 -0.468 18053
687 1 2 . 1 1 23 23 SER N N 453 116.191 116.191 116.025 0.166 18053
688 1 2 . 1 1 23 23 SER HA H 453 4.364 4.364 4.242 0.122 18053
689 1 2 . 1 1 23 23 SER C C 453 173.432 173.432 173.614 -0.182 18053
690 1 2 . 1 1 23 23 SER CA C 453 59.744 59.744 61.395 -1.651 18053
691 1 2 . 1 1 23 23 SER CB C 453 64.335 64.335 63.830 0.505 18053
692 1 2 . 1 1 23 23 SER H H 453 8.494 8.494 8.184 0.310 18053
693 1 2 . 1 1 24 24 VAL N N 454 121.656 121.656 116.808 4.848 18053
694 1 2 . 1 1 24 24 VAL HA H 454 5.035 5.035 4.242 0.793 18053
695 1 2 . 1 1 24 24 VAL C C 454 174.606 174.606 174.471 0.135 18053
696 1 2 . 1 1 24 24 VAL CA C 454 61.055 61.055 61.472 -0.417 18053
697 1 2 . 1 1 24 24 VAL CB C 454 32.503 32.503 34.278 -1.774 18053
698 1 2 . 1 1 24 24 VAL H H 454 7.830 7.830 7.779 0.051 18053
699 1 2 . 1 1 25 25 SER N N 455 119.323 119.323 118.856 0.467 18053
700 1 2 . 1 1 25 25 SER HA H 455 4.672 4.672 4.975 -0.303 18053
701 1 2 . 1 1 25 25 SER C C 455 174.426 174.426 173.202 1.224 18053
702 1 2 . 1 1 25 25 SER CA C 455 55.268 55.268 55.100 0.168 18053
703 1 2 . 1 1 25 25 SER CB C 455 65.162 65.162 65.805 -0.643 18053
704 1 2 . 1 1 25 25 SER H H 455 9.065 9.065 8.736 0.329 18053
705 1 2 . 1 1 26 26 ILE N N 456 119.468 119.468 122.193 -2.725 18053
706 1 2 . 1 1 26 26 ILE HA H 456 4.180 4.180 4.175 0.005 18053
707 1 2 . 1 1 26 26 ILE C C 456 175.506 175.506 175.809 -0.303 18053
708 1 2 . 1 1 26 26 ILE CA C 456 61.328 61.328 61.930 -0.602 18053
709 1 2 . 1 1 26 26 ILE CB C 456 37.962 37.962 37.958 0.004 18053
710 1 2 . 1 1 26 26 ILE H H 456 8.295 8.295 8.677 -0.382 18053
711 1 2 . 1 1 27 27 GLU N N 457 129.726 129.726 129.992 -0.266 18053
712 1 2 . 1 1 27 27 GLU HA H 457 4.228 4.228 4.299 -0.071 18053
713 1 2 . 1 1 27 27 GLU C C 457 175.179 175.179 176.058 -0.879 18053
714 1 2 . 1 1 27 27 GLU CA C 457 55.432 55.432 57.778 -2.346 18053
715 1 2 . 1 1 27 27 GLU CB C 457 30.142 30.142 31.107 -0.965 18053
716 1 2 . 1 1 27 27 GLU H H 457 8.393 8.393 8.693 -0.300 18053
717 1 2 . 1 1 28 28 GLU N N 458 117.076 117.076 115.677 1.399 18053
718 1 2 . 1 1 28 28 GLU HA H 458 4.168 4.168 4.686 -0.518 18053
719 1 2 . 1 1 28 28 GLU C C 458 174.701 174.701 174.798 -0.097 18053
720 1 2 . 1 1 28 28 GLU CA C 458 56.906 56.906 55.072 1.834 18053
721 1 2 . 1 1 28 28 GLU CB C 458 31.848 31.848 34.055 -2.207 18053
722 1 2 . 1 1 28 28 GLU H H 458 7.489 7.489 7.878 -0.389 18053
723 1 2 . 1 1 29 29 ILE N N 459 122.183 122.183 119.856 2.327 18053
724 1 2 . 1 1 29 29 ILE HA H 459 3.764 3.764 3.978 -0.214 18053
725 1 2 . 1 1 29 29 ILE C C 459 174.169 174.169 174.610 -0.441 18053
726 1 2 . 1 1 29 29 ILE CA C 459 59.526 59.526 59.339 0.187 18053
727 1 2 . 1 1 29 29 ILE CB C 459 40.309 40.309 41.083 -0.774 18053
728 1 2 . 1 1 29 29 ILE H H 459 8.126 8.126 8.306 -0.180 18053
729 1 2 . 1 1 30 30 ASP N N 460 123.205 123.205 124.056 -0.851 18053
730 1 2 . 1 1 30 30 ASP HA H 460 4.183 4.183 4.374 -0.191 18053
731 1 2 . 1 1 30 30 ASP C C 460 178.318 178.318 177.626 0.692 18053
732 1 2 . 1 1 30 30 ASP CA C 460 53.930 53.930 53.131 0.799 18053
733 1 2 . 1 1 30 30 ASP CB C 460 42.807 42.807 42.579 0.228 18053
734 1 2 . 1 1 30 30 ASP H H 460 6.704 6.704 7.529 -0.825 18053
735 1 2 . 1 1 31 31 LEU N N 461 128.551 128.551 119.944 8.607 18053
736 1 2 . 1 1 31 31 LEU HA H 461 4.064 4.064 4.363 -0.299 18053
737 1 2 . 1 1 31 31 LEU C C 461 177.513 177.513 177.755 -0.242 18053
738 1 2 . 1 1 31 31 LEU CA C 461 57.124 57.124 57.050 0.074 18053
739 1 2 . 1 1 31 31 LEU CB C 461 41.237 41.237 41.837 -0.600 18053
740 1 2 . 1 1 31 31 LEU H H 461 9.012 9.012 8.243 0.769 18053
741 1 2 . 1 1 32 32 GLU N N 462 115.101 115.101 117.783 -2.682 18053
742 1 2 . 1 1 32 32 GLU HA H 462 4.283 4.283 4.354 -0.071 18053
743 1 2 . 1 1 32 32 GLU C C 462 177.062 177.062 177.307 -0.245 18053
744 1 2 . 1 1 32 32 GLU CA C 462 55.759 55.759 56.363 -0.604 18053
745 1 2 . 1 1 32 32 GLU CB C 462 29.569 29.569 30.303 -0.734 18053
746 1 2 . 1 1 32 32 GLU H H 462 7.588 7.588 7.775 -0.187 18053
747 1 2 . 1 1 33 33 GLY N N 463 106.299 106.299 106.370 -0.071 18053
748 1 2 . 1 1 33 33 GLY C C 463 174.824 174.824 175.215 -0.391 18053
749 1 2 . 1 1 33 33 GLY CA C 463 46.806 46.806 45.592 1.214 18053
750 1 2 . 1 1 33 33 GLY H H 463 7.372 7.372 7.654 -0.282 18053
751 1 2 . 1 1 34 34 LYS N N 464 118.744 118.744 117.923 0.821 18053
752 1 2 . 1 1 34 34 LYS HA H 464 4.562 4.562 4.257 0.305 18053
753 1 2 . 1 1 34 34 LYS C C 464 177.076 177.076 175.245 1.831 18053
754 1 2 . 1 1 34 34 LYS CA C 464 59.963 59.963 56.742 3.221 18053
755 1 2 . 1 1 34 34 LYS CB C 464 33.111 33.111 33.028 0.083 18053
756 1 2 . 1 1 34 34 LYS H H 464 9.547 9.547 8.295 1.252 18053
757 1 2 . 1 1 35 35 PHE N N 465 109.125 109.125 112.270 -3.145 18053
758 1 2 . 1 1 35 35 PHE HA H 465 5.514 5.514 4.579 0.935 18053
759 1 2 . 1 1 35 35 PHE C C 465 174.183 174.183 172.627 1.556 18053
760 1 2 . 1 1 35 35 PHE CA C 465 56.632 56.632 55.592 1.040 18053
761 1 2 . 1 1 35 35 PHE CB C 465 40.599 40.599 40.734 -0.135 18053
762 1 2 . 1 1 35 35 PHE H H 465 6.740 6.740 7.068 -0.328 18053
763 1 2 . 1 1 36 36 VAL N N 466 119.579 119.579 120.324 -0.745 18053
764 1 2 . 1 1 36 36 VAL HA H 466 3.709 3.709 4.053 -0.344 18053
765 1 2 . 1 1 36 36 VAL C C 466 172.668 172.668 174.048 -1.380 18053
766 1 2 . 1 1 36 36 VAL CA C 466 62.692 62.692 60.979 1.713 18053
767 1 2 . 1 1 36 36 VAL CB C 466 36.215 36.215 33.884 2.331 18053
768 1 2 . 1 1 36 36 VAL H H 466 7.628 7.628 8.206 -0.578 18053
769 1 2 . 1 1 37 37 GLN N N 467 126.831 126.831 127.680 -0.849 18053
770 1 2 . 1 1 37 37 GLN HA H 467 5.449 5.449 4.567 0.882 18053
771 1 2 . 1 1 37 37 GLN C C 467 174.797 174.797 174.683 0.114 18053
772 1 2 . 1 1 37 37 GLN CA C 467 54.121 54.121 55.297 -1.176 18053
773 1 2 . 1 1 37 37 GLN CB C 467 34.623 34.623 30.382 4.241 18053
774 1 2 . 1 1 37 37 GLN H H 467 8.392 8.392 8.453 -0.061 18053
775 1 2 . 1 1 38 38 LEU N N 468 123.018 123.018 127.034 -4.016 18053
776 1 2 . 1 1 38 38 LEU HA H 468 5.422 5.422 5.264 0.158 18053
777 1 2 . 1 1 38 38 LEU C C 468 175.588 175.588 175.820 -0.232 18053
778 1 2 . 1 1 38 38 LEU CA C 468 52.702 52.702 53.361 -0.659 18053
779 1 2 . 1 1 38 38 LEU CB C 468 45.046 45.046 45.523 -0.476 18053
780 1 2 . 1 1 38 38 LEU H H 468 9.103 9.103 8.982 0.121 18053
781 1 2 . 1 1 39 39 LYS N N 469 118.983 118.983 120.498 -1.515 18053
782 1 2 . 1 1 39 39 LYS HA H 469 4.852 4.852 4.659 0.193 18053
783 1 2 . 1 1 39 39 LYS C C 469 173.309 173.309 174.401 -1.092 18053
784 1 2 . 1 1 39 39 LYS CA C 469 54.994 54.994 54.837 0.157 18053
785 1 2 . 1 1 39 39 LYS CB C 469 38.246 38.246 36.394 1.852 18053
786 1 2 . 1 1 39 39 LYS H H 469 8.496 8.496 8.848 -0.352 18053
787 1 2 . 1 1 40 40 ASN N N 470 121.758 121.758 125.634 -3.876 18053
788 1 2 . 1 1 40 40 ASN HA H 470 4.788 4.788 4.792 -0.004 18053
789 1 2 . 1 1 40 40 ASN C C 470 174.496 174.496 174.521 -0.025 18053
790 1 2 . 1 1 40 40 ASN CA C 470 51.119 51.119 53.843 -2.724 18053
791 1 2 . 1 1 40 40 ASN CB C 470 37.559 37.559 39.503 -1.944 18053
792 1 2 . 1 1 40 40 ASN H H 470 8.283 8.283 8.678 -0.395 18053
793 1 2 . 1 1 41 41 ASN N N 471 122.422 122.422 123.523 -1.101 18053
794 1 2 . 1 1 41 41 ASN HA H 471 4.588 4.588 4.918 -0.330 18053
795 1 2 . 1 1 41 41 ASN C C 471 174.810 174.810 174.489 0.321 18053
796 1 2 . 1 1 41 41 ASN CA C 471 53.985 53.985 52.282 1.703 18053
797 1 2 . 1 1 41 41 ASN CB C 471 39.600 39.600 39.434 0.166 18053
798 1 2 . 1 1 41 41 ASN H H 471 8.681 8.681 8.349 0.332 18053
799 1 2 . 1 1 42 42 SER N N 472 116.446 116.446 115.693 0.753 18053
800 1 2 . 1 1 42 42 SER HA H 472 4.719 4.719 4.381 0.338 18053
801 1 2 . 1 1 42 42 SER C C 472 172.804 172.804 174.401 -1.597 18053
802 1 2 . 1 1 42 42 SER CA C 472 57.288 57.288 58.212 -0.924 18053
803 1 2 . 1 1 42 42 SER CB C 472 66.241 66.241 64.097 2.144 18053
804 1 2 . 1 1 42 42 SER H H 472 8.370 8.370 7.808 0.562 18053
805 1 2 . 1 1 43 43 ASP N N 473 117.706 117.706 121.945 -4.239 18053
806 1 2 . 1 1 43 43 ASP HA H 473 4.474 4.474 4.696 -0.222 18053
807 1 2 . 1 1 43 43 ASP C C 473 175.343 175.343 176.234 -0.891 18053
808 1 2 . 1 1 43 43 ASP CA C 473 53.521 53.521 54.458 -0.937 18053
809 1 2 . 1 1 43 43 ASP CB C 473 40.322 40.322 40.797 -0.475 18053
810 1 2 . 1 1 43 43 ASP H H 473 8.254 8.254 8.596 -0.342 18053
811 1 2 . 1 1 44 44 LYS N N 474 120.209 120.209 119.805 0.404 18053
812 1 2 . 1 1 44 44 LYS HA H 474 4.569 4.569 4.512 0.057 18053
813 1 2 . 1 1 44 44 LYS C C 474 175.397 175.397 174.505 0.892 18053
814 1 2 . 1 1 44 44 LYS CA C 474 54.012 54.012 54.584 -0.572 18053
815 1 2 . 1 1 44 44 LYS CB C 474 35.383 35.383 34.455 0.928 18053
816 1 2 . 1 1 44 44 LYS H H 474 8.305 8.305 7.521 0.784 18053
817 1 2 . 1 1 45 45 ASP N N 475 124.993 124.993 118.639 6.354 18053
818 1 2 . 1 1 45 45 ASP HA H 475 3.975 3.975 4.518 -0.543 18053
819 1 2 . 1 1 45 45 ASP C C 475 174.810 174.810 175.721 -0.911 18053
820 1 2 . 1 1 45 45 ASP CA C 475 54.995 54.995 54.495 0.499 18053
821 1 2 . 1 1 45 45 ASP CB C 475 40.364 40.364 41.136 -0.772 18053
822 1 2 . 1 1 45 45 ASP H H 475 8.722 8.722 8.383 0.339 18053
823 1 2 . 1 1 46 46 GLN N N 476 120.549 120.549 123.218 -2.669 18053
824 1 2 . 1 1 46 46 GLN HA H 476 4.436 4.436 4.601 -0.165 18053
825 1 2 . 1 1 46 46 GLN C C 476 174.019 174.019 174.523 -0.504 18053
826 1 2 . 1 1 46 46 GLN CA C 476 53.138 53.138 54.423 -1.285 18053
827 1 2 . 1 1 46 46 GLN CB C 476 31.466 31.466 31.370 0.096 18053
828 1 2 . 1 1 46 46 GLN H H 476 7.878 7.878 8.617 -0.739 18053
829 1 2 . 1 1 47 47 SER N N 477 121.537 121.537 121.457 0.080 18053
830 1 2 . 1 1 47 47 SER HA H 477 4.229 4.229 4.291 -0.062 18053
831 1 2 . 1 1 47 47 SER C C 477 174.565 174.565 173.669 0.896 18053
832 1 2 . 1 1 47 47 SER CA C 477 58.706 58.706 58.600 0.106 18053
833 1 2 . 1 1 47 47 SER CB C 477 62.965 62.965 63.446 -0.481 18053
834 1 2 . 1 1 47 47 SER H H 477 8.748 8.748 8.693 0.055 18053
835 1 2 . 1 1 48 48 LEU N N 478 127.751 127.751 124.816 2.935 18053
836 1 2 . 1 1 48 48 LEU HA H 478 2.631 2.631 4.343 -1.712 18053
837 1 2 . 1 1 48 48 LEU C C 478 176.789 176.789 177.330 -0.541 18053
838 1 2 . 1 1 48 48 LEU CA C 478 52.102 52.102 53.885 -1.783 18053
839 1 2 . 1 1 48 48 LEU CB C 478 42.343 42.343 43.437 -1.094 18053
840 1 2 . 1 1 48 48 LEU H H 478 7.856 7.856 8.138 -0.282 18053
841 1 2 . 1 1 49 49 GLY N N 479 107.525 107.525 107.429 0.096 18053
842 1 2 . 1 1 49 49 GLY C C 479 176.653 176.653 175.164 1.489 18053
843 1 2 . 1 1 49 49 GLY CA C 479 48.062 48.062 45.894 2.168 18053
844 1 2 . 1 1 49 49 GLY H H 479 7.728 7.728 8.814 -1.086 18053
845 1 2 . 1 1 50 50 ASN N N 480 117.059 117.059 119.024 -1.965 18053
846 1 2 . 1 1 50 50 ASN HA H 480 4.255 4.255 4.632 -0.377 18053
847 1 2 . 1 1 50 50 ASN C C 480 174.961 174.961 174.978 -0.017 18053
848 1 2 . 1 1 50 50 ASN CA C 480 56.360 56.360 54.160 2.200 18053
849 1 2 . 1 1 50 50 ASN CB C 480 37.416 37.416 39.237 -1.821 18053
850 1 2 . 1 1 50 50 ASN H H 480 7.552 7.552 8.676 -1.124 18053
851 1 2 . 1 1 51 51 TRP N N 481 122.166 122.166 118.502 3.664 18053
852 1 2 . 1 1 51 51 TRP HA H 481 4.477 4.477 4.883 -0.406 18053
853 1 2 . 1 1 51 51 TRP C C 481 175.575 175.575 175.668 -0.093 18053
854 1 2 . 1 1 51 51 TRP CA C 481 58.762 58.762 58.406 0.356 18053
855 1 2 . 1 1 51 51 TRP CB C 481 28.041 28.041 29.850 -1.809 18053
856 1 2 . 1 1 51 51 TRP H H 481 8.914 8.914 7.853 1.061 18053
857 1 2 . 1 1 52 52 ARG N N 482 116.480 116.480 118.832 -2.352 18053
858 1 2 . 1 1 52 52 ARG HA H 482 5.968 5.968 5.161 0.807 18053
859 1 2 . 1 1 52 52 ARG C C 482 175.807 175.807 174.799 1.008 18053
860 1 2 . 1 1 52 52 ARG CA C 482 54.121 54.121 54.758 -0.638 18053
861 1 2 . 1 1 52 52 ARG CB C 482 35.124 35.124 34.028 1.096 18053
862 1 2 . 1 1 52 52 ARG H H 482 9.147 9.147 9.241 -0.094 18053
863 1 2 . 1 1 53 53 ILE N N 483 119.579 119.579 124.769 -5.190 18053
864 1 2 . 1 1 53 53 ILE HA H 483 4.985 4.985 4.636 0.349 18053
865 1 2 . 1 1 53 53 ILE C C 483 175.670 175.670 175.554 0.116 18053
866 1 2 . 1 1 53 53 ILE CA C 483 60.400 60.400 60.851 -0.451 18053
867 1 2 . 1 1 53 53 ILE CB C 483 40.227 40.227 38.505 1.722 18053
868 1 2 . 1 1 53 53 ILE H H 483 9.000 9.000 8.723 0.277 18053
869 1 2 . 1 1 54 54 LYS N N 484 124.737 124.737 129.034 -4.297 18053
870 1 2 . 1 1 54 54 LYS HA H 484 5.463 5.463 4.963 0.500 18053
871 1 2 . 1 1 54 54 LYS C C 484 175.575 175.575 175.645 -0.070 18053
872 1 2 . 1 1 54 54 LYS CA C 484 54.613 54.613 55.252 -0.638 18053
873 1 2 . 1 1 54 54 LYS CB C 484 35.041 35.041 32.640 2.401 18053
874 1 2 . 1 1 54 54 LYS H H 484 9.678 9.678 8.920 0.758 18053
875 1 2 . 1 1 55 55 ARG N N 485 124.090 124.090 126.779 -2.689 18053
876 1 2 . 1 1 55 55 ARG HA H 485 5.525 5.525 4.407 1.118 18053
877 1 2 . 1 1 55 55 ARG C C 485 174.155 174.155 174.966 -0.811 18053
878 1 2 . 1 1 55 55 ARG CA C 485 53.903 53.903 55.865 -1.962 18053
879 1 2 . 1 1 55 55 ARG H H 485 9.314 9.314 8.465 0.849 18053
880 1 2 . 1 1 56 56 GLN N N 486 126.576 126.576 127.392 -0.816 18053
881 1 2 . 1 1 56 56 GLN HA H 486 4.842 4.842 4.476 0.366 18053
882 1 2 . 1 1 56 56 GLN C C 486 174.991 174.991 174.146 0.845 18053
883 1 2 . 1 1 56 56 GLN CA C 486 54.831 54.831 54.731 0.100 18053
884 1 2 . 1 1 56 56 GLN CB C 486 31.465 31.465 29.369 2.096 18053
885 1 2 . 1 1 56 56 GLN H H 486 8.831 8.831 8.242 0.589 18053
886 1 2 . 1 1 57 57 VAL N N 487 126.712 126.712 126.941 -0.229 18053
887 1 2 . 1 1 57 57 VAL HA H 487 4.266 4.266 4.245 0.021 18053
888 1 2 . 1 1 57 57 VAL C C 487 175.916 175.916 177.091 -1.175 18053
889 1 2 . 1 1 57 57 VAL CA C 487 61.820 61.820 61.948 -0.128 18053
890 1 2 . 1 1 57 57 VAL CB C 487 32.803 32.803 31.996 0.807 18053
891 1 2 . 1 1 57 57 VAL H H 487 8.786 8.786 8.595 0.191 18053
892 1 2 . 1 1 58 58 LEU N N 488 127.274 127.274 126.511 0.763 18053
893 1 2 . 1 1 58 58 LEU HA H 488 4.085 4.085 4.108 -0.023 18053
894 1 2 . 1 1 58 58 LEU C C 488 177.158 177.158 177.971 -0.813 18053
895 1 2 . 1 1 58 58 LEU CA C 488 56.906 56.906 57.880 -0.974 18053
896 1 2 . 1 1 58 58 LEU CB C 488 41.374 41.374 41.655 -0.281 18053
897 1 2 . 1 1 58 58 LEU H H 488 8.316 8.316 8.470 -0.154 18053
898 1 2 . 1 1 59 59 GLU N N 489 119.647 119.647 118.818 0.829 18053
899 1 2 . 1 1 59 59 GLU HA H 489 4.112 4.112 4.192 -0.080 18053
900 1 2 . 1 1 59 59 GLU C C 489 176.230 176.230 177.407 -1.177 18053
901 1 2 . 1 1 59 59 GLU CA C 489 57.015 57.015 57.477 -0.463 18053
902 1 2 . 1 1 59 59 GLU CB C 489 28.149 28.149 29.828 -1.679 18053
903 1 2 . 1 1 59 59 GLU H H 489 8.636 8.636 8.429 0.207 18053
904 1 2 . 1 1 60 60 GLY N N 490 108.819 108.819 106.576 2.243 18053
905 1 2 . 1 1 60 60 GLY C C 490 173.568 173.568 173.797 -0.229 18053
906 1 2 . 1 1 60 60 GLY CA C 490 44.773 44.773 44.510 0.263 18053
907 1 2 . 1 1 60 60 GLY H H 490 8.160 8.160 7.735 0.425 18053
908 1 2 . 1 1 61 61 GLU N N 491 121.009 121.009 121.405 -0.396 18053
909 1 2 . 1 1 61 61 GLU HA H 491 4.323 4.323 4.596 -0.273 18053
910 1 2 . 1 1 61 61 GLU C C 491 175.725 175.725 175.034 0.691 18053
911 1 2 . 1 1 61 61 GLU CA C 491 56.196 56.196 55.178 1.018 18053
912 1 2 . 1 1 61 61 GLU CB C 491 30.865 30.865 31.048 -0.183 18053
913 1 2 . 1 1 61 61 GLU H H 491 8.320 8.320 7.855 0.465 18053
914 1 2 . 1 1 62 62 GLU N N 492 123.426 123.426 125.325 -1.899 18053
915 1 2 . 1 1 62 62 GLU HA H 492 5.054 5.054 4.950 0.104 18053
916 1 2 . 1 1 62 62 GLU C C 492 175.930 175.930 175.707 0.223 18053
917 1 2 . 1 1 62 62 GLU CA C 492 55.650 55.650 54.824 0.826 18053
918 1 2 . 1 1 62 62 GLU CB C 492 32.312 32.312 28.968 3.344 18053
919 1 2 . 1 1 62 62 GLU H H 492 8.594 8.594 8.678 -0.084 18053
920 1 2 . 1 1 63 63 ILE N N 493 119.732 119.732 118.985 0.747 18053
921 1 2 . 1 1 63 63 ILE HA H 493 4.788 4.788 4.798 -0.010 18053
922 1 2 . 1 1 63 63 ILE C C 493 174.647 174.647 174.328 0.319 18053
923 1 2 . 1 1 63 63 ILE CA C 493 60.181 60.181 59.646 0.535 18053
924 1 2 . 1 1 63 63 ILE CB C 493 41.183 41.183 40.648 0.535 18053
925 1 2 . 1 1 63 63 ILE H H 493 8.523 8.523 8.163 0.360 18053
926 1 2 . 1 1 64 64 ALA N N 494 122.166 122.166 122.465 -0.299 18053
927 1 2 . 1 1 64 64 ALA HA H 494 5.521 5.521 4.962 0.559 18053
928 1 2 . 1 1 64 64 ALA C C 494 174.606 174.606 175.604 -0.998 18053
929 1 2 . 1 1 64 64 ALA CA C 494 51.528 51.528 51.846 -0.318 18053
930 1 2 . 1 1 64 64 ALA CB C 494 22.239 22.239 21.619 0.620 18053
931 1 2 . 1 1 64 64 ALA H H 494 8.741 8.741 8.227 0.514 18053
932 1 2 . 1 1 65 65 TYR N N 495 126.729 126.729 125.019 1.710 18053
933 1 2 . 1 1 65 65 TYR HA H 495 3.094 3.094 4.200 -1.106 18053
934 1 2 . 1 1 65 65 TYR C C 495 173.036 173.036 173.429 -0.393 18053
935 1 2 . 1 1 65 65 TYR CA C 495 56.905 56.905 56.185 0.720 18053
936 1 2 . 1 1 65 65 TYR CB C 495 40.269 40.269 40.705 -0.436 18053
937 1 2 . 1 1 65 65 TYR H H 495 8.462 8.462 8.328 0.134 18053
938 1 2 . 1 1 66 66 LYS N N 496 128.108 128.108 126.789 1.319 18053
939 1 2 . 1 1 66 66 LYS HA H 496 4.822 4.822 4.487 0.335 18053
940 1 2 . 1 1 66 66 LYS C C 496 174.906 174.906 174.787 0.119 18053
941 1 2 . 1 1 66 66 LYS CA C 496 53.739 53.739 55.300 -1.561 18053
942 1 2 . 1 1 66 66 LYS CB C 496 34.782 34.782 33.567 1.215 18053
943 1 2 . 1 1 66 66 LYS H H 496 7.010 7.010 7.762 -0.752 18053
944 1 2 . 1 1 67 67 PHE N N 497 125.299 125.299 119.505 5.794 18053
945 1 2 . 1 1 67 67 PHE HA H 497 3.932 3.932 4.237 -0.305 18053
946 1 2 . 1 1 67 67 PHE C C 497 177.990 177.990 176.449 1.541 18053
947 1 2 . 1 1 67 67 PHE CA C 497 59.007 59.007 57.834 1.173 18053
948 1 2 . 1 1 67 67 PHE CB C 497 40.981 40.981 39.589 1.392 18053
949 1 2 . 1 1 67 67 PHE H H 497 8.509 8.509 8.489 0.021 18053
950 1 2 . 1 1 68 68 THR N N 498 116.191 116.191 113.201 2.990 18053
951 1 2 . 1 1 68 68 THR HA H 498 4.417 4.417 4.628 -0.211 18053
952 1 2 . 1 1 68 68 THR CA C 498 60.855 60.855 59.882 0.973 18053
953 1 2 . 1 1 68 68 THR CB C 498 68.019 68.019 68.442 -0.423 18053
954 1 2 . 1 1 68 68 THR H H 498 8.688 8.688 8.353 0.335 18053
955 1 2 . 1 1 69 69 PRO HA H 499 3.948 3.948 4.476 -0.528 18053
956 1 2 . 1 1 69 69 PRO C C 499 177.444 177.444 177.149 0.295 18053
957 1 2 . 1 1 69 69 PRO CA C 499 66.077 66.077 65.154 0.923 18053
958 1 2 . 1 1 69 69 PRO CB C 499 32.776 32.776 31.890 0.886 18053
959 1 2 . 1 1 70 70 LYS N N 500 113.552 113.552 115.900 -2.348 18053
960 1 2 . 1 1 70 70 LYS HA H 500 4.385 4.385 4.151 0.234 18053
961 1 2 . 1 1 70 70 LYS C C 500 176.325 176.325 176.709 -0.384 18053
962 1 2 . 1 1 70 70 LYS CA C 500 54.995 54.995 56.830 -1.835 18053
963 1 2 . 1 1 70 70 LYS CB C 500 31.793 31.793 31.674 0.119 18053
964 1 2 . 1 1 70 70 LYS H H 500 8.016 8.016 7.961 0.055 18053
965 1 2 . 1 1 71 71 TYR N N 501 121.860 121.860 121.629 0.231 18053
966 1 2 . 1 1 71 71 TYR HA H 501 3.730 3.730 4.381 -0.651 18053
967 1 2 . 1 1 71 71 TYR C C 501 174.838 174.838 173.815 1.023 18053
968 1 2 . 1 1 71 71 TYR CA C 501 62.310 62.310 59.156 3.154 18053
969 1 2 . 1 1 71 71 TYR CB C 501 38.781 38.781 39.242 -0.461 18053
970 1 2 . 1 1 71 71 TYR H H 501 7.460 7.460 7.728 -0.268 18053
971 1 2 . 1 1 72 72 ILE N N 502 129.487 129.487 127.758 1.729 18053
972 1 2 . 1 1 72 72 ILE HA H 502 3.928 3.928 4.300 -0.372 18053
973 1 2 . 1 1 72 72 ILE C C 502 172.968 172.968 174.208 -1.240 18053
974 1 2 . 1 1 72 72 ILE CA C 502 59.308 59.308 59.517 -0.208 18053
975 1 2 . 1 1 72 72 ILE CB C 502 40.910 40.910 40.356 0.554 18053
976 1 2 . 1 1 72 72 ILE H H 502 7.168 7.168 7.930 -0.762 18053
977 1 2 . 1 1 73 73 LEU N N 503 128.278 128.278 129.049 -0.771 18053
978 1 2 . 1 1 73 73 LEU HA H 503 4.493 4.493 4.452 0.041 18053
979 1 2 . 1 1 73 73 LEU C C 503 175.834 175.834 175.353 0.481 18053
980 1 2 . 1 1 73 73 LEU CA C 503 51.965 51.965 53.578 -1.613 18053
981 1 2 . 1 1 73 73 LEU CB C 503 42.548 42.548 44.471 -1.923 18053
982 1 2 . 1 1 73 73 LEU H H 503 8.483 8.483 8.590 -0.107 18053
983 1 2 . 1 1 74 74 ARG N N 504 129.589 129.589 125.494 4.095 18053
984 1 2 . 1 1 74 74 ARG HA H 504 3.743 3.743 4.382 -0.639 18053
985 1 2 . 1 1 74 74 ARG C C 504 175.233 175.233 175.281 -0.048 18053
986 1 2 . 1 1 74 74 ARG CA C 504 56.851 56.851 54.572 2.280 18053
987 1 2 . 1 1 74 74 ARG CB C 504 30.292 30.292 31.298 -1.006 18053
988 1 2 . 1 1 74 74 ARG H H 504 8.673 8.673 8.388 0.285 18053
989 1 2 . 1 1 75 75 ALA N N 505 123.205 123.205 124.350 -1.145 18053
990 1 2 . 1 1 75 75 ALA HA H 505 3.522 3.522 4.480 -0.958 18053
991 1 2 . 1 1 75 75 ALA C C 505 178.441 178.441 178.552 -0.111 18053
992 1 2 . 1 1 75 75 ALA CA C 505 53.794 53.794 52.160 1.634 18053
993 1 2 . 1 1 75 75 ALA CB C 505 18.910 18.910 18.719 0.191 18053
994 1 2 . 1 1 75 75 ALA H H 505 8.564 8.564 8.271 0.293 18053
995 1 2 . 1 1 76 76 GLY N N 506 112.241 112.241 111.974 0.267 18053
996 1 2 . 1 1 76 76 GLY C C 506 174.278 174.278 174.257 0.021 18053
997 1 2 . 1 1 76 76 GLY CA C 506 46.725 46.725 45.368 1.357 18053
998 1 2 . 1 1 76 76 GLY H H 506 7.381 7.381 8.657 -1.276 18053
999 1 2 . 1 1 77 77 GLN N N 507 117.382 117.382 118.124 -0.742 18053
1000 1 2 . 1 1 77 77 GLN HA H 507 4.364 4.364 4.704 -0.340 18053
1001 1 2 . 1 1 77 77 GLN C C 507 173.937 173.937 174.365 -0.428 18053
1002 1 2 . 1 1 77 77 GLN CA C 507 54.558 54.558 54.014 0.544 18053
1003 1 2 . 1 1 77 77 GLN CB C 507 30.073 30.073 31.886 -1.813 18053
1004 1 2 . 1 1 77 77 GLN H H 507 7.996 7.996 7.612 0.384 18053
1005 1 2 . 1 1 78 78 MET N N 508 116.957 116.957 115.433 1.524 18053
1006 1 2 . 1 1 78 78 MET HA H 508 5.388 5.388 4.773 0.615 18053
1007 1 2 . 1 1 78 78 MET C C 508 175.807 175.807 173.657 2.150 18053
1008 1 2 . 1 1 78 78 MET CA C 508 54.067 54.067 54.897 -0.830 18053
1009 1 2 . 1 1 78 78 MET CB C 508 37.198 37.198 36.220 0.978 18053
1010 1 2 . 1 1 78 78 MET H H 508 8.092 8.092 8.267 -0.175 18053
1011 1 2 . 1 1 79 79 VAL N N 509 119.340 119.340 119.065 0.275 18053
1012 1 2 . 1 1 79 79 VAL HA H 509 4.956 4.956 4.576 0.380 18053
1013 1 2 . 1 1 79 79 VAL C C 509 172.217 172.217 173.991 -1.774 18053
1014 1 2 . 1 1 79 79 VAL CA C 509 59.471 59.471 60.947 -1.476 18053
1015 1 2 . 1 1 79 79 VAL CB C 509 33.676 33.676 34.950 -1.274 18053
1016 1 2 . 1 1 79 79 VAL H H 509 8.534 8.534 8.303 0.231 18053
1017 1 2 . 1 1 80 80 THR N N 510 124.533 124.533 125.162 -0.629 18053
1018 1 2 . 1 1 80 80 THR HA H 510 4.586 4.586 5.004 -0.418 18053
1019 1 2 . 1 1 80 80 THR C C 510 172.215 172.215 174.356 -2.141 18053
1020 1 2 . 1 1 80 80 THR CA C 510 62.119 62.119 61.585 0.534 18053
1021 1 2 . 1 1 80 80 THR CB C 510 69.407 69.407 69.654 -0.247 18053
1022 1 2 . 1 1 80 80 THR H H 510 8.301 8.301 8.484 -0.183 18053
1023 1 2 . 1 1 81 81 VAL N N 511 127.002 127.002 123.524 3.478 18053
1024 1 2 . 1 1 81 81 VAL HA H 511 4.596 4.596 5.130 -0.534 18053
1025 1 2 . 1 1 81 81 VAL C C 511 176.667 176.667 174.443 2.224 18053
1026 1 2 . 1 1 81 81 VAL CA C 511 61.382 61.382 60.520 0.862 18053
1027 1 2 . 1 1 81 81 VAL CB C 511 30.945 30.945 32.935 -1.990 18053
1028 1 2 . 1 1 81 81 VAL H H 511 8.796 8.796 8.276 0.520 18053
1029 1 2 . 1 1 82 82 TRP N N 512 131.479 131.479 126.758 4.721 18053
1030 1 2 . 1 1 82 82 TRP HA H 512 5.338 5.338 5.396 -0.058 18053
1031 1 2 . 1 1 82 82 TRP C C 512 176.885 176.885 175.401 1.484 18053
1032 1 2 . 1 1 82 82 TRP CA C 512 56.442 56.442 55.838 0.604 18053
1033 1 2 . 1 1 82 82 TRP CB C 512 30.701 30.701 33.991 -3.290 18053
1034 1 2 . 1 1 82 82 TRP H H 512 9.924 9.924 9.166 0.758 18053
1035 1 2 . 1 1 83 83 ALA N N 513 123.954 123.954 121.342 2.612 18053
1036 1 2 . 1 1 83 83 ALA HA H 513 4.308 4.308 5.095 -0.787 18053
1037 1 2 . 1 1 83 83 ALA C C 513 178.140 178.140 178.293 -0.153 18053
1038 1 2 . 1 1 83 83 ALA CA C 513 52.211 52.211 50.941 1.270 18053
1039 1 2 . 1 1 83 83 ALA CB C 513 18.745 18.745 20.301 -1.556 18053
1040 1 2 . 1 1 83 83 ALA H H 513 9.048 9.048 8.688 0.360 18053
1041 1 2 . 1 1 84 84 ALA N N 514 125.146 125.146 126.730 -1.584 18053
1042 1 2 . 1 1 84 84 ALA HA H 514 3.951 3.951 4.085 -0.134 18053
1043 1 2 . 1 1 84 84 ALA C C 514 179.519 179.519 178.705 0.814 18053
1044 1 2 . 1 1 84 84 ALA CA C 514 54.804 54.804 55.019 -0.215 18053
1045 1 2 . 1 1 84 84 ALA CB C 514 18.582 18.582 19.023 -0.441 18053
1046 1 2 . 1 1 84 84 ALA H H 514 8.341 8.341 8.412 -0.071 18053
1047 1 2 . 1 1 85 85 GLY N N 515 103.388 103.388 104.059 -0.671 18053
1048 1 2 . 1 1 85 85 GLY C C 515 174.674 174.674 174.607 0.067 18053
1049 1 2 . 1 1 85 85 GLY CA C 515 45.878 45.878 44.594 1.284 18053
1050 1 2 . 1 1 85 85 GLY H H 515 7.996 7.996 7.761 0.235 18053
1051 1 2 . 1 1 86 86 ALA N N 516 120.140 120.140 124.123 -3.983 18053
1052 1 2 . 1 1 86 86 ALA HA H 516 4.344 4.344 4.590 -0.246 18053
1053 1 2 . 1 1 86 86 ALA C C 516 177.690 177.690 178.132 -0.442 18053
1054 1 2 . 1 1 86 86 ALA CA C 516 53.139 53.139 51.959 1.180 18053
1055 1 2 . 1 1 86 86 ALA CB C 516 20.547 20.547 19.447 1.100 18053
1056 1 2 . 1 1 86 86 ALA H H 516 7.474 7.474 7.279 0.195 18053
1057 1 2 . 1 1 87 87 GLY N N 517 105.720 105.720 108.302 -2.582 18053
1058 1 2 . 1 1 87 87 GLY C C 517 173.650 173.650 174.544 -0.894 18053
1059 1 2 . 1 1 87 87 GLY CA C 517 46.014 46.014 45.361 0.653 18053
1060 1 2 . 1 1 87 87 GLY H H 517 7.779 7.779 7.792 -0.013 18053
1061 1 2 . 1 1 88 88 VAL N N 518 121.537 121.537 118.583 2.954 18053
1062 1 2 . 1 1 88 88 VAL HA H 518 3.585 3.585 4.045 -0.460 18053
1063 1 2 . 1 1 88 88 VAL C C 518 174.851 174.851 175.190 -0.339 18053
1064 1 2 . 1 1 88 88 VAL CA C 518 61.274 61.274 61.047 0.227 18053
1065 1 2 . 1 1 88 88 VAL CB C 518 33.376 33.376 32.778 0.598 18053
1066 1 2 . 1 1 88 88 VAL H H 518 7.499 7.499 7.674 -0.175 18053
1067 1 2 . 1 1 89 89 ALA N N 519 128.295 128.295 129.244 -0.949 18053
1068 1 2 . 1 1 89 89 ALA HA H 519 4.192 4.192 4.346 -0.154 18053
1069 1 2 . 1 1 89 89 ALA C C 519 176.680 176.680 176.207 0.473 18053
1070 1 2 . 1 1 89 89 ALA CA C 519 51.283 51.283 51.353 -0.070 18053
1071 1 2 . 1 1 89 89 ALA CB C 519 19.292 19.292 19.334 -0.042 18053
1072 1 2 . 1 1 89 89 ALA H H 519 7.960 7.960 8.122 -0.162 18053
1073 1 2 . 1 1 90 90 HIS N N 520 122.643 122.643 122.908 -0.265 18053
1074 1 2 . 1 1 90 90 HIS HA H 520 4.033 4.033 4.399 -0.366 18053
1075 1 2 . 1 1 90 90 HIS C C 520 175.793 175.793 174.444 1.349 18053
1076 1 2 . 1 1 90 90 HIS CA C 520 58.653 58.653 56.144 2.509 18053
1077 1 2 . 1 1 90 90 HIS CB C 520 32.285 32.285 30.157 2.128 18053
1078 1 2 . 1 1 90 90 HIS H H 520 8.394 8.394 8.709 -0.315 18053
1079 1 2 . 1 1 91 91 SER N N 521 121.247 121.247 123.304 -2.057 18053
1080 1 2 . 1 1 91 91 SER HA H 521 4.629 4.629 4.712 -0.083 18053
1081 1 2 . 1 1 91 91 SER CA C 521 55.843 55.843 56.095 -0.252 18053
1082 1 2 . 1 1 91 91 SER CB C 521 62.367 62.367 63.393 -1.026 18053
1083 1 2 . 1 1 91 91 SER H H 521 8.569 8.569 8.341 0.228 18053
1084 1 2 . 1 1 92 92 PRO HA H 522 4.002 4.002 4.831 -0.829 18053
1085 1 2 . 1 1 92 92 PRO CA C 522 62.244 62.244 62.499 -0.255 18053
1086 1 2 . 1 1 92 92 PRO CB C 522 30.931 30.931 31.509 -0.577 18053
1087 1 2 . 1 1 93 93 PRO HA H 523 4.672 4.672 4.769 -0.097 18053
1088 1 2 . 1 1 93 93 PRO C C 523 177.786 177.786 178.040 -0.254 18053
1089 1 2 . 1 1 93 93 PRO CA C 523 64.003 64.003 63.982 0.021 18053
1090 1 2 . 1 1 93 93 PRO CB C 523 34.905 34.905 32.260 2.646 18053
1091 1 2 . 1 1 94 94 SER N N 524 117.212 117.212 115.794 1.418 18053
1092 1 2 . 1 1 94 94 SER HA H 524 4.678 4.678 4.416 0.262 18053
1093 1 2 . 1 1 94 94 SER C C 524 174.851 174.851 174.397 0.454 18053
1094 1 2 . 1 1 94 94 SER CA C 524 61.874 61.874 61.335 0.539 18053
1095 1 2 . 1 1 94 94 SER CB C 524 64.057 64.057 63.889 0.168 18053
1096 1 2 . 1 1 94 94 SER H H 524 8.463 8.463 8.127 0.336 18053
1097 1 2 . 1 1 95 95 THR N N 525 121.588 121.588 118.542 3.046 18053
1098 1 2 . 1 1 95 95 THR HA H 525 4.859 4.859 5.250 -0.391 18053
1099 1 2 . 1 1 95 95 THR C C 525 172.094 172.094 173.172 -1.078 18053
1100 1 2 . 1 1 95 95 THR CA C 525 62.309 62.309 61.661 0.648 18053
1101 1 2 . 1 1 95 95 THR CB C 525 70.281 70.281 70.175 0.105 18053
1102 1 2 . 1 1 95 95 THR H H 525 7.631 7.631 7.877 -0.246 18053
1103 1 2 . 1 1 96 96 LEU N N 526 127.274 127.274 128.789 -1.515 18053
1104 1 2 . 1 1 96 96 LEU HA H 526 5.131 5.131 5.329 -0.198 18053
1105 1 2 . 1 1 96 96 LEU C C 526 175.916 175.916 176.062 -0.146 18053
1106 1 2 . 1 1 96 96 LEU CA C 526 52.075 52.075 53.990 -1.915 18053
1107 1 2 . 1 1 96 96 LEU CB C 526 43.790 43.790 44.157 -0.367 18053
1108 1 2 . 1 1 96 96 LEU H H 526 8.977 8.977 8.469 0.508 18053
1109 1 2 . 1 1 97 97 VAL N N 527 124.056 124.056 120.126 3.930 18053
1110 1 2 . 1 1 97 97 VAL HA H 527 4.869 4.869 4.717 0.152 18053
1111 1 2 . 1 1 97 97 VAL C C 527 176.230 176.230 175.158 1.072 18053
1112 1 2 . 1 1 97 97 VAL CA C 527 61.519 61.519 61.639 -0.120 18053
1113 1 2 . 1 1 97 97 VAL CB C 527 33.704 33.704 33.964 -0.260 18053
1114 1 2 . 1 1 97 97 VAL H H 527 10.724 10.724 8.107 2.617 18053
1115 1 2 . 1 1 98 98 TRP N N 528 132.586 132.586 131.374 1.212 18053
1116 1 2 . 1 1 98 98 TRP HA H 528 4.965 4.965 4.343 0.622 18053
1117 1 2 . 1 1 98 98 TRP C C 528 173.391 173.391 174.312 -0.921 18053
1118 1 2 . 1 1 98 98 TRP CA C 528 53.303 53.303 55.402 -2.099 18053
1119 1 2 . 1 1 98 98 TRP CB C 528 28.245 28.245 29.484 -1.239 18053
1120 1 2 . 1 1 98 98 TRP H H 528 9.400 9.400 9.055 0.345 18053
1121 1 2 . 1 1 99 99 LYS N N 529 126.644 126.644 128.668 -2.024 18053
1122 1 2 . 1 1 99 99 LYS HA H 529 3.839 3.839 4.143 -0.304 18053
1123 1 2 . 1 1 99 99 LYS C C 529 177.581 177.581 177.125 0.456 18053
1124 1 2 . 1 1 99 99 LYS CA C 529 58.543 58.543 57.247 1.296 18053
1125 1 2 . 1 1 99 99 LYS CB C 529 32.176 32.176 32.941 -0.764 18053
1126 1 2 . 1 1 99 99 LYS H H 529 8.153 8.153 8.406 -0.253 18053
1127 1 2 . 1 1 100 100 GLY N N 530 110.385 110.385 113.198 -2.813 18053
1128 1 2 . 1 1 100 100 GLY C C 530 172.367 172.367 173.898 -1.531 18053
1129 1 2 . 1 1 100 100 GLY CA C 530 45.278 45.278 44.792 0.486 18053
1130 1 2 . 1 1 100 100 GLY H H 530 8.363 8.363 8.523 -0.160 18053
1131 1 2 . 1 1 101 101 GLN N N 531 121.162 121.162 122.426 -1.264 18053
1132 1 2 . 1 1 101 101 GLN HA H 531 3.972 3.972 4.093 -0.121 18053
1133 1 2 . 1 1 101 101 GLN CA C 531 52.620 52.620 55.108 -2.488 18053
1134 1 2 . 1 1 101 101 GLN CB C 531 27.595 27.595 27.470 0.125 18053
1135 1 2 . 1 1 101 101 GLN H H 531 6.815 6.815 7.420 -0.605 18053
1136 1 2 . 1 1 102 102 SER N N 532 122.728 122.728 121.401 1.327 18053
1137 1 2 . 1 1 102 102 SER HA H 532 3.866 3.866 4.351 -0.485 18053
1138 1 2 . 1 1 102 102 SER C C 532 174.537 174.537 175.858 -1.321 18053
1139 1 2 . 1 1 102 102 SER CA C 532 61.983 61.983 61.537 0.446 18053
1140 1 2 . 1 1 102 102 SER CB C 532 62.802 62.802 63.573 -0.771 18053
1141 1 2 . 1 1 102 102 SER H H 532 8.662 8.662 8.584 0.078 18053
1142 1 2 . 1 1 103 103 SER N N 533 110.811 110.811 115.454 -4.643 18053
1143 1 2 . 1 1 103 103 SER HA H 533 4.240 4.240 4.432 -0.192 18053
1144 1 2 . 1 1 103 103 SER C C 533 174.087 174.087 174.964 -0.877 18053
1145 1 2 . 1 1 103 103 SER CA C 533 56.633 56.633 58.900 -2.267 18053
1146 1 2 . 1 1 103 103 SER CB C 533 64.658 64.658 63.883 0.775 18053
1147 1 2 . 1 1 103 103 SER H H 533 7.134 7.134 7.406 -0.272 18053
1148 1 2 . 1 1 104 104 TRP N N 534 126.133 126.133 122.153 3.980 18053
1149 1 2 . 1 1 104 104 TRP HA H 534 4.098 4.098 4.071 0.027 18053
1150 1 2 . 1 1 104 104 TRP C C 534 176.066 176.066 175.115 0.951 18053
1151 1 2 . 1 1 104 104 TRP CA C 534 60.127 60.127 58.083 2.044 18053
1152 1 2 . 1 1 104 104 TRP CB C 534 28.764 28.764 28.574 0.190 18053
1153 1 2 . 1 1 104 104 TRP H H 534 9.764 9.764 7.579 2.185 18053
1154 1 2 . 1 1 105 105 GLY N N 535 105.907 105.907 106.008 -0.101 18053
1155 1 2 . 1 1 105 105 GLY C C 535 172.217 172.217 173.806 -1.589 18053
1156 1 2 . 1 1 105 105 GLY CA C 535 44.240 44.240 44.856 -0.616 18053
1157 1 2 . 1 1 105 105 GLY H H 535 8.095 8.095 7.679 0.416 18053
1158 1 2 . 1 1 106 106 THR N N 536 111.253 111.253 113.117 -1.864 18053
1159 1 2 . 1 1 106 106 THR HA H 536 3.859 3.859 4.022 -0.163 18053
1160 1 2 . 1 1 106 106 THR C C 536 172.872 172.872 175.144 -2.272 18053
1161 1 2 . 1 1 106 106 THR CA C 536 59.635 59.635 62.188 -2.553 18053
1162 1 2 . 1 1 106 106 THR CB C 536 70.526 70.526 69.436 1.090 18053
1163 1 2 . 1 1 106 106 THR H H 536 7.913 7.913 7.639 0.274 18053
1164 1 2 . 1 1 107 107 GLY N N 537 107.712 107.712 112.237 -4.525 18053
1165 1 2 . 1 1 107 107 GLY C C 537 172.709 172.709 172.943 -0.234 18053
1166 1 2 . 1 1 107 107 GLY CA C 537 45.166 45.166 45.558 -0.392 18053
1167 1 2 . 1 1 107 107 GLY H H 537 7.533 7.533 7.874 -0.341 18053
1168 1 2 . 1 1 108 108 GLU N N 538 118.864 118.864 120.177 -1.313 18053
1169 1 2 . 1 1 108 108 GLU HA H 538 4.136 4.136 4.407 -0.271 18053
1170 1 2 . 1 1 108 108 GLU C C 538 176.353 176.353 176.744 -0.391 18053
1171 1 2 . 1 1 108 108 GLU CA C 538 58.352 58.352 57.255 1.097 18053
1172 1 2 . 1 1 108 108 GLU CB C 538 30.156 30.156 30.884 -0.728 18053
1173 1 2 . 1 1 108 108 GLU H H 538 8.558 8.558 8.449 0.109 18053
1174 1 2 . 1 1 109 109 SER N N 539 110.419 110.419 115.674 -5.255 18053
1175 1 2 . 1 1 109 109 SER HA H 539 4.963 4.963 4.962 0.001 18053
1176 1 2 . 1 1 109 109 SER C C 539 173.787 173.787 172.999 0.788 18053
1177 1 2 . 1 1 109 109 SER CA C 539 57.125 57.125 58.088 -0.963 18053
1178 1 2 . 1 1 109 109 SER CB C 539 64.439 64.439 65.357 -0.918 18053
1179 1 2 . 1 1 109 109 SER H H 539 7.620 7.620 8.321 -0.701 18053
1180 1 2 . 1 1 110 110 PHE N N 540 118.778 118.778 119.502 -0.724 18053
1181 1 2 . 1 1 110 110 PHE HA H 540 5.081 5.081 5.158 -0.077 18053
1182 1 2 . 1 1 110 110 PHE C C 540 176.052 176.052 172.933 3.119 18053
1183 1 2 . 1 1 110 110 PHE CA C 540 56.789 56.789 56.732 0.057 18053
1184 1 2 . 1 1 110 110 PHE CB C 540 40.760 40.760 42.431 -1.671 18053
1185 1 2 . 1 1 110 110 PHE H H 540 8.318 8.318 8.473 -0.155 18053
1186 1 2 . 1 1 112 112 THR HA H 542 5.468 5.468 4.966 0.502 18053
1187 1 2 . 1 1 112 112 THR C C 542 172.381 172.381 173.352 -0.971 18053
1188 1 2 . 1 1 112 112 THR CA C 542 61.818 61.818 62.970 -1.152 18053
1189 1 2 . 1 1 112 112 THR CB C 542 70.990 70.990 70.306 0.684 18053
1190 1 2 . 1 1 113 113 VAL N N 543 124.771 124.771 127.068 -2.297 18053
1191 1 2 . 1 1 113 113 VAL HA H 543 4.864 4.864 4.570 0.294 18053
1192 1 2 . 1 1 113 113 VAL C C 543 173.132 173.132 174.209 -1.077 18053
1193 1 2 . 1 1 113 113 VAL CA C 543 60.099 60.099 61.279 -1.181 18053
1194 1 2 . 1 1 113 113 VAL CB C 543 36.433 36.433 33.598 2.835 18053
1195 1 2 . 1 1 113 113 VAL H H 543 9.380 9.380 9.066 0.314 18053
1196 1 2 . 1 1 114 114 LEU N N 544 128.789 128.789 130.006 -1.217 18053
1197 1 2 . 1 1 114 114 LEU HA H 544 5.320 5.320 5.109 0.211 18053
1198 1 2 . 1 1 114 114 LEU C C 544 174.237 174.237 175.126 -0.889 18053
1199 1 2 . 1 1 114 114 LEU CA C 544 53.193 53.193 54.308 -1.115 18053
1200 1 2 . 1 1 114 114 LEU CB C 544 45.879 45.879 43.913 1.966 18053
1201 1 2 . 1 1 114 114 LEU H H 544 8.948 8.948 8.299 0.649 18053
1202 1 2 . 1 1 115 115 VAL N N 545 127.002 127.002 124.482 2.520 18053
1203 1 2 . 1 1 115 115 VAL HA H 545 4.854 4.854 4.700 0.154 18053
1204 1 2 . 1 1 115 115 VAL C C 545 175.206 175.206 174.610 0.596 18053
1205 1 2 . 1 1 115 115 VAL CA C 545 59.334 59.334 59.575 -0.241 18053
1206 1 2 . 1 1 115 115 VAL CB C 545 34.495 34.495 35.771 -1.276 18053
1207 1 2 . 1 1 115 115 VAL H H 545 9.564 9.564 8.770 0.794 18053
1208 1 2 . 1 1 116 116 ASN N N 546 121.179 121.179 121.128 0.051 18053
1209 1 2 . 1 1 116 116 ASN HA H 546 2.897 2.897 4.120 -1.223 18053
1210 1 2 . 1 1 116 116 ASN C C 546 176.885 176.885 175.508 1.377 18053
1211 1 2 . 1 1 116 116 ASN CA C 546 50.409 50.409 51.296 -0.887 18053
1212 1 2 . 1 1 116 116 ASN CB C 546 36.639 36.639 39.807 -3.168 18053
1213 1 2 . 1 1 116 116 ASN H H 546 8.016 8.016 7.735 0.281 18053
1214 1 2 . 1 1 117 117 ALA N N 547 119.834 119.834 121.402 -1.568 18053
1215 1 2 . 1 1 117 117 ALA HA H 547 3.866 3.866 3.937 -0.071 18053
1216 1 2 . 1 1 117 117 ALA C C 547 177.772 177.772 178.675 -0.903 18053
1217 1 2 . 1 1 117 117 ALA CA C 547 54.504 54.504 54.860 -0.356 18053
1218 1 2 . 1 1 117 117 ALA CB C 547 18.200 18.200 18.513 -0.313 18053
1219 1 2 . 1 1 117 117 ALA H H 547 6.444 6.444 8.292 -1.848 18053
1220 1 2 . 1 1 118 118 ASP N N 548 115.646 115.646 116.941 -1.295 18053
1221 1 2 . 1 1 118 118 ASP HA H 548 4.644 4.644 4.361 0.283 18053
1222 1 2 . 1 1 118 118 ASP C C 548 176.052 176.052 177.421 -1.369 18053
1223 1 2 . 1 1 118 118 ASP CA C 548 54.067 54.067 55.779 -1.712 18053
1224 1 2 . 1 1 118 118 ASP CB C 548 41.674 41.674 41.335 0.339 18053
1225 1 2 . 1 1 118 118 ASP H H 548 7.181 7.181 7.953 -0.772 18053
1226 1 2 . 1 1 119 119 GLY N N 549 107.167 107.167 106.924 0.243 18053
1227 1 2 . 1 1 119 119 GLY C C 549 173.841 173.841 173.996 -0.155 18053
1228 1 2 . 1 1 119 119 GLY CA C 549 45.455 45.455 44.655 0.800 18053
1229 1 2 . 1 1 119 119 GLY H H 549 7.738 7.738 7.569 0.169 18053
1230 1 2 . 1 1 120 120 GLU N N 550 121.196 121.196 120.462 0.734 18053
1231 1 2 . 1 1 120 120 GLU HA H 550 4.112 4.112 4.240 -0.128 18053
1232 1 2 . 1 1 120 120 GLU C C 550 175.588 175.588 175.252 0.336 18053
1233 1 2 . 1 1 120 120 GLU CA C 550 54.831 54.831 55.831 -1.000 18053
1234 1 2 . 1 1 120 120 GLU CB C 550 29.937 29.937 30.202 -0.265 18053
1235 1 2 . 1 1 120 120 GLU H H 550 7.587 7.587 7.803 -0.216 18053
1236 1 2 . 1 1 121 121 GLU N N 551 123.886 123.886 123.407 0.479 18053
1237 1 2 . 1 1 121 121 GLU HA H 551 4.276 4.276 4.243 0.033 18053
1238 1 2 . 1 1 121 121 GLU C C 551 176.817 176.817 176.647 0.170 18053
1239 1 2 . 1 1 121 121 GLU CA C 551 56.796 56.796 56.528 0.268 18053
1240 1 2 . 1 1 121 121 GLU CB C 551 28.955 28.955 28.849 0.106 18053
1241 1 2 . 1 1 121 121 GLU H H 551 8.697 8.697 8.828 -0.131 18053
1242 1 2 . 1 1 122 122 VAL N N 552 120.055 120.055 118.866 1.189 18053
1243 1 2 . 1 1 122 122 VAL HA H 552 4.364 4.364 4.066 0.298 18053
1244 1 2 . 1 1 122 122 VAL C C 552 175.998 175.998 175.176 0.822 18053
1245 1 2 . 1 1 122 122 VAL CA C 552 61.655 61.655 62.593 -0.938 18053
1246 1 2 . 1 1 122 122 VAL CB C 552 33.049 33.049 32.285 0.764 18053
1247 1 2 . 1 1 122 122 VAL H H 552 8.845 8.845 8.003 0.842 18053
1248 1 2 . 1 1 123 123 ALA N N 553 122.098 122.098 120.972 1.126 18053
1249 1 2 . 1 1 123 123 ALA HA H 553 4.890 4.890 4.720 0.170 18053
1250 1 2 . 1 1 123 123 ALA C C 553 175.261 175.261 175.006 0.255 18053
1251 1 2 . 1 1 123 123 ALA CA C 553 52.757 52.757 52.268 0.489 18053
1252 1 2 . 1 1 123 123 ALA CB C 553 22.267 22.267 22.018 0.249 18053
1253 1 2 . 1 1 123 123 ALA H H 553 7.788 7.788 7.766 0.022 18053
1254 1 2 . 1 1 124 124 MET N N 554 118.217 118.217 120.846 -2.629 18053
1255 1 2 . 1 1 124 124 MET HA H 554 5.286 5.286 5.110 0.176 18053
1256 1 2 . 1 1 124 124 MET C C 554 174.428 174.428 174.102 0.326 18053
1257 1 2 . 1 1 124 124 MET CA C 554 55.104 55.104 55.862 -0.758 18053
1258 1 2 . 1 1 124 124 MET CB C 554 35.342 35.342 35.730 -0.388 18053
1259 1 2 . 1 1 124 124 MET H H 554 8.693 8.693 8.617 0.076 18053
1260 1 2 . 1 1 125 125 ARG N N 555 122.132 122.132 126.404 -4.272 18053
1261 1 2 . 1 1 125 125 ARG HA H 555 4.900 4.900 4.805 0.095 18053
1262 1 2 . 1 1 125 125 ARG CA C 555 56.388 56.388 54.922 1.466 18053
1263 1 2 . 1 1 125 125 ARG CB C 555 34.378 34.378 33.724 0.654 18053
1264 1 2 . 1 1 125 125 ARG H H 555 8.919 8.919 8.911 0.008 18053
1265 1 2 . 1 1 126 126 THR HA H 556 4.685 4.685 4.618 0.067 18053
1266 1 2 . 1 1 126 126 THR C C 556 172.436 172.436 173.984 -1.548 18053
1267 1 2 . 1 1 126 126 THR CA C 556 61.382 61.382 62.346 -0.964 18053
1268 1 2 . 1 1 126 126 THR CB C 556 70.444 70.444 69.307 1.137 18053
1269 1 2 . 1 1 127 127 VAL N N 557 124.976 124.976 128.267 -3.291 18053
1270 1 2 . 1 1 127 127 VAL HA H 557 4.146 4.146 4.098 0.048 18053
1271 1 2 . 1 1 127 127 VAL C C 557 173.937 173.937 173.529 0.408 18053
1272 1 2 . 1 1 127 127 VAL CA C 557 61.109 61.109 60.440 0.669 18053
1273 1 2 . 1 1 127 127 VAL CB C 557 33.759 33.759 34.160 -0.402 18053
1274 1 2 . 1 1 127 127 VAL H H 557 8.127 8.127 8.677 -0.550 18053
1275 1 2 . 1 1 128 128 LYS N N 558 125.384 125.384 125.361 0.023 18053
1276 1 2 . 1 1 128 128 LYS HA H 558 4.706 4.706 4.985 -0.279 18053
1277 1 2 . 1 1 128 128 LYS C C 558 175.534 175.534 175.946 -0.412 18053
1278 1 2 . 1 1 128 128 LYS CA C 558 54.886 54.886 52.674 2.212 18053
1279 1 2 . 1 1 128 128 LYS CB C 558 34.673 34.673 34.310 0.363 18053
1280 1 2 . 1 1 128 128 LYS H H 558 8.289 8.289 8.231 0.058 18053
1281 1 2 . 1 1 129 129 LYS N N 559 124.005 124.005 123.497 0.508 18053
1282 1 2 . 1 1 129 129 LYS HA H 559 4.310 4.310 4.169 0.141 18053
1283 1 2 . 1 1 129 129 LYS C C 559 176.571 176.571 175.712 0.859 18053
1284 1 2 . 1 1 129 129 LYS CA C 559 56.742 56.742 56.868 -0.126 18053
1285 1 2 . 1 1 129 129 LYS CB C 559 33.362 33.362 31.550 1.812 18053
1286 1 2 . 1 1 129 129 LYS H H 559 8.461 8.461 8.293 0.168 18053
1287 1 2 . 1 1 130 130 SER N N 560 117.195 117.195 120.886 -3.691 18053
1288 1 2 . 1 1 130 130 SER HA H 560 4.384 4.384 4.683 -0.299 18053
1289 1 2 . 1 1 130 130 SER C C 560 174.565 174.565 173.181 1.384 18053
1290 1 2 . 1 1 130 130 SER CA C 560 58.434 58.434 58.151 0.283 18053
1291 1 2 . 1 1 130 130 SER CB C 560 63.812 63.812 63.598 0.214 18053
1292 1 2 . 1 1 130 130 SER H H 560 8.465 8.465 8.200 0.265 18053
1293 1 2 . 1 1 131 131 SER N N 561 118.149 118.149 122.440 -4.291 18053
1294 1 2 . 1 1 131 131 SER HA H 561 4.412 4.412 4.766 -0.354 18053
1295 1 2 . 1 1 131 131 SER C C 561 174.456 174.456 173.837 0.619 18053
1296 1 2 . 1 1 131 131 SER CA C 561 58.489 58.489 58.498 -0.009 18053
1297 1 2 . 1 1 131 131 SER CB C 561 63.811 63.811 64.284 -0.473 18053
1298 1 2 . 1 1 131 131 SER H H 561 8.336 8.336 8.390 -0.054 18053
1299 1 2 . 1 1 132 132 VAL N N 562 121.332 121.332 123.027 -1.695 18053
1300 1 2 . 1 1 132 132 VAL HA H 562 4.035 4.035 4.362 -0.327 18053
1301 1 2 . 1 1 132 132 VAL C C 562 176.066 176.066 175.082 0.984 18053
1302 1 2 . 1 1 132 132 VAL CA C 562 62.446 62.446 62.585 -0.139 18053
1303 1 2 . 1 1 132 132 VAL CB C 562 32.394 32.394 32.388 0.006 18053
1304 1 2 . 1 1 132 132 VAL H H 562 7.982 7.982 8.534 -0.552 18053
1305 1 2 . 1 1 133 133 MET N N 563 124.022 124.022 119.750 4.272 18053
1306 1 2 . 1 1 133 133 MET HA H 563 4.385 4.385 4.854 -0.469 18053
1307 1 2 . 1 1 133 133 MET C C 563 176.039 176.039 175.103 0.936 18053
1308 1 2 . 1 1 133 133 MET CA C 563 55.350 55.350 54.592 0.758 18053
1309 1 2 . 1 1 133 133 MET CB C 563 32.503 32.503 33.969 -1.466 18053
1310 1 2 . 1 1 133 133 MET H H 563 8.295 8.295 7.541 0.754 18053
1311 1 2 . 1 1 134 134 ARG N N 564 122.677 122.677 120.418 2.259 18053
1312 1 2 . 1 1 134 134 ARG HA H 564 4.262 4.262 4.137 0.125 18053
1313 1 2 . 1 1 134 134 ARG C C 564 176.298 176.298 174.854 1.444 18053
1314 1 2 . 1 1 134 134 ARG CA C 564 56.087 56.087 56.295 -0.208 18053
1315 1 2 . 1 1 134 134 ARG CB C 564 30.702 30.702 30.211 0.491 18053
1316 1 2 . 1 1 134 134 ARG H H 564 8.295 8.295 8.426 -0.131 18053
1317 1 2 . 1 1 135 135 GLU N N 565 121.945 121.945 125.398 -3.453 18053
1318 1 2 . 1 1 135 135 GLU HA H 565 4.160 4.160 4.447 -0.287 18053
1319 1 2 . 1 1 135 135 GLU C C 565 176.080 176.080 176.139 -0.059 18053
1320 1 2 . 1 1 135 135 GLU CA C 565 56.906 56.906 56.057 0.849 18053
1321 1 2 . 1 1 135 135 GLU CB C 565 29.774 29.774 28.988 0.786 18053
1322 1 2 . 1 1 135 135 GLU H H 565 8.470 8.470 8.790 -0.320 18053
1323 1 2 . 1 1 136 136 ASN N N 566 118.761 118.761 121.532 -2.771 18053
1324 1 2 . 1 1 136 136 ASN HA H 566 4.617 4.617 4.758 -0.141 18053
1325 1 2 . 1 1 136 136 ASN C C 566 175.315 175.315 175.268 0.047 18053
1326 1 2 . 1 1 136 136 ASN CA C 566 53.193 53.193 52.614 0.579 18053
1327 1 2 . 1 1 136 136 ASN CB C 566 38.836 38.836 38.300 0.536 18053
1328 1 2 . 1 1 136 136 ASN H H 566 8.341 8.341 8.340 0.001 18053
1329 1 2 . 1 1 137 137 GLU N N 567 121.349 121.349 119.147 2.202 18053
1330 1 2 . 1 1 137 137 GLU HA H 567 4.152 4.152 4.039 0.113 18053
1331 1 2 . 1 1 137 137 GLU C C 567 176.243 176.243 177.202 -0.959 18053
1332 1 2 . 1 1 137 137 GLU CA C 567 56.906 56.906 58.300 -1.394 18053
1333 1 2 . 1 1 137 137 GLU CB C 567 29.992 29.992 29.664 0.328 18053
1334 1 2 . 1 1 137 137 GLU H H 567 8.349 8.349 8.153 0.196 18053
1335 1 2 . 1 1 138 138 ASN N N 568 118.761 118.761 118.858 -0.097 18053
1336 1 2 . 1 1 138 138 ASN HA H 568 4.712 4.712 4.755 -0.043 18053
1337 1 2 . 1 1 138 138 ASN C C 568 174.551 174.551 175.227 -0.676 18053
1338 1 2 . 1 1 138 138 ASN CA C 568 53.193 53.193 52.963 0.230 18053
1339 1 2 . 1 1 138 138 ASN CB C 568 39.327 39.327 38.858 0.469 18053
1340 1 2 . 1 1 138 138 ASN H H 568 8.397 8.397 8.122 0.275 18053
1341 1 3 . 1 1 20 20 ALA N N 450 125.180 125.180 127.514 -2.334 18053
1342 1 3 . 1 1 20 20 ALA HA H 450 4.706 4.706 4.854 -0.148 18053
1343 1 3 . 1 1 20 20 ALA C C 450 177.226 177.226 177.872 -0.646 18053
1344 1 3 . 1 1 20 20 ALA CA C 450 52.757 52.757 51.114 1.643 18053
1345 1 3 . 1 1 20 20 ALA CB C 450 20.411 20.411 19.602 0.809 18053
1346 1 3 . 1 1 20 20 ALA H H 450 8.484 8.484 8.268 0.216 18053
1347 1 3 . 1 1 21 21 SER N N 451 115.714 115.714 119.139 -3.425 18053
1348 1 3 . 1 1 21 21 SER HA H 451 4.513 4.513 4.445 0.068 18053
1349 1 3 . 1 1 21 21 SER C C 451 174.742 174.742 175.804 -1.062 18053
1350 1 3 . 1 1 21 21 SER CA C 451 58.516 58.516 58.240 0.276 18053
1351 1 3 . 1 1 21 21 SER CB C 451 64.159 64.159 62.118 2.041 18053
1352 1 3 . 1 1 21 21 SER H H 451 8.487 8.487 8.414 0.073 18053
1353 1 3 . 1 1 22 22 GLY N N 452 111.509 111.509 115.828 -4.319 18053
1354 1 3 . 1 1 22 22 GLY C C 452 174.401 174.401 174.816 -0.415 18053
1355 1 3 . 1 1 22 22 GLY CA C 452 45.059 45.059 46.659 -1.600 18053
1356 1 3 . 1 1 22 22 GLY H H 452 8.198 8.198 8.579 -0.381 18053
1357 1 3 . 1 1 23 23 SER N N 453 116.191 116.191 115.100 1.091 18053
1358 1 3 . 1 1 23 23 SER HA H 453 4.364 4.364 4.695 -0.331 18053
1359 1 3 . 1 1 23 23 SER C C 453 173.432 173.432 172.921 0.511 18053
1360 1 3 . 1 1 23 23 SER CA C 453 59.744 59.744 59.026 0.718 18053
1361 1 3 . 1 1 23 23 SER CB C 453 64.335 64.335 65.269 -0.934 18053
1362 1 3 . 1 1 23 23 SER H H 453 8.494 8.494 8.597 -0.103 18053
1363 1 3 . 1 1 24 24 VAL N N 454 121.656 121.656 123.642 -1.986 18053
1364 1 3 . 1 1 24 24 VAL HA H 454 5.035 5.035 4.280 0.755 18053
1365 1 3 . 1 1 24 24 VAL C C 454 174.606 174.606 175.824 -1.218 18053
1366 1 3 . 1 1 24 24 VAL CA C 454 61.055 61.055 62.089 -1.034 18053
1367 1 3 . 1 1 24 24 VAL CB C 454 32.503 32.503 32.117 0.386 18053
1368 1 3 . 1 1 24 24 VAL H H 454 7.830 7.830 7.939 -0.109 18053
1369 1 3 . 1 1 25 25 SER N N 455 119.323 119.323 121.809 -2.486 18053
1370 1 3 . 1 1 25 25 SER HA H 455 4.672 4.672 5.007 -0.335 18053
1371 1 3 . 1 1 25 25 SER C C 455 174.426 174.426 173.985 0.441 18053
1372 1 3 . 1 1 25 25 SER CA C 455 55.268 55.268 56.449 -1.181 18053
1373 1 3 . 1 1 25 25 SER CB C 455 65.162 65.162 66.027 -0.865 18053
1374 1 3 . 1 1 25 25 SER H H 455 9.065 9.065 8.943 0.122 18053
1375 1 3 . 1 1 26 26 ILE N N 456 119.468 119.468 123.547 -4.079 18053
1376 1 3 . 1 1 26 26 ILE HA H 456 4.180 4.180 4.160 0.020 18053
1377 1 3 . 1 1 26 26 ILE C C 456 175.506 175.506 176.070 -0.564 18053
1378 1 3 . 1 1 26 26 ILE CA C 456 61.328 61.328 62.026 -0.698 18053
1379 1 3 . 1 1 26 26 ILE CB C 456 37.962 37.962 37.081 0.881 18053
1380 1 3 . 1 1 26 26 ILE H H 456 8.295 8.295 8.819 -0.524 18053
1381 1 3 . 1 1 27 27 GLU N N 457 129.726 129.726 130.361 -0.635 18053
1382 1 3 . 1 1 27 27 GLU HA H 457 4.228 4.228 4.243 -0.015 18053
1383 1 3 . 1 1 27 27 GLU C C 457 175.179 175.179 176.307 -1.128 18053
1384 1 3 . 1 1 27 27 GLU CA C 457 55.432 55.432 58.285 -2.853 18053
1385 1 3 . 1 1 27 27 GLU CB C 457 30.142 30.142 30.531 -0.389 18053
1386 1 3 . 1 1 27 27 GLU H H 457 8.393 8.393 8.574 -0.181 18053
1387 1 3 . 1 1 28 28 GLU N N 458 117.076 117.076 115.409 1.667 18053
1388 1 3 . 1 1 28 28 GLU HA H 458 4.168 4.168 4.705 -0.537 18053
1389 1 3 . 1 1 28 28 GLU C C 458 174.701 174.701 174.680 0.021 18053
1390 1 3 . 1 1 28 28 GLU CA C 458 56.906 56.906 55.215 1.691 18053
1391 1 3 . 1 1 28 28 GLU CB C 458 31.848 31.848 33.845 -1.997 18053
1392 1 3 . 1 1 28 28 GLU H H 458 7.489 7.489 7.948 -0.459 18053
1393 1 3 . 1 1 29 29 ILE N N 459 122.183 122.183 119.347 2.836 18053
1394 1 3 . 1 1 29 29 ILE HA H 459 3.764 3.764 3.994 -0.230 18053
1395 1 3 . 1 1 29 29 ILE C C 459 174.169 174.169 174.618 -0.449 18053
1396 1 3 . 1 1 29 29 ILE CA C 459 59.526 59.526 59.442 0.084 18053
1397 1 3 . 1 1 29 29 ILE CB C 459 40.309 40.309 41.470 -1.161 18053
1398 1 3 . 1 1 29 29 ILE H H 459 8.126 8.126 8.283 -0.157 18053
1399 1 3 . 1 1 30 30 ASP N N 460 123.205 123.205 123.255 -0.050 18053
1400 1 3 . 1 1 30 30 ASP HA H 460 4.183 4.183 4.272 -0.089 18053
1401 1 3 . 1 1 30 30 ASP C C 460 178.318 178.318 177.961 0.357 18053
1402 1 3 . 1 1 30 30 ASP CA C 460 53.930 53.930 54.161 -0.231 18053
1403 1 3 . 1 1 30 30 ASP CB C 460 42.807 42.807 42.334 0.473 18053
1404 1 3 . 1 1 30 30 ASP H H 460 6.704 6.704 7.388 -0.684 18053
1405 1 3 . 1 1 31 31 LEU N N 461 128.551 128.551 121.632 6.919 18053
1406 1 3 . 1 1 31 31 LEU HA H 461 4.064 4.064 4.094 -0.030 18053
1407 1 3 . 1 1 31 31 LEU C C 461 177.513 177.513 177.084 0.429 18053
1408 1 3 . 1 1 31 31 LEU CA C 461 57.124 57.124 57.384 -0.260 18053
1409 1 3 . 1 1 31 31 LEU CB C 461 41.237 41.237 41.854 -0.617 18053
1410 1 3 . 1 1 31 31 LEU H H 461 9.012 9.012 8.236 0.776 18053
1411 1 3 . 1 1 32 32 GLU N N 462 115.101 115.101 116.705 -1.604 18053
1412 1 3 . 1 1 32 32 GLU HA H 462 4.283 4.283 4.304 -0.021 18053
1413 1 3 . 1 1 32 32 GLU C C 462 177.062 177.062 176.712 0.350 18053
1414 1 3 . 1 1 32 32 GLU CA C 462 55.759 55.759 57.096 -1.337 18053
1415 1 3 . 1 1 32 32 GLU CB C 462 29.569 29.569 30.887 -1.318 18053
1416 1 3 . 1 1 32 32 GLU H H 462 7.588 7.588 7.927 -0.339 18053
1417 1 3 . 1 1 33 33 GLY N N 463 106.299 106.299 106.210 0.089 18053
1418 1 3 . 1 1 33 33 GLY C C 463 174.824 174.824 175.214 -0.390 18053
1419 1 3 . 1 1 33 33 GLY CA C 463 46.806 46.806 45.063 1.743 18053
1420 1 3 . 1 1 33 33 GLY H H 463 7.372 7.372 7.977 -0.605 18053
1421 1 3 . 1 1 34 34 LYS N N 464 118.744 118.744 118.763 -0.019 18053
1422 1 3 . 1 1 34 34 LYS HA H 464 4.562 4.562 4.331 0.231 18053
1423 1 3 . 1 1 34 34 LYS C C 464 177.076 177.076 175.514 1.562 18053
1424 1 3 . 1 1 34 34 LYS CA C 464 59.963 59.963 57.068 2.895 18053
1425 1 3 . 1 1 34 34 LYS CB C 464 33.111 33.111 32.873 0.238 18053
1426 1 3 . 1 1 34 34 LYS H H 464 9.547 9.547 8.091 1.456 18053
1427 1 3 . 1 1 35 35 PHE N N 465 109.125 109.125 112.539 -3.414 18053
1428 1 3 . 1 1 35 35 PHE HA H 465 5.514 5.514 5.437 0.077 18053
1429 1 3 . 1 1 35 35 PHE C C 465 174.183 174.183 173.143 1.040 18053
1430 1 3 . 1 1 35 35 PHE CA C 465 56.632 56.632 55.541 1.091 18053
1431 1 3 . 1 1 35 35 PHE CB C 465 40.599 40.599 41.062 -0.463 18053
1432 1 3 . 1 1 35 35 PHE H H 465 6.740 6.740 7.189 -0.449 18053
1433 1 3 . 1 1 36 36 VAL N N 466 119.579 119.579 120.256 -0.677 18053
1434 1 3 . 1 1 36 36 VAL HA H 466 3.709 3.709 4.301 -0.592 18053
1435 1 3 . 1 1 36 36 VAL C C 466 172.668 172.668 174.359 -1.691 18053
1436 1 3 . 1 1 36 36 VAL CA C 466 62.692 62.692 61.602 1.090 18053
1437 1 3 . 1 1 36 36 VAL CB C 466 36.215 36.215 34.830 1.385 18053
1438 1 3 . 1 1 36 36 VAL H H 466 7.628 7.628 8.886 -1.258 18053
1439 1 3 . 1 1 37 37 GLN N N 467 126.831 126.831 127.726 -0.895 18053
1440 1 3 . 1 1 37 37 GLN HA H 467 5.449 5.449 4.706 0.743 18053
1441 1 3 . 1 1 37 37 GLN C C 467 174.797 174.797 174.707 0.090 18053
1442 1 3 . 1 1 37 37 GLN CA C 467 54.121 54.121 55.043 -0.922 18053
1443 1 3 . 1 1 37 37 GLN CB C 467 34.623 34.623 29.577 5.046 18053
1444 1 3 . 1 1 37 37 GLN H H 467 8.392 8.392 8.590 -0.198 18053
1445 1 3 . 1 1 38 38 LEU N N 468 123.018 123.018 127.151 -4.133 18053
1446 1 3 . 1 1 38 38 LEU HA H 468 5.422 5.422 5.242 0.180 18053
1447 1 3 . 1 1 38 38 LEU C C 468 175.588 175.588 176.041 -0.453 18053
1448 1 3 . 1 1 38 38 LEU CA C 468 52.702 52.702 53.544 -0.842 18053
1449 1 3 . 1 1 38 38 LEU CB C 468 45.046 45.046 45.339 -0.293 18053
1450 1 3 . 1 1 38 38 LEU H H 468 9.103 9.103 8.918 0.185 18053
1451 1 3 . 1 1 39 39 LYS N N 469 118.983 118.983 120.410 -1.427 18053
1452 1 3 . 1 1 39 39 LYS HA H 469 4.852 4.852 4.827 0.025 18053
1453 1 3 . 1 1 39 39 LYS C C 469 173.309 173.309 174.263 -0.954 18053
1454 1 3 . 1 1 39 39 LYS CA C 469 54.994 54.994 54.699 0.295 18053
1455 1 3 . 1 1 39 39 LYS CB C 469 38.246 38.246 36.591 1.655 18053
1456 1 3 . 1 1 39 39 LYS H H 469 8.496 8.496 8.838 -0.342 18053
1457 1 3 . 1 1 40 40 ASN N N 470 121.758 121.758 124.400 -2.642 18053
1458 1 3 . 1 1 40 40 ASN HA H 470 4.788 4.788 4.998 -0.210 18053
1459 1 3 . 1 1 40 40 ASN C C 470 174.496 174.496 174.060 0.436 18053
1460 1 3 . 1 1 40 40 ASN CA C 470 51.119 51.119 52.302 -1.183 18053
1461 1 3 . 1 1 40 40 ASN CB C 470 37.559 37.559 40.119 -2.560 18053
1462 1 3 . 1 1 40 40 ASN H H 470 8.283 8.283 8.764 -0.481 18053
1463 1 3 . 1 1 41 41 ASN N N 471 122.422 122.422 124.609 -2.187 18053
1464 1 3 . 1 1 41 41 ASN HA H 471 4.588 4.588 4.953 -0.365 18053
1465 1 3 . 1 1 41 41 ASN C C 471 174.810 174.810 173.895 0.915 18053
1466 1 3 . 1 1 41 41 ASN CA C 471 53.985 53.985 52.732 1.253 18053
1467 1 3 . 1 1 41 41 ASN CB C 471 39.600 39.600 39.787 -0.187 18053
1468 1 3 . 1 1 41 41 ASN H H 471 8.681 8.681 8.543 0.138 18053
1469 1 3 . 1 1 42 42 SER N N 472 116.446 116.446 116.646 -0.200 18053
1470 1 3 . 1 1 42 42 SER HA H 472 4.719 4.719 4.587 0.132 18053
1471 1 3 . 1 1 42 42 SER C C 472 172.804 172.804 173.620 -0.816 18053
1472 1 3 . 1 1 42 42 SER CA C 472 57.288 57.288 57.292 -0.005 18053
1473 1 3 . 1 1 42 42 SER CB C 472 66.241 66.241 65.693 0.548 18053
1474 1 3 . 1 1 42 42 SER H H 472 8.370 8.370 8.172 0.198 18053
1475 1 3 . 1 1 43 43 ASP N N 473 117.706 117.706 121.689 -3.983 18053
1476 1 3 . 1 1 43 43 ASP HA H 473 4.474 4.474 4.491 -0.017 18053
1477 1 3 . 1 1 43 43 ASP C C 473 175.343 175.343 175.428 -0.085 18053
1478 1 3 . 1 1 43 43 ASP CA C 473 53.521 53.521 56.487 -2.966 18053
1479 1 3 . 1 1 43 43 ASP CB C 473 40.322 40.322 41.306 -0.984 18053
1480 1 3 . 1 1 43 43 ASP H H 473 8.254 8.254 8.727 -0.473 18053
1481 1 3 . 1 1 44 44 LYS N N 474 120.209 120.209 118.203 2.006 18053
1482 1 3 . 1 1 44 44 LYS HA H 474 4.569 4.569 4.507 0.062 18053
1483 1 3 . 1 1 44 44 LYS C C 474 175.397 175.397 174.251 1.146 18053
1484 1 3 . 1 1 44 44 LYS CA C 474 54.012 54.012 54.721 -0.709 18053
1485 1 3 . 1 1 44 44 LYS CB C 474 35.383 35.383 34.128 1.255 18053
1486 1 3 . 1 1 44 44 LYS H H 474 8.305 8.305 7.600 0.705 18053
1487 1 3 . 1 1 45 45 ASP N N 475 124.993 124.993 118.274 6.719 18053
1488 1 3 . 1 1 45 45 ASP HA H 475 3.975 3.975 4.301 -0.326 18053
1489 1 3 . 1 1 45 45 ASP C C 475 174.810 174.810 175.933 -1.123 18053
1490 1 3 . 1 1 45 45 ASP CA C 475 54.995 54.995 54.450 0.545 18053
1491 1 3 . 1 1 45 45 ASP CB C 475 40.364 40.364 40.250 0.114 18053
1492 1 3 . 1 1 45 45 ASP H H 475 8.722 8.722 8.301 0.421 18053
1493 1 3 . 1 1 46 46 GLN N N 476 120.549 120.549 125.336 -4.787 18053
1494 1 3 . 1 1 46 46 GLN HA H 476 4.436 4.436 4.213 0.223 18053
1495 1 3 . 1 1 46 46 GLN C C 476 174.019 174.019 175.238 -1.219 18053
1496 1 3 . 1 1 46 46 GLN CA C 476 53.138 53.138 55.278 -2.140 18053
1497 1 3 . 1 1 46 46 GLN CB C 476 31.466 31.466 28.819 2.647 18053
1498 1 3 . 1 1 46 46 GLN H H 476 7.878 7.878 8.231 -0.353 18053
1499 1 3 . 1 1 47 47 SER N N 477 121.537 121.537 122.376 -0.839 18053
1500 1 3 . 1 1 47 47 SER HA H 477 4.229 4.229 4.260 -0.031 18053
1501 1 3 . 1 1 47 47 SER C C 477 174.565 174.565 173.745 0.820 18053
1502 1 3 . 1 1 47 47 SER CA C 477 58.706 58.706 58.931 -0.224 18053
1503 1 3 . 1 1 47 47 SER CB C 477 62.965 62.965 62.917 0.048 18053
1504 1 3 . 1 1 47 47 SER H H 477 8.748 8.748 8.742 0.006 18053
1505 1 3 . 1 1 48 48 LEU N N 478 127.751 127.751 126.874 0.877 18053
1506 1 3 . 1 1 48 48 LEU HA H 478 2.631 2.631 4.379 -1.748 18053
1507 1 3 . 1 1 48 48 LEU C C 478 176.789 176.789 176.265 0.524 18053
1508 1 3 . 1 1 48 48 LEU CA C 478 52.102 52.102 54.083 -1.980 18053
1509 1 3 . 1 1 48 48 LEU CB C 478 42.343 42.343 43.306 -0.963 18053
1510 1 3 . 1 1 48 48 LEU H H 478 7.856 7.856 7.680 0.176 18053
1511 1 3 . 1 1 49 49 GLY N N 479 107.525 107.525 108.681 -1.156 18053
1512 1 3 . 1 1 49 49 GLY C C 479 176.653 176.653 175.464 1.189 18053
1513 1 3 . 1 1 49 49 GLY CA C 479 48.062 48.062 45.771 2.291 18053
1514 1 3 . 1 1 49 49 GLY H H 479 7.728 7.728 8.658 -0.930 18053
1515 1 3 . 1 1 50 50 ASN N N 480 117.059 117.059 119.785 -2.726 18053
1516 1 3 . 1 1 50 50 ASN HA H 480 4.255 4.255 4.571 -0.316 18053
1517 1 3 . 1 1 50 50 ASN C C 480 174.961 174.961 175.667 -0.706 18053
1518 1 3 . 1 1 50 50 ASN CA C 480 56.360 56.360 55.237 1.123 18053
1519 1 3 . 1 1 50 50 ASN CB C 480 37.416 37.416 38.760 -1.344 18053
1520 1 3 . 1 1 50 50 ASN H H 480 7.552 7.552 8.799 -1.247 18053
1521 1 3 . 1 1 51 51 TRP N N 481 122.166 122.166 118.918 3.248 18053
1522 1 3 . 1 1 51 51 TRP HA H 481 4.477 4.477 4.819 -0.342 18053
1523 1 3 . 1 1 51 51 TRP C C 481 175.575 175.575 175.479 0.096 18053
1524 1 3 . 1 1 51 51 TRP CA C 481 58.762 58.762 57.747 1.015 18053
1525 1 3 . 1 1 51 51 TRP CB C 481 28.041 28.041 29.963 -1.922 18053
1526 1 3 . 1 1 51 51 TRP H H 481 8.914 8.914 7.830 1.084 18053
1527 1 3 . 1 1 52 52 ARG N N 482 116.480 116.480 117.726 -1.246 18053
1528 1 3 . 1 1 52 52 ARG HA H 482 5.968 5.968 5.068 0.900 18053
1529 1 3 . 1 1 52 52 ARG C C 482 175.807 175.807 174.957 0.850 18053
1530 1 3 . 1 1 52 52 ARG CA C 482 54.121 54.121 54.971 -0.850 18053
1531 1 3 . 1 1 52 52 ARG CB C 482 35.124 35.124 33.810 1.314 18053
1532 1 3 . 1 1 52 52 ARG H H 482 9.147 9.147 8.908 0.239 18053
1533 1 3 . 1 1 53 53 ILE N N 483 119.579 119.579 125.349 -5.770 18053
1534 1 3 . 1 1 53 53 ILE HA H 483 4.985 4.985 4.927 0.058 18053
1535 1 3 . 1 1 53 53 ILE C C 483 175.670 175.670 175.821 -0.151 18053
1536 1 3 . 1 1 53 53 ILE CA C 483 60.400 60.400 60.804 -0.404 18053
1537 1 3 . 1 1 53 53 ILE CB C 483 40.227 40.227 38.563 1.664 18053
1538 1 3 . 1 1 53 53 ILE H H 483 9.000 9.000 8.780 0.220 18053
1539 1 3 . 1 1 54 54 LYS N N 484 124.737 124.737 128.235 -3.498 18053
1540 1 3 . 1 1 54 54 LYS HA H 484 5.463 5.463 4.700 0.763 18053
1541 1 3 . 1 1 54 54 LYS C C 484 175.575 175.575 175.877 -0.302 18053
1542 1 3 . 1 1 54 54 LYS CA C 484 54.613 54.613 56.516 -1.903 18053
1543 1 3 . 1 1 54 54 LYS CB C 484 35.041 35.041 33.751 1.290 18053
1544 1 3 . 1 1 54 54 LYS H H 484 9.678 9.678 8.563 1.115 18053
1545 1 3 . 1 1 55 55 ARG N N 485 124.090 124.090 124.406 -0.316 18053
1546 1 3 . 1 1 55 55 ARG HA H 485 5.525 5.525 4.827 0.698 18053
1547 1 3 . 1 1 55 55 ARG C C 485 174.155 174.155 174.084 0.071 18053
1548 1 3 . 1 1 55 55 ARG CA C 485 53.903 53.903 55.538 -1.635 18053
1549 1 3 . 1 1 55 55 ARG H H 485 9.314 9.314 8.673 0.641 18053
1550 1 3 . 1 1 56 56 GLN N N 486 126.576 126.576 127.738 -1.162 18053
1551 1 3 . 1 1 56 56 GLN HA H 486 4.842 4.842 4.530 0.312 18053
1552 1 3 . 1 1 56 56 GLN C C 486 174.991 174.991 174.770 0.221 18053
1553 1 3 . 1 1 56 56 GLN CA C 486 54.831 54.831 54.691 0.140 18053
1554 1 3 . 1 1 56 56 GLN CB C 486 31.465 31.465 30.289 1.176 18053
1555 1 3 . 1 1 56 56 GLN H H 486 8.831 8.831 8.357 0.474 18053
1556 1 3 . 1 1 57 57 VAL N N 487 126.712 126.712 126.695 0.017 18053
1557 1 3 . 1 1 57 57 VAL HA H 487 4.266 4.266 3.925 0.341 18053
1558 1 3 . 1 1 57 57 VAL C C 487 175.916 175.916 177.614 -1.698 18053
1559 1 3 . 1 1 57 57 VAL CA C 487 61.820 61.820 63.689 -1.869 18053
1560 1 3 . 1 1 57 57 VAL CB C 487 32.803 32.803 32.116 0.687 18053
1561 1 3 . 1 1 57 57 VAL H H 487 8.786 8.786 8.508 0.278 18053
1562 1 3 . 1 1 58 58 LEU N N 488 127.274 127.274 124.236 3.038 18053
1563 1 3 . 1 1 58 58 LEU HA H 488 4.085 4.085 4.058 0.028 18053
1564 1 3 . 1 1 58 58 LEU C C 488 177.158 177.158 178.692 -1.534 18053
1565 1 3 . 1 1 58 58 LEU CA C 488 56.906 56.906 58.140 -1.234 18053
1566 1 3 . 1 1 58 58 LEU CB C 488 41.374 41.374 41.593 -0.218 18053
1567 1 3 . 1 1 58 58 LEU H H 488 8.316 8.316 8.438 -0.122 18053
1568 1 3 . 1 1 59 59 GLU N N 489 119.647 119.647 119.901 -0.254 18053
1569 1 3 . 1 1 59 59 GLU HA H 489 4.112 4.112 4.125 -0.013 18053
1570 1 3 . 1 1 59 59 GLU C C 489 176.230 176.230 177.470 -1.240 18053
1571 1 3 . 1 1 59 59 GLU CA C 489 57.015 57.015 57.677 -0.662 18053
1572 1 3 . 1 1 59 59 GLU CB C 489 28.149 28.149 29.931 -1.782 18053
1573 1 3 . 1 1 59 59 GLU H H 489 8.636 8.636 8.386 0.250 18053
1574 1 3 . 1 1 60 60 GLY N N 490 108.819 108.819 106.881 1.938 18053
1575 1 3 . 1 1 60 60 GLY C C 490 173.568 173.568 173.374 0.194 18053
1576 1 3 . 1 1 60 60 GLY CA C 490 44.773 44.773 44.651 0.122 18053
1577 1 3 . 1 1 60 60 GLY H H 490 8.160 8.160 7.745 0.415 18053
1578 1 3 . 1 1 61 61 GLU N N 491 121.009 121.009 122.089 -1.080 18053
1579 1 3 . 1 1 61 61 GLU HA H 491 4.323 4.323 4.305 0.018 18053
1580 1 3 . 1 1 61 61 GLU C C 491 175.725 175.725 175.615 0.110 18053
1581 1 3 . 1 1 61 61 GLU CA C 491 56.196 56.196 56.667 -0.471 18053
1582 1 3 . 1 1 61 61 GLU CB C 491 30.865 30.865 29.859 1.006 18053
1583 1 3 . 1 1 61 61 GLU H H 491 8.320 8.320 8.554 -0.234 18053
1584 1 3 . 1 1 62 62 GLU N N 492 123.426 123.426 124.978 -1.552 18053
1585 1 3 . 1 1 62 62 GLU HA H 492 5.054 5.054 5.295 -0.241 18053
1586 1 3 . 1 1 62 62 GLU C C 492 175.930 175.930 176.316 -0.386 18053
1587 1 3 . 1 1 62 62 GLU CA C 492 55.650 55.650 54.961 0.689 18053
1588 1 3 . 1 1 62 62 GLU CB C 492 32.312 32.312 32.234 0.078 18053
1589 1 3 . 1 1 62 62 GLU H H 492 8.594 8.594 8.617 -0.023 18053
1590 1 3 . 1 1 63 63 ILE N N 493 119.732 119.732 117.306 2.426 18053
1591 1 3 . 1 1 63 63 ILE HA H 493 4.788 4.788 4.817 -0.029 18053
1592 1 3 . 1 1 63 63 ILE C C 493 174.647 174.647 174.228 0.419 18053
1593 1 3 . 1 1 63 63 ILE CA C 493 60.181 60.181 59.489 0.692 18053
1594 1 3 . 1 1 63 63 ILE CB C 493 41.183 41.183 41.498 -0.315 18053
1595 1 3 . 1 1 63 63 ILE H H 493 8.523 8.523 8.308 0.215 18053
1596 1 3 . 1 1 64 64 ALA N N 494 122.166 122.166 126.257 -4.091 18053
1597 1 3 . 1 1 64 64 ALA HA H 494 5.521 5.521 5.245 0.276 18053
1598 1 3 . 1 1 64 64 ALA C C 494 174.606 174.606 176.290 -1.684 18053
1599 1 3 . 1 1 64 64 ALA CA C 494 51.528 51.528 50.964 0.564 18053
1600 1 3 . 1 1 64 64 ALA CB C 494 22.239 22.239 20.649 1.590 18053
1601 1 3 . 1 1 64 64 ALA H H 494 8.741 8.741 8.535 0.206 18053
1602 1 3 . 1 1 65 65 TYR N N 495 126.729 126.729 127.347 -0.618 18053
1603 1 3 . 1 1 65 65 TYR HA H 495 3.094 3.094 3.893 -0.799 18053
1604 1 3 . 1 1 65 65 TYR C C 495 173.036 173.036 173.517 -0.481 18053
1605 1 3 . 1 1 65 65 TYR CA C 495 56.905 56.905 55.759 1.146 18053
1606 1 3 . 1 1 65 65 TYR CB C 495 40.269 40.269 39.026 1.243 18053
1607 1 3 . 1 1 65 65 TYR H H 495 8.462 8.462 8.646 -0.184 18053
1608 1 3 . 1 1 66 66 LYS N N 496 128.108 128.108 125.890 2.218 18053
1609 1 3 . 1 1 66 66 LYS HA H 496 4.822 4.822 4.426 0.396 18053
1610 1 3 . 1 1 66 66 LYS C C 496 174.906 174.906 174.736 0.170 18053
1611 1 3 . 1 1 66 66 LYS CA C 496 53.739 53.739 54.731 -0.992 18053
1612 1 3 . 1 1 66 66 LYS CB C 496 34.782 34.782 33.518 1.264 18053
1613 1 3 . 1 1 66 66 LYS H H 496 7.010 7.010 7.751 -0.741 18053
1614 1 3 . 1 1 67 67 PHE N N 497 125.299 125.299 120.847 4.452 18053
1615 1 3 . 1 1 67 67 PHE HA H 497 3.932 3.932 4.179 -0.247 18053
1616 1 3 . 1 1 67 67 PHE C C 497 177.990 177.990 175.303 2.687 18053
1617 1 3 . 1 1 67 67 PHE CA C 497 59.007 59.007 57.421 1.586 18053
1618 1 3 . 1 1 67 67 PHE CB C 497 40.981 40.981 40.506 0.475 18053
1619 1 3 . 1 1 67 67 PHE H H 497 8.509 8.509 8.247 0.262 18053
1620 1 3 . 1 1 68 68 THR N N 498 116.191 116.191 111.647 4.544 18053
1621 1 3 . 1 1 68 68 THR HA H 498 4.417 4.417 4.642 -0.225 18053
1622 1 3 . 1 1 68 68 THR CA C 498 60.855 60.855 59.234 1.621 18053
1623 1 3 . 1 1 68 68 THR CB C 498 68.019 68.019 69.377 -1.358 18053
1624 1 3 . 1 1 68 68 THR H H 498 8.688 8.688 8.272 0.416 18053
1625 1 3 . 1 1 69 69 PRO HA H 499 3.948 3.948 4.654 -0.706 18053
1626 1 3 . 1 1 69 69 PRO C C 499 177.444 177.444 177.430 0.014 18053
1627 1 3 . 1 1 69 69 PRO CA C 499 66.077 66.077 64.375 1.702 18053
1628 1 3 . 1 1 69 69 PRO CB C 499 32.776 32.776 32.263 0.513 18053
1629 1 3 . 1 1 70 70 LYS N N 500 113.552 113.552 115.607 -2.055 18053
1630 1 3 . 1 1 70 70 LYS HA H 500 4.385 4.385 4.135 0.250 18053
1631 1 3 . 1 1 70 70 LYS C C 500 176.325 176.325 176.602 -0.277 18053
1632 1 3 . 1 1 70 70 LYS CA C 500 54.995 54.995 56.935 -1.940 18053
1633 1 3 . 1 1 70 70 LYS CB C 500 31.793 31.793 31.739 0.054 18053
1634 1 3 . 1 1 70 70 LYS H H 500 8.016 8.016 8.078 -0.062 18053
1635 1 3 . 1 1 71 71 TYR N N 501 121.860 121.860 121.548 0.312 18053
1636 1 3 . 1 1 71 71 TYR HA H 501 3.730 3.730 4.404 -0.674 18053
1637 1 3 . 1 1 71 71 TYR C C 501 174.838 174.838 173.756 1.082 18053
1638 1 3 . 1 1 71 71 TYR CA C 501 62.310 62.310 58.914 3.396 18053
1639 1 3 . 1 1 71 71 TYR CB C 501 38.781 38.781 39.296 -0.515 18053
1640 1 3 . 1 1 71 71 TYR H H 501 7.460 7.460 7.682 -0.222 18053
1641 1 3 . 1 1 72 72 ILE N N 502 129.487 129.487 126.911 2.576 18053
1642 1 3 . 1 1 72 72 ILE HA H 502 3.928 3.928 4.526 -0.598 18053
1643 1 3 . 1 1 72 72 ILE C C 502 172.968 172.968 173.715 -0.747 18053
1644 1 3 . 1 1 72 72 ILE CA C 502 59.308 59.308 59.544 -0.236 18053
1645 1 3 . 1 1 72 72 ILE CB C 502 40.910 40.910 41.349 -0.439 18053
1646 1 3 . 1 1 72 72 ILE H H 502 7.168 7.168 8.116 -0.948 18053
1647 1 3 . 1 1 73 73 LEU N N 503 128.278 128.278 127.959 0.319 18053
1648 1 3 . 1 1 73 73 LEU HA H 503 4.493 4.493 4.634 -0.141 18053
1649 1 3 . 1 1 73 73 LEU C C 503 175.834 175.834 174.936 0.898 18053
1650 1 3 . 1 1 73 73 LEU CA C 503 51.965 51.965 52.560 -0.596 18053
1651 1 3 . 1 1 73 73 LEU CB C 503 42.548 42.548 44.830 -2.282 18053
1652 1 3 . 1 1 73 73 LEU H H 503 8.483 8.483 8.628 -0.145 18053
1653 1 3 . 1 1 74 74 ARG N N 504 129.589 129.589 125.393 4.196 18053
1654 1 3 . 1 1 74 74 ARG HA H 504 3.743 3.743 4.192 -0.449 18053
1655 1 3 . 1 1 74 74 ARG C C 504 175.233 175.233 175.541 -0.308 18053
1656 1 3 . 1 1 74 74 ARG CA C 504 56.851 56.851 55.137 1.714 18053
1657 1 3 . 1 1 74 74 ARG CB C 504 30.292 30.292 30.678 -0.386 18053
1658 1 3 . 1 1 74 74 ARG H H 504 8.673 8.673 8.454 0.219 18053
1659 1 3 . 1 1 75 75 ALA N N 505 123.205 123.205 123.540 -0.335 18053
1660 1 3 . 1 1 75 75 ALA HA H 505 3.522 3.522 4.075 -0.553 18053
1661 1 3 . 1 1 75 75 ALA C C 505 178.441 178.441 177.992 0.449 18053
1662 1 3 . 1 1 75 75 ALA CA C 505 53.794 53.794 53.611 0.183 18053
1663 1 3 . 1 1 75 75 ALA CB C 505 18.910 18.910 18.543 0.367 18053
1664 1 3 . 1 1 75 75 ALA H H 505 8.564 8.564 8.169 0.395 18053
1665 1 3 . 1 1 76 76 GLY N N 506 112.241 112.241 114.103 -1.862 18053
1666 1 3 . 1 1 76 76 GLY C C 506 174.278 174.278 174.988 -0.710 18053
1667 1 3 . 1 1 76 76 GLY CA C 506 46.725 46.725 45.275 1.450 18053
1668 1 3 . 1 1 76 76 GLY H H 506 7.381 7.381 8.518 -1.137 18053
1669 1 3 . 1 1 77 77 GLN N N 507 117.382 117.382 119.034 -1.652 18053
1670 1 3 . 1 1 77 77 GLN HA H 507 4.364 4.364 4.629 -0.265 18053
1671 1 3 . 1 1 77 77 GLN C C 507 173.937 173.937 174.918 -0.981 18053
1672 1 3 . 1 1 77 77 GLN CA C 507 54.558 54.558 54.538 0.020 18053
1673 1 3 . 1 1 77 77 GLN CB C 507 30.073 30.073 30.725 -0.652 18053
1674 1 3 . 1 1 77 77 GLN H H 507 7.996 7.996 7.741 0.255 18053
1675 1 3 . 1 1 78 78 MET N N 508 116.957 116.957 114.981 1.976 18053
1676 1 3 . 1 1 78 78 MET HA H 508 5.388 5.388 4.792 0.596 18053
1677 1 3 . 1 1 78 78 MET C C 508 175.807 175.807 173.672 2.135 18053
1678 1 3 . 1 1 78 78 MET CA C 508 54.067 54.067 54.766 -0.699 18053
1679 1 3 . 1 1 78 78 MET CB C 508 37.198 37.198 36.446 0.752 18053
1680 1 3 . 1 1 78 78 MET H H 508 8.092 8.092 8.307 -0.215 18053
1681 1 3 . 1 1 79 79 VAL N N 509 119.340 119.340 120.028 -0.688 18053
1682 1 3 . 1 1 79 79 VAL HA H 509 4.956 4.956 4.607 0.349 18053
1683 1 3 . 1 1 79 79 VAL C C 509 172.217 172.217 174.169 -1.952 18053
1684 1 3 . 1 1 79 79 VAL CA C 509 59.471 59.471 60.928 -1.457 18053
1685 1 3 . 1 1 79 79 VAL CB C 509 33.676 33.676 35.525 -1.849 18053
1686 1 3 . 1 1 79 79 VAL H H 509 8.534 8.534 8.424 0.110 18053
1687 1 3 . 1 1 80 80 THR N N 510 124.533 124.533 126.173 -1.640 18053
1688 1 3 . 1 1 80 80 THR HA H 510 4.586 4.586 4.978 -0.392 18053
1689 1 3 . 1 1 80 80 THR C C 510 172.215 172.215 174.043 -1.828 18053
1690 1 3 . 1 1 80 80 THR CA C 510 62.119 62.119 61.552 0.567 18053
1691 1 3 . 1 1 80 80 THR CB C 510 69.407 69.407 69.413 -0.007 18053
1692 1 3 . 1 1 80 80 THR H H 510 8.301 8.301 8.752 -0.451 18053
1693 1 3 . 1 1 81 81 VAL N N 511 127.002 127.002 128.791 -1.789 18053
1694 1 3 . 1 1 81 81 VAL HA H 511 4.596 4.596 4.452 0.144 18053
1695 1 3 . 1 1 81 81 VAL C C 511 176.667 176.667 175.129 1.538 18053
1696 1 3 . 1 1 81 81 VAL CA C 511 61.382 61.382 62.755 -1.373 18053
1697 1 3 . 1 1 81 81 VAL CB C 511 30.945 30.945 30.911 0.034 18053
1698 1 3 . 1 1 81 81 VAL H H 511 8.796 8.796 8.813 -0.017 18053
1699 1 3 . 1 1 82 82 TRP N N 512 131.479 131.479 129.142 2.337 18053
1700 1 3 . 1 1 82 82 TRP HA H 512 5.338 5.338 5.270 0.068 18053
1701 1 3 . 1 1 82 82 TRP C C 512 176.885 176.885 175.355 1.530 18053
1702 1 3 . 1 1 82 82 TRP CA C 512 56.442 56.442 56.961 -0.519 18053
1703 1 3 . 1 1 82 82 TRP CB C 512 30.701 30.701 31.273 -0.573 18053
1704 1 3 . 1 1 82 82 TRP H H 512 9.924 9.924 9.199 0.725 18053
1705 1 3 . 1 1 83 83 ALA N N 513 123.954 123.954 120.951 3.003 18053
1706 1 3 . 1 1 83 83 ALA HA H 513 4.308 4.308 4.676 -0.368 18053
1707 1 3 . 1 1 83 83 ALA C C 513 178.140 178.140 178.439 -0.299 18053
1708 1 3 . 1 1 83 83 ALA CA C 513 52.211 52.211 50.961 1.250 18053
1709 1 3 . 1 1 83 83 ALA CB C 513 18.745 18.745 20.133 -1.388 18053
1710 1 3 . 1 1 83 83 ALA H H 513 9.048 9.048 8.644 0.404 18053
1711 1 3 . 1 1 84 84 ALA N N 514 125.146 125.146 125.474 -0.328 18053
1712 1 3 . 1 1 84 84 ALA HA H 514 3.951 3.951 4.089 -0.138 18053
1713 1 3 . 1 1 84 84 ALA C C 514 179.519 179.519 179.176 0.343 18053
1714 1 3 . 1 1 84 84 ALA CA C 514 54.804 54.804 54.877 -0.073 18053
1715 1 3 . 1 1 84 84 ALA CB C 514 18.582 18.582 18.855 -0.273 18053
1716 1 3 . 1 1 84 84 ALA H H 514 8.341 8.341 8.367 -0.026 18053
1717 1 3 . 1 1 85 85 GLY N N 515 103.388 103.388 104.962 -1.574 18053
1718 1 3 . 1 1 85 85 GLY C C 515 174.674 174.674 175.073 -0.399 18053
1719 1 3 . 1 1 85 85 GLY CA C 515 45.878 45.878 45.405 0.473 18053
1720 1 3 . 1 1 85 85 GLY H H 515 7.996 7.996 7.887 0.109 18053
1721 1 3 . 1 1 86 86 ALA N N 516 120.140 120.140 122.327 -2.187 18053
1722 1 3 . 1 1 86 86 ALA HA H 516 4.344 4.344 4.361 -0.017 18053
1723 1 3 . 1 1 86 86 ALA C C 516 177.690 177.690 178.497 -0.807 18053
1724 1 3 . 1 1 86 86 ALA CA C 516 53.139 53.139 52.352 0.787 18053
1725 1 3 . 1 1 86 86 ALA CB C 516 20.547 20.547 18.964 1.583 18053
1726 1 3 . 1 1 86 86 ALA H H 516 7.474 7.474 7.242 0.232 18053
1727 1 3 . 1 1 87 87 GLY N N 517 105.720 105.720 107.810 -2.090 18053
1728 1 3 . 1 1 87 87 GLY C C 517 173.650 173.650 174.759 -1.109 18053
1729 1 3 . 1 1 87 87 GLY CA C 517 46.014 46.014 45.684 0.331 18053
1730 1 3 . 1 1 87 87 GLY H H 517 7.779 7.779 7.710 0.069 18053
1731 1 3 . 1 1 88 88 VAL N N 518 121.537 121.537 119.637 1.900 18053
1732 1 3 . 1 1 88 88 VAL HA H 518 3.585 3.585 3.991 -0.406 18053
1733 1 3 . 1 1 88 88 VAL C C 518 174.851 174.851 175.513 -0.662 18053
1734 1 3 . 1 1 88 88 VAL CA C 518 61.274 61.274 61.574 -0.300 18053
1735 1 3 . 1 1 88 88 VAL CB C 518 33.376 33.376 32.995 0.381 18053
1736 1 3 . 1 1 88 88 VAL H H 518 7.499 7.499 7.736 -0.237 18053
1737 1 3 . 1 1 89 89 ALA N N 519 128.295 128.295 130.978 -2.683 18053
1738 1 3 . 1 1 89 89 ALA HA H 519 4.192 4.192 4.253 -0.061 18053
1739 1 3 . 1 1 89 89 ALA C C 519 176.680 176.680 176.826 -0.146 18053
1740 1 3 . 1 1 89 89 ALA CA C 519 51.283 51.283 51.927 -0.644 18053
1741 1 3 . 1 1 89 89 ALA CB C 519 19.292 19.292 18.551 0.741 18053
1742 1 3 . 1 1 89 89 ALA H H 519 7.960 7.960 8.150 -0.190 18053
1743 1 3 . 1 1 90 90 HIS N N 520 122.643 122.643 125.341 -2.698 18053
1744 1 3 . 1 1 90 90 HIS HA H 520 4.033 4.033 4.313 -0.280 18053
1745 1 3 . 1 1 90 90 HIS C C 520 175.793 175.793 174.319 1.474 18053
1746 1 3 . 1 1 90 90 HIS CA C 520 58.653 58.653 56.099 2.554 18053
1747 1 3 . 1 1 90 90 HIS CB C 520 32.285 32.285 29.850 2.435 18053
1748 1 3 . 1 1 90 90 HIS H H 520 8.394 8.394 8.832 -0.438 18053
1749 1 3 . 1 1 91 91 SER N N 521 121.247 121.247 124.118 -2.871 18053
1750 1 3 . 1 1 91 91 SER HA H 521 4.629 4.629 4.692 -0.063 18053
1751 1 3 . 1 1 91 91 SER CA C 521 55.843 55.843 55.904 -0.061 18053
1752 1 3 . 1 1 91 91 SER CB C 521 62.367 62.367 63.502 -1.135 18053
1753 1 3 . 1 1 91 91 SER H H 521 8.569 8.569 8.329 0.240 18053
1754 1 3 . 1 1 92 92 PRO HA H 522 4.002 4.002 4.670 -0.668 18053
1755 1 3 . 1 1 92 92 PRO CA C 522 62.244 62.244 62.665 -0.421 18053
1756 1 3 . 1 1 92 92 PRO CB C 522 30.931 30.931 31.414 -0.483 18053
1757 1 3 . 1 1 93 93 PRO HA H 523 4.672 4.672 4.731 -0.059 18053
1758 1 3 . 1 1 93 93 PRO C C 523 177.786 177.786 178.537 -0.751 18053
1759 1 3 . 1 1 93 93 PRO CA C 523 64.003 64.003 64.407 -0.404 18053
1760 1 3 . 1 1 93 93 PRO CB C 523 34.905 34.905 32.443 2.462 18053
1761 1 3 . 1 1 94 94 SER N N 524 117.212 117.212 116.665 0.547 18053
1762 1 3 . 1 1 94 94 SER HA H 524 4.678 4.678 4.610 0.068 18053
1763 1 3 . 1 1 94 94 SER C C 524 174.851 174.851 174.658 0.193 18053
1764 1 3 . 1 1 94 94 SER CA C 524 61.874 61.874 61.248 0.626 18053
1765 1 3 . 1 1 94 94 SER CB C 524 64.057 64.057 63.435 0.622 18053
1766 1 3 . 1 1 94 94 SER H H 524 8.463 8.463 8.396 0.067 18053
1767 1 3 . 1 1 95 95 THR N N 525 121.588 121.588 118.587 3.001 18053
1768 1 3 . 1 1 95 95 THR HA H 525 4.859 4.859 5.003 -0.144 18053
1769 1 3 . 1 1 95 95 THR C C 525 172.094 172.094 173.086 -0.992 18053
1770 1 3 . 1 1 95 95 THR CA C 525 62.309 62.309 61.757 0.552 18053
1771 1 3 . 1 1 95 95 THR CB C 525 70.281 70.281 69.741 0.540 18053
1772 1 3 . 1 1 95 95 THR H H 525 7.631 7.631 7.946 -0.315 18053
1773 1 3 . 1 1 96 96 LEU N N 526 127.274 127.274 128.771 -1.497 18053
1774 1 3 . 1 1 96 96 LEU HA H 526 5.131 5.131 5.045 0.086 18053
1775 1 3 . 1 1 96 96 LEU C C 526 175.916 175.916 175.387 0.529 18053
1776 1 3 . 1 1 96 96 LEU CA C 526 52.075 52.075 53.906 -1.831 18053
1777 1 3 . 1 1 96 96 LEU CB C 526 43.790 43.790 44.028 -0.238 18053
1778 1 3 . 1 1 96 96 LEU H H 526 8.977 8.977 8.587 0.390 18053
1779 1 3 . 1 1 97 97 VAL N N 527 124.056 124.056 119.894 4.162 18053
1780 1 3 . 1 1 97 97 VAL HA H 527 4.869 4.869 4.578 0.291 18053
1781 1 3 . 1 1 97 97 VAL C C 527 176.230 176.230 175.317 0.913 18053
1782 1 3 . 1 1 97 97 VAL CA C 527 61.519 61.519 60.722 0.797 18053
1783 1 3 . 1 1 97 97 VAL CB C 527 33.704 33.704 33.478 0.226 18053
1784 1 3 . 1 1 97 97 VAL H H 527 10.724 10.724 7.981 2.743 18053
1785 1 3 . 1 1 98 98 TRP N N 528 132.586 132.586 131.307 1.279 18053
1786 1 3 . 1 1 98 98 TRP HA H 528 4.965 4.965 4.217 0.748 18053
1787 1 3 . 1 1 98 98 TRP C C 528 173.391 173.391 174.406 -1.015 18053
1788 1 3 . 1 1 98 98 TRP CA C 528 53.303 53.303 54.563 -1.260 18053
1789 1 3 . 1 1 98 98 TRP CB C 528 28.245 28.245 28.036 0.209 18053
1790 1 3 . 1 1 98 98 TRP H H 528 9.400 9.400 8.271 1.129 18053
1791 1 3 . 1 1 99 99 LYS N N 529 126.644 126.644 127.743 -1.099 18053
1792 1 3 . 1 1 99 99 LYS HA H 529 3.839 3.839 4.034 -0.195 18053
1793 1 3 . 1 1 99 99 LYS C C 529 177.581 177.581 177.114 0.467 18053
1794 1 3 . 1 1 99 99 LYS CA C 529 58.543 58.543 57.577 0.966 18053
1795 1 3 . 1 1 99 99 LYS CB C 529 32.176 32.176 32.783 -0.607 18053
1796 1 3 . 1 1 99 99 LYS H H 529 8.153 8.153 7.944 0.209 18053
1797 1 3 . 1 1 100 100 GLY N N 530 110.385 110.385 113.405 -3.020 18053
1798 1 3 . 1 1 100 100 GLY C C 530 172.367 172.367 174.347 -1.980 18053
1799 1 3 . 1 1 100 100 GLY CA C 530 45.278 45.278 44.788 0.490 18053
1800 1 3 . 1 1 100 100 GLY H H 530 8.363 8.363 8.504 -0.141 18053
1801 1 3 . 1 1 101 101 GLN N N 531 121.162 121.162 122.950 -1.788 18053
1802 1 3 . 1 1 101 101 GLN HA H 531 3.972 3.972 4.385 -0.413 18053
1803 1 3 . 1 1 101 101 GLN CA C 531 52.620 52.620 53.372 -0.752 18053
1804 1 3 . 1 1 101 101 GLN CB C 531 27.595 27.595 27.241 0.353 18053
1805 1 3 . 1 1 101 101 GLN H H 531 6.815 6.815 7.239 -0.424 18053
1806 1 3 . 1 1 102 102 SER N N 532 122.728 122.728 120.380 2.348 18053
1807 1 3 . 1 1 102 102 SER HA H 532 3.866 3.866 4.246 -0.380 18053
1808 1 3 . 1 1 102 102 SER C C 532 174.537 174.537 176.156 -1.619 18053
1809 1 3 . 1 1 102 102 SER CA C 532 61.983 61.983 61.449 0.534 18053
1810 1 3 . 1 1 102 102 SER CB C 532 62.802 62.802 63.041 -0.239 18053
1811 1 3 . 1 1 102 102 SER H H 532 8.662 8.662 8.327 0.335 18053
1812 1 3 . 1 1 103 103 SER N N 533 110.811 110.811 117.432 -6.621 18053
1813 1 3 . 1 1 103 103 SER HA H 533 4.240 4.240 4.328 -0.088 18053
1814 1 3 . 1 1 103 103 SER C C 533 174.087 174.087 175.072 -0.985 18053
1815 1 3 . 1 1 103 103 SER CA C 533 56.633 56.633 59.788 -3.155 18053
1816 1 3 . 1 1 103 103 SER CB C 533 64.658 64.658 63.776 0.882 18053
1817 1 3 . 1 1 103 103 SER H H 533 7.134 7.134 7.874 -0.740 18053
1818 1 3 . 1 1 104 104 TRP N N 534 126.133 126.133 122.362 3.771 18053
1819 1 3 . 1 1 104 104 TRP HA H 534 4.098 4.098 4.142 -0.044 18053
1820 1 3 . 1 1 104 104 TRP C C 534 176.066 176.066 175.952 0.114 18053
1821 1 3 . 1 1 104 104 TRP CA C 534 60.127 60.127 57.578 2.549 18053
1822 1 3 . 1 1 104 104 TRP CB C 534 28.764 28.764 28.558 0.206 18053
1823 1 3 . 1 1 104 104 TRP H H 534 9.764 9.764 7.831 1.933 18053
1824 1 3 . 1 1 105 105 GLY N N 535 105.907 105.907 106.574 -0.667 18053
1825 1 3 . 1 1 105 105 GLY C C 535 172.217 172.217 174.184 -1.967 18053
1826 1 3 . 1 1 105 105 GLY CA C 535 44.240 44.240 45.302 -1.062 18053
1827 1 3 . 1 1 105 105 GLY H H 535 8.095 8.095 7.886 0.209 18053
1828 1 3 . 1 1 106 106 THR N N 536 111.253 111.253 113.029 -1.776 18053
1829 1 3 . 1 1 106 106 THR HA H 536 3.859 3.859 4.363 -0.504 18053
1830 1 3 . 1 1 106 106 THR C C 536 172.872 172.872 174.850 -1.978 18053
1831 1 3 . 1 1 106 106 THR CA C 536 59.635 59.635 61.629 -1.994 18053
1832 1 3 . 1 1 106 106 THR CB C 536 70.526 70.526 69.284 1.242 18053
1833 1 3 . 1 1 106 106 THR H H 536 7.913 7.913 7.582 0.331 18053
1834 1 3 . 1 1 107 107 GLY N N 537 107.712 107.712 114.282 -6.570 18053
1835 1 3 . 1 1 107 107 GLY C C 537 172.709 172.709 174.071 -1.362 18053
1836 1 3 . 1 1 107 107 GLY CA C 537 45.166 45.166 43.806 1.360 18053
1837 1 3 . 1 1 107 107 GLY H H 537 7.533 7.533 8.251 -0.718 18053
1838 1 3 . 1 1 108 108 GLU N N 538 118.864 118.864 117.167 1.697 18053
1839 1 3 . 1 1 108 108 GLU HA H 538 4.136 4.136 4.163 -0.027 18053
1840 1 3 . 1 1 108 108 GLU C C 538 176.353 176.353 175.360 0.993 18053
1841 1 3 . 1 1 108 108 GLU CA C 538 58.352 58.352 57.286 1.066 18053
1842 1 3 . 1 1 108 108 GLU CB C 538 30.156 30.156 30.185 -0.029 18053
1843 1 3 . 1 1 108 108 GLU H H 538 8.558 8.558 8.583 -0.025 18053
1844 1 3 . 1 1 109 109 SER N N 539 110.419 110.419 114.014 -3.595 18053
1845 1 3 . 1 1 109 109 SER HA H 539 4.963 4.963 4.906 0.057 18053
1846 1 3 . 1 1 109 109 SER C C 539 173.787 173.787 172.557 1.230 18053
1847 1 3 . 1 1 109 109 SER CA C 539 57.125 57.125 57.532 -0.407 18053
1848 1 3 . 1 1 109 109 SER CB C 539 64.439 64.439 65.648 -1.210 18053
1849 1 3 . 1 1 109 109 SER H H 539 7.620 7.620 7.584 0.036 18053
1850 1 3 . 1 1 110 110 PHE N N 540 118.778 118.778 119.056 -0.278 18053
1851 1 3 . 1 1 110 110 PHE HA H 540 5.081 5.081 5.135 -0.054 18053
1852 1 3 . 1 1 110 110 PHE C C 540 176.052 176.052 172.902 3.150 18053
1853 1 3 . 1 1 110 110 PHE CA C 540 56.789 56.789 56.988 -0.199 18053
1854 1 3 . 1 1 110 110 PHE CB C 540 40.760 40.760 41.013 -0.253 18053
1855 1 3 . 1 1 110 110 PHE H H 540 8.318 8.318 8.748 -0.430 18053
1856 1 3 . 1 1 112 112 THR HA H 542 5.468 5.468 4.921 0.547 18053
1857 1 3 . 1 1 112 112 THR C C 542 172.381 172.381 172.865 -0.484 18053
1858 1 3 . 1 1 112 112 THR CA C 542 61.818 61.818 62.043 -0.225 18053
1859 1 3 . 1 1 112 112 THR CB C 542 70.990 70.990 70.813 0.177 18053
1860 1 3 . 1 1 113 113 VAL N N 543 124.771 124.771 127.270 -2.499 18053
1861 1 3 . 1 1 113 113 VAL HA H 543 4.864 4.864 4.590 0.274 18053
1862 1 3 . 1 1 113 113 VAL C C 543 173.132 173.132 174.035 -0.903 18053
1863 1 3 . 1 1 113 113 VAL CA C 543 60.099 60.099 60.924 -0.825 18053
1864 1 3 . 1 1 113 113 VAL CB C 543 36.433 36.433 34.302 2.131 18053
1865 1 3 . 1 1 113 113 VAL H H 543 9.380 9.380 8.812 0.568 18053
1866 1 3 . 1 1 114 114 LEU N N 544 128.789 128.789 127.222 1.567 18053
1867 1 3 . 1 1 114 114 LEU HA H 544 5.320 5.320 5.133 0.187 18053
1868 1 3 . 1 1 114 114 LEU C C 544 174.237 174.237 175.181 -0.944 18053
1869 1 3 . 1 1 114 114 LEU CA C 544 53.193 53.193 53.641 -0.447 18053
1870 1 3 . 1 1 114 114 LEU CB C 544 45.879 45.879 44.886 0.993 18053
1871 1 3 . 1 1 114 114 LEU H H 544 8.948 8.948 8.545 0.403 18053
1872 1 3 . 1 1 115 115 VAL N N 545 127.002 127.002 126.080 0.922 18053
1873 1 3 . 1 1 115 115 VAL HA H 545 4.854 4.854 4.744 0.111 18053
1874 1 3 . 1 1 115 115 VAL C C 545 175.206 175.206 174.730 0.476 18053
1875 1 3 . 1 1 115 115 VAL CA C 545 59.334 59.334 60.364 -1.030 18053
1876 1 3 . 1 1 115 115 VAL CB C 545 34.495 34.495 34.505 -0.010 18053
1877 1 3 . 1 1 115 115 VAL H H 545 9.564 9.564 8.963 0.601 18053
1878 1 3 . 1 1 116 116 ASN N N 546 121.179 121.179 120.994 0.185 18053
1879 1 3 . 1 1 116 116 ASN HA H 546 2.897 2.897 3.809 -0.912 18053
1880 1 3 . 1 1 116 116 ASN C C 546 176.885 176.885 175.325 1.560 18053
1881 1 3 . 1 1 116 116 ASN CA C 546 50.409 50.409 51.215 -0.806 18053
1882 1 3 . 1 1 116 116 ASN CB C 546 36.639 36.639 39.586 -2.947 18053
1883 1 3 . 1 1 116 116 ASN H H 546 8.016 8.016 7.953 0.063 18053
1884 1 3 . 1 1 117 117 ALA N N 547 119.834 119.834 121.772 -1.938 18053
1885 1 3 . 1 1 117 117 ALA HA H 547 3.866 3.866 3.934 -0.068 18053
1886 1 3 . 1 1 117 117 ALA C C 547 177.772 177.772 178.202 -0.430 18053
1887 1 3 . 1 1 117 117 ALA CA C 547 54.504 54.504 54.440 0.064 18053
1888 1 3 . 1 1 117 117 ALA CB C 547 18.200 18.200 18.440 -0.240 18053
1889 1 3 . 1 1 117 117 ALA H H 547 6.444 6.444 8.024 -1.580 18053
1890 1 3 . 1 1 118 118 ASP N N 548 115.646 115.646 117.412 -1.766 18053
1891 1 3 . 1 1 118 118 ASP HA H 548 4.644 4.644 4.358 0.286 18053
1892 1 3 . 1 1 118 118 ASP C C 548 176.052 176.052 177.442 -1.390 18053
1893 1 3 . 1 1 118 118 ASP CA C 548 54.067 54.067 55.546 -1.479 18053
1894 1 3 . 1 1 118 118 ASP CB C 548 41.674 41.674 41.292 0.382 18053
1895 1 3 . 1 1 118 118 ASP H H 548 7.181 7.181 8.035 -0.854 18053
1896 1 3 . 1 1 119 119 GLY N N 549 107.167 107.167 106.723 0.444 18053
1897 1 3 . 1 1 119 119 GLY C C 549 173.841 173.841 173.846 -0.005 18053
1898 1 3 . 1 1 119 119 GLY CA C 549 45.455 45.455 44.561 0.894 18053
1899 1 3 . 1 1 119 119 GLY H H 549 7.738 7.738 7.566 0.172 18053
1900 1 3 . 1 1 120 120 GLU N N 550 121.196 121.196 119.916 1.280 18053
1901 1 3 . 1 1 120 120 GLU HA H 550 4.112 4.112 4.387 -0.275 18053
1902 1 3 . 1 1 120 120 GLU C C 550 175.588 175.588 175.462 0.126 18053
1903 1 3 . 1 1 120 120 GLU CA C 550 54.831 54.831 55.030 -0.199 18053
1904 1 3 . 1 1 120 120 GLU CB C 550 29.937 29.937 30.684 -0.747 18053
1905 1 3 . 1 1 120 120 GLU H H 550 7.587 7.587 7.617 -0.030 18053
1906 1 3 . 1 1 121 121 GLU N N 551 123.886 123.886 123.247 0.639 18053
1907 1 3 . 1 1 121 121 GLU HA H 551 4.276 4.276 4.328 -0.052 18053
1908 1 3 . 1 1 121 121 GLU C C 551 176.817 176.817 176.627 0.190 18053
1909 1 3 . 1 1 121 121 GLU CA C 551 56.796 56.796 56.621 0.175 18053
1910 1 3 . 1 1 121 121 GLU CB C 551 28.955 28.955 28.916 0.038 18053
1911 1 3 . 1 1 121 121 GLU H H 551 8.697 8.697 8.731 -0.034 18053
1912 1 3 . 1 1 122 122 VAL N N 552 120.055 120.055 119.289 0.766 18053
1913 1 3 . 1 1 122 122 VAL HA H 552 4.364 4.364 4.059 0.305 18053
1914 1 3 . 1 1 122 122 VAL C C 552 175.998 175.998 175.619 0.379 18053
1915 1 3 . 1 1 122 122 VAL CA C 552 61.655 61.655 63.119 -1.464 18053
1916 1 3 . 1 1 122 122 VAL CB C 552 33.049 33.049 32.563 0.486 18053
1917 1 3 . 1 1 122 122 VAL H H 552 8.845 8.845 8.146 0.699 18053
1918 1 3 . 1 1 123 123 ALA N N 553 122.098 122.098 121.614 0.484 18053
1919 1 3 . 1 1 123 123 ALA HA H 553 4.890 4.890 4.761 0.129 18053
1920 1 3 . 1 1 123 123 ALA C C 553 175.261 175.261 175.148 0.113 18053
1921 1 3 . 1 1 123 123 ALA CA C 553 52.757 52.757 50.937 1.820 18053
1922 1 3 . 1 1 123 123 ALA CB C 553 22.267 22.267 22.156 0.111 18053
1923 1 3 . 1 1 123 123 ALA H H 553 7.788 7.788 7.707 0.081 18053
1924 1 3 . 1 1 124 124 MET N N 554 118.217 118.217 120.646 -2.429 18053
1925 1 3 . 1 1 124 124 MET HA H 554 5.286 5.286 5.250 0.036 18053
1926 1 3 . 1 1 124 124 MET C C 554 174.428 174.428 173.930 0.498 18053
1927 1 3 . 1 1 124 124 MET CA C 554 55.104 55.104 55.147 -0.043 18053
1928 1 3 . 1 1 124 124 MET CB C 554 35.342 35.342 36.731 -1.389 18053
1929 1 3 . 1 1 124 124 MET H H 554 8.693 8.693 8.463 0.230 18053
1930 1 3 . 1 1 125 125 ARG N N 555 122.132 122.132 123.194 -1.062 18053
1931 1 3 . 1 1 125 125 ARG HA H 555 4.900 4.900 4.972 -0.072 18053
1932 1 3 . 1 1 125 125 ARG CA C 555 56.388 56.388 53.684 2.704 18053
1933 1 3 . 1 1 125 125 ARG CB C 555 34.378 34.378 34.519 -0.141 18053
1934 1 3 . 1 1 125 125 ARG H H 555 8.919 8.919 9.116 -0.197 18053
1935 1 3 . 1 1 126 126 THR HA H 556 4.685 4.685 4.894 -0.209 18053
1936 1 3 . 1 1 126 126 THR C C 556 172.436 172.436 173.551 -1.115 18053
1937 1 3 . 1 1 126 126 THR CA C 556 61.382 61.382 61.714 -0.332 18053
1938 1 3 . 1 1 126 126 THR CB C 556 70.444 70.444 70.454 -0.010 18053
1939 1 3 . 1 1 127 127 VAL N N 557 124.976 124.976 126.997 -2.021 18053
1940 1 3 . 1 1 127 127 VAL HA H 557 4.146 4.146 4.143 0.003 18053
1941 1 3 . 1 1 127 127 VAL C C 557 173.937 173.937 173.616 0.321 18053
1942 1 3 . 1 1 127 127 VAL CA C 557 61.109 61.109 60.942 0.167 18053
1943 1 3 . 1 1 127 127 VAL CB C 557 33.759 33.759 34.418 -0.659 18053
1944 1 3 . 1 1 127 127 VAL H H 557 8.127 8.127 8.745 -0.618 18053
1945 1 3 . 1 1 128 128 LYS N N 558 125.384 125.384 125.736 -0.352 18053
1946 1 3 . 1 1 128 128 LYS HA H 558 4.706 4.706 4.421 0.285 18053
1947 1 3 . 1 1 128 128 LYS C C 558 175.534 175.534 175.638 -0.104 18053
1948 1 3 . 1 1 128 128 LYS CA C 558 54.886 54.886 54.100 0.786 18053
1949 1 3 . 1 1 128 128 LYS CB C 558 34.673 34.673 33.748 0.925 18053
1950 1 3 . 1 1 128 128 LYS H H 558 8.289 8.289 8.332 -0.043 18053
1951 1 3 . 1 1 129 129 LYS N N 559 124.005 124.005 126.180 -2.175 18053
1952 1 3 . 1 1 129 129 LYS HA H 559 4.310 4.310 4.128 0.182 18053
1953 1 3 . 1 1 129 129 LYS C C 559 176.571 176.571 176.142 0.429 18053
1954 1 3 . 1 1 129 129 LYS CA C 559 56.742 56.742 57.274 -0.532 18053
1955 1 3 . 1 1 129 129 LYS CB C 559 33.362 33.362 31.654 1.708 18053
1956 1 3 . 1 1 129 129 LYS H H 559 8.461 8.461 8.515 -0.054 18053
1957 1 3 . 1 1 130 130 SER N N 560 117.195 117.195 122.329 -5.134 18053
1958 1 3 . 1 1 130 130 SER HA H 560 4.384 4.384 4.540 -0.156 18053
1959 1 3 . 1 1 130 130 SER C C 560 174.565 174.565 174.000 0.565 18053
1960 1 3 . 1 1 130 130 SER CA C 560 58.434 58.434 59.053 -0.619 18053
1961 1 3 . 1 1 130 130 SER CB C 560 63.812 63.812 64.306 -0.494 18053
1962 1 3 . 1 1 130 130 SER H H 560 8.465 8.465 8.252 0.213 18053
1963 1 3 . 1 1 131 131 SER N N 561 118.149 118.149 116.190 1.959 18053
1964 1 3 . 1 1 131 131 SER HA H 561 4.412 4.412 4.357 0.055 18053
1965 1 3 . 1 1 131 131 SER C C 561 174.456 174.456 174.196 0.260 18053
1966 1 3 . 1 1 131 131 SER CA C 561 58.489 58.489 58.466 0.023 18053
1967 1 3 . 1 1 131 131 SER CB C 561 63.811 63.811 63.658 0.152 18053
1968 1 3 . 1 1 131 131 SER H H 561 8.336 8.336 8.357 -0.021 18053
1969 1 3 . 1 1 132 132 VAL N N 562 121.332 121.332 122.440 -1.108 18053
1970 1 3 . 1 1 132 132 VAL HA H 562 4.035 4.035 3.953 0.082 18053
1971 1 3 . 1 1 132 132 VAL C C 562 176.066 176.066 175.482 0.584 18053
1972 1 3 . 1 1 132 132 VAL CA C 562 62.446 62.446 63.439 -0.993 18053
1973 1 3 . 1 1 132 132 VAL CB C 562 32.394 32.394 32.056 0.338 18053
1974 1 3 . 1 1 132 132 VAL H H 562 7.982 7.982 8.289 -0.307 18053
1975 1 3 . 1 1 133 133 MET N N 563 124.022 124.022 118.395 5.627 18053
1976 1 3 . 1 1 133 133 MET HA H 563 4.385 4.385 4.689 -0.304 18053
1977 1 3 . 1 1 133 133 MET C C 563 176.039 176.039 176.012 0.027 18053
1978 1 3 . 1 1 133 133 MET CA C 563 55.350 55.350 54.698 0.652 18053
1979 1 3 . 1 1 133 133 MET CB C 563 32.503 32.503 33.681 -1.178 18053
1980 1 3 . 1 1 133 133 MET H H 563 8.295 8.295 7.623 0.672 18053
1981 1 3 . 1 1 134 134 ARG N N 564 122.677 122.677 121.671 1.006 18053
1982 1 3 . 1 1 134 134 ARG HA H 564 4.262 4.262 4.434 -0.172 18053
1983 1 3 . 1 1 134 134 ARG C C 564 176.298 176.298 175.836 0.462 18053
1984 1 3 . 1 1 134 134 ARG CA C 564 56.087 56.087 55.511 0.576 18053
1985 1 3 . 1 1 134 134 ARG CB C 564 30.702 30.702 30.927 -0.225 18053
1986 1 3 . 1 1 134 134 ARG H H 564 8.295 8.295 8.367 -0.072 18053
1987 1 3 . 1 1 135 135 GLU N N 565 121.945 121.945 120.130 1.815 18053
1988 1 3 . 1 1 135 135 GLU HA H 565 4.160 4.160 4.131 0.029 18053
1989 1 3 . 1 1 135 135 GLU C C 565 176.080 176.080 175.253 0.827 18053
1990 1 3 . 1 1 135 135 GLU CA C 565 56.906 56.906 56.506 0.400 18053
1991 1 3 . 1 1 135 135 GLU CB C 565 29.774 29.774 29.795 -0.021 18053
1992 1 3 . 1 1 135 135 GLU H H 565 8.470 8.470 8.508 -0.038 18053
1993 1 3 . 1 1 136 136 ASN N N 566 118.761 118.761 121.545 -2.784 18053
1994 1 3 . 1 1 136 136 ASN HA H 566 4.617 4.617 4.897 -0.280 18053
1995 1 3 . 1 1 136 136 ASN C C 566 175.315 175.315 175.777 -0.462 18053
1996 1 3 . 1 1 136 136 ASN CA C 566 53.193 53.193 52.659 0.534 18053
1997 1 3 . 1 1 136 136 ASN CB C 566 38.836 38.836 38.436 0.400 18053
1998 1 3 . 1 1 136 136 ASN H H 566 8.341 8.341 8.501 -0.160 18053
1999 1 3 . 1 1 137 137 GLU N N 567 121.349 121.349 120.905 0.444 18053
2000 1 3 . 1 1 137 137 GLU HA H 567 4.152 4.152 4.083 0.069 18053
2001 1 3 . 1 1 137 137 GLU C C 567 176.243 176.243 176.326 -0.083 18053
2002 1 3 . 1 1 137 137 GLU CA C 567 56.906 56.906 58.248 -1.342 18053
2003 1 3 . 1 1 137 137 GLU CB C 567 29.992 29.992 29.888 0.104 18053
2004 1 3 . 1 1 137 137 GLU H H 567 8.349 8.349 8.432 -0.083 18053
2005 1 3 . 1 1 138 138 ASN N N 568 118.761 118.761 119.479 -0.718 18053
2006 1 3 . 1 1 138 138 ASN HA H 568 4.712 4.712 4.864 -0.152 18053
2007 1 3 . 1 1 138 138 ASN C C 568 174.551 174.551 174.981 -0.430 18053
2008 1 3 . 1 1 138 138 ASN CA C 568 53.193 53.193 53.141 0.053 18053
2009 1 3 . 1 1 138 138 ASN CB C 568 39.327 39.327 38.519 0.808 18053
2010 1 3 . 1 1 138 138 ASN H H 568 8.397 8.397 8.375 0.022 18053
2011 1 4 . 1 1 20 20 ALA N N 450 125.180 125.180 125.510 -0.330 18053
2012 1 4 . 1 1 20 20 ALA HA H 450 4.706 4.706 4.487 0.219 18053
2013 1 4 . 1 1 20 20 ALA C C 450 177.226 177.226 177.831 -0.605 18053
2014 1 4 . 1 1 20 20 ALA CA C 450 52.757 52.757 51.993 0.764 18053
2015 1 4 . 1 1 20 20 ALA CB C 450 20.411 20.411 18.069 2.342 18053
2016 1 4 . 1 1 20 20 ALA H H 450 8.484 8.484 8.556 -0.072 18053
2017 1 4 . 1 1 21 21 SER N N 451 115.714 115.714 119.879 -4.165 18053
2018 1 4 . 1 1 21 21 SER HA H 451 4.513 4.513 4.371 0.142 18053
2019 1 4 . 1 1 21 21 SER C C 451 174.742 174.742 175.581 -0.839 18053
2020 1 4 . 1 1 21 21 SER CA C 451 58.516 58.516 59.754 -1.238 18053
2021 1 4 . 1 1 21 21 SER CB C 451 64.159 64.159 62.302 1.857 18053
2022 1 4 . 1 1 21 21 SER H H 451 8.487 8.487 8.123 0.364 18053
2023 1 4 . 1 1 22 22 GLY N N 452 111.509 111.509 115.940 -4.431 18053
2024 1 4 . 1 1 22 22 GLY C C 452 174.401 174.401 174.599 -0.198 18053
2025 1 4 . 1 1 22 22 GLY CA C 452 45.059 45.059 47.067 -2.008 18053
2026 1 4 . 1 1 22 22 GLY H H 452 8.198 8.198 8.696 -0.498 18053
2027 1 4 . 1 1 23 23 SER N N 453 116.191 116.191 114.805 1.386 18053
2028 1 4 . 1 1 23 23 SER HA H 453 4.364 4.364 4.834 -0.470 18053
2029 1 4 . 1 1 23 23 SER C C 453 173.432 173.432 173.208 0.224 18053
2030 1 4 . 1 1 23 23 SER CA C 453 59.744 59.744 59.254 0.490 18053
2031 1 4 . 1 1 23 23 SER CB C 453 64.335 64.335 65.874 -1.539 18053
2032 1 4 . 1 1 23 23 SER H H 453 8.494 8.494 8.313 0.181 18053
2033 1 4 . 1 1 24 24 VAL N N 454 121.656 121.656 121.558 0.098 18053
2034 1 4 . 1 1 24 24 VAL HA H 454 5.035 5.035 4.306 0.729 18053
2035 1 4 . 1 1 24 24 VAL C C 454 174.606 174.606 175.357 -0.751 18053
2036 1 4 . 1 1 24 24 VAL CA C 454 61.055 61.055 61.669 -0.614 18053
2037 1 4 . 1 1 24 24 VAL CB C 454 32.503 32.503 33.276 -0.773 18053
2038 1 4 . 1 1 24 24 VAL H H 454 7.830 7.830 8.002 -0.172 18053
2039 1 4 . 1 1 25 25 SER N N 455 119.323 119.323 116.475 2.848 18053
2040 1 4 . 1 1 25 25 SER HA H 455 4.672 4.672 4.852 -0.180 18053
2041 1 4 . 1 1 25 25 SER C C 455 174.426 174.426 173.116 1.310 18053
2042 1 4 . 1 1 25 25 SER CA C 455 55.268 55.268 56.065 -0.797 18053
2043 1 4 . 1 1 25 25 SER CB C 455 65.162 65.162 65.910 -0.748 18053
2044 1 4 . 1 1 25 25 SER H H 455 9.065 9.065 8.478 0.587 18053
2045 1 4 . 1 1 26 26 ILE N N 456 119.468 119.468 123.881 -4.413 18053
2046 1 4 . 1 1 26 26 ILE HA H 456 4.180 4.180 4.432 -0.252 18053
2047 1 4 . 1 1 26 26 ILE C C 456 175.506 175.506 176.559 -1.053 18053
2048 1 4 . 1 1 26 26 ILE CA C 456 61.328 61.328 61.667 -0.339 18053
2049 1 4 . 1 1 26 26 ILE CB C 456 37.962 37.962 36.776 1.186 18053
2050 1 4 . 1 1 26 26 ILE H H 456 8.295 8.295 8.751 -0.456 18053
2051 1 4 . 1 1 27 27 GLU N N 457 129.726 129.726 129.796 -0.070 18053
2052 1 4 . 1 1 27 27 GLU HA H 457 4.228 4.228 4.218 0.010 18053
2053 1 4 . 1 1 27 27 GLU C C 457 175.179 175.179 176.279 -1.100 18053
2054 1 4 . 1 1 27 27 GLU CA C 457 55.432 55.432 58.393 -2.961 18053
2055 1 4 . 1 1 27 27 GLU CB C 457 30.142 30.142 30.563 -0.421 18053
2056 1 4 . 1 1 27 27 GLU H H 457 8.393 8.393 8.553 -0.160 18053
2057 1 4 . 1 1 28 28 GLU N N 458 117.076 117.076 115.881 1.195 18053
2058 1 4 . 1 1 28 28 GLU HA H 458 4.168 4.168 4.666 -0.498 18053
2059 1 4 . 1 1 28 28 GLU C C 458 174.701 174.701 174.388 0.313 18053
2060 1 4 . 1 1 28 28 GLU CA C 458 56.906 56.906 55.568 1.338 18053
2061 1 4 . 1 1 28 28 GLU CB C 458 31.848 31.848 34.170 -2.322 18053
2062 1 4 . 1 1 28 28 GLU H H 458 7.489 7.489 7.858 -0.369 18053
2063 1 4 . 1 1 29 29 ILE N N 459 122.183 122.183 119.771 2.412 18053
2064 1 4 . 1 1 29 29 ILE HA H 459 3.764 3.764 3.953 -0.189 18053
2065 1 4 . 1 1 29 29 ILE C C 459 174.169 174.169 174.589 -0.420 18053
2066 1 4 . 1 1 29 29 ILE CA C 459 59.526 59.526 59.386 0.140 18053
2067 1 4 . 1 1 29 29 ILE CB C 459 40.309 40.309 41.185 -0.876 18053
2068 1 4 . 1 1 29 29 ILE H H 459 8.126 8.126 8.247 -0.121 18053
2069 1 4 . 1 1 30 30 ASP N N 460 123.205 123.205 123.070 0.135 18053
2070 1 4 . 1 1 30 30 ASP HA H 460 4.183 4.183 4.226 -0.043 18053
2071 1 4 . 1 1 30 30 ASP C C 460 178.318 178.318 177.795 0.523 18053
2072 1 4 . 1 1 30 30 ASP CA C 460 53.930 53.930 53.624 0.306 18053
2073 1 4 . 1 1 30 30 ASP CB C 460 42.807 42.807 42.494 0.313 18053
2074 1 4 . 1 1 30 30 ASP H H 460 6.704 6.704 7.329 -0.625 18053
2075 1 4 . 1 1 31 31 LEU N N 461 128.551 128.551 121.544 7.007 18053
2076 1 4 . 1 1 31 31 LEU HA H 461 4.064 4.064 4.099 -0.035 18053
2077 1 4 . 1 1 31 31 LEU C C 461 177.513 177.513 177.899 -0.386 18053
2078 1 4 . 1 1 31 31 LEU CA C 461 57.124 57.124 57.044 0.080 18053
2079 1 4 . 1 1 31 31 LEU CB C 461 41.237 41.237 41.864 -0.627 18053
2080 1 4 . 1 1 31 31 LEU H H 461 9.012 9.012 8.291 0.721 18053
2081 1 4 . 1 1 32 32 GLU N N 462 115.101 115.101 118.378 -3.277 18053
2082 1 4 . 1 1 32 32 GLU HA H 462 4.283 4.283 4.366 -0.083 18053
2083 1 4 . 1 1 32 32 GLU C C 462 177.062 177.062 177.753 -0.691 18053
2084 1 4 . 1 1 32 32 GLU CA C 462 55.759 55.759 57.228 -1.469 18053
2085 1 4 . 1 1 32 32 GLU CB C 462 29.569 29.569 30.545 -0.976 18053
2086 1 4 . 1 1 32 32 GLU H H 462 7.588 7.588 8.186 -0.598 18053
2087 1 4 . 1 1 33 33 GLY N N 463 106.299 106.299 107.095 -0.796 18053
2088 1 4 . 1 1 33 33 GLY C C 463 174.824 174.824 175.032 -0.208 18053
2089 1 4 . 1 1 33 33 GLY CA C 463 46.806 46.806 45.453 1.353 18053
2090 1 4 . 1 1 33 33 GLY H H 463 7.372 7.372 8.063 -0.691 18053
2091 1 4 . 1 1 34 34 LYS N N 464 118.744 118.744 119.046 -0.302 18053
2092 1 4 . 1 1 34 34 LYS HA H 464 4.562 4.562 4.213 0.349 18053
2093 1 4 . 1 1 34 34 LYS C C 464 177.076 177.076 174.853 2.223 18053
2094 1 4 . 1 1 34 34 LYS CA C 464 59.963 59.963 57.989 1.974 18053
2095 1 4 . 1 1 34 34 LYS CB C 464 33.111 33.111 32.914 0.197 18053
2096 1 4 . 1 1 34 34 LYS H H 464 9.547 9.547 8.244 1.303 18053
2097 1 4 . 1 1 35 35 PHE N N 465 109.125 109.125 112.733 -3.608 18053
2098 1 4 . 1 1 35 35 PHE HA H 465 5.514 5.514 5.179 0.335 18053
2099 1 4 . 1 1 35 35 PHE C C 465 174.183 174.183 172.559 1.624 18053
2100 1 4 . 1 1 35 35 PHE CA C 465 56.632 56.632 55.108 1.524 18053
2101 1 4 . 1 1 35 35 PHE CB C 465 40.599 40.599 41.033 -0.434 18053
2102 1 4 . 1 1 35 35 PHE H H 465 6.740 6.740 7.012 -0.272 18053
2103 1 4 . 1 1 36 36 VAL N N 466 119.579 119.579 119.493 0.086 18053
2104 1 4 . 1 1 36 36 VAL HA H 466 3.709 3.709 4.029 -0.320 18053
2105 1 4 . 1 1 36 36 VAL C C 466 172.668 172.668 174.019 -1.351 18053
2106 1 4 . 1 1 36 36 VAL CA C 466 62.692 62.692 61.156 1.536 18053
2107 1 4 . 1 1 36 36 VAL CB C 466 36.215 36.215 34.697 1.518 18053
2108 1 4 . 1 1 36 36 VAL H H 466 7.628 7.628 8.332 -0.704 18053
2109 1 4 . 1 1 37 37 GLN N N 467 126.831 126.831 127.079 -0.248 18053
2110 1 4 . 1 1 37 37 GLN HA H 467 5.449 5.449 4.874 0.575 18053
2111 1 4 . 1 1 37 37 GLN C C 467 174.797 174.797 174.734 0.063 18053
2112 1 4 . 1 1 37 37 GLN CA C 467 54.121 54.121 54.404 -0.283 18053
2113 1 4 . 1 1 37 37 GLN CB C 467 34.623 34.623 29.965 4.658 18053
2114 1 4 . 1 1 37 37 GLN H H 467 8.392 8.392 8.657 -0.265 18053
2115 1 4 . 1 1 38 38 LEU N N 468 123.018 123.018 129.377 -6.359 18053
2116 1 4 . 1 1 38 38 LEU HA H 468 5.422 5.422 5.250 0.172 18053
2117 1 4 . 1 1 38 38 LEU C C 468 175.588 175.588 175.180 0.408 18053
2118 1 4 . 1 1 38 38 LEU CA C 468 52.702 52.702 53.801 -1.099 18053
2119 1 4 . 1 1 38 38 LEU CB C 468 45.046 45.046 44.174 0.872 18053
2120 1 4 . 1 1 38 38 LEU H H 468 9.103 9.103 8.577 0.526 18053
2121 1 4 . 1 1 39 39 LYS N N 469 118.983 118.983 123.855 -4.872 18053
2122 1 4 . 1 1 39 39 LYS HA H 469 4.852 4.852 4.907 -0.055 18053
2123 1 4 . 1 1 39 39 LYS C C 469 173.309 173.309 175.131 -1.822 18053
2124 1 4 . 1 1 39 39 LYS CA C 469 54.994 54.994 53.827 1.167 18053
2125 1 4 . 1 1 39 39 LYS CB C 469 38.246 38.246 35.810 2.436 18053
2126 1 4 . 1 1 39 39 LYS H H 469 8.496 8.496 8.570 -0.074 18053
2127 1 4 . 1 1 40 40 ASN N N 470 121.758 121.758 125.352 -3.594 18053
2128 1 4 . 1 1 40 40 ASN HA H 470 4.788 4.788 4.796 -0.008 18053
2129 1 4 . 1 1 40 40 ASN C C 470 174.496 174.496 175.448 -0.952 18053
2130 1 4 . 1 1 40 40 ASN CA C 470 51.119 51.119 52.398 -1.280 18053
2131 1 4 . 1 1 40 40 ASN CB C 470 37.559 37.559 38.768 -1.209 18053
2132 1 4 . 1 1 40 40 ASN H H 470 8.283 8.283 8.725 -0.442 18053
2133 1 4 . 1 1 41 41 ASN N N 471 122.422 122.422 124.841 -2.419 18053
2134 1 4 . 1 1 41 41 ASN HA H 471 4.588 4.588 4.699 -0.111 18053
2135 1 4 . 1 1 41 41 ASN C C 471 174.810 174.810 175.245 -0.435 18053
2136 1 4 . 1 1 41 41 ASN CA C 471 53.985 53.985 53.971 0.014 18053
2137 1 4 . 1 1 41 41 ASN CB C 471 39.600 39.600 38.937 0.663 18053
2138 1 4 . 1 1 41 41 ASN H H 471 8.681 8.681 8.451 0.230 18053
2139 1 4 . 1 1 42 42 SER N N 472 116.446 116.446 116.041 0.405 18053
2140 1 4 . 1 1 42 42 SER HA H 472 4.719 4.719 4.518 0.201 18053
2141 1 4 . 1 1 42 42 SER C C 472 172.804 172.804 174.609 -1.805 18053
2142 1 4 . 1 1 42 42 SER CA C 472 57.288 57.288 58.711 -1.423 18053
2143 1 4 . 1 1 42 42 SER CB C 472 66.241 66.241 64.507 1.734 18053
2144 1 4 . 1 1 42 42 SER H H 472 8.370 8.370 7.744 0.626 18053
2145 1 4 . 1 1 43 43 ASP N N 473 117.706 117.706 121.689 -3.983 18053
2146 1 4 . 1 1 43 43 ASP HA H 473 4.474 4.474 4.472 0.002 18053
2147 1 4 . 1 1 43 43 ASP C C 473 175.343 175.343 176.170 -0.827 18053
2148 1 4 . 1 1 43 43 ASP CA C 473 53.521 53.521 55.437 -1.916 18053
2149 1 4 . 1 1 43 43 ASP CB C 473 40.322 40.322 41.080 -0.758 18053
2150 1 4 . 1 1 43 43 ASP H H 473 8.254 8.254 8.694 -0.440 18053
2151 1 4 . 1 1 44 44 LYS N N 474 120.209 120.209 118.489 1.720 18053
2152 1 4 . 1 1 44 44 LYS HA H 474 4.569 4.569 4.449 0.120 18053
2153 1 4 . 1 1 44 44 LYS C C 474 175.397 175.397 174.789 0.608 18053
2154 1 4 . 1 1 44 44 LYS CA C 474 54.012 54.012 54.807 -0.795 18053
2155 1 4 . 1 1 44 44 LYS CB C 474 35.383 35.383 34.077 1.306 18053
2156 1 4 . 1 1 44 44 LYS H H 474 8.305 8.305 7.686 0.619 18053
2157 1 4 . 1 1 45 45 ASP N N 475 124.993 124.993 120.872 4.121 18053
2158 1 4 . 1 1 45 45 ASP HA H 475 3.975 3.975 4.459 -0.484 18053
2159 1 4 . 1 1 45 45 ASP C C 475 174.810 174.810 175.952 -1.142 18053
2160 1 4 . 1 1 45 45 ASP CA C 475 54.995 54.995 54.423 0.572 18053
2161 1 4 . 1 1 45 45 ASP CB C 475 40.364 40.364 41.431 -1.067 18053
2162 1 4 . 1 1 45 45 ASP H H 475 8.722 8.722 8.377 0.345 18053
2163 1 4 . 1 1 46 46 GLN N N 476 120.549 120.549 125.677 -5.128 18053
2164 1 4 . 1 1 46 46 GLN HA H 476 4.436 4.436 4.310 0.126 18053
2165 1 4 . 1 1 46 46 GLN C C 476 174.019 174.019 175.036 -1.017 18053
2166 1 4 . 1 1 46 46 GLN CA C 476 53.138 53.138 54.935 -1.797 18053
2167 1 4 . 1 1 46 46 GLN CB C 476 31.466 31.466 29.086 2.380 18053
2168 1 4 . 1 1 46 46 GLN H H 476 7.878 7.878 8.156 -0.278 18053
2169 1 4 . 1 1 47 47 SER N N 477 121.537 121.537 121.784 -0.247 18053
2170 1 4 . 1 1 47 47 SER HA H 477 4.229 4.229 4.285 -0.056 18053
2171 1 4 . 1 1 47 47 SER C C 477 174.565 174.565 174.215 0.350 18053
2172 1 4 . 1 1 47 47 SER CA C 477 58.706 58.706 58.419 0.287 18053
2173 1 4 . 1 1 47 47 SER CB C 477 62.965 62.965 62.665 0.300 18053
2174 1 4 . 1 1 47 47 SER H H 477 8.748 8.748 8.585 0.163 18053
2175 1 4 . 1 1 48 48 LEU N N 478 127.751 127.751 125.567 2.184 18053
2176 1 4 . 1 1 48 48 LEU HA H 478 2.631 2.631 4.287 -1.656 18053
2177 1 4 . 1 1 48 48 LEU C C 478 176.789 176.789 177.081 -0.292 18053
2178 1 4 . 1 1 48 48 LEU CA C 478 52.102 52.102 54.648 -2.546 18053
2179 1 4 . 1 1 48 48 LEU CB C 478 42.343 42.343 43.209 -0.866 18053
2180 1 4 . 1 1 48 48 LEU H H 478 7.856 7.856 7.729 0.127 18053
2181 1 4 . 1 1 49 49 GLY N N 479 107.525 107.525 106.987 0.538 18053
2182 1 4 . 1 1 49 49 GLY C C 479 176.653 176.653 175.553 1.100 18053
2183 1 4 . 1 1 49 49 GLY CA C 479 48.062 48.062 45.873 2.189 18053
2184 1 4 . 1 1 49 49 GLY H H 479 7.728 7.728 8.767 -1.039 18053
2185 1 4 . 1 1 50 50 ASN N N 480 117.059 117.059 119.416 -2.357 18053
2186 1 4 . 1 1 50 50 ASN HA H 480 4.255 4.255 4.588 -0.333 18053
2187 1 4 . 1 1 50 50 ASN C C 480 174.961 174.961 174.934 0.027 18053
2188 1 4 . 1 1 50 50 ASN CA C 480 56.360 56.360 54.599 1.761 18053
2189 1 4 . 1 1 50 50 ASN CB C 480 37.416 37.416 38.849 -1.433 18053
2190 1 4 . 1 1 50 50 ASN H H 480 7.552 7.552 8.757 -1.205 18053
2191 1 4 . 1 1 51 51 TRP N N 481 122.166 122.166 119.131 3.035 18053
2192 1 4 . 1 1 51 51 TRP HA H 481 4.477 4.477 4.799 -0.322 18053
2193 1 4 . 1 1 51 51 TRP C C 481 175.575 175.575 175.763 -0.188 18053
2194 1 4 . 1 1 51 51 TRP CA C 481 58.762 58.762 57.887 0.875 18053
2195 1 4 . 1 1 51 51 TRP CB C 481 28.041 28.041 30.185 -2.144 18053
2196 1 4 . 1 1 51 51 TRP H H 481 8.914 8.914 8.131 0.783 18053
2197 1 4 . 1 1 52 52 ARG N N 482 116.480 116.480 116.479 0.001 18053
2198 1 4 . 1 1 52 52 ARG HA H 482 5.968 5.968 5.149 0.819 18053
2199 1 4 . 1 1 52 52 ARG C C 482 175.807 175.807 174.732 1.075 18053
2200 1 4 . 1 1 52 52 ARG CA C 482 54.121 54.121 55.154 -1.033 18053
2201 1 4 . 1 1 52 52 ARG CB C 482 35.124 35.124 33.982 1.142 18053
2202 1 4 . 1 1 52 52 ARG H H 482 9.147 9.147 9.016 0.131 18053
2203 1 4 . 1 1 53 53 ILE N N 483 119.579 119.579 124.424 -4.845 18053
2204 1 4 . 1 1 53 53 ILE HA H 483 4.985 4.985 5.009 -0.024 18053
2205 1 4 . 1 1 53 53 ILE C C 483 175.670 175.670 176.014 -0.344 18053
2206 1 4 . 1 1 53 53 ILE CA C 483 60.400 60.400 60.723 -0.323 18053
2207 1 4 . 1 1 53 53 ILE CB C 483 40.227 40.227 38.166 2.061 18053
2208 1 4 . 1 1 53 53 ILE H H 483 9.000 9.000 8.747 0.253 18053
2209 1 4 . 1 1 54 54 LYS N N 484 124.737 124.737 128.094 -3.357 18053
2210 1 4 . 1 1 54 54 LYS HA H 484 5.463 5.463 5.039 0.424 18053
2211 1 4 . 1 1 54 54 LYS C C 484 175.575 175.575 176.381 -0.806 18053
2212 1 4 . 1 1 54 54 LYS CA C 484 54.613 54.613 56.398 -1.784 18053
2213 1 4 . 1 1 54 54 LYS CB C 484 35.041 35.041 34.045 0.996 18053
2214 1 4 . 1 1 54 54 LYS H H 484 9.678 9.678 8.692 0.986 18053
2215 1 4 . 1 1 55 55 ARG N N 485 124.090 124.090 122.066 2.024 18053
2216 1 4 . 1 1 55 55 ARG HA H 485 5.525 5.525 4.935 0.590 18053
2217 1 4 . 1 1 55 55 ARG C C 485 174.155 174.155 174.027 0.128 18053
2218 1 4 . 1 1 55 55 ARG CA C 485 53.903 53.903 56.178 -2.275 18053
2219 1 4 . 1 1 55 55 ARG H H 485 9.314 9.314 8.660 0.654 18053
2220 1 4 . 1 1 56 56 GLN N N 486 126.576 126.576 128.438 -1.862 18053
2221 1 4 . 1 1 56 56 GLN HA H 486 4.842 4.842 4.829 0.013 18053
2222 1 4 . 1 1 56 56 GLN C C 486 174.991 174.991 174.776 0.215 18053
2223 1 4 . 1 1 56 56 GLN CA C 486 54.831 54.831 55.032 -0.201 18053
2224 1 4 . 1 1 56 56 GLN CB C 486 31.465 31.465 30.324 1.141 18053
2225 1 4 . 1 1 56 56 GLN H H 486 8.831 8.831 8.647 0.184 18053
2226 1 4 . 1 1 57 57 VAL N N 487 126.712 126.712 126.063 0.649 18053
2227 1 4 . 1 1 57 57 VAL HA H 487 4.266 4.266 4.151 0.115 18053
2228 1 4 . 1 1 57 57 VAL C C 487 175.916 175.916 177.608 -1.692 18053
2229 1 4 . 1 1 57 57 VAL CA C 487 61.820 61.820 62.355 -0.535 18053
2230 1 4 . 1 1 57 57 VAL CB C 487 32.803 32.803 31.818 0.985 18053
2231 1 4 . 1 1 57 57 VAL H H 487 8.786 8.786 8.702 0.084 18053
2232 1 4 . 1 1 58 58 LEU N N 488 127.274 127.274 125.908 1.366 18053
2233 1 4 . 1 1 58 58 LEU HA H 488 4.085 4.085 4.125 -0.040 18053
2234 1 4 . 1 1 58 58 LEU C C 488 177.158 177.158 177.732 -0.574 18053
2235 1 4 . 1 1 58 58 LEU CA C 488 56.906 56.906 57.466 -0.560 18053
2236 1 4 . 1 1 58 58 LEU CB C 488 41.374 41.374 41.460 -0.086 18053
2237 1 4 . 1 1 58 58 LEU H H 488 8.316 8.316 8.333 -0.017 18053
2238 1 4 . 1 1 59 59 GLU N N 489 119.647 119.647 119.251 0.396 18053
2239 1 4 . 1 1 59 59 GLU HA H 489 4.112 4.112 4.172 -0.060 18053
2240 1 4 . 1 1 59 59 GLU C C 489 176.230 176.230 177.361 -1.131 18053
2241 1 4 . 1 1 59 59 GLU CA C 489 57.015 57.015 56.929 0.086 18053
2242 1 4 . 1 1 59 59 GLU CB C 489 28.149 28.149 29.980 -1.831 18053
2243 1 4 . 1 1 59 59 GLU H H 489 8.636 8.636 8.213 0.423 18053
2244 1 4 . 1 1 60 60 GLY N N 490 108.819 108.819 107.055 1.764 18053
2245 1 4 . 1 1 60 60 GLY C C 490 173.568 173.568 173.786 -0.218 18053
2246 1 4 . 1 1 60 60 GLY CA C 490 44.773 44.773 44.683 0.090 18053
2247 1 4 . 1 1 60 60 GLY H H 490 8.160 8.160 7.828 0.332 18053
2248 1 4 . 1 1 61 61 GLU N N 491 121.009 121.009 118.378 2.631 18053
2249 1 4 . 1 1 61 61 GLU HA H 491 4.323 4.323 4.688 -0.365 18053
2250 1 4 . 1 1 61 61 GLU C C 491 175.725 175.725 173.768 1.957 18053
2251 1 4 . 1 1 61 61 GLU CA C 491 56.196 56.196 54.487 1.709 18053
2252 1 4 . 1 1 61 61 GLU CB C 491 30.865 30.865 32.212 -1.347 18053
2253 1 4 . 1 1 61 61 GLU H H 491 8.320 8.320 7.995 0.325 18053
2254 1 4 . 1 1 62 62 GLU N N 492 123.426 123.426 119.332 4.094 18053
2255 1 4 . 1 1 62 62 GLU HA H 492 5.054 5.054 5.443 -0.389 18053
2256 1 4 . 1 1 62 62 GLU C C 492 175.930 175.930 176.028 -0.098 18053
2257 1 4 . 1 1 62 62 GLU CA C 492 55.650 55.650 55.026 0.624 18053
2258 1 4 . 1 1 62 62 GLU CB C 492 32.312 32.312 32.616 -0.304 18053
2259 1 4 . 1 1 62 62 GLU H H 492 8.594 8.594 8.524 0.070 18053
2260 1 4 . 1 1 63 63 ILE N N 493 119.732 119.732 118.905 0.827 18053
2261 1 4 . 1 1 63 63 ILE HA H 493 4.788 4.788 4.704 0.085 18053
2262 1 4 . 1 1 63 63 ILE C C 493 174.647 174.647 174.444 0.203 18053
2263 1 4 . 1 1 63 63 ILE CA C 493 60.181 60.181 59.991 0.190 18053
2264 1 4 . 1 1 63 63 ILE CB C 493 41.183 41.183 40.469 0.713 18053
2265 1 4 . 1 1 63 63 ILE H H 493 8.523 8.523 8.139 0.384 18053
2266 1 4 . 1 1 64 64 ALA N N 494 122.166 122.166 125.790 -3.624 18053
2267 1 4 . 1 1 64 64 ALA HA H 494 5.521 5.521 4.888 0.633 18053
2268 1 4 . 1 1 64 64 ALA C C 494 174.606 174.606 175.930 -1.324 18053
2269 1 4 . 1 1 64 64 ALA CA C 494 51.528 51.528 50.742 0.786 18053
2270 1 4 . 1 1 64 64 ALA CB C 494 22.239 22.239 20.842 1.397 18053
2271 1 4 . 1 1 64 64 ALA H H 494 8.741 8.741 8.234 0.507 18053
2272 1 4 . 1 1 65 65 TYR N N 495 126.729 126.729 126.911 -0.182 18053
2273 1 4 . 1 1 65 65 TYR HA H 495 3.094 3.094 3.593 -0.499 18053
2274 1 4 . 1 1 65 65 TYR C C 495 173.036 173.036 173.794 -0.758 18053
2275 1 4 . 1 1 65 65 TYR CA C 495 56.905 56.905 56.245 0.660 18053
2276 1 4 . 1 1 65 65 TYR CB C 495 40.269 40.269 38.491 1.778 18053
2277 1 4 . 1 1 65 65 TYR H H 495 8.462 8.462 8.490 -0.028 18053
2278 1 4 . 1 1 66 66 LYS N N 496 128.108 128.108 126.833 1.275 18053
2279 1 4 . 1 1 66 66 LYS HA H 496 4.822 4.822 4.265 0.557 18053
2280 1 4 . 1 1 66 66 LYS C C 496 174.906 174.906 174.722 0.184 18053
2281 1 4 . 1 1 66 66 LYS CA C 496 53.739 53.739 55.246 -1.507 18053
2282 1 4 . 1 1 66 66 LYS CB C 496 34.782 34.782 33.552 1.230 18053
2283 1 4 . 1 1 66 66 LYS H H 496 7.010 7.010 7.274 -0.264 18053
2284 1 4 . 1 1 67 67 PHE N N 497 125.299 125.299 120.574 4.725 18053
2285 1 4 . 1 1 67 67 PHE HA H 497 3.932 3.932 4.282 -0.350 18053
2286 1 4 . 1 1 67 67 PHE C C 497 177.990 177.990 175.384 2.606 18053
2287 1 4 . 1 1 67 67 PHE CA C 497 59.007 59.007 57.320 1.687 18053
2288 1 4 . 1 1 67 67 PHE CB C 497 40.981 40.981 40.493 0.488 18053
2289 1 4 . 1 1 67 67 PHE H H 497 8.509 8.509 8.032 0.477 18053
2290 1 4 . 1 1 68 68 THR N N 498 116.191 116.191 111.400 4.791 18053
2291 1 4 . 1 1 68 68 THR HA H 498 4.417 4.417 4.622 -0.205 18053
2292 1 4 . 1 1 68 68 THR CA C 498 60.855 60.855 59.254 1.601 18053
2293 1 4 . 1 1 68 68 THR CB C 498 68.019 68.019 69.571 -1.552 18053
2294 1 4 . 1 1 68 68 THR H H 498 8.688 8.688 8.283 0.405 18053
2295 1 4 . 1 1 69 69 PRO HA H 499 3.948 3.948 4.779 -0.831 18053
2296 1 4 . 1 1 69 69 PRO C C 499 177.444 177.444 176.732 0.712 18053
2297 1 4 . 1 1 69 69 PRO CA C 499 66.077 66.077 64.088 1.989 18053
2298 1 4 . 1 1 69 69 PRO CB C 499 32.776 32.776 32.011 0.765 18053
2299 1 4 . 1 1 70 70 LYS N N 500 113.552 113.552 115.694 -2.142 18053
2300 1 4 . 1 1 70 70 LYS HA H 500 4.385 4.385 4.242 0.143 18053
2301 1 4 . 1 1 70 70 LYS C C 500 176.325 176.325 175.959 0.366 18053
2302 1 4 . 1 1 70 70 LYS CA C 500 54.995 54.995 56.151 -1.157 18053
2303 1 4 . 1 1 70 70 LYS CB C 500 31.793 31.793 32.192 -0.399 18053
2304 1 4 . 1 1 70 70 LYS H H 500 8.016 8.016 8.112 -0.096 18053
2305 1 4 . 1 1 71 71 TYR N N 501 121.860 121.860 122.286 -0.426 18053
2306 1 4 . 1 1 71 71 TYR HA H 501 3.730 3.730 4.354 -0.624 18053
2307 1 4 . 1 1 71 71 TYR C C 501 174.838 174.838 174.016 0.822 18053
2308 1 4 . 1 1 71 71 TYR CA C 501 62.310 62.310 59.306 3.004 18053
2309 1 4 . 1 1 71 71 TYR CB C 501 38.781 38.781 39.320 -0.539 18053
2310 1 4 . 1 1 71 71 TYR H H 501 7.460 7.460 7.690 -0.230 18053
2311 1 4 . 1 1 72 72 ILE N N 502 129.487 129.487 127.332 2.155 18053
2312 1 4 . 1 1 72 72 ILE HA H 502 3.928 3.928 4.365 -0.437 18053
2313 1 4 . 1 1 72 72 ILE C C 502 172.968 172.968 173.868 -0.900 18053
2314 1 4 . 1 1 72 72 ILE CA C 502 59.308 59.308 59.620 -0.312 18053
2315 1 4 . 1 1 72 72 ILE CB C 502 40.910 40.910 40.367 0.543 18053
2316 1 4 . 1 1 72 72 ILE H H 502 7.168 7.168 7.877 -0.709 18053
2317 1 4 . 1 1 73 73 LEU N N 503 128.278 128.278 128.754 -0.476 18053
2318 1 4 . 1 1 73 73 LEU HA H 503 4.493 4.493 4.491 0.002 18053
2319 1 4 . 1 1 73 73 LEU C C 503 175.834 175.834 175.218 0.616 18053
2320 1 4 . 1 1 73 73 LEU CA C 503 51.965 51.965 53.929 -1.964 18053
2321 1 4 . 1 1 73 73 LEU CB C 503 42.548 42.548 43.197 -0.649 18053
2322 1 4 . 1 1 73 73 LEU H H 503 8.483 8.483 8.444 0.039 18053
2323 1 4 . 1 1 74 74 ARG N N 504 129.589 129.589 124.001 5.588 18053
2324 1 4 . 1 1 74 74 ARG HA H 504 3.743 3.743 4.289 -0.546 18053
2325 1 4 . 1 1 74 74 ARG C C 504 175.233 175.233 176.153 -0.920 18053
2326 1 4 . 1 1 74 74 ARG CA C 504 56.851 56.851 55.033 1.818 18053
2327 1 4 . 1 1 74 74 ARG CB C 504 30.292 30.292 30.612 -0.320 18053
2328 1 4 . 1 1 74 74 ARG H H 504 8.673 8.673 8.450 0.223 18053
2329 1 4 . 1 1 75 75 ALA N N 505 123.205 123.205 124.428 -1.223 18053
2330 1 4 . 1 1 75 75 ALA HA H 505 3.522 3.522 3.995 -0.473 18053
2331 1 4 . 1 1 75 75 ALA C C 505 178.441 178.441 177.977 0.464 18053
2332 1 4 . 1 1 75 75 ALA CA C 505 53.794 53.794 53.191 0.603 18053
2333 1 4 . 1 1 75 75 ALA CB C 505 18.910 18.910 18.112 0.798 18053
2334 1 4 . 1 1 75 75 ALA H H 505 8.564 8.564 8.189 0.375 18053
2335 1 4 . 1 1 76 76 GLY N N 506 112.241 112.241 113.189 -0.948 18053
2336 1 4 . 1 1 76 76 GLY C C 506 174.278 174.278 174.718 -0.440 18053
2337 1 4 . 1 1 76 76 GLY CA C 506 46.725 46.725 44.941 1.784 18053
2338 1 4 . 1 1 76 76 GLY H H 506 7.381 7.381 8.535 -1.154 18053
2339 1 4 . 1 1 77 77 GLN N N 507 117.382 117.382 119.882 -2.500 18053
2340 1 4 . 1 1 77 77 GLN HA H 507 4.364 4.364 4.477 -0.113 18053
2341 1 4 . 1 1 77 77 GLN C C 507 173.937 173.937 174.834 -0.897 18053
2342 1 4 . 1 1 77 77 GLN CA C 507 54.558 54.558 55.389 -0.831 18053
2343 1 4 . 1 1 77 77 GLN CB C 507 30.073 30.073 29.925 0.147 18053
2344 1 4 . 1 1 77 77 GLN H H 507 7.996 7.996 7.636 0.360 18053
2345 1 4 . 1 1 78 78 MET N N 508 116.957 116.957 114.694 2.263 18053
2346 1 4 . 1 1 78 78 MET HA H 508 5.388 5.388 5.271 0.117 18053
2347 1 4 . 1 1 78 78 MET C C 508 175.807 175.807 174.497 1.310 18053
2348 1 4 . 1 1 78 78 MET CA C 508 54.067 54.067 54.458 -0.391 18053
2349 1 4 . 1 1 78 78 MET CB C 508 37.198 37.198 35.925 1.273 18053
2350 1 4 . 1 1 78 78 MET H H 508 8.092 8.092 8.252 -0.161 18053
2351 1 4 . 1 1 79 79 VAL N N 509 119.340 119.340 124.484 -5.144 18053
2352 1 4 . 1 1 79 79 VAL HA H 509 4.956 4.956 4.587 0.369 18053
2353 1 4 . 1 1 79 79 VAL C C 509 172.217 172.217 175.034 -2.817 18053
2354 1 4 . 1 1 79 79 VAL CA C 509 59.471 59.471 60.709 -1.238 18053
2355 1 4 . 1 1 79 79 VAL CB C 509 33.676 33.676 33.522 0.154 18053
2356 1 4 . 1 1 79 79 VAL H H 509 8.534 8.534 8.841 -0.307 18053
2357 1 4 . 1 1 80 80 THR N N 510 124.533 124.533 126.690 -2.157 18053
2358 1 4 . 1 1 80 80 THR HA H 510 4.586 4.586 4.697 -0.111 18053
2359 1 4 . 1 1 80 80 THR C C 510 172.215 172.215 174.440 -2.225 18053
2360 1 4 . 1 1 80 80 THR CA C 510 62.119 62.119 62.479 -0.360 18053
2361 1 4 . 1 1 80 80 THR CB C 510 69.407 69.407 67.982 1.425 18053
2362 1 4 . 1 1 80 80 THR H H 510 8.301 8.301 8.688 -0.387 18053
2363 1 4 . 1 1 81 81 VAL N N 511 127.002 127.002 128.181 -1.179 18053
2364 1 4 . 1 1 81 81 VAL HA H 511 4.596 4.596 4.318 0.278 18053
2365 1 4 . 1 1 81 81 VAL C C 511 176.667 176.667 175.761 0.906 18053
2366 1 4 . 1 1 81 81 VAL CA C 511 61.382 61.382 62.229 -0.847 18053
2367 1 4 . 1 1 81 81 VAL CB C 511 30.945 30.945 31.217 -0.272 18053
2368 1 4 . 1 1 81 81 VAL H H 511 8.796 8.796 8.860 -0.064 18053
2369 1 4 . 1 1 82 82 TRP N N 512 131.479 131.479 129.684 1.795 18053
2370 1 4 . 1 1 82 82 TRP HA H 512 5.338 5.338 5.213 0.125 18053
2371 1 4 . 1 1 82 82 TRP C C 512 176.885 176.885 175.498 1.387 18053
2372 1 4 . 1 1 82 82 TRP CA C 512 56.442 56.442 57.239 -0.797 18053
2373 1 4 . 1 1 82 82 TRP CB C 512 30.701 30.701 31.289 -0.588 18053
2374 1 4 . 1 1 82 82 TRP H H 512 9.924 9.924 9.337 0.587 18053
2375 1 4 . 1 1 83 83 ALA N N 513 123.954 123.954 120.870 3.084 18053
2376 1 4 . 1 1 83 83 ALA HA H 513 4.308 4.308 4.950 -0.642 18053
2377 1 4 . 1 1 83 83 ALA C C 513 178.140 178.140 178.276 -0.136 18053
2378 1 4 . 1 1 83 83 ALA CA C 513 52.211 52.211 50.441 1.770 18053
2379 1 4 . 1 1 83 83 ALA CB C 513 18.745 18.745 20.691 -1.946 18053
2380 1 4 . 1 1 83 83 ALA H H 513 9.048 9.048 8.721 0.327 18053
2381 1 4 . 1 1 84 84 ALA N N 514 125.146 125.146 127.540 -2.394 18053
2382 1 4 . 1 1 84 84 ALA HA H 514 3.951 3.951 4.052 -0.101 18053
2383 1 4 . 1 1 84 84 ALA C C 514 179.519 179.519 179.243 0.276 18053
2384 1 4 . 1 1 84 84 ALA CA C 514 54.804 54.804 54.973 -0.169 18053
2385 1 4 . 1 1 84 84 ALA CB C 514 18.582 18.582 18.929 -0.347 18053
2386 1 4 . 1 1 84 84 ALA H H 514 8.341 8.341 8.450 -0.109 18053
2387 1 4 . 1 1 85 85 GLY N N 515 103.388 103.388 104.379 -0.991 18053
2388 1 4 . 1 1 85 85 GLY C C 515 174.674 174.674 174.785 -0.111 18053
2389 1 4 . 1 1 85 85 GLY CA C 515 45.878 45.878 44.938 0.940 18053
2390 1 4 . 1 1 85 85 GLY H H 515 7.996 7.996 7.909 0.087 18053
2391 1 4 . 1 1 86 86 ALA N N 516 120.140 120.140 123.311 -3.171 18053
2392 1 4 . 1 1 86 86 ALA HA H 516 4.344 4.344 4.339 0.005 18053
2393 1 4 . 1 1 86 86 ALA C C 516 177.690 177.690 177.693 -0.003 18053
2394 1 4 . 1 1 86 86 ALA CA C 516 53.139 53.139 52.148 0.991 18053
2395 1 4 . 1 1 86 86 ALA CB C 516 20.547 20.547 19.595 0.952 18053
2396 1 4 . 1 1 86 86 ALA H H 516 7.474 7.474 7.333 0.141 18053
2397 1 4 . 1 1 87 87 GLY N N 517 105.720 105.720 107.912 -2.192 18053
2398 1 4 . 1 1 87 87 GLY C C 517 173.650 173.650 174.411 -0.761 18053
2399 1 4 . 1 1 87 87 GLY CA C 517 46.014 46.014 45.617 0.397 18053
2400 1 4 . 1 1 87 87 GLY H H 517 7.779 7.779 7.745 0.034 18053
2401 1 4 . 1 1 88 88 VAL N N 518 121.537 121.537 119.571 1.966 18053
2402 1 4 . 1 1 88 88 VAL HA H 518 3.585 3.585 3.974 -0.389 18053
2403 1 4 . 1 1 88 88 VAL C C 518 174.851 174.851 175.358 -0.507 18053
2404 1 4 . 1 1 88 88 VAL CA C 518 61.274 61.274 61.508 -0.234 18053
2405 1 4 . 1 1 88 88 VAL CB C 518 33.376 33.376 32.533 0.843 18053
2406 1 4 . 1 1 88 88 VAL H H 518 7.499 7.499 7.527 -0.028 18053
2407 1 4 . 1 1 89 89 ALA N N 519 128.295 128.295 130.623 -2.328 18053
2408 1 4 . 1 1 89 89 ALA HA H 519 4.192 4.192 4.334 -0.142 18053
2409 1 4 . 1 1 89 89 ALA C C 519 176.680 176.680 176.656 0.024 18053
2410 1 4 . 1 1 89 89 ALA CA C 519 51.283 51.283 51.644 -0.360 18053
2411 1 4 . 1 1 89 89 ALA CB C 519 19.292 19.292 18.935 0.357 18053
2412 1 4 . 1 1 89 89 ALA H H 519 7.960 7.960 8.128 -0.168 18053
2413 1 4 . 1 1 90 90 HIS N N 520 122.643 122.643 125.169 -2.526 18053
2414 1 4 . 1 1 90 90 HIS HA H 520 4.033 4.033 4.427 -0.394 18053
2415 1 4 . 1 1 90 90 HIS C C 520 175.793 175.793 174.665 1.128 18053
2416 1 4 . 1 1 90 90 HIS CA C 520 58.653 58.653 55.868 2.784 18053
2417 1 4 . 1 1 90 90 HIS CB C 520 32.285 32.285 30.141 2.144 18053
2418 1 4 . 1 1 90 90 HIS H H 520 8.394 8.394 8.900 -0.506 18053
2419 1 4 . 1 1 91 91 SER N N 521 121.247 121.247 123.981 -2.734 18053
2420 1 4 . 1 1 91 91 SER HA H 521 4.629 4.629 4.796 -0.167 18053
2421 1 4 . 1 1 91 91 SER CA C 521 55.843 55.843 56.157 -0.314 18053
2422 1 4 . 1 1 91 91 SER CB C 521 62.367 62.367 63.496 -1.129 18053
2423 1 4 . 1 1 91 91 SER H H 521 8.569 8.569 8.720 -0.151 18053
2424 1 4 . 1 1 92 92 PRO HA H 522 4.002 4.002 4.766 -0.764 18053
2425 1 4 . 1 1 92 92 PRO CA C 522 62.244 62.244 61.965 0.279 18053
2426 1 4 . 1 1 92 92 PRO CB C 522 30.931 30.931 31.894 -0.963 18053
2427 1 4 . 1 1 93 93 PRO HA H 523 4.672 4.672 4.774 -0.102 18053
2428 1 4 . 1 1 93 93 PRO C C 523 177.786 177.786 178.389 -0.603 18053
2429 1 4 . 1 1 93 93 PRO CA C 523 64.003 64.003 64.456 -0.453 18053
2430 1 4 . 1 1 93 93 PRO CB C 523 34.905 34.905 32.485 2.420 18053
2431 1 4 . 1 1 94 94 SER N N 524 117.212 117.212 115.990 1.222 18053
2432 1 4 . 1 1 94 94 SER HA H 524 4.678 4.678 4.707 -0.029 18053
2433 1 4 . 1 1 94 94 SER C C 524 174.851 174.851 174.707 0.144 18053
2434 1 4 . 1 1 94 94 SER CA C 524 61.874 61.874 61.282 0.591 18053
2435 1 4 . 1 1 94 94 SER CB C 524 64.057 64.057 63.620 0.437 18053
2436 1 4 . 1 1 94 94 SER H H 524 8.463 8.463 8.576 -0.113 18053
2437 1 4 . 1 1 95 95 THR N N 525 121.588 121.588 118.793 2.795 18053
2438 1 4 . 1 1 95 95 THR HA H 525 4.859 4.859 4.989 -0.130 18053
2439 1 4 . 1 1 95 95 THR C C 525 172.094 172.094 172.735 -0.641 18053
2440 1 4 . 1 1 95 95 THR CA C 525 62.309 62.309 62.184 0.125 18053
2441 1 4 . 1 1 95 95 THR CB C 525 70.281 70.281 69.123 1.158 18053
2442 1 4 . 1 1 95 95 THR H H 525 7.631 7.631 8.020 -0.389 18053
2443 1 4 . 1 1 96 96 LEU N N 526 127.274 127.274 128.212 -0.938 18053
2444 1 4 . 1 1 96 96 LEU HA H 526 5.131 5.131 5.183 -0.052 18053
2445 1 4 . 1 1 96 96 LEU C C 526 175.916 175.916 174.811 1.105 18053
2446 1 4 . 1 1 96 96 LEU CA C 526 52.075 52.075 53.897 -1.822 18053
2447 1 4 . 1 1 96 96 LEU CB C 526 43.790 43.790 44.977 -1.187 18053
2448 1 4 . 1 1 96 96 LEU H H 526 8.977 8.977 8.327 0.650 18053
2449 1 4 . 1 1 97 97 VAL N N 527 124.056 124.056 122.969 1.087 18053
2450 1 4 . 1 1 97 97 VAL HA H 527 4.869 4.869 4.585 0.284 18053
2451 1 4 . 1 1 97 97 VAL C C 527 176.230 176.230 174.859 1.371 18053
2452 1 4 . 1 1 97 97 VAL CA C 527 61.519 61.519 60.654 0.865 18053
2453 1 4 . 1 1 97 97 VAL CB C 527 33.704 33.704 34.053 -0.349 18053
2454 1 4 . 1 1 97 97 VAL H H 527 10.724 10.724 7.844 2.880 18053
2455 1 4 . 1 1 98 98 TRP N N 528 132.586 132.586 130.198 2.388 18053
2456 1 4 . 1 1 98 98 TRP HA H 528 4.965 4.965 4.281 0.684 18053
2457 1 4 . 1 1 98 98 TRP C C 528 173.391 173.391 174.679 -1.288 18053
2458 1 4 . 1 1 98 98 TRP CA C 528 53.303 53.303 55.163 -1.860 18053
2459 1 4 . 1 1 98 98 TRP CB C 528 28.245 28.245 28.392 -0.147 18053
2460 1 4 . 1 1 98 98 TRP H H 528 9.400 9.400 8.912 0.488 18053
2461 1 4 . 1 1 99 99 LYS N N 529 126.644 126.644 129.330 -2.686 18053
2462 1 4 . 1 1 99 99 LYS HA H 529 3.839 3.839 4.153 -0.314 18053
2463 1 4 . 1 1 99 99 LYS C C 529 177.581 177.581 177.331 0.250 18053
2464 1 4 . 1 1 99 99 LYS CA C 529 58.543 58.543 57.566 0.977 18053
2465 1 4 . 1 1 99 99 LYS CB C 529 32.176 32.176 32.926 -0.750 18053
2466 1 4 . 1 1 99 99 LYS H H 529 8.153 8.153 8.047 0.106 18053
2467 1 4 . 1 1 100 100 GLY N N 530 110.385 110.385 111.915 -1.530 18053
2468 1 4 . 1 1 100 100 GLY C C 530 172.367 172.367 173.692 -1.325 18053
2469 1 4 . 1 1 100 100 GLY CA C 530 45.278 45.278 44.995 0.283 18053
2470 1 4 . 1 1 100 100 GLY H H 530 8.363 8.363 8.547 -0.184 18053
2471 1 4 . 1 1 101 101 GLN N N 531 121.162 121.162 121.644 -0.482 18053
2472 1 4 . 1 1 101 101 GLN HA H 531 3.972 3.972 4.044 -0.072 18053
2473 1 4 . 1 1 101 101 GLN CA C 531 52.620 52.620 53.618 -0.998 18053
2474 1 4 . 1 1 101 101 GLN CB C 531 27.595 27.595 28.346 -0.751 18053
2475 1 4 . 1 1 101 101 GLN H H 531 6.815 6.815 7.215 -0.400 18053
2476 1 4 . 1 1 102 102 SER N N 532 122.728 122.728 124.266 -1.538 18053
2477 1 4 . 1 1 102 102 SER HA H 532 3.866 3.866 4.406 -0.540 18053
2478 1 4 . 1 1 102 102 SER C C 532 174.537 174.537 175.716 -1.179 18053
2479 1 4 . 1 1 102 102 SER CA C 532 61.983 61.983 61.289 0.694 18053
2480 1 4 . 1 1 102 102 SER CB C 532 62.802 62.802 63.272 -0.470 18053
2481 1 4 . 1 1 102 102 SER H H 532 8.662 8.662 8.756 -0.094 18053
2482 1 4 . 1 1 103 103 SER N N 533 110.811 110.811 113.653 -2.842 18053
2483 1 4 . 1 1 103 103 SER HA H 533 4.240 4.240 4.686 -0.446 18053
2484 1 4 . 1 1 103 103 SER C C 533 174.087 174.087 173.819 0.268 18053
2485 1 4 . 1 1 103 103 SER CA C 533 56.633 56.633 56.906 -0.273 18053
2486 1 4 . 1 1 103 103 SER CB C 533 64.658 64.658 63.953 0.705 18053
2487 1 4 . 1 1 103 103 SER H H 533 7.134 7.134 7.628 -0.494 18053
2488 1 4 . 1 1 104 104 TRP N N 534 126.133 126.133 120.923 5.210 18053
2489 1 4 . 1 1 104 104 TRP HA H 534 4.098 4.098 4.089 0.009 18053
2490 1 4 . 1 1 104 104 TRP C C 534 176.066 176.066 175.561 0.505 18053
2491 1 4 . 1 1 104 104 TRP CA C 534 60.127 60.127 58.271 1.856 18053
2492 1 4 . 1 1 104 104 TRP CB C 534 28.764 28.764 28.818 -0.054 18053
2493 1 4 . 1 1 104 104 TRP H H 534 9.764 9.764 7.527 2.237 18053
2494 1 4 . 1 1 105 105 GLY N N 535 105.907 105.907 105.989 -0.082 18053
2495 1 4 . 1 1 105 105 GLY C C 535 172.217 172.217 174.785 -2.568 18053
2496 1 4 . 1 1 105 105 GLY CA C 535 44.240 44.240 44.840 -0.600 18053
2497 1 4 . 1 1 105 105 GLY H H 535 8.095 8.095 7.863 0.232 18053
2498 1 4 . 1 1 106 106 THR N N 536 111.253 111.253 115.183 -3.930 18053
2499 1 4 . 1 1 106 106 THR HA H 536 3.859 3.859 4.425 -0.566 18053
2500 1 4 . 1 1 106 106 THR C C 536 172.872 172.872 175.092 -2.220 18053
2501 1 4 . 1 1 106 106 THR CA C 536 59.635 59.635 62.669 -3.034 18053
2502 1 4 . 1 1 106 106 THR CB C 536 70.526 70.526 70.172 0.354 18053
2503 1 4 . 1 1 106 106 THR H H 536 7.913 7.913 7.588 0.325 18053
2504 1 4 . 1 1 107 107 GLY N N 537 107.712 107.712 110.584 -2.872 18053
2505 1 4 . 1 1 107 107 GLY C C 537 172.709 172.709 173.243 -0.534 18053
2506 1 4 . 1 1 107 107 GLY CA C 537 45.166 45.166 45.499 -0.333 18053
2507 1 4 . 1 1 107 107 GLY H H 537 7.533 7.533 8.299 -0.766 18053
2508 1 4 . 1 1 108 108 GLU N N 538 118.864 118.864 117.185 1.679 18053
2509 1 4 . 1 1 108 108 GLU HA H 538 4.136 4.136 4.066 0.070 18053
2510 1 4 . 1 1 108 108 GLU C C 538 176.353 176.353 175.466 0.887 18053
2511 1 4 . 1 1 108 108 GLU CA C 538 58.352 58.352 58.274 0.078 18053
2512 1 4 . 1 1 108 108 GLU CB C 538 30.156 30.156 30.202 -0.046 18053
2513 1 4 . 1 1 108 108 GLU H H 538 8.558 8.558 8.589 -0.031 18053
2514 1 4 . 1 1 109 109 SER N N 539 110.419 110.419 113.797 -3.378 18053
2515 1 4 . 1 1 109 109 SER HA H 539 4.963 4.963 5.009 -0.046 18053
2516 1 4 . 1 1 109 109 SER C C 539 173.787 173.787 172.173 1.614 18053
2517 1 4 . 1 1 109 109 SER CA C 539 57.125 57.125 57.690 -0.565 18053
2518 1 4 . 1 1 109 109 SER CB C 539 64.439 64.439 64.962 -0.523 18053
2519 1 4 . 1 1 109 109 SER H H 539 7.620 7.620 7.573 0.047 18053
2520 1 4 . 1 1 110 110 PHE N N 540 118.778 118.778 118.895 -0.117 18053
2521 1 4 . 1 1 110 110 PHE HA H 540 5.081 5.081 5.310 -0.229 18053
2522 1 4 . 1 1 110 110 PHE C C 540 176.052 176.052 173.436 2.616 18053
2523 1 4 . 1 1 110 110 PHE CA C 540 56.789 56.789 56.415 0.374 18053
2524 1 4 . 1 1 110 110 PHE CB C 540 40.760 40.760 42.237 -1.477 18053
2525 1 4 . 1 1 110 110 PHE H H 540 8.318 8.318 8.156 0.162 18053
2526 1 4 . 1 1 112 112 THR HA H 542 5.468 5.468 4.755 0.713 18053
2527 1 4 . 1 1 112 112 THR C C 542 172.381 172.381 173.365 -0.984 18053
2528 1 4 . 1 1 112 112 THR CA C 542 61.818 61.818 63.434 -1.616 18053
2529 1 4 . 1 1 112 112 THR CB C 542 70.990 70.990 69.743 1.247 18053
2530 1 4 . 1 1 113 113 VAL N N 543 124.771 124.771 127.636 -2.865 18053
2531 1 4 . 1 1 113 113 VAL HA H 543 4.864 4.864 4.459 0.405 18053
2532 1 4 . 1 1 113 113 VAL C C 543 173.132 173.132 174.033 -0.901 18053
2533 1 4 . 1 1 113 113 VAL CA C 543 60.099 60.099 61.083 -0.984 18053
2534 1 4 . 1 1 113 113 VAL CB C 543 36.433 36.433 34.955 1.478 18053
2535 1 4 . 1 1 113 113 VAL H H 543 9.380 9.380 8.791 0.589 18053
2536 1 4 . 1 1 114 114 LEU N N 544 128.789 128.789 128.430 0.359 18053
2537 1 4 . 1 1 114 114 LEU HA H 544 5.320 5.320 4.899 0.421 18053
2538 1 4 . 1 1 114 114 LEU C C 544 174.237 174.237 175.164 -0.927 18053
2539 1 4 . 1 1 114 114 LEU CA C 544 53.193 53.193 53.869 -0.676 18053
2540 1 4 . 1 1 114 114 LEU CB C 544 45.879 45.879 43.744 2.135 18053
2541 1 4 . 1 1 114 114 LEU H H 544 8.948 8.948 8.478 0.470 18053
2542 1 4 . 1 1 115 115 VAL N N 545 127.002 127.002 126.596 0.406 18053
2543 1 4 . 1 1 115 115 VAL HA H 545 4.854 4.854 4.670 0.184 18053
2544 1 4 . 1 1 115 115 VAL C C 545 175.206 175.206 174.748 0.458 18053
2545 1 4 . 1 1 115 115 VAL CA C 545 59.334 59.334 60.592 -1.258 18053
2546 1 4 . 1 1 115 115 VAL CB C 545 34.495 34.495 34.407 0.088 18053
2547 1 4 . 1 1 115 115 VAL H H 545 9.564 9.564 8.969 0.595 18053
2548 1 4 . 1 1 116 116 ASN N N 546 121.179 121.179 122.819 -1.640 18053
2549 1 4 . 1 1 116 116 ASN HA H 546 2.897 2.897 3.788 -0.891 18053
2550 1 4 . 1 1 116 116 ASN C C 546 176.885 176.885 174.901 1.984 18053
2551 1 4 . 1 1 116 116 ASN CA C 546 50.409 50.409 51.359 -0.950 18053
2552 1 4 . 1 1 116 116 ASN CB C 546 36.639 36.639 39.405 -2.766 18053
2553 1 4 . 1 1 116 116 ASN H H 546 8.016 8.016 7.875 0.141 18053
2554 1 4 . 1 1 117 117 ALA N N 547 119.834 119.834 119.241 0.593 18053
2555 1 4 . 1 1 117 117 ALA HA H 547 3.866 3.866 4.049 -0.183 18053
2556 1 4 . 1 1 117 117 ALA C C 547 177.772 177.772 179.014 -1.242 18053
2557 1 4 . 1 1 117 117 ALA CA C 547 54.504 54.504 54.575 -0.071 18053
2558 1 4 . 1 1 117 117 ALA CB C 547 18.200 18.200 18.391 -0.191 18053
2559 1 4 . 1 1 117 117 ALA H H 547 6.444 6.444 7.994 -1.550 18053
2560 1 4 . 1 1 118 118 ASP N N 548 115.646 115.646 117.549 -1.903 18053
2561 1 4 . 1 1 118 118 ASP HA H 548 4.644 4.644 4.366 0.278 18053
2562 1 4 . 1 1 118 118 ASP C C 548 176.052 176.052 177.413 -1.361 18053
2563 1 4 . 1 1 118 118 ASP CA C 548 54.067 54.067 55.659 -1.592 18053
2564 1 4 . 1 1 118 118 ASP CB C 548 41.674 41.674 41.289 0.385 18053
2565 1 4 . 1 1 118 118 ASP H H 548 7.181 7.181 8.149 -0.968 18053
2566 1 4 . 1 1 119 119 GLY N N 549 107.167 107.167 106.575 0.592 18053
2567 1 4 . 1 1 119 119 GLY C C 549 173.841 173.841 173.568 0.273 18053
2568 1 4 . 1 1 119 119 GLY CA C 549 45.455 45.455 44.694 0.761 18053
2569 1 4 . 1 1 119 119 GLY H H 549 7.738 7.738 7.529 0.209 18053
2570 1 4 . 1 1 120 120 GLU N N 550 121.196 121.196 119.177 2.019 18053
2571 1 4 . 1 1 120 120 GLU HA H 550 4.112 4.112 4.349 -0.237 18053
2572 1 4 . 1 1 120 120 GLU C C 550 175.588 175.588 175.521 0.067 18053
2573 1 4 . 1 1 120 120 GLU CA C 550 54.831 54.831 55.087 -0.256 18053
2574 1 4 . 1 1 120 120 GLU CB C 550 29.937 29.937 30.457 -0.520 18053
2575 1 4 . 1 1 120 120 GLU H H 550 7.587 7.587 7.563 0.024 18053
2576 1 4 . 1 1 121 121 GLU N N 551 123.886 123.886 123.401 0.485 18053
2577 1 4 . 1 1 121 121 GLU HA H 551 4.276 4.276 4.301 -0.025 18053
2578 1 4 . 1 1 121 121 GLU C C 551 176.817 176.817 176.471 0.346 18053
2579 1 4 . 1 1 121 121 GLU CA C 551 56.796 56.796 56.901 -0.105 18053
2580 1 4 . 1 1 121 121 GLU CB C 551 28.955 28.955 29.271 -0.316 18053
2581 1 4 . 1 1 121 121 GLU H H 551 8.697 8.697 8.728 -0.031 18053
2582 1 4 . 1 1 122 122 VAL N N 552 120.055 120.055 120.859 -0.804 18053
2583 1 4 . 1 1 122 122 VAL HA H 552 4.364 4.364 4.089 0.275 18053
2584 1 4 . 1 1 122 122 VAL C C 552 175.998 175.998 175.309 0.689 18053
2585 1 4 . 1 1 122 122 VAL CA C 552 61.655 61.655 63.115 -1.460 18053
2586 1 4 . 1 1 122 122 VAL CB C 552 33.049 33.049 32.743 0.306 18053
2587 1 4 . 1 1 122 122 VAL H H 552 8.845 8.845 8.062 0.783 18053
2588 1 4 . 1 1 123 123 ALA N N 553 122.098 122.098 120.219 1.879 18053
2589 1 4 . 1 1 123 123 ALA HA H 553 4.890 4.890 4.799 0.091 18053
2590 1 4 . 1 1 123 123 ALA C C 553 175.261 175.261 175.280 -0.019 18053
2591 1 4 . 1 1 123 123 ALA CA C 553 52.757 52.757 51.336 1.421 18053
2592 1 4 . 1 1 123 123 ALA CB C 553 22.267 22.267 21.781 0.486 18053
2593 1 4 . 1 1 123 123 ALA H H 553 7.788 7.788 7.794 -0.006 18053
2594 1 4 . 1 1 124 124 MET N N 554 118.217 118.217 121.495 -3.278 18053
2595 1 4 . 1 1 124 124 MET HA H 554 5.286 5.286 4.837 0.449 18053
2596 1 4 . 1 1 124 124 MET C C 554 174.428 174.428 174.078 0.350 18053
2597 1 4 . 1 1 124 124 MET CA C 554 55.104 55.104 55.240 -0.136 18053
2598 1 4 . 1 1 124 124 MET CB C 554 35.342 35.342 36.297 -0.955 18053
2599 1 4 . 1 1 124 124 MET H H 554 8.693 8.693 8.526 0.167 18053
2600 1 4 . 1 1 125 125 ARG N N 555 122.132 122.132 125.561 -3.429 18053
2601 1 4 . 1 1 125 125 ARG HA H 555 4.900 4.900 4.768 0.132 18053
2602 1 4 . 1 1 125 125 ARG CA C 555 56.388 56.388 55.129 1.259 18053
2603 1 4 . 1 1 125 125 ARG CB C 555 34.378 34.378 34.885 -0.507 18053
2604 1 4 . 1 1 125 125 ARG H H 555 8.919 8.919 9.006 -0.087 18053
2605 1 4 . 1 1 126 126 THR HA H 556 4.685 4.685 4.596 0.089 18053
2606 1 4 . 1 1 126 126 THR C C 556 172.436 172.436 174.021 -1.585 18053
2607 1 4 . 1 1 126 126 THR CA C 556 61.382 61.382 61.689 -0.307 18053
2608 1 4 . 1 1 126 126 THR CB C 556 70.444 70.444 69.790 0.654 18053
2609 1 4 . 1 1 127 127 VAL N N 557 124.976 124.976 127.676 -2.700 18053
2610 1 4 . 1 1 127 127 VAL HA H 557 4.146 4.146 4.069 0.077 18053
2611 1 4 . 1 1 127 127 VAL C C 557 173.937 173.937 174.402 -0.465 18053
2612 1 4 . 1 1 127 127 VAL CA C 557 61.109 61.109 60.771 0.338 18053
2613 1 4 . 1 1 127 127 VAL CB C 557 33.759 33.759 32.874 0.885 18053
2614 1 4 . 1 1 127 127 VAL H H 557 8.127 8.127 8.844 -0.717 18053
2615 1 4 . 1 1 128 128 LYS N N 558 125.384 125.384 126.991 -1.607 18053
2616 1 4 . 1 1 128 128 LYS HA H 558 4.706 4.706 4.474 0.232 18053
2617 1 4 . 1 1 128 128 LYS C C 558 175.534 175.534 175.674 -0.140 18053
2618 1 4 . 1 1 128 128 LYS CA C 558 54.886 54.886 53.785 1.101 18053
2619 1 4 . 1 1 128 128 LYS CB C 558 34.673 34.673 31.625 3.048 18053
2620 1 4 . 1 1 128 128 LYS H H 558 8.289 8.289 8.358 -0.069 18053
2621 1 4 . 1 1 129 129 LYS N N 559 124.005 124.005 126.934 -2.929 18053
2622 1 4 . 1 1 129 129 LYS HA H 559 4.310 4.310 4.263 0.047 18053
2623 1 4 . 1 1 129 129 LYS C C 559 176.571 176.571 177.636 -1.065 18053
2624 1 4 . 1 1 129 129 LYS CA C 559 56.742 56.742 56.810 -0.068 18053
2625 1 4 . 1 1 129 129 LYS CB C 559 33.362 33.362 32.973 0.389 18053
2626 1 4 . 1 1 129 129 LYS H H 559 8.461 8.461 7.772 0.689 18053
2627 1 4 . 1 1 130 130 SER N N 560 117.195 117.195 120.093 -2.898 18053
2628 1 4 . 1 1 130 130 SER HA H 560 4.384 4.384 4.280 0.104 18053
2629 1 4 . 1 1 130 130 SER C C 560 174.565 174.565 174.538 0.027 18053
2630 1 4 . 1 1 130 130 SER CA C 560 58.434 58.434 60.215 -1.781 18053
2631 1 4 . 1 1 130 130 SER CB C 560 63.812 63.812 63.434 0.378 18053
2632 1 4 . 1 1 130 130 SER H H 560 8.465 8.465 8.509 -0.044 18053
2633 1 4 . 1 1 131 131 SER N N 561 118.149 118.149 112.759 5.390 18053
2634 1 4 . 1 1 131 131 SER HA H 561 4.412 4.412 4.506 -0.094 18053
2635 1 4 . 1 1 131 131 SER C C 561 174.456 174.456 172.845 1.611 18053
2636 1 4 . 1 1 131 131 SER CA C 561 58.489 58.489 57.958 0.531 18053
2637 1 4 . 1 1 131 131 SER CB C 561 63.811 63.811 64.675 -0.864 18053
2638 1 4 . 1 1 131 131 SER H H 561 8.336 8.336 7.583 0.753 18053
2639 1 4 . 1 1 132 132 VAL N N 562 121.332 121.332 119.387 1.945 18053
2640 1 4 . 1 1 132 132 VAL HA H 562 4.035 4.035 4.338 -0.303 18053
2641 1 4 . 1 1 132 132 VAL C C 562 176.066 176.066 175.707 0.359 18053
2642 1 4 . 1 1 132 132 VAL CA C 562 62.446 62.446 61.490 0.956 18053
2643 1 4 . 1 1 132 132 VAL CB C 562 32.394 32.394 32.640 -0.246 18053
2644 1 4 . 1 1 132 132 VAL H H 562 7.982 7.982 8.250 -0.268 18053
2645 1 4 . 1 1 133 133 MET N N 563 124.022 124.022 121.934 2.088 18053
2646 1 4 . 1 1 133 133 MET HA H 563 4.385 4.385 4.382 0.003 18053
2647 1 4 . 1 1 133 133 MET C C 563 176.039 176.039 175.849 0.190 18053
2648 1 4 . 1 1 133 133 MET CA C 563 55.350 55.350 55.826 -0.476 18053
2649 1 4 . 1 1 133 133 MET CB C 563 32.503 32.503 31.053 1.450 18053
2650 1 4 . 1 1 133 133 MET H H 563 8.295 8.295 7.825 0.470 18053
2651 1 4 . 1 1 134 134 ARG N N 564 122.677 122.677 124.595 -1.918 18053
2652 1 4 . 1 1 134 134 ARG HA H 564 4.262 4.262 4.599 -0.337 18053
2653 1 4 . 1 1 134 134 ARG C C 564 176.298 176.298 176.003 0.295 18053
2654 1 4 . 1 1 134 134 ARG CA C 564 56.087 56.087 55.045 1.042 18053
2655 1 4 . 1 1 134 134 ARG CB C 564 30.702 30.702 32.215 -1.513 18053
2656 1 4 . 1 1 134 134 ARG H H 564 8.295 8.295 8.315 -0.020 18053
2657 1 4 . 1 1 135 135 GLU N N 565 121.945 121.945 121.835 0.110 18053
2658 1 4 . 1 1 135 135 GLU HA H 565 4.160 4.160 4.317 -0.157 18053
2659 1 4 . 1 1 135 135 GLU C C 565 176.080 176.080 176.247 -0.167 18053
2660 1 4 . 1 1 135 135 GLU CA C 565 56.906 56.906 56.748 0.158 18053
2661 1 4 . 1 1 135 135 GLU CB C 565 29.774 29.774 30.044 -0.270 18053
2662 1 4 . 1 1 135 135 GLU H H 565 8.470 8.470 8.726 -0.256 18053
2663 1 4 . 1 1 136 136 ASN N N 566 118.761 118.761 123.638 -4.877 18053
2664 1 4 . 1 1 136 136 ASN HA H 566 4.617 4.617 4.804 -0.187 18053
2665 1 4 . 1 1 136 136 ASN C C 566 175.315 175.315 176.514 -1.199 18053
2666 1 4 . 1 1 136 136 ASN CA C 566 53.193 53.193 53.498 -0.305 18053
2667 1 4 . 1 1 136 136 ASN CB C 566 38.836 38.836 39.157 -0.321 18053
2668 1 4 . 1 1 136 136 ASN H H 566 8.341 8.341 9.001 -0.660 18053
2669 1 4 . 1 1 137 137 GLU N N 567 121.349 121.349 120.671 0.678 18053
2670 1 4 . 1 1 137 137 GLU HA H 567 4.152 4.152 4.232 -0.080 18053
2671 1 4 . 1 1 137 137 GLU C C 567 176.243 176.243 176.647 -0.404 18053
2672 1 4 . 1 1 137 137 GLU CA C 567 56.906 56.906 57.953 -1.047 18053
2673 1 4 . 1 1 137 137 GLU CB C 567 29.992 29.992 29.623 0.369 18053
2674 1 4 . 1 1 137 137 GLU H H 567 8.349 8.349 8.811 -0.462 18053
2675 1 4 . 1 1 138 138 ASN N N 568 118.761 118.761 114.583 4.178 18053
2676 1 4 . 1 1 138 138 ASN HA H 568 4.712 4.712 4.780 -0.068 18053
2677 1 4 . 1 1 138 138 ASN C C 568 174.551 174.551 174.556 -0.005 18053
2678 1 4 . 1 1 138 138 ASN CA C 568 53.193 53.193 52.915 0.278 18053
2679 1 4 . 1 1 138 138 ASN CB C 568 39.327 39.327 38.573 0.754 18053
2680 1 4 . 1 1 138 138 ASN H H 568 8.397 8.397 8.029 0.368 18053
2681 1 5 . 1 1 20 20 ALA N N 450 125.180 125.180 128.144 -2.964 18053
2682 1 5 . 1 1 20 20 ALA HA H 450 4.706 4.706 4.344 0.362 18053
2683 1 5 . 1 1 20 20 ALA C C 450 177.226 177.226 177.138 0.088 18053
2684 1 5 . 1 1 20 20 ALA CA C 450 52.757 52.757 52.181 0.576 18053
2685 1 5 . 1 1 20 20 ALA CB C 450 20.411 20.411 19.057 1.354 18053
2686 1 5 . 1 1 20 20 ALA H H 450 8.484 8.484 8.441 0.043 18053
2687 1 5 . 1 1 21 21 SER N N 451 115.714 115.714 119.666 -3.952 18053
2688 1 5 . 1 1 21 21 SER HA H 451 4.513 4.513 4.527 -0.014 18053
2689 1 5 . 1 1 21 21 SER C C 451 174.742 174.742 175.098 -0.356 18053
2690 1 5 . 1 1 21 21 SER CA C 451 58.516 58.516 58.217 0.299 18053
2691 1 5 . 1 1 21 21 SER CB C 451 64.159 64.159 63.148 1.011 18053
2692 1 5 . 1 1 21 21 SER H H 451 8.487 8.487 8.065 0.422 18053
2693 1 5 . 1 1 22 22 GLY N N 452 111.509 111.509 115.520 -4.011 18053
2694 1 5 . 1 1 22 22 GLY C C 452 174.401 174.401 175.060 -0.659 18053
2695 1 5 . 1 1 22 22 GLY CA C 452 45.059 45.059 45.314 -0.255 18053
2696 1 5 . 1 1 22 22 GLY H H 452 8.198 8.198 8.596 -0.398 18053
2697 1 5 . 1 1 23 23 SER N N 453 116.191 116.191 115.448 0.743 18053
2698 1 5 . 1 1 23 23 SER HA H 453 4.364 4.364 4.326 0.038 18053
2699 1 5 . 1 1 23 23 SER C C 453 173.432 173.432 173.770 -0.338 18053
2700 1 5 . 1 1 23 23 SER CA C 453 59.744 59.744 60.729 -0.985 18053
2701 1 5 . 1 1 23 23 SER CB C 453 64.335 64.335 63.788 0.547 18053
2702 1 5 . 1 1 23 23 SER H H 453 8.494 8.494 8.416 0.078 18053
2703 1 5 . 1 1 24 24 VAL N N 454 121.656 121.656 118.212 3.444 18053
2704 1 5 . 1 1 24 24 VAL HA H 454 5.035 5.035 4.409 0.626 18053
2705 1 5 . 1 1 24 24 VAL C C 454 174.606 174.606 174.764 -0.158 18053
2706 1 5 . 1 1 24 24 VAL CA C 454 61.055 61.055 60.495 0.560 18053
2707 1 5 . 1 1 24 24 VAL CB C 454 32.503 32.503 34.789 -2.287 18053
2708 1 5 . 1 1 24 24 VAL H H 454 7.830 7.830 7.792 0.038 18053
2709 1 5 . 1 1 25 25 SER N N 455 119.323 119.323 118.510 0.813 18053
2710 1 5 . 1 1 25 25 SER HA H 455 4.672 4.672 4.846 -0.174 18053
2711 1 5 . 1 1 25 25 SER C C 455 174.426 174.426 173.348 1.078 18053
2712 1 5 . 1 1 25 25 SER CA C 455 55.268 55.268 56.626 -1.358 18053
2713 1 5 . 1 1 25 25 SER CB C 455 65.162 65.162 66.748 -1.586 18053
2714 1 5 . 1 1 25 25 SER H H 455 9.065 9.065 8.783 0.282 18053
2715 1 5 . 1 1 26 26 ILE N N 456 119.468 119.468 123.284 -3.816 18053
2716 1 5 . 1 1 26 26 ILE HA H 456 4.180 4.180 3.895 0.285 18053
2717 1 5 . 1 1 26 26 ILE C C 456 175.506 175.506 175.889 -0.383 18053
2718 1 5 . 1 1 26 26 ILE CA C 456 61.328 61.328 62.808 -1.480 18053
2719 1 5 . 1 1 26 26 ILE CB C 456 37.962 37.962 38.193 -0.231 18053
2720 1 5 . 1 1 26 26 ILE H H 456 8.295 8.295 8.728 -0.433 18053
2721 1 5 . 1 1 27 27 GLU N N 457 129.726 129.726 128.712 1.014 18053
2722 1 5 . 1 1 27 27 GLU HA H 457 4.228 4.228 4.431 -0.203 18053
2723 1 5 . 1 1 27 27 GLU C C 457 175.179 175.179 175.875 -0.696 18053
2724 1 5 . 1 1 27 27 GLU CA C 457 55.432 55.432 57.057 -1.625 18053
2725 1 5 . 1 1 27 27 GLU CB C 457 30.142 30.142 31.558 -1.416 18053
2726 1 5 . 1 1 27 27 GLU H H 457 8.393 8.393 8.656 -0.263 18053
2727 1 5 . 1 1 28 28 GLU N N 458 117.076 117.076 116.525 0.551 18053
2728 1 5 . 1 1 28 28 GLU HA H 458 4.168 4.168 4.636 -0.468 18053
2729 1 5 . 1 1 28 28 GLU C C 458 174.701 174.701 174.921 -0.220 18053
2730 1 5 . 1 1 28 28 GLU CA C 458 56.906 56.906 55.009 1.897 18053
2731 1 5 . 1 1 28 28 GLU CB C 458 31.848 31.848 33.803 -1.955 18053
2732 1 5 . 1 1 28 28 GLU H H 458 7.489 7.489 7.981 -0.492 18053
2733 1 5 . 1 1 29 29 ILE N N 459 122.183 122.183 120.065 2.118 18053
2734 1 5 . 1 1 29 29 ILE HA H 459 3.764 3.764 3.887 -0.123 18053
2735 1 5 . 1 1 29 29 ILE C C 459 174.169 174.169 174.657 -0.488 18053
2736 1 5 . 1 1 29 29 ILE CA C 459 59.526 59.526 59.401 0.125 18053
2737 1 5 . 1 1 29 29 ILE CB C 459 40.309 40.309 41.322 -1.013 18053
2738 1 5 . 1 1 29 29 ILE H H 459 8.126 8.126 8.269 -0.143 18053
2739 1 5 . 1 1 30 30 ASP N N 460 123.205 123.205 124.472 -1.267 18053
2740 1 5 . 1 1 30 30 ASP HA H 460 4.183 4.183 4.325 -0.142 18053
2741 1 5 . 1 1 30 30 ASP C C 460 178.318 178.318 177.737 0.581 18053
2742 1 5 . 1 1 30 30 ASP CA C 460 53.930 53.930 53.930 -0.000 18053
2743 1 5 . 1 1 30 30 ASP CB C 460 42.807 42.807 42.517 0.290 18053
2744 1 5 . 1 1 30 30 ASP H H 460 6.704 6.704 7.442 -0.738 18053
2745 1 5 . 1 1 31 31 LEU N N 461 128.551 128.551 122.478 6.073 18053
2746 1 5 . 1 1 31 31 LEU HA H 461 4.064 4.064 4.191 -0.127 18053
2747 1 5 . 1 1 31 31 LEU C C 461 177.513 177.513 177.497 0.016 18053
2748 1 5 . 1 1 31 31 LEU CA C 461 57.124 57.124 56.787 0.337 18053
2749 1 5 . 1 1 31 31 LEU CB C 461 41.237 41.237 41.823 -0.586 18053
2750 1 5 . 1 1 31 31 LEU H H 461 9.012 9.012 8.335 0.677 18053
2751 1 5 . 1 1 32 32 GLU N N 462 115.101 115.101 117.562 -2.461 18053
2752 1 5 . 1 1 32 32 GLU HA H 462 4.283 4.283 4.356 -0.073 18053
2753 1 5 . 1 1 32 32 GLU C C 462 177.062 177.062 176.906 0.156 18053
2754 1 5 . 1 1 32 32 GLU CA C 462 55.759 55.759 57.255 -1.496 18053
2755 1 5 . 1 1 32 32 GLU CB C 462 29.569 29.569 30.870 -1.301 18053
2756 1 5 . 1 1 32 32 GLU H H 462 7.588 7.588 7.945 -0.357 18053
2757 1 5 . 1 1 33 33 GLY N N 463 106.299 106.299 105.971 0.328 18053
2758 1 5 . 1 1 33 33 GLY C C 463 174.824 174.824 175.321 -0.497 18053
2759 1 5 . 1 1 33 33 GLY CA C 463 46.806 46.806 44.991 1.815 18053
2760 1 5 . 1 1 33 33 GLY H H 463 7.372 7.372 8.061 -0.689 18053
2761 1 5 . 1 1 34 34 LYS N N 464 118.744 118.744 119.021 -0.277 18053
2762 1 5 . 1 1 34 34 LYS HA H 464 4.562 4.562 4.356 0.205 18053
2763 1 5 . 1 1 34 34 LYS C C 464 177.076 177.076 175.264 1.812 18053
2764 1 5 . 1 1 34 34 LYS CA C 464 59.963 59.963 57.333 2.630 18053
2765 1 5 . 1 1 34 34 LYS CB C 464 33.111 33.111 33.204 -0.093 18053
2766 1 5 . 1 1 34 34 LYS H H 464 9.547 9.547 8.094 1.453 18053
2767 1 5 . 1 1 35 35 PHE N N 465 109.125 109.125 111.836 -2.711 18053
2768 1 5 . 1 1 35 35 PHE HA H 465 5.514 5.514 4.855 0.659 18053
2769 1 5 . 1 1 35 35 PHE C C 465 174.183 174.183 172.658 1.525 18053
2770 1 5 . 1 1 35 35 PHE CA C 465 56.632 56.632 55.281 1.351 18053
2771 1 5 . 1 1 35 35 PHE CB C 465 40.599 40.599 40.506 0.093 18053
2772 1 5 . 1 1 35 35 PHE H H 465 6.740 6.740 7.056 -0.316 18053
2773 1 5 . 1 1 36 36 VAL N N 466 119.579 119.579 119.506 0.073 18053
2774 1 5 . 1 1 36 36 VAL HA H 466 3.709 3.709 4.048 -0.339 18053
2775 1 5 . 1 1 36 36 VAL C C 466 172.668 172.668 174.414 -1.746 18053
2776 1 5 . 1 1 36 36 VAL CA C 466 62.692 62.692 61.114 1.578 18053
2777 1 5 . 1 1 36 36 VAL CB C 466 36.215 36.215 33.676 2.539 18053
2778 1 5 . 1 1 36 36 VAL H H 466 7.628 7.628 8.504 -0.876 18053
2779 1 5 . 1 1 37 37 GLN N N 467 126.831 126.831 128.131 -1.300 18053
2780 1 5 . 1 1 37 37 GLN HA H 467 5.449 5.449 4.561 0.888 18053
2781 1 5 . 1 1 37 37 GLN C C 467 174.797 174.797 174.389 0.408 18053
2782 1 5 . 1 1 37 37 GLN CA C 467 54.121 54.121 54.943 -0.822 18053
2783 1 5 . 1 1 37 37 GLN CB C 467 34.623 34.623 29.038 5.585 18053
2784 1 5 . 1 1 37 37 GLN H H 467 8.392 8.392 8.444 -0.052 18053
2785 1 5 . 1 1 38 38 LEU N N 468 123.018 123.018 129.377 -6.359 18053
2786 1 5 . 1 1 38 38 LEU HA H 468 5.422 5.422 4.714 0.708 18053
2787 1 5 . 1 1 38 38 LEU C C 468 175.588 175.588 174.303 1.285 18053
2788 1 5 . 1 1 38 38 LEU CA C 468 52.702 52.702 54.146 -1.444 18053
2789 1 5 . 1 1 38 38 LEU CB C 468 45.046 45.046 45.567 -0.521 18053
2790 1 5 . 1 1 38 38 LEU H H 468 9.103 9.103 8.928 0.175 18053
2791 1 5 . 1 1 39 39 LYS N N 469 118.983 118.983 125.159 -6.176 18053
2792 1 5 . 1 1 39 39 LYS HA H 469 4.852 4.852 4.631 0.221 18053
2793 1 5 . 1 1 39 39 LYS C C 469 173.309 173.309 174.517 -1.208 18053
2794 1 5 . 1 1 39 39 LYS CA C 469 54.994 54.994 54.533 0.461 18053
2795 1 5 . 1 1 39 39 LYS CB C 469 38.246 38.246 35.821 2.425 18053
2796 1 5 . 1 1 39 39 LYS H H 469 8.496 8.496 8.719 -0.223 18053
2797 1 5 . 1 1 40 40 ASN N N 470 121.758 121.758 122.682 -0.924 18053
2798 1 5 . 1 1 40 40 ASN HA H 470 4.788 4.788 4.694 0.094 18053
2799 1 5 . 1 1 40 40 ASN C C 470 174.496 174.496 174.797 -0.301 18053
2800 1 5 . 1 1 40 40 ASN CA C 470 51.119 51.119 52.604 -1.485 18053
2801 1 5 . 1 1 40 40 ASN CB C 470 37.559 37.559 39.426 -1.867 18053
2802 1 5 . 1 1 40 40 ASN H H 470 8.283 8.283 8.428 -0.145 18053
2803 1 5 . 1 1 41 41 ASN N N 471 122.422 122.422 124.040 -1.618 18053
2804 1 5 . 1 1 41 41 ASN HA H 471 4.588 4.588 4.796 -0.208 18053
2805 1 5 . 1 1 41 41 ASN C C 471 174.810 174.810 175.056 -0.246 18053
2806 1 5 . 1 1 41 41 ASN CA C 471 53.985 53.985 52.675 1.310 18053
2807 1 5 . 1 1 41 41 ASN CB C 471 39.600 39.600 40.110 -0.510 18053
2808 1 5 . 1 1 41 41 ASN H H 471 8.681 8.681 8.563 0.118 18053
2809 1 5 . 1 1 42 42 SER N N 472 116.446 116.446 116.118 0.328 18053
2810 1 5 . 1 1 42 42 SER HA H 472 4.719 4.719 4.502 0.217 18053
2811 1 5 . 1 1 42 42 SER C C 472 172.804 172.804 175.034 -2.230 18053
2812 1 5 . 1 1 42 42 SER CA C 472 57.288 57.288 57.380 -0.092 18053
2813 1 5 . 1 1 42 42 SER CB C 472 66.241 66.241 64.847 1.394 18053
2814 1 5 . 1 1 42 42 SER H H 472 8.370 8.370 8.202 0.168 18053
2815 1 5 . 1 1 43 43 ASP N N 473 117.706 117.706 119.979 -2.273 18053
2816 1 5 . 1 1 43 43 ASP HA H 473 4.474 4.474 4.681 -0.207 18053
2817 1 5 . 1 1 43 43 ASP C C 473 175.343 175.343 175.701 -0.358 18053
2818 1 5 . 1 1 43 43 ASP CA C 473 53.521 53.521 54.456 -0.935 18053
2819 1 5 . 1 1 43 43 ASP CB C 473 40.322 40.322 40.682 -0.360 18053
2820 1 5 . 1 1 43 43 ASP H H 473 8.254 8.254 8.590 -0.336 18053
2821 1 5 . 1 1 44 44 LYS N N 474 120.209 120.209 119.471 0.738 18053
2822 1 5 . 1 1 44 44 LYS HA H 474 4.569 4.569 4.485 0.084 18053
2823 1 5 . 1 1 44 44 LYS C C 474 175.397 175.397 174.130 1.267 18053
2824 1 5 . 1 1 44 44 LYS CA C 474 54.012 54.012 54.641 -0.629 18053
2825 1 5 . 1 1 44 44 LYS CB C 474 35.383 35.383 33.718 1.665 18053
2826 1 5 . 1 1 44 44 LYS H H 474 8.305 8.305 7.342 0.963 18053
2827 1 5 . 1 1 45 45 ASP N N 475 124.993 124.993 121.177 3.816 18053
2828 1 5 . 1 1 45 45 ASP HA H 475 3.975 3.975 4.419 -0.444 18053
2829 1 5 . 1 1 45 45 ASP C C 475 174.810 174.810 176.021 -1.211 18053
2830 1 5 . 1 1 45 45 ASP CA C 475 54.995 54.995 55.755 -0.760 18053
2831 1 5 . 1 1 45 45 ASP CB C 475 40.364 40.364 40.105 0.259 18053
2832 1 5 . 1 1 45 45 ASP H H 475 8.722 8.722 8.536 0.186 18053
2833 1 5 . 1 1 46 46 GLN N N 476 120.549 120.549 126.588 -6.039 18053
2834 1 5 . 1 1 46 46 GLN HA H 476 4.436 4.436 4.298 0.138 18053
2835 1 5 . 1 1 46 46 GLN C C 476 174.019 174.019 175.226 -1.207 18053
2836 1 5 . 1 1 46 46 GLN CA C 476 53.138 53.138 55.137 -1.999 18053
2837 1 5 . 1 1 46 46 GLN CB C 476 31.466 31.466 29.233 2.233 18053
2838 1 5 . 1 1 46 46 GLN H H 476 7.878 7.878 8.269 -0.391 18053
2839 1 5 . 1 1 47 47 SER N N 477 121.537 121.537 122.284 -0.747 18053
2840 1 5 . 1 1 47 47 SER HA H 477 4.229 4.229 4.225 0.004 18053
2841 1 5 . 1 1 47 47 SER C C 477 174.565 174.565 173.730 0.835 18053
2842 1 5 . 1 1 47 47 SER CA C 477 58.706 58.706 58.837 -0.132 18053
2843 1 5 . 1 1 47 47 SER CB C 477 62.965 62.965 63.094 -0.129 18053
2844 1 5 . 1 1 47 47 SER H H 477 8.748 8.748 8.743 0.005 18053
2845 1 5 . 1 1 48 48 LEU N N 478 127.751 127.751 127.035 0.716 18053
2846 1 5 . 1 1 48 48 LEU HA H 478 2.631 2.631 4.455 -1.824 18053
2847 1 5 . 1 1 48 48 LEU C C 478 176.789 176.789 176.825 -0.036 18053
2848 1 5 . 1 1 48 48 LEU CA C 478 52.102 52.102 54.928 -2.826 18053
2849 1 5 . 1 1 48 48 LEU CB C 478 42.343 42.343 43.335 -0.992 18053
2850 1 5 . 1 1 48 48 LEU H H 478 7.856 7.856 7.583 0.273 18053
2851 1 5 . 1 1 49 49 GLY N N 479 107.525 107.525 106.968 0.557 18053
2852 1 5 . 1 1 49 49 GLY C C 479 176.653 176.653 175.462 1.191 18053
2853 1 5 . 1 1 49 49 GLY CA C 479 48.062 48.062 45.844 2.218 18053
2854 1 5 . 1 1 49 49 GLY H H 479 7.728 7.728 8.707 -0.979 18053
2855 1 5 . 1 1 50 50 ASN N N 480 117.059 117.059 120.093 -3.034 18053
2856 1 5 . 1 1 50 50 ASN HA H 480 4.255 4.255 4.589 -0.334 18053
2857 1 5 . 1 1 50 50 ASN C C 480 174.961 174.961 175.731 -0.770 18053
2858 1 5 . 1 1 50 50 ASN CA C 480 56.360 56.360 54.466 1.894 18053
2859 1 5 . 1 1 50 50 ASN CB C 480 37.416 37.416 38.911 -1.495 18053
2860 1 5 . 1 1 50 50 ASN H H 480 7.552 7.552 8.856 -1.304 18053
2861 1 5 . 1 1 51 51 TRP N N 481 122.166 122.166 118.238 3.928 18053
2862 1 5 . 1 1 51 51 TRP HA H 481 4.477 4.477 4.876 -0.399 18053
2863 1 5 . 1 1 51 51 TRP C C 481 175.575 175.575 175.627 -0.052 18053
2864 1 5 . 1 1 51 51 TRP CA C 481 58.762 58.762 57.968 0.794 18053
2865 1 5 . 1 1 51 51 TRP CB C 481 28.041 28.041 30.747 -2.706 18053
2866 1 5 . 1 1 51 51 TRP H H 481 8.914 8.914 7.777 1.137 18053
2867 1 5 . 1 1 52 52 ARG N N 482 116.480 116.480 115.901 0.579 18053
2868 1 5 . 1 1 52 52 ARG HA H 482 5.968 5.968 5.234 0.734 18053
2869 1 5 . 1 1 52 52 ARG C C 482 175.807 175.807 174.988 0.819 18053
2870 1 5 . 1 1 52 52 ARG CA C 482 54.121 54.121 55.424 -1.303 18053
2871 1 5 . 1 1 52 52 ARG CB C 482 35.124 35.124 33.397 1.727 18053
2872 1 5 . 1 1 52 52 ARG H H 482 9.147 9.147 9.269 -0.122 18053
2873 1 5 . 1 1 53 53 ILE N N 483 119.579 119.579 125.991 -6.412 18053
2874 1 5 . 1 1 53 53 ILE HA H 483 4.985 4.985 4.927 0.058 18053
2875 1 5 . 1 1 53 53 ILE C C 483 175.670 175.670 175.916 -0.246 18053
2876 1 5 . 1 1 53 53 ILE CA C 483 60.400 60.400 60.929 -0.529 18053
2877 1 5 . 1 1 53 53 ILE CB C 483 40.227 40.227 38.318 1.909 18053
2878 1 5 . 1 1 53 53 ILE H H 483 9.000 9.000 8.617 0.383 18053
2879 1 5 . 1 1 54 54 LYS N N 484 124.737 124.737 127.968 -3.231 18053
2880 1 5 . 1 1 54 54 LYS HA H 484 5.463 5.463 5.240 0.223 18053
2881 1 5 . 1 1 54 54 LYS C C 484 175.575 175.575 176.378 -0.803 18053
2882 1 5 . 1 1 54 54 LYS CA C 484 54.613 54.613 55.792 -1.179 18053
2883 1 5 . 1 1 54 54 LYS CB C 484 35.041 35.041 34.218 0.823 18053
2884 1 5 . 1 1 54 54 LYS H H 484 9.678 9.678 8.569 1.109 18053
2885 1 5 . 1 1 55 55 ARG N N 485 124.090 124.090 120.771 3.319 18053
2886 1 5 . 1 1 55 55 ARG HA H 485 5.525 5.525 4.821 0.704 18053
2887 1 5 . 1 1 55 55 ARG C C 485 174.155 174.155 174.129 0.026 18053
2888 1 5 . 1 1 55 55 ARG CA C 485 53.903 53.903 55.978 -2.075 18053
2889 1 5 . 1 1 55 55 ARG H H 485 9.314 9.314 8.793 0.521 18053
2890 1 5 . 1 1 56 56 GLN N N 486 126.576 126.576 127.788 -1.212 18053
2891 1 5 . 1 1 56 56 GLN HA H 486 4.842 4.842 4.819 0.023 18053
2892 1 5 . 1 1 56 56 GLN C C 486 174.991 174.991 175.327 -0.336 18053
2893 1 5 . 1 1 56 56 GLN CA C 486 54.831 54.831 54.581 0.250 18053
2894 1 5 . 1 1 56 56 GLN CB C 486 31.465 31.465 29.231 2.234 18053
2895 1 5 . 1 1 56 56 GLN H H 486 8.831 8.831 8.636 0.195 18053
2896 1 5 . 1 1 57 57 VAL N N 487 126.712 126.712 124.398 2.314 18053
2897 1 5 . 1 1 57 57 VAL HA H 487 4.266 4.266 4.096 0.170 18053
2898 1 5 . 1 1 57 57 VAL C C 487 175.916 175.916 178.033 -2.117 18053
2899 1 5 . 1 1 57 57 VAL CA C 487 61.820 61.820 62.590 -0.770 18053
2900 1 5 . 1 1 57 57 VAL CB C 487 32.803 32.803 32.009 0.794 18053
2901 1 5 . 1 1 57 57 VAL H H 487 8.786 8.786 8.363 0.423 18053
2902 1 5 . 1 1 58 58 LEU N N 488 127.274 127.274 124.070 3.204 18053
2903 1 5 . 1 1 58 58 LEU HA H 488 4.085 4.085 4.112 -0.027 18053
2904 1 5 . 1 1 58 58 LEU C C 488 177.158 177.158 177.893 -0.735 18053
2905 1 5 . 1 1 58 58 LEU CA C 488 56.906 56.906 58.007 -1.101 18053
2906 1 5 . 1 1 58 58 LEU CB C 488 41.374 41.374 41.271 0.103 18053
2907 1 5 . 1 1 58 58 LEU H H 488 8.316 8.316 8.484 -0.168 18053
2908 1 5 . 1 1 59 59 GLU N N 489 119.647 119.647 117.149 2.498 18053
2909 1 5 . 1 1 59 59 GLU HA H 489 4.112 4.112 4.314 -0.202 18053
2910 1 5 . 1 1 59 59 GLU C C 489 176.230 176.230 177.357 -1.127 18053
2911 1 5 . 1 1 59 59 GLU CA C 489 57.015 57.015 56.360 0.655 18053
2912 1 5 . 1 1 59 59 GLU CB C 489 28.149 28.149 29.860 -1.711 18053
2913 1 5 . 1 1 59 59 GLU H H 489 8.636 8.636 8.281 0.355 18053
2914 1 5 . 1 1 60 60 GLY N N 490 108.819 108.819 108.642 0.177 18053
2915 1 5 . 1 1 60 60 GLY C C 490 173.568 173.568 173.263 0.305 18053
2916 1 5 . 1 1 60 60 GLY CA C 490 44.773 44.773 44.646 0.127 18053
2917 1 5 . 1 1 60 60 GLY H H 490 8.160 8.160 7.758 0.402 18053
2918 1 5 . 1 1 61 61 GLU N N 491 121.009 121.009 121.281 -0.272 18053
2919 1 5 . 1 1 61 61 GLU HA H 491 4.323 4.323 4.324 -0.001 18053
2920 1 5 . 1 1 61 61 GLU C C 491 175.725 175.725 175.785 -0.060 18053
2921 1 5 . 1 1 61 61 GLU CA C 491 56.196 56.196 56.278 -0.082 18053
2922 1 5 . 1 1 61 61 GLU CB C 491 30.865 30.865 29.742 1.123 18053
2923 1 5 . 1 1 61 61 GLU H H 491 8.320 8.320 8.553 -0.233 18053
2924 1 5 . 1 1 62 62 GLU N N 492 123.426 123.426 125.152 -1.726 18053
2925 1 5 . 1 1 62 62 GLU HA H 492 5.054 5.054 5.061 -0.007 18053
2926 1 5 . 1 1 62 62 GLU C C 492 175.930 175.930 176.242 -0.312 18053
2927 1 5 . 1 1 62 62 GLU CA C 492 55.650 55.650 55.093 0.557 18053
2928 1 5 . 1 1 62 62 GLU CB C 492 32.312 32.312 29.470 2.842 18053
2929 1 5 . 1 1 62 62 GLU H H 492 8.594 8.594 8.583 0.011 18053
2930 1 5 . 1 1 63 63 ILE N N 493 119.732 119.732 120.062 -0.330 18053
2931 1 5 . 1 1 63 63 ILE HA H 493 4.788 4.788 4.715 0.073 18053
2932 1 5 . 1 1 63 63 ILE C C 493 174.647 174.647 174.325 0.322 18053
2933 1 5 . 1 1 63 63 ILE CA C 493 60.181 60.181 60.069 0.112 18053
2934 1 5 . 1 1 63 63 ILE CB C 493 41.183 41.183 40.419 0.764 18053
2935 1 5 . 1 1 63 63 ILE H H 493 8.523 8.523 7.934 0.589 18053
2936 1 5 . 1 1 64 64 ALA N N 494 122.166 122.166 127.875 -5.709 18053
2937 1 5 . 1 1 64 64 ALA HA H 494 5.521 5.521 4.919 0.602 18053
2938 1 5 . 1 1 64 64 ALA C C 494 174.606 174.606 175.212 -0.606 18053
2939 1 5 . 1 1 64 64 ALA CA C 494 51.528 51.528 50.712 0.816 18053
2940 1 5 . 1 1 64 64 ALA CB C 494 22.239 22.239 21.278 0.961 18053
2941 1 5 . 1 1 64 64 ALA H H 494 8.741 8.741 8.461 0.280 18053
2942 1 5 . 1 1 65 65 TYR N N 495 126.729 126.729 125.956 0.773 18053
2943 1 5 . 1 1 65 65 TYR HA H 495 3.094 3.094 3.604 -0.510 18053
2944 1 5 . 1 1 65 65 TYR C C 495 173.036 173.036 173.477 -0.441 18053
2945 1 5 . 1 1 65 65 TYR CA C 495 56.905 56.905 56.422 0.483 18053
2946 1 5 . 1 1 65 65 TYR CB C 495 40.269 40.269 38.403 1.866 18053
2947 1 5 . 1 1 65 65 TYR H H 495 8.462 8.462 8.284 0.178 18053
2948 1 5 . 1 1 66 66 LYS N N 496 128.108 128.108 126.719 1.389 18053
2949 1 5 . 1 1 66 66 LYS HA H 496 4.822 4.822 4.289 0.533 18053
2950 1 5 . 1 1 66 66 LYS C C 496 174.906 174.906 175.686 -0.780 18053
2951 1 5 . 1 1 66 66 LYS CA C 496 53.739 53.739 55.251 -1.512 18053
2952 1 5 . 1 1 66 66 LYS CB C 496 34.782 34.782 33.007 1.775 18053
2953 1 5 . 1 1 66 66 LYS H H 496 7.010 7.010 7.635 -0.625 18053
2954 1 5 . 1 1 67 67 PHE N N 497 125.299 125.299 122.478 2.821 18053
2955 1 5 . 1 1 67 67 PHE HA H 497 3.932 3.932 4.228 -0.296 18053
2956 1 5 . 1 1 67 67 PHE C C 497 177.990 177.990 175.478 2.512 18053
2957 1 5 . 1 1 67 67 PHE CA C 497 59.007 59.007 57.494 1.513 18053
2958 1 5 . 1 1 67 67 PHE CB C 497 40.981 40.981 40.400 0.581 18053
2959 1 5 . 1 1 67 67 PHE H H 497 8.509 8.509 7.937 0.572 18053
2960 1 5 . 1 1 68 68 THR N N 498 116.191 116.191 111.837 4.354 18053
2961 1 5 . 1 1 68 68 THR HA H 498 4.417 4.417 4.652 -0.235 18053
2962 1 5 . 1 1 68 68 THR CA C 498 60.855 60.855 59.456 1.399 18053
2963 1 5 . 1 1 68 68 THR CB C 498 68.019 68.019 69.290 -1.271 18053
2964 1 5 . 1 1 68 68 THR H H 498 8.688 8.688 8.315 0.373 18053
2965 1 5 . 1 1 69 69 PRO HA H 499 3.948 3.948 4.483 -0.535 18053
2966 1 5 . 1 1 69 69 PRO C C 499 177.444 177.444 176.810 0.634 18053
2967 1 5 . 1 1 69 69 PRO CA C 499 66.077 66.077 64.476 1.601 18053
2968 1 5 . 1 1 69 69 PRO CB C 499 32.776 32.776 32.098 0.678 18053
2969 1 5 . 1 1 70 70 LYS N N 500 113.552 113.552 114.061 -0.509 18053
2970 1 5 . 1 1 70 70 LYS HA H 500 4.385 4.385 4.165 0.220 18053
2971 1 5 . 1 1 70 70 LYS C C 500 176.325 176.325 176.803 -0.478 18053
2972 1 5 . 1 1 70 70 LYS CA C 500 54.995 54.995 56.949 -1.954 18053
2973 1 5 . 1 1 70 70 LYS CB C 500 31.793 31.793 32.051 -0.258 18053
2974 1 5 . 1 1 70 70 LYS H H 500 8.016 8.016 7.887 0.129 18053
2975 1 5 . 1 1 71 71 TYR N N 501 121.860 121.860 121.854 0.006 18053
2976 1 5 . 1 1 71 71 TYR HA H 501 3.730 3.730 4.352 -0.622 18053
2977 1 5 . 1 1 71 71 TYR C C 501 174.838 174.838 174.125 0.713 18053
2978 1 5 . 1 1 71 71 TYR CA C 501 62.310 62.310 59.601 2.709 18053
2979 1 5 . 1 1 71 71 TYR CB C 501 38.781 38.781 39.256 -0.475 18053
2980 1 5 . 1 1 71 71 TYR H H 501 7.460 7.460 7.768 -0.308 18053
2981 1 5 . 1 1 72 72 ILE N N 502 129.487 129.487 127.447 2.040 18053
2982 1 5 . 1 1 72 72 ILE HA H 502 3.928 3.928 4.434 -0.506 18053
2983 1 5 . 1 1 72 72 ILE C C 502 172.968 172.968 173.374 -0.406 18053
2984 1 5 . 1 1 72 72 ILE CA C 502 59.308 59.308 59.563 -0.255 18053
2985 1 5 . 1 1 72 72 ILE CB C 502 40.910 40.910 41.272 -0.362 18053
2986 1 5 . 1 1 72 72 ILE H H 502 7.168 7.168 7.618 -0.450 18053
2987 1 5 . 1 1 73 73 LEU N N 503 128.278 128.278 126.849 1.429 18053
2988 1 5 . 1 1 73 73 LEU HA H 503 4.493 4.493 4.597 -0.104 18053
2989 1 5 . 1 1 73 73 LEU C C 503 175.834 175.834 175.289 0.545 18053
2990 1 5 . 1 1 73 73 LEU CA C 503 51.965 51.965 52.507 -0.542 18053
2991 1 5 . 1 1 73 73 LEU CB C 503 42.548 42.548 44.839 -2.291 18053
2992 1 5 . 1 1 73 73 LEU H H 503 8.483 8.483 8.307 0.176 18053
2993 1 5 . 1 1 74 74 ARG N N 504 129.589 129.589 125.102 4.487 18053
2994 1 5 . 1 1 74 74 ARG HA H 504 3.743 3.743 4.211 -0.468 18053
2995 1 5 . 1 1 74 74 ARG C C 504 175.233 175.233 175.250 -0.017 18053
2996 1 5 . 1 1 74 74 ARG CA C 504 56.851 56.851 55.196 1.655 18053
2997 1 5 . 1 1 74 74 ARG CB C 504 30.292 30.292 30.768 -0.476 18053
2998 1 5 . 1 1 74 74 ARG H H 504 8.673 8.673 8.327 0.346 18053
2999 1 5 . 1 1 75 75 ALA N N 505 123.205 123.205 123.594 -0.389 18053
3000 1 5 . 1 1 75 75 ALA HA H 505 3.522 3.522 4.140 -0.618 18053
3001 1 5 . 1 1 75 75 ALA C C 505 178.441 178.441 178.760 -0.319 18053
3002 1 5 . 1 1 75 75 ALA CA C 505 53.794 53.794 53.187 0.607 18053
3003 1 5 . 1 1 75 75 ALA CB C 505 18.910 18.910 18.951 -0.041 18053
3004 1 5 . 1 1 75 75 ALA H H 505 8.564 8.564 8.216 0.347 18053
3005 1 5 . 1 1 76 76 GLY N N 506 112.241 112.241 111.892 0.349 18053
3006 1 5 . 1 1 76 76 GLY C C 506 174.278 174.278 174.715 -0.437 18053
3007 1 5 . 1 1 76 76 GLY CA C 506 46.725 46.725 45.530 1.195 18053
3008 1 5 . 1 1 76 76 GLY H H 506 7.381 7.381 8.466 -1.085 18053
3009 1 5 . 1 1 77 77 GLN N N 507 117.382 117.382 120.876 -3.494 18053
3010 1 5 . 1 1 77 77 GLN HA H 507 4.364 4.364 4.286 0.078 18053
3011 1 5 . 1 1 77 77 GLN C C 507 173.937 173.937 174.774 -0.837 18053
3012 1 5 . 1 1 77 77 GLN CA C 507 54.558 54.558 56.058 -1.500 18053
3013 1 5 . 1 1 77 77 GLN CB C 507 30.073 30.073 29.523 0.550 18053
3014 1 5 . 1 1 77 77 GLN H H 507 7.996 7.996 7.613 0.383 18053
3015 1 5 . 1 1 78 78 MET N N 508 116.957 116.957 113.377 3.580 18053
3016 1 5 . 1 1 78 78 MET HA H 508 5.388 5.388 5.078 0.310 18053
3017 1 5 . 1 1 78 78 MET C C 508 175.807 175.807 173.851 1.956 18053
3018 1 5 . 1 1 78 78 MET CA C 508 54.067 54.067 54.646 -0.579 18053
3019 1 5 . 1 1 78 78 MET CB C 508 37.198 37.198 37.236 -0.038 18053
3020 1 5 . 1 1 78 78 MET H H 508 8.092 8.092 8.178 -0.086 18053
3021 1 5 . 1 1 79 79 VAL N N 509 119.340 119.340 122.301 -2.961 18053
3022 1 5 . 1 1 79 79 VAL HA H 509 4.956 4.956 4.776 0.180 18053
3023 1 5 . 1 1 79 79 VAL C C 509 172.217 172.217 174.621 -2.404 18053
3024 1 5 . 1 1 79 79 VAL CA C 509 59.471 59.471 59.747 -0.276 18053
3025 1 5 . 1 1 79 79 VAL CB C 509 33.676 33.676 34.548 -0.872 18053
3026 1 5 . 1 1 79 79 VAL H H 509 8.534 8.534 8.870 -0.336 18053
3027 1 5 . 1 1 80 80 THR N N 510 124.533 124.533 126.172 -1.639 18053
3028 1 5 . 1 1 80 80 THR HA H 510 4.586 4.586 4.773 -0.187 18053
3029 1 5 . 1 1 80 80 THR C C 510 172.215 172.215 174.177 -1.962 18053
3030 1 5 . 1 1 80 80 THR CA C 510 62.119 62.119 62.085 0.034 18053
3031 1 5 . 1 1 80 80 THR CB C 510 69.407 69.407 69.091 0.316 18053
3032 1 5 . 1 1 80 80 THR H H 510 8.301 8.301 8.878 -0.577 18053
3033 1 5 . 1 1 81 81 VAL N N 511 127.002 127.002 128.358 -1.356 18053
3034 1 5 . 1 1 81 81 VAL HA H 511 4.596 4.596 4.483 0.113 18053
3035 1 5 . 1 1 81 81 VAL C C 511 176.667 176.667 175.612 1.055 18053
3036 1 5 . 1 1 81 81 VAL CA C 511 61.382 61.382 62.897 -1.515 18053
3037 1 5 . 1 1 81 81 VAL CB C 511 30.945 30.945 30.986 -0.041 18053
3038 1 5 . 1 1 81 81 VAL H H 511 8.796 8.796 8.822 -0.026 18053
3039 1 5 . 1 1 82 82 TRP N N 512 131.479 131.479 129.564 1.915 18053
3040 1 5 . 1 1 82 82 TRP HA H 512 5.338 5.338 5.235 0.103 18053
3041 1 5 . 1 1 82 82 TRP C C 512 176.885 176.885 175.802 1.083 18053
3042 1 5 . 1 1 82 82 TRP CA C 512 56.442 56.442 57.291 -0.848 18053
3043 1 5 . 1 1 82 82 TRP CB C 512 30.701 30.701 31.078 -0.377 18053
3044 1 5 . 1 1 82 82 TRP H H 512 9.924 9.924 9.344 0.580 18053
3045 1 5 . 1 1 83 83 ALA N N 513 123.954 123.954 121.129 2.825 18053
3046 1 5 . 1 1 83 83 ALA HA H 513 4.308 4.308 4.967 -0.659 18053
3047 1 5 . 1 1 83 83 ALA C C 513 178.140 178.140 178.368 -0.228 18053
3048 1 5 . 1 1 83 83 ALA CA C 513 52.211 52.211 50.940 1.271 18053
3049 1 5 . 1 1 83 83 ALA CB C 513 18.745 18.745 20.363 -1.618 18053
3050 1 5 . 1 1 83 83 ALA H H 513 9.048 9.048 8.588 0.460 18053
3051 1 5 . 1 1 84 84 ALA N N 514 125.146 125.146 124.402 0.744 18053
3052 1 5 . 1 1 84 84 ALA HA H 514 3.951 3.951 4.180 -0.229 18053
3053 1 5 . 1 1 84 84 ALA C C 514 179.519 179.519 179.311 0.208 18053
3054 1 5 . 1 1 84 84 ALA CA C 514 54.804 54.804 54.789 0.015 18053
3055 1 5 . 1 1 84 84 ALA CB C 514 18.582 18.582 18.959 -0.377 18053
3056 1 5 . 1 1 84 84 ALA H H 514 8.341 8.341 8.283 0.058 18053
3057 1 5 . 1 1 85 85 GLY N N 515 103.388 103.388 105.182 -1.794 18053
3058 1 5 . 1 1 85 85 GLY C C 515 174.674 174.674 175.364 -0.690 18053
3059 1 5 . 1 1 85 85 GLY CA C 515 45.878 45.878 45.639 0.239 18053
3060 1 5 . 1 1 85 85 GLY H H 515 7.996 7.996 8.072 -0.076 18053
3061 1 5 . 1 1 86 86 ALA N N 516 120.140 120.140 122.976 -2.836 18053
3062 1 5 . 1 1 86 86 ALA HA H 516 4.344 4.344 4.483 -0.139 18053
3063 1 5 . 1 1 86 86 ALA C C 516 177.690 177.690 178.382 -0.692 18053
3064 1 5 . 1 1 86 86 ALA CA C 516 53.139 53.139 52.325 0.814 18053
3065 1 5 . 1 1 86 86 ALA CB C 516 20.547 20.547 18.996 1.551 18053
3066 1 5 . 1 1 86 86 ALA H H 516 7.474 7.474 7.325 0.149 18053
3067 1 5 . 1 1 87 87 GLY N N 517 105.720 105.720 108.247 -2.527 18053
3068 1 5 . 1 1 87 87 GLY C C 517 173.650 173.650 174.701 -1.051 18053
3069 1 5 . 1 1 87 87 GLY CA C 517 46.014 46.014 45.396 0.618 18053
3070 1 5 . 1 1 87 87 GLY H H 517 7.779 7.779 7.709 0.070 18053
3071 1 5 . 1 1 88 88 VAL N N 518 121.537 121.537 120.043 1.494 18053
3072 1 5 . 1 1 88 88 VAL HA H 518 3.585 3.585 4.105 -0.520 18053
3073 1 5 . 1 1 88 88 VAL C C 518 174.851 174.851 175.253 -0.402 18053
3074 1 5 . 1 1 88 88 VAL CA C 518 61.274 61.274 61.423 -0.149 18053
3075 1 5 . 1 1 88 88 VAL CB C 518 33.376 33.376 32.681 0.695 18053
3076 1 5 . 1 1 88 88 VAL H H 518 7.499 7.499 7.803 -0.304 18053
3077 1 5 . 1 1 89 89 ALA N N 519 128.295 128.295 130.452 -2.157 18053
3078 1 5 . 1 1 89 89 ALA HA H 519 4.192 4.192 4.324 -0.132 18053
3079 1 5 . 1 1 89 89 ALA C C 519 176.680 176.680 176.778 -0.098 18053
3080 1 5 . 1 1 89 89 ALA CA C 519 51.283 51.283 51.933 -0.650 18053
3081 1 5 . 1 1 89 89 ALA CB C 519 19.292 19.292 19.230 0.062 18053
3082 1 5 . 1 1 89 89 ALA H H 519 7.960 7.960 8.149 -0.189 18053
3083 1 5 . 1 1 90 90 HIS N N 520 122.643 122.643 124.482 -1.839 18053
3084 1 5 . 1 1 90 90 HIS HA H 520 4.033 4.033 4.412 -0.379 18053
3085 1 5 . 1 1 90 90 HIS C C 520 175.793 175.793 174.458 1.335 18053
3086 1 5 . 1 1 90 90 HIS CA C 520 58.653 58.653 56.165 2.488 18053
3087 1 5 . 1 1 90 90 HIS CB C 520 32.285 32.285 29.709 2.576 18053
3088 1 5 . 1 1 90 90 HIS H H 520 8.394 8.394 8.892 -0.498 18053
3089 1 5 . 1 1 91 91 SER N N 521 121.247 121.247 124.142 -2.895 18053
3090 1 5 . 1 1 91 91 SER HA H 521 4.629 4.629 4.720 -0.091 18053
3091 1 5 . 1 1 91 91 SER CA C 521 55.843 55.843 56.133 -0.290 18053
3092 1 5 . 1 1 91 91 SER CB C 521 62.367 62.367 63.716 -1.349 18053
3093 1 5 . 1 1 91 91 SER H H 521 8.569 8.569 8.556 0.013 18053
3094 1 5 . 1 1 92 92 PRO HA H 522 4.002 4.002 4.681 -0.679 18053
3095 1 5 . 1 1 92 92 PRO CA C 522 62.244 62.244 62.489 -0.245 18053
3096 1 5 . 1 1 92 92 PRO CB C 522 30.931 30.931 31.448 -0.517 18053
3097 1 5 . 1 1 93 93 PRO HA H 523 4.672 4.672 4.737 -0.065 18053
3098 1 5 . 1 1 93 93 PRO C C 523 177.786 177.786 178.142 -0.356 18053
3099 1 5 . 1 1 93 93 PRO CA C 523 64.003 64.003 64.330 -0.327 18053
3100 1 5 . 1 1 93 93 PRO CB C 523 34.905 34.905 32.520 2.385 18053
3101 1 5 . 1 1 94 94 SER N N 524 117.212 117.212 116.616 0.596 18053
3102 1 5 . 1 1 94 94 SER HA H 524 4.678 4.678 4.483 0.195 18053
3103 1 5 . 1 1 94 94 SER C C 524 174.851 174.851 174.704 0.147 18053
3104 1 5 . 1 1 94 94 SER CA C 524 61.874 61.874 61.358 0.516 18053
3105 1 5 . 1 1 94 94 SER CB C 524 64.057 64.057 63.689 0.368 18053
3106 1 5 . 1 1 94 94 SER H H 524 8.463 8.463 8.356 0.107 18053
3107 1 5 . 1 1 95 95 THR N N 525 121.588 121.588 119.180 2.408 18053
3108 1 5 . 1 1 95 95 THR HA H 525 4.859 4.859 5.031 -0.172 18053
3109 1 5 . 1 1 95 95 THR C C 525 172.094 172.094 172.907 -0.813 18053
3110 1 5 . 1 1 95 95 THR CA C 525 62.309 62.309 62.080 0.229 18053
3111 1 5 . 1 1 95 95 THR CB C 525 70.281 70.281 69.627 0.654 18053
3112 1 5 . 1 1 95 95 THR H H 525 7.631 7.631 8.024 -0.393 18053
3113 1 5 . 1 1 96 96 LEU N N 526 127.274 127.274 129.500 -2.226 18053
3114 1 5 . 1 1 96 96 LEU HA H 526 5.131 5.131 5.109 0.022 18053
3115 1 5 . 1 1 96 96 LEU C C 526 175.916 175.916 175.488 0.428 18053
3116 1 5 . 1 1 96 96 LEU CA C 526 52.075 52.075 54.213 -2.138 18053
3117 1 5 . 1 1 96 96 LEU CB C 526 43.790 43.790 44.492 -0.702 18053
3118 1 5 . 1 1 96 96 LEU H H 526 8.977 8.977 8.378 0.599 18053
3119 1 5 . 1 1 97 97 VAL N N 527 124.056 124.056 120.813 3.243 18053
3120 1 5 . 1 1 97 97 VAL HA H 527 4.869 4.869 4.627 0.242 18053
3121 1 5 . 1 1 97 97 VAL C C 527 176.230 176.230 174.960 1.270 18053
3122 1 5 . 1 1 97 97 VAL CA C 527 61.519 61.519 61.442 0.077 18053
3123 1 5 . 1 1 97 97 VAL CB C 527 33.704 33.704 34.342 -0.638 18053
3124 1 5 . 1 1 97 97 VAL H H 527 10.724 10.724 7.854 2.870 18053
3125 1 5 . 1 1 98 98 TRP N N 528 132.586 132.586 130.551 2.035 18053
3126 1 5 . 1 1 98 98 TRP HA H 528 4.965 4.965 4.251 0.714 18053
3127 1 5 . 1 1 98 98 TRP C C 528 173.391 173.391 174.548 -1.157 18053
3128 1 5 . 1 1 98 98 TRP CA C 528 53.303 53.303 55.417 -2.114 18053
3129 1 5 . 1 1 98 98 TRP CB C 528 28.245 28.245 28.749 -0.504 18053
3130 1 5 . 1 1 98 98 TRP H H 528 9.400 9.400 8.824 0.576 18053
3131 1 5 . 1 1 99 99 LYS N N 529 126.644 126.644 127.620 -0.976 18053
3132 1 5 . 1 1 99 99 LYS HA H 529 3.839 3.839 4.096 -0.257 18053
3133 1 5 . 1 1 99 99 LYS C C 529 177.581 177.581 177.705 -0.124 18053
3134 1 5 . 1 1 99 99 LYS CA C 529 58.543 58.543 57.367 1.175 18053
3135 1 5 . 1 1 99 99 LYS CB C 529 32.176 32.176 32.860 -0.684 18053
3136 1 5 . 1 1 99 99 LYS H H 529 8.153 8.153 8.004 0.149 18053
3137 1 5 . 1 1 100 100 GLY N N 530 110.385 110.385 114.660 -4.275 18053
3138 1 5 . 1 1 100 100 GLY C C 530 172.367 172.367 173.892 -1.525 18053
3139 1 5 . 1 1 100 100 GLY CA C 530 45.278 45.278 45.524 -0.246 18053
3140 1 5 . 1 1 100 100 GLY H H 530 8.363 8.363 8.640 -0.277 18053
3141 1 5 . 1 1 101 101 GLN N N 531 121.162 121.162 123.227 -2.065 18053
3142 1 5 . 1 1 101 101 GLN HA H 531 3.972 3.972 3.978 -0.006 18053
3143 1 5 . 1 1 101 101 GLN CA C 531 52.620 52.620 54.034 -1.414 18053
3144 1 5 . 1 1 101 101 GLN CB C 531 27.595 27.595 26.966 0.629 18053
3145 1 5 . 1 1 101 101 GLN H H 531 6.815 6.815 7.371 -0.556 18053
3146 1 5 . 1 1 102 102 SER N N 532 122.728 122.728 122.849 -0.121 18053
3147 1 5 . 1 1 102 102 SER HA H 532 3.866 3.866 4.366 -0.500 18053
3148 1 5 . 1 1 102 102 SER C C 532 174.537 174.537 176.100 -1.563 18053
3149 1 5 . 1 1 102 102 SER CA C 532 61.983 61.983 61.320 0.663 18053
3150 1 5 . 1 1 102 102 SER CB C 532 62.802 62.802 63.337 -0.535 18053
3151 1 5 . 1 1 102 102 SER H H 532 8.662 8.662 8.380 0.282 18053
3152 1 5 . 1 1 103 103 SER N N 533 110.811 110.811 116.058 -5.247 18053
3153 1 5 . 1 1 103 103 SER HA H 533 4.240 4.240 4.441 -0.201 18053
3154 1 5 . 1 1 103 103 SER C C 533 174.087 174.087 174.424 -0.337 18053
3155 1 5 . 1 1 103 103 SER CA C 533 56.633 56.633 59.348 -2.715 18053
3156 1 5 . 1 1 103 103 SER CB C 533 64.658 64.658 63.821 0.837 18053
3157 1 5 . 1 1 103 103 SER H H 533 7.134 7.134 7.729 -0.595 18053
3158 1 5 . 1 1 104 104 TRP N N 534 126.133 126.133 121.043 5.090 18053
3159 1 5 . 1 1 104 104 TRP HA H 534 4.098 4.098 4.076 0.022 18053
3160 1 5 . 1 1 104 104 TRP C C 534 176.066 176.066 175.545 0.521 18053
3161 1 5 . 1 1 104 104 TRP CA C 534 60.127 60.127 57.586 2.541 18053
3162 1 5 . 1 1 104 104 TRP CB C 534 28.764 28.764 28.782 -0.018 18053
3163 1 5 . 1 1 104 104 TRP H H 534 9.764 9.764 7.603 2.161 18053
3164 1 5 . 1 1 105 105 GLY N N 535 105.907 105.907 105.488 0.419 18053
3165 1 5 . 1 1 105 105 GLY C C 535 172.217 172.217 173.990 -1.773 18053
3166 1 5 . 1 1 105 105 GLY CA C 535 44.240 44.240 45.014 -0.774 18053
3167 1 5 . 1 1 105 105 GLY H H 535 8.095 8.095 8.183 -0.088 18053
3168 1 5 . 1 1 106 106 THR N N 536 111.253 111.253 112.344 -1.091 18053
3169 1 5 . 1 1 106 106 THR HA H 536 3.859 3.859 4.485 -0.626 18053
3170 1 5 . 1 1 106 106 THR C C 536 172.872 172.872 175.080 -2.208 18053
3171 1 5 . 1 1 106 106 THR CA C 536 59.635 59.635 62.448 -2.813 18053
3172 1 5 . 1 1 106 106 THR CB C 536 70.526 70.526 68.987 1.539 18053
3173 1 5 . 1 1 106 106 THR H H 536 7.913 7.913 7.428 0.485 18053
3174 1 5 . 1 1 107 107 GLY N N 537 107.712 107.712 114.408 -6.696 18053
3175 1 5 . 1 1 107 107 GLY C C 537 172.709 172.709 172.738 -0.029 18053
3176 1 5 . 1 1 107 107 GLY CA C 537 45.166 45.166 45.340 -0.174 18053
3177 1 5 . 1 1 107 107 GLY H H 537 7.533 7.533 8.058 -0.525 18053
3178 1 5 . 1 1 108 108 GLU N N 538 118.864 118.864 119.201 -0.337 18053
3179 1 5 . 1 1 108 108 GLU HA H 538 4.136 4.136 4.157 -0.021 18053
3180 1 5 . 1 1 108 108 GLU C C 538 176.353 176.353 175.437 0.916 18053
3181 1 5 . 1 1 108 108 GLU CA C 538 58.352 58.352 57.245 1.107 18053
3182 1 5 . 1 1 108 108 GLU CB C 538 30.156 30.156 30.182 -0.026 18053
3183 1 5 . 1 1 108 108 GLU H H 538 8.558 8.558 8.618 -0.060 18053
3184 1 5 . 1 1 109 109 SER N N 539 110.419 110.419 112.602 -2.183 18053
3185 1 5 . 1 1 109 109 SER HA H 539 4.963 4.963 4.735 0.228 18053
3186 1 5 . 1 1 109 109 SER C C 539 173.787 173.787 172.681 1.106 18053
3187 1 5 . 1 1 109 109 SER CA C 539 57.125 57.125 57.537 -0.412 18053
3188 1 5 . 1 1 109 109 SER CB C 539 64.439 64.439 64.707 -0.268 18053
3189 1 5 . 1 1 109 109 SER H H 539 7.620 7.620 7.617 0.003 18053
3190 1 5 . 1 1 110 110 PHE N N 540 118.778 118.778 117.920 0.858 18053
3191 1 5 . 1 1 110 110 PHE HA H 540 5.081 5.081 5.326 -0.245 18053
3192 1 5 . 1 1 110 110 PHE C C 540 176.052 176.052 173.070 2.982 18053
3193 1 5 . 1 1 110 110 PHE CA C 540 56.789 56.789 56.615 0.174 18053
3194 1 5 . 1 1 110 110 PHE CB C 540 40.760 40.760 42.136 -1.375 18053
3195 1 5 . 1 1 110 110 PHE H H 540 8.318 8.318 8.592 -0.274 18053
3196 1 5 . 1 1 112 112 THR HA H 542 5.468 5.468 4.648 0.820 18053
3197 1 5 . 1 1 112 112 THR C C 542 172.381 172.381 173.552 -1.171 18053
3198 1 5 . 1 1 112 112 THR CA C 542 61.818 61.818 63.253 -1.435 18053
3199 1 5 . 1 1 112 112 THR CB C 542 70.990 70.990 69.328 1.662 18053
3200 1 5 . 1 1 113 113 VAL N N 543 124.771 124.771 126.935 -2.164 18053
3201 1 5 . 1 1 113 113 VAL HA H 543 4.864 4.864 4.485 0.379 18053
3202 1 5 . 1 1 113 113 VAL C C 543 173.132 173.132 174.232 -1.100 18053
3203 1 5 . 1 1 113 113 VAL CA C 543 60.099 60.099 60.557 -0.458 18053
3204 1 5 . 1 1 113 113 VAL CB C 543 36.433 36.433 33.965 2.468 18053
3205 1 5 . 1 1 113 113 VAL H H 543 9.380 9.380 8.485 0.895 18053
3206 1 5 . 1 1 114 114 LEU N N 544 128.789 128.789 128.622 0.167 18053
3207 1 5 . 1 1 114 114 LEU HA H 544 5.320 5.320 4.889 0.431 18053
3208 1 5 . 1 1 114 114 LEU C C 544 174.237 174.237 175.007 -0.770 18053
3209 1 5 . 1 1 114 114 LEU CA C 544 53.193 53.193 53.807 -0.614 18053
3210 1 5 . 1 1 114 114 LEU CB C 544 45.879 45.879 44.306 1.573 18053
3211 1 5 . 1 1 114 114 LEU H H 544 8.948 8.948 8.553 0.395 18053
3212 1 5 . 1 1 115 115 VAL N N 545 127.002 127.002 127.040 -0.038 18053
3213 1 5 . 1 1 115 115 VAL HA H 545 4.854 4.854 4.808 0.046 18053
3214 1 5 . 1 1 115 115 VAL C C 545 175.206 175.206 174.779 0.427 18053
3215 1 5 . 1 1 115 115 VAL CA C 545 59.334 59.334 60.427 -1.093 18053
3216 1 5 . 1 1 115 115 VAL CB C 545 34.495 34.495 34.670 -0.175 18053
3217 1 5 . 1 1 115 115 VAL H H 545 9.564 9.564 8.946 0.618 18053
3218 1 5 . 1 1 116 116 ASN N N 546 121.179 121.179 122.469 -1.290 18053
3219 1 5 . 1 1 116 116 ASN HA H 546 2.897 2.897 3.785 -0.888 18053
3220 1 5 . 1 1 116 116 ASN C C 546 176.885 176.885 175.698 1.187 18053
3221 1 5 . 1 1 116 116 ASN CA C 546 50.409 50.409 50.972 -0.563 18053
3222 1 5 . 1 1 116 116 ASN CB C 546 36.639 36.639 38.947 -2.308 18053
3223 1 5 . 1 1 116 116 ASN H H 546 8.016 8.016 7.827 0.189 18053
3224 1 5 . 1 1 117 117 ALA N N 547 119.834 119.834 122.252 -2.418 18053
3225 1 5 . 1 1 117 117 ALA HA H 547 3.866 3.866 4.092 -0.226 18053
3226 1 5 . 1 1 117 117 ALA C C 547 177.772 177.772 178.616 -0.844 18053
3227 1 5 . 1 1 117 117 ALA CA C 547 54.504 54.504 54.435 0.069 18053
3228 1 5 . 1 1 117 117 ALA CB C 547 18.200 18.200 17.983 0.217 18053
3229 1 5 . 1 1 117 117 ALA H H 547 6.444 6.444 8.089 -1.645 18053
3230 1 5 . 1 1 118 118 ASP N N 548 115.646 115.646 117.398 -1.752 18053
3231 1 5 . 1 1 118 118 ASP HA H 548 4.644 4.644 4.303 0.341 18053
3232 1 5 . 1 1 118 118 ASP C C 548 176.052 176.052 177.393 -1.341 18053
3233 1 5 . 1 1 118 118 ASP CA C 548 54.067 54.067 55.490 -1.423 18053
3234 1 5 . 1 1 118 118 ASP CB C 548 41.674 41.674 40.807 0.867 18053
3235 1 5 . 1 1 118 118 ASP H H 548 7.181 7.181 8.014 -0.833 18053
3236 1 5 . 1 1 119 119 GLY N N 549 107.167 107.167 107.922 -0.755 18053
3237 1 5 . 1 1 119 119 GLY C C 549 173.841 173.841 173.666 0.175 18053
3238 1 5 . 1 1 119 119 GLY CA C 549 45.455 45.455 44.609 0.846 18053
3239 1 5 . 1 1 119 119 GLY H H 549 7.738 7.738 7.672 0.066 18053
3240 1 5 . 1 1 120 120 GLU N N 550 121.196 121.196 121.124 0.072 18053
3241 1 5 . 1 1 120 120 GLU HA H 550 4.112 4.112 4.259 -0.147 18053
3242 1 5 . 1 1 120 120 GLU C C 550 175.588 175.588 175.879 -0.291 18053
3243 1 5 . 1 1 120 120 GLU CA C 550 54.831 54.831 55.813 -0.982 18053
3244 1 5 . 1 1 120 120 GLU CB C 550 29.937 29.937 30.180 -0.242 18053
3245 1 5 . 1 1 120 120 GLU H H 550 7.587 7.587 7.709 -0.122 18053
3246 1 5 . 1 1 121 121 GLU N N 551 123.886 123.886 124.805 -0.919 18053
3247 1 5 . 1 1 121 121 GLU HA H 551 4.276 4.276 4.315 -0.039 18053
3248 1 5 . 1 1 121 121 GLU C C 551 176.817 176.817 175.745 1.072 18053
3249 1 5 . 1 1 121 121 GLU CA C 551 56.796 56.796 56.352 0.444 18053
3250 1 5 . 1 1 121 121 GLU CB C 551 28.955 28.955 28.586 0.369 18053
3251 1 5 . 1 1 121 121 GLU H H 551 8.697 8.697 8.766 -0.069 18053
3252 1 5 . 1 1 122 122 VAL N N 552 120.055 120.055 123.278 -3.223 18053
3253 1 5 . 1 1 122 122 VAL HA H 552 4.364 4.364 3.823 0.541 18053
3254 1 5 . 1 1 122 122 VAL C C 552 175.998 175.998 175.473 0.525 18053
3255 1 5 . 1 1 122 122 VAL CA C 552 61.655 61.655 64.041 -2.386 18053
3256 1 5 . 1 1 122 122 VAL CB C 552 33.049 33.049 32.799 0.250 18053
3257 1 5 . 1 1 122 122 VAL H H 552 8.845 8.845 8.136 0.709 18053
3258 1 5 . 1 1 123 123 ALA N N 553 122.098 122.098 120.089 2.009 18053
3259 1 5 . 1 1 123 123 ALA HA H 553 4.890 4.890 4.766 0.124 18053
3260 1 5 . 1 1 123 123 ALA C C 553 175.261 175.261 175.020 0.241 18053
3261 1 5 . 1 1 123 123 ALA CA C 553 52.757 52.757 50.776 1.981 18053
3262 1 5 . 1 1 123 123 ALA CB C 553 22.267 22.267 22.020 0.247 18053
3263 1 5 . 1 1 123 123 ALA H H 553 7.788 7.788 7.726 0.062 18053
3264 1 5 . 1 1 124 124 MET N N 554 118.217 118.217 120.746 -2.529 18053
3265 1 5 . 1 1 124 124 MET HA H 554 5.286 5.286 4.961 0.325 18053
3266 1 5 . 1 1 124 124 MET C C 554 174.428 174.428 174.428 0.000 18053
3267 1 5 . 1 1 124 124 MET CA C 554 55.104 55.104 55.805 -0.701 18053
3268 1 5 . 1 1 124 124 MET CB C 554 35.342 35.342 36.636 -1.294 18053
3269 1 5 . 1 1 124 124 MET H H 554 8.693 8.693 8.601 0.092 18053
3270 1 5 . 1 1 125 125 ARG N N 555 122.132 122.132 126.823 -4.691 18053
3271 1 5 . 1 1 125 125 ARG HA H 555 4.900 4.900 4.830 0.070 18053
3272 1 5 . 1 1 125 125 ARG CA C 555 56.388 56.388 55.306 1.082 18053
3273 1 5 . 1 1 125 125 ARG CB C 555 34.378 34.378 33.107 1.271 18053
3274 1 5 . 1 1 125 125 ARG H H 555 8.919 8.919 8.951 -0.032 18053
3275 1 5 . 1 1 126 126 THR HA H 556 4.685 4.685 4.432 0.253 18053
3276 1 5 . 1 1 126 126 THR C C 556 172.436 172.436 173.676 -1.240 18053
3277 1 5 . 1 1 126 126 THR CA C 556 61.382 61.382 63.239 -1.857 18053
3278 1 5 . 1 1 126 126 THR CB C 556 70.444 70.444 69.268 1.176 18053
3279 1 5 . 1 1 127 127 VAL N N 557 124.976 124.976 129.955 -4.979 18053
3280 1 5 . 1 1 127 127 VAL HA H 557 4.146 4.146 4.141 0.005 18053
3281 1 5 . 1 1 127 127 VAL C C 557 173.937 173.937 174.059 -0.122 18053
3282 1 5 . 1 1 127 127 VAL CA C 557 61.109 61.109 61.157 -0.048 18053
3283 1 5 . 1 1 127 127 VAL CB C 557 33.759 33.759 33.034 0.725 18053
3284 1 5 . 1 1 127 127 VAL H H 557 8.127 8.127 8.569 -0.442 18053
3285 1 5 . 1 1 128 128 LYS N N 558 125.384 125.384 127.582 -2.198 18053
3286 1 5 . 1 1 128 128 LYS HA H 558 4.706 4.706 4.368 0.338 18053
3287 1 5 . 1 1 128 128 LYS C C 558 175.534 175.534 176.178 -0.644 18053
3288 1 5 . 1 1 128 128 LYS CA C 558 54.886 54.886 54.183 0.703 18053
3289 1 5 . 1 1 128 128 LYS CB C 558 34.673 34.673 33.388 1.285 18053
3290 1 5 . 1 1 128 128 LYS H H 558 8.289 8.289 8.643 -0.354 18053
3291 1 5 . 1 1 129 129 LYS N N 559 124.005 124.005 126.394 -2.389 18053
3292 1 5 . 1 1 129 129 LYS HA H 559 4.310 4.310 4.045 0.265 18053
3293 1 5 . 1 1 129 129 LYS C C 559 176.571 176.571 175.636 0.935 18053
3294 1 5 . 1 1 129 129 LYS CA C 559 56.742 56.742 57.277 -0.535 18053
3295 1 5 . 1 1 129 129 LYS CB C 559 33.362 33.362 31.938 1.424 18053
3296 1 5 . 1 1 129 129 LYS H H 559 8.461 8.461 7.985 0.476 18053
3297 1 5 . 1 1 130 130 SER N N 560 117.195 117.195 122.235 -5.040 18053
3298 1 5 . 1 1 130 130 SER HA H 560 4.384 4.384 4.596 -0.212 18053
3299 1 5 . 1 1 130 130 SER C C 560 174.565 174.565 173.332 1.233 18053
3300 1 5 . 1 1 130 130 SER CA C 560 58.434 58.434 57.194 1.240 18053
3301 1 5 . 1 1 130 130 SER CB C 560 63.812 63.812 65.154 -1.342 18053
3302 1 5 . 1 1 130 130 SER H H 560 8.465 8.465 8.018 0.447 18053
3303 1 5 . 1 1 131 131 SER N N 561 118.149 118.149 122.642 -4.493 18053
3304 1 5 . 1 1 131 131 SER HA H 561 4.412 4.412 4.348 0.064 18053
3305 1 5 . 1 1 131 131 SER C C 561 174.456 174.456 174.415 0.041 18053
3306 1 5 . 1 1 131 131 SER CA C 561 58.489 58.489 59.792 -1.303 18053
3307 1 5 . 1 1 131 131 SER CB C 561 63.811 63.811 63.207 0.604 18053
3308 1 5 . 1 1 131 131 SER H H 561 8.336 8.336 8.847 -0.511 18053
3309 1 5 . 1 1 132 132 VAL N N 562 121.332 121.332 125.170 -3.838 18053
3310 1 5 . 1 1 132 132 VAL HA H 562 4.035 4.035 4.149 -0.114 18053
3311 1 5 . 1 1 132 132 VAL C C 562 176.066 176.066 174.701 1.365 18053
3312 1 5 . 1 1 132 132 VAL CA C 562 62.446 62.446 62.171 0.275 18053
3313 1 5 . 1 1 132 132 VAL CB C 562 32.394 32.394 32.968 -0.573 18053
3314 1 5 . 1 1 132 132 VAL H H 562 7.982 7.982 8.267 -0.285 18053
3315 1 5 . 1 1 133 133 MET N N 563 124.022 124.022 119.501 4.521 18053
3316 1 5 . 1 1 133 133 MET HA H 563 4.385 4.385 4.526 -0.141 18053
3317 1 5 . 1 1 133 133 MET C C 563 176.039 176.039 175.979 0.060 18053
3318 1 5 . 1 1 133 133 MET CA C 563 55.350 55.350 55.776 -0.426 18053
3319 1 5 . 1 1 133 133 MET CB C 563 32.503 32.503 31.932 0.571 18053
3320 1 5 . 1 1 133 133 MET H H 563 8.295 8.295 7.730 0.565 18053
3321 1 5 . 1 1 134 134 ARG N N 564 122.677 122.677 123.878 -1.201 18053
3322 1 5 . 1 1 134 134 ARG HA H 564 4.262 4.262 4.539 -0.277 18053
3323 1 5 . 1 1 134 134 ARG C C 564 176.298 176.298 175.729 0.569 18053
3324 1 5 . 1 1 134 134 ARG CA C 564 56.087 56.087 54.826 1.261 18053
3325 1 5 . 1 1 134 134 ARG CB C 564 30.702 30.702 31.567 -0.865 18053
3326 1 5 . 1 1 134 134 ARG H H 564 8.295 8.295 8.479 -0.184 18053
3327 1 5 . 1 1 135 135 GLU N N 565 121.945 121.945 122.005 -0.060 18053
3328 1 5 . 1 1 135 135 GLU HA H 565 4.160 4.160 4.250 -0.090 18053
3329 1 5 . 1 1 135 135 GLU C C 565 176.080 176.080 175.583 0.497 18053
3330 1 5 . 1 1 135 135 GLU CA C 565 56.906 56.906 57.348 -0.442 18053
3331 1 5 . 1 1 135 135 GLU CB C 565 29.774 29.774 28.778 0.996 18053
3332 1 5 . 1 1 135 135 GLU H H 565 8.470 8.470 8.572 -0.102 18053
3333 1 5 . 1 1 136 136 ASN N N 566 118.761 118.761 124.246 -5.485 18053
3334 1 5 . 1 1 136 136 ASN HA H 566 4.617 4.617 4.724 -0.107 18053
3335 1 5 . 1 1 136 136 ASN C C 566 175.315 175.315 174.713 0.602 18053
3336 1 5 . 1 1 136 136 ASN CA C 566 53.193 53.193 53.832 -0.639 18053
3337 1 5 . 1 1 136 136 ASN CB C 566 38.836 38.836 38.799 0.037 18053
3338 1 5 . 1 1 136 136 ASN H H 566 8.341 8.341 8.257 0.084 18053
3339 1 5 . 1 1 137 137 GLU N N 567 121.349 121.349 122.347 -0.998 18053
3340 1 5 . 1 1 137 137 GLU HA H 567 4.152 4.152 4.243 -0.091 18053
3341 1 5 . 1 1 137 137 GLU C C 567 176.243 176.243 176.665 -0.422 18053
3342 1 5 . 1 1 137 137 GLU CA C 567 56.906 56.906 57.845 -0.939 18053
3343 1 5 . 1 1 137 137 GLU CB C 567 29.992 29.992 30.127 -0.135 18053
3344 1 5 . 1 1 137 137 GLU H H 567 8.349 8.349 8.427 -0.078 18053
3345 1 5 . 1 1 138 138 ASN N N 568 118.761 118.761 118.077 0.684 18053
3346 1 5 . 1 1 138 138 ASN HA H 568 4.712 4.712 4.767 -0.055 18053
3347 1 5 . 1 1 138 138 ASN C C 568 174.551 174.551 174.402 0.149 18053
3348 1 5 . 1 1 138 138 ASN CA C 568 53.193 53.193 53.056 0.137 18053
3349 1 5 . 1 1 138 138 ASN CB C 568 39.327 39.327 39.590 -0.263 18053
3350 1 5 . 1 1 138 138 ASN H H 568 8.397 8.397 7.854 0.543 18053
3351 1 6 . 1 1 20 20 ALA N N 450 125.180 125.180 126.352 -1.172 18053
3352 1 6 . 1 1 20 20 ALA HA H 450 4.706 4.706 4.598 0.108 18053
3353 1 6 . 1 1 20 20 ALA C C 450 177.226 177.226 176.849 0.377 18053
3354 1 6 . 1 1 20 20 ALA CA C 450 52.757 52.757 52.303 0.454 18053
3355 1 6 . 1 1 20 20 ALA CB C 450 20.411 20.411 20.169 0.242 18053
3356 1 6 . 1 1 20 20 ALA H H 450 8.484 8.484 7.913 0.571 18053
3357 1 6 . 1 1 21 21 SER N N 451 115.714 115.714 121.727 -6.013 18053
3358 1 6 . 1 1 21 21 SER HA H 451 4.513 4.513 4.500 0.013 18053
3359 1 6 . 1 1 21 21 SER C C 451 174.742 174.742 175.711 -0.969 18053
3360 1 6 . 1 1 21 21 SER CA C 451 58.516 58.516 58.349 0.167 18053
3361 1 6 . 1 1 21 21 SER CB C 451 64.159 64.159 62.511 1.648 18053
3362 1 6 . 1 1 21 21 SER H H 451 8.487 8.487 8.773 -0.286 18053
3363 1 6 . 1 1 22 22 GLY N N 452 111.509 111.509 113.383 -1.874 18053
3364 1 6 . 1 1 22 22 GLY C C 452 174.401 174.401 174.835 -0.434 18053
3365 1 6 . 1 1 22 22 GLY CA C 452 45.059 45.059 45.878 -0.819 18053
3366 1 6 . 1 1 22 22 GLY H H 452 8.198 8.198 8.343 -0.145 18053
3367 1 6 . 1 1 23 23 SER N N 453 116.191 116.191 113.629 2.562 18053
3368 1 6 . 1 1 23 23 SER HA H 453 4.364 4.364 4.091 0.273 18053
3369 1 6 . 1 1 23 23 SER C C 453 173.432 173.432 173.212 0.220 18053
3370 1 6 . 1 1 23 23 SER CA C 453 59.744 59.744 59.080 0.664 18053
3371 1 6 . 1 1 23 23 SER CB C 453 64.335 64.335 63.079 1.256 18053
3372 1 6 . 1 1 23 23 SER H H 453 8.494 8.494 8.286 0.208 18053
3373 1 6 . 1 1 24 24 VAL N N 454 121.656 121.656 118.681 2.975 18053
3374 1 6 . 1 1 24 24 VAL HA H 454 5.035 5.035 4.736 0.299 18053
3375 1 6 . 1 1 24 24 VAL C C 454 174.606 174.606 175.670 -1.064 18053
3376 1 6 . 1 1 24 24 VAL CA C 454 61.055 61.055 61.319 -0.264 18053
3377 1 6 . 1 1 24 24 VAL CB C 454 32.503 32.503 33.000 -0.497 18053
3378 1 6 . 1 1 24 24 VAL H H 454 7.830 7.830 7.541 0.289 18053
3379 1 6 . 1 1 25 25 SER N N 455 119.323 119.323 122.339 -3.016 18053
3380 1 6 . 1 1 25 25 SER HA H 455 4.672 4.672 4.818 -0.146 18053
3381 1 6 . 1 1 25 25 SER C C 455 174.426 174.426 173.896 0.530 18053
3382 1 6 . 1 1 25 25 SER CA C 455 55.268 55.268 55.774 -0.506 18053
3383 1 6 . 1 1 25 25 SER CB C 455 65.162 65.162 66.155 -0.993 18053
3384 1 6 . 1 1 25 25 SER H H 455 9.065 9.065 8.713 0.352 18053
3385 1 6 . 1 1 26 26 ILE N N 456 119.468 119.468 126.449 -6.981 18053
3386 1 6 . 1 1 26 26 ILE HA H 456 4.180 4.180 4.184 -0.004 18053
3387 1 6 . 1 1 26 26 ILE C C 456 175.506 175.506 175.792 -0.286 18053
3388 1 6 . 1 1 26 26 ILE CA C 456 61.328 61.328 61.989 -0.661 18053
3389 1 6 . 1 1 26 26 ILE CB C 456 37.962 37.962 37.515 0.447 18053
3390 1 6 . 1 1 26 26 ILE H H 456 8.295 8.295 8.759 -0.464 18053
3391 1 6 . 1 1 27 27 GLU N N 457 129.726 129.726 127.748 1.978 18053
3392 1 6 . 1 1 27 27 GLU HA H 457 4.228 4.228 4.340 -0.112 18053
3393 1 6 . 1 1 27 27 GLU C C 457 175.179 175.179 177.016 -1.837 18053
3394 1 6 . 1 1 27 27 GLU CA C 457 55.432 55.432 57.585 -2.153 18053
3395 1 6 . 1 1 27 27 GLU CB C 457 30.142 30.142 30.563 -0.421 18053
3396 1 6 . 1 1 27 27 GLU H H 457 8.393 8.393 8.395 -0.002 18053
3397 1 6 . 1 1 28 28 GLU N N 458 117.076 117.076 118.272 -1.196 18053
3398 1 6 . 1 1 28 28 GLU HA H 458 4.168 4.168 4.582 -0.414 18053
3399 1 6 . 1 1 28 28 GLU C C 458 174.701 174.701 174.836 -0.135 18053
3400 1 6 . 1 1 28 28 GLU CA C 458 56.906 56.906 55.518 1.388 18053
3401 1 6 . 1 1 28 28 GLU CB C 458 31.848 31.848 32.531 -0.683 18053
3402 1 6 . 1 1 28 28 GLU H H 458 7.489 7.489 7.984 -0.495 18053
3403 1 6 . 1 1 29 29 ILE N N 459 122.183 122.183 121.338 0.845 18053
3404 1 6 . 1 1 29 29 ILE HA H 459 3.764 3.764 4.295 -0.531 18053
3405 1 6 . 1 1 29 29 ILE C C 459 174.169 174.169 174.780 -0.611 18053
3406 1 6 . 1 1 29 29 ILE CA C 459 59.526 59.526 59.379 0.147 18053
3407 1 6 . 1 1 29 29 ILE CB C 459 40.309 40.309 41.997 -1.688 18053
3408 1 6 . 1 1 29 29 ILE H H 459 8.126 8.126 8.341 -0.214 18053
3409 1 6 . 1 1 30 30 ASP N N 460 123.205 123.205 123.318 -0.113 18053
3410 1 6 . 1 1 30 30 ASP HA H 460 4.183 4.183 4.225 -0.042 18053
3411 1 6 . 1 1 30 30 ASP C C 460 178.318 178.318 177.708 0.610 18053
3412 1 6 . 1 1 30 30 ASP CA C 460 53.930 53.930 53.874 0.056 18053
3413 1 6 . 1 1 30 30 ASP CB C 460 42.807 42.807 42.439 0.368 18053
3414 1 6 . 1 1 30 30 ASP H H 460 6.704 6.704 7.764 -1.060 18053
3415 1 6 . 1 1 31 31 LEU N N 461 128.551 128.551 119.852 8.699 18053
3416 1 6 . 1 1 31 31 LEU HA H 461 4.064 4.064 4.085 -0.021 18053
3417 1 6 . 1 1 31 31 LEU C C 461 177.513 177.513 177.869 -0.356 18053
3418 1 6 . 1 1 31 31 LEU CA C 461 57.124 57.124 57.035 0.089 18053
3419 1 6 . 1 1 31 31 LEU CB C 461 41.237 41.237 41.246 -0.009 18053
3420 1 6 . 1 1 31 31 LEU H H 461 9.012 9.012 8.542 0.470 18053
3421 1 6 . 1 1 32 32 GLU N N 462 115.101 115.101 118.053 -2.952 18053
3422 1 6 . 1 1 32 32 GLU HA H 462 4.283 4.283 4.729 -0.446 18053
3423 1 6 . 1 1 32 32 GLU C C 462 177.062 177.062 176.826 0.236 18053
3424 1 6 . 1 1 32 32 GLU CA C 462 55.759 55.759 56.261 -0.502 18053
3425 1 6 . 1 1 32 32 GLU CB C 462 29.569 29.569 32.245 -2.676 18053
3426 1 6 . 1 1 32 32 GLU H H 462 7.588 7.588 8.523 -0.935 18053
3427 1 6 . 1 1 33 33 GLY N N 463 106.299 106.299 106.811 -0.512 18053
3428 1 6 . 1 1 33 33 GLY C C 463 174.824 174.824 174.782 0.042 18053
3429 1 6 . 1 1 33 33 GLY CA C 463 46.806 46.806 44.957 1.849 18053
3430 1 6 . 1 1 33 33 GLY H H 463 7.372 7.372 8.235 -0.863 18053
3431 1 6 . 1 1 34 34 LYS N N 464 118.744 118.744 119.525 -0.781 18053
3432 1 6 . 1 1 34 34 LYS HA H 464 4.562 4.562 4.410 0.152 18053
3433 1 6 . 1 1 34 34 LYS C C 464 177.076 177.076 175.250 1.826 18053
3434 1 6 . 1 1 34 34 LYS CA C 464 59.963 59.963 58.012 1.951 18053
3435 1 6 . 1 1 34 34 LYS CB C 464 33.111 33.111 32.878 0.233 18053
3436 1 6 . 1 1 34 34 LYS H H 464 9.547 9.547 7.970 1.577 18053
3437 1 6 . 1 1 35 35 PHE N N 465 109.125 109.125 112.121 -2.996 18053
3438 1 6 . 1 1 35 35 PHE HA H 465 5.514 5.514 5.629 -0.115 18053
3439 1 6 . 1 1 35 35 PHE C C 465 174.183 174.183 172.965 1.218 18053
3440 1 6 . 1 1 35 35 PHE CA C 465 56.632 56.632 55.738 0.894 18053
3441 1 6 . 1 1 35 35 PHE CB C 465 40.599 40.599 41.245 -0.646 18053
3442 1 6 . 1 1 35 35 PHE H H 465 6.740 6.740 7.191 -0.451 18053
3443 1 6 . 1 1 36 36 VAL N N 466 119.579 119.579 120.265 -0.686 18053
3444 1 6 . 1 1 36 36 VAL HA H 466 3.709 3.709 4.440 -0.731 18053
3445 1 6 . 1 1 36 36 VAL C C 466 172.668 172.668 174.303 -1.635 18053
3446 1 6 . 1 1 36 36 VAL CA C 466 62.692 62.692 61.221 1.470 18053
3447 1 6 . 1 1 36 36 VAL CB C 466 36.215 36.215 35.082 1.133 18053
3448 1 6 . 1 1 36 36 VAL H H 466 7.628 7.628 8.849 -1.221 18053
3449 1 6 . 1 1 37 37 GLN N N 467 126.831 126.831 128.351 -1.520 18053
3450 1 6 . 1 1 37 37 GLN HA H 467 5.449 5.449 4.644 0.805 18053
3451 1 6 . 1 1 37 37 GLN C C 467 174.797 174.797 174.723 0.074 18053
3452 1 6 . 1 1 37 37 GLN CA C 467 54.121 54.121 54.892 -0.771 18053
3453 1 6 . 1 1 37 37 GLN CB C 467 34.623 34.623 28.832 5.791 18053
3454 1 6 . 1 1 37 37 GLN H H 467 8.392 8.392 8.505 -0.113 18053
3455 1 6 . 1 1 38 38 LEU N N 468 123.018 123.018 127.457 -4.439 18053
3456 1 6 . 1 1 38 38 LEU HA H 468 5.422 5.422 5.083 0.339 18053
3457 1 6 . 1 1 38 38 LEU C C 468 175.588 175.588 176.654 -1.066 18053
3458 1 6 . 1 1 38 38 LEU CA C 468 52.702 52.702 54.050 -1.348 18053
3459 1 6 . 1 1 38 38 LEU CB C 468 45.046 45.046 43.907 1.139 18053
3460 1 6 . 1 1 38 38 LEU H H 468 9.103 9.103 8.861 0.242 18053
3461 1 6 . 1 1 39 39 LYS N N 469 118.983 118.983 120.214 -1.231 18053
3462 1 6 . 1 1 39 39 LYS HA H 469 4.852 4.852 4.749 0.103 18053
3463 1 6 . 1 1 39 39 LYS C C 469 173.309 173.309 174.252 -0.943 18053
3464 1 6 . 1 1 39 39 LYS CA C 469 54.994 54.994 54.739 0.256 18053
3465 1 6 . 1 1 39 39 LYS CB C 469 38.246 38.246 36.394 1.852 18053
3466 1 6 . 1 1 39 39 LYS H H 469 8.496 8.496 8.621 -0.125 18053
3467 1 6 . 1 1 40 40 ASN N N 470 121.758 121.758 124.924 -3.166 18053
3468 1 6 . 1 1 40 40 ASN HA H 470 4.788 4.788 5.010 -0.222 18053
3469 1 6 . 1 1 40 40 ASN C C 470 174.496 174.496 175.297 -0.801 18053
3470 1 6 . 1 1 40 40 ASN CA C 470 51.119 51.119 52.186 -1.067 18053
3471 1 6 . 1 1 40 40 ASN CB C 470 37.559 37.559 38.598 -1.039 18053
3472 1 6 . 1 1 40 40 ASN H H 470 8.283 8.283 8.465 -0.182 18053
3473 1 6 . 1 1 41 41 ASN N N 471 122.422 122.422 122.587 -0.165 18053
3474 1 6 . 1 1 41 41 ASN HA H 471 4.588 4.588 4.604 -0.016 18053
3475 1 6 . 1 1 41 41 ASN C C 471 174.810 174.810 175.651 -0.841 18053
3476 1 6 . 1 1 41 41 ASN CA C 471 53.985 53.985 54.545 -0.560 18053
3477 1 6 . 1 1 41 41 ASN CB C 471 39.600 39.600 38.742 0.858 18053
3478 1 6 . 1 1 41 41 ASN H H 471 8.681 8.681 8.348 0.333 18053
3479 1 6 . 1 1 42 42 SER N N 472 116.446 116.446 115.316 1.130 18053
3480 1 6 . 1 1 42 42 SER HA H 472 4.719 4.719 4.374 0.345 18053
3481 1 6 . 1 1 42 42 SER C C 472 172.804 172.804 174.650 -1.846 18053
3482 1 6 . 1 1 42 42 SER CA C 472 57.288 57.288 58.072 -0.784 18053
3483 1 6 . 1 1 42 42 SER CB C 472 66.241 66.241 64.488 1.753 18053
3484 1 6 . 1 1 42 42 SER H H 472 8.370 8.370 7.626 0.744 18053
3485 1 6 . 1 1 43 43 ASP N N 473 117.706 117.706 126.169 -8.463 18053
3486 1 6 . 1 1 43 43 ASP HA H 473 4.474 4.474 4.585 -0.111 18053
3487 1 6 . 1 1 43 43 ASP C C 473 175.343 175.343 175.509 -0.166 18053
3488 1 6 . 1 1 43 43 ASP CA C 473 53.521 53.521 55.076 -1.555 18053
3489 1 6 . 1 1 43 43 ASP CB C 473 40.322 40.322 40.746 -0.424 18053
3490 1 6 . 1 1 43 43 ASP H H 473 8.254 8.254 8.746 -0.492 18053
3491 1 6 . 1 1 44 44 LYS N N 474 120.209 120.209 118.712 1.497 18053
3492 1 6 . 1 1 44 44 LYS HA H 474 4.569 4.569 4.578 -0.009 18053
3493 1 6 . 1 1 44 44 LYS C C 474 175.397 175.397 175.054 0.343 18053
3494 1 6 . 1 1 44 44 LYS CA C 474 54.012 54.012 54.267 -0.255 18053
3495 1 6 . 1 1 44 44 LYS CB C 474 35.383 35.383 34.453 0.930 18053
3496 1 6 . 1 1 44 44 LYS H H 474 8.305 8.305 7.389 0.916 18053
3497 1 6 . 1 1 45 45 ASP N N 475 124.993 124.993 120.169 4.824 18053
3498 1 6 . 1 1 45 45 ASP HA H 475 3.975 3.975 4.438 -0.463 18053
3499 1 6 . 1 1 45 45 ASP C C 475 174.810 174.810 176.239 -1.429 18053
3500 1 6 . 1 1 45 45 ASP CA C 475 54.995 54.995 55.666 -0.671 18053
3501 1 6 . 1 1 45 45 ASP CB C 475 40.364 40.364 41.316 -0.952 18053
3502 1 6 . 1 1 45 45 ASP H H 475 8.722 8.722 8.505 0.217 18053
3503 1 6 . 1 1 46 46 GLN N N 476 120.549 120.549 120.764 -0.215 18053
3504 1 6 . 1 1 46 46 GLN HA H 476 4.436 4.436 4.504 -0.068 18053
3505 1 6 . 1 1 46 46 GLN C C 476 174.019 174.019 174.479 -0.460 18053
3506 1 6 . 1 1 46 46 GLN CA C 476 53.138 53.138 54.144 -1.006 18053
3507 1 6 . 1 1 46 46 GLN CB C 476 31.466 31.466 31.535 -0.069 18053
3508 1 6 . 1 1 46 46 GLN H H 476 7.878 7.878 8.504 -0.626 18053
3509 1 6 . 1 1 47 47 SER N N 477 121.537 121.537 121.354 0.183 18053
3510 1 6 . 1 1 47 47 SER HA H 477 4.229 4.229 4.256 -0.027 18053
3511 1 6 . 1 1 47 47 SER C C 477 174.565 174.565 174.228 0.337 18053
3512 1 6 . 1 1 47 47 SER CA C 477 58.706 58.706 58.563 0.143 18053
3513 1 6 . 1 1 47 47 SER CB C 477 62.965 62.965 62.725 0.240 18053
3514 1 6 . 1 1 47 47 SER H H 477 8.748 8.748 8.606 0.142 18053
3515 1 6 . 1 1 48 48 LEU N N 478 127.751 127.751 125.687 2.064 18053
3516 1 6 . 1 1 48 48 LEU HA H 478 2.631 2.631 4.317 -1.686 18053
3517 1 6 . 1 1 48 48 LEU C C 478 176.789 176.789 177.389 -0.600 18053
3518 1 6 . 1 1 48 48 LEU CA C 478 52.102 52.102 54.515 -2.413 18053
3519 1 6 . 1 1 48 48 LEU CB C 478 42.343 42.343 43.370 -1.027 18053
3520 1 6 . 1 1 48 48 LEU H H 478 7.856 7.856 7.399 0.457 18053
3521 1 6 . 1 1 49 49 GLY N N 479 107.525 107.525 108.809 -1.284 18053
3522 1 6 . 1 1 49 49 GLY C C 479 176.653 176.653 175.308 1.345 18053
3523 1 6 . 1 1 49 49 GLY CA C 479 48.062 48.062 45.981 2.081 18053
3524 1 6 . 1 1 49 49 GLY H H 479 7.728 7.728 8.722 -0.994 18053
3525 1 6 . 1 1 50 50 ASN N N 480 117.059 117.059 120.351 -3.292 18053
3526 1 6 . 1 1 50 50 ASN HA H 480 4.255 4.255 4.575 -0.320 18053
3527 1 6 . 1 1 50 50 ASN C C 480 174.961 174.961 175.271 -0.310 18053
3528 1 6 . 1 1 50 50 ASN CA C 480 56.360 56.360 54.250 2.110 18053
3529 1 6 . 1 1 50 50 ASN CB C 480 37.416 37.416 38.923 -1.507 18053
3530 1 6 . 1 1 50 50 ASN H H 480 7.552 7.552 8.796 -1.244 18053
3531 1 6 . 1 1 51 51 TRP N N 481 122.166 122.166 118.400 3.766 18053
3532 1 6 . 1 1 51 51 TRP HA H 481 4.477 4.477 4.831 -0.354 18053
3533 1 6 . 1 1 51 51 TRP C C 481 175.575 175.575 175.911 -0.336 18053
3534 1 6 . 1 1 51 51 TRP CA C 481 58.762 58.762 58.733 0.029 18053
3535 1 6 . 1 1 51 51 TRP CB C 481 28.041 28.041 29.837 -1.796 18053
3536 1 6 . 1 1 51 51 TRP H H 481 8.914 8.914 7.939 0.975 18053
3537 1 6 . 1 1 52 52 ARG N N 482 116.480 116.480 118.334 -1.854 18053
3538 1 6 . 1 1 52 52 ARG HA H 482 5.968 5.968 5.293 0.675 18053
3539 1 6 . 1 1 52 52 ARG C C 482 175.807 175.807 175.260 0.547 18053
3540 1 6 . 1 1 52 52 ARG CA C 482 54.121 54.121 54.858 -0.737 18053
3541 1 6 . 1 1 52 52 ARG CB C 482 35.124 35.124 33.251 1.873 18053
3542 1 6 . 1 1 52 52 ARG H H 482 9.147 9.147 8.940 0.207 18053
3543 1 6 . 1 1 53 53 ILE N N 483 119.579 119.579 126.462 -6.883 18053
3544 1 6 . 1 1 53 53 ILE HA H 483 4.985 4.985 4.897 0.088 18053
3545 1 6 . 1 1 53 53 ILE C C 483 175.670 175.670 175.986 -0.316 18053
3546 1 6 . 1 1 53 53 ILE CA C 483 60.400 60.400 60.891 -0.490 18053
3547 1 6 . 1 1 53 53 ILE CB C 483 40.227 40.227 38.435 1.792 18053
3548 1 6 . 1 1 53 53 ILE H H 483 9.000 9.000 8.825 0.175 18053
3549 1 6 . 1 1 54 54 LYS N N 484 124.737 124.737 129.234 -4.497 18053
3550 1 6 . 1 1 54 54 LYS HA H 484 5.463 5.463 4.723 0.740 18053
3551 1 6 . 1 1 54 54 LYS C C 484 175.575 175.575 175.971 -0.396 18053
3552 1 6 . 1 1 54 54 LYS CA C 484 54.613 54.613 56.647 -2.034 18053
3553 1 6 . 1 1 54 54 LYS CB C 484 35.041 35.041 33.084 1.958 18053
3554 1 6 . 1 1 54 54 LYS H H 484 9.678 9.678 8.639 1.039 18053
3555 1 6 . 1 1 55 55 ARG N N 485 124.090 124.090 125.606 -1.516 18053
3556 1 6 . 1 1 55 55 ARG HA H 485 5.525 5.525 4.921 0.604 18053
3557 1 6 . 1 1 55 55 ARG C C 485 174.155 174.155 174.728 -0.573 18053
3558 1 6 . 1 1 55 55 ARG CA C 485 53.903 53.903 54.002 -0.099 18053
3559 1 6 . 1 1 55 55 ARG H H 485 9.314 9.314 8.692 0.622 18053
3560 1 6 . 1 1 56 56 GLN N N 486 126.576 126.576 125.529 1.047 18053
3561 1 6 . 1 1 56 56 GLN HA H 486 4.842 4.842 4.923 -0.081 18053
3562 1 6 . 1 1 56 56 GLN C C 486 174.991 174.991 173.932 1.059 18053
3563 1 6 . 1 1 56 56 GLN CA C 486 54.831 54.831 54.425 0.406 18053
3564 1 6 . 1 1 56 56 GLN CB C 486 31.465 31.465 31.727 -0.262 18053
3565 1 6 . 1 1 56 56 GLN H H 486 8.831 8.831 8.231 0.600 18053
3566 1 6 . 1 1 57 57 VAL N N 487 126.712 126.712 125.272 1.440 18053
3567 1 6 . 1 1 57 57 VAL HA H 487 4.266 4.266 4.332 -0.066 18053
3568 1 6 . 1 1 57 57 VAL C C 487 175.916 175.916 177.267 -1.351 18053
3569 1 6 . 1 1 57 57 VAL CA C 487 61.820 61.820 61.079 0.741 18053
3570 1 6 . 1 1 57 57 VAL CB C 487 32.803 32.803 33.497 -0.694 18053
3571 1 6 . 1 1 57 57 VAL H H 487 8.786 8.786 8.563 0.223 18053
3572 1 6 . 1 1 58 58 LEU N N 488 127.274 127.274 124.628 2.646 18053
3573 1 6 . 1 1 58 58 LEU HA H 488 4.085 4.085 4.276 -0.191 18053
3574 1 6 . 1 1 58 58 LEU C C 488 177.158 177.158 178.396 -1.238 18053
3575 1 6 . 1 1 58 58 LEU CA C 488 56.906 56.906 57.533 -0.628 18053
3576 1 6 . 1 1 58 58 LEU CB C 488 41.374 41.374 41.660 -0.286 18053
3577 1 6 . 1 1 58 58 LEU H H 488 8.316 8.316 8.405 -0.089 18053
3578 1 6 . 1 1 59 59 GLU N N 489 119.647 119.647 118.603 1.044 18053
3579 1 6 . 1 1 59 59 GLU HA H 489 4.112 4.112 4.176 -0.064 18053
3580 1 6 . 1 1 59 59 GLU C C 489 176.230 176.230 177.261 -1.031 18053
3581 1 6 . 1 1 59 59 GLU CA C 489 57.015 57.015 57.339 -0.324 18053
3582 1 6 . 1 1 59 59 GLU CB C 489 28.149 28.149 29.616 -1.467 18053
3583 1 6 . 1 1 59 59 GLU H H 489 8.636 8.636 8.437 0.199 18053
3584 1 6 . 1 1 60 60 GLY N N 490 108.819 108.819 106.372 2.447 18053
3585 1 6 . 1 1 60 60 GLY C C 490 173.568 173.568 173.784 -0.216 18053
3586 1 6 . 1 1 60 60 GLY CA C 490 44.773 44.773 44.773 0.000 18053
3587 1 6 . 1 1 60 60 GLY H H 490 8.160 8.160 7.739 0.421 18053
3588 1 6 . 1 1 61 61 GLU N N 491 121.009 121.009 123.335 -2.326 18053
3589 1 6 . 1 1 61 61 GLU HA H 491 4.323 4.323 4.176 0.147 18053
3590 1 6 . 1 1 61 61 GLU C C 491 175.725 175.725 175.547 0.178 18053
3591 1 6 . 1 1 61 61 GLU CA C 491 56.196 56.196 56.543 -0.347 18053
3592 1 6 . 1 1 61 61 GLU CB C 491 30.865 30.865 28.865 2.000 18053
3593 1 6 . 1 1 61 61 GLU H H 491 8.320 8.320 8.404 -0.084 18053
3594 1 6 . 1 1 62 62 GLU N N 492 123.426 123.426 124.208 -0.782 18053
3595 1 6 . 1 1 62 62 GLU HA H 492 5.054 5.054 5.458 -0.404 18053
3596 1 6 . 1 1 62 62 GLU C C 492 175.930 175.930 175.896 0.034 18053
3597 1 6 . 1 1 62 62 GLU CA C 492 55.650 55.650 54.833 0.817 18053
3598 1 6 . 1 1 62 62 GLU CB C 492 32.312 32.312 31.196 1.116 18053
3599 1 6 . 1 1 62 62 GLU H H 492 8.594 8.594 8.436 0.158 18053
3600 1 6 . 1 1 63 63 ILE N N 493 119.732 119.732 118.366 1.366 18053
3601 1 6 . 1 1 63 63 ILE HA H 493 4.788 4.788 4.895 -0.107 18053
3602 1 6 . 1 1 63 63 ILE C C 493 174.647 174.647 174.145 0.502 18053
3603 1 6 . 1 1 63 63 ILE CA C 493 60.181 60.181 59.298 0.883 18053
3604 1 6 . 1 1 63 63 ILE CB C 493 41.183 41.183 41.949 -0.766 18053
3605 1 6 . 1 1 63 63 ILE H H 493 8.523 8.523 8.517 0.006 18053
3606 1 6 . 1 1 64 64 ALA N N 494 122.166 122.166 122.770 -0.604 18053
3607 1 6 . 1 1 64 64 ALA HA H 494 5.521 5.521 5.186 0.335 18053
3608 1 6 . 1 1 64 64 ALA C C 494 174.606 174.606 176.088 -1.482 18053
3609 1 6 . 1 1 64 64 ALA CA C 494 51.528 51.528 51.701 -0.173 18053
3610 1 6 . 1 1 64 64 ALA CB C 494 22.239 22.239 20.928 1.311 18053
3611 1 6 . 1 1 64 64 ALA H H 494 8.741 8.741 8.510 0.231 18053
3612 1 6 . 1 1 65 65 TYR N N 495 126.729 126.729 126.787 -0.058 18053
3613 1 6 . 1 1 65 65 TYR HA H 495 3.094 3.094 3.728 -0.634 18053
3614 1 6 . 1 1 65 65 TYR C C 495 173.036 173.036 174.023 -0.987 18053
3615 1 6 . 1 1 65 65 TYR CA C 495 56.905 56.905 56.574 0.331 18053
3616 1 6 . 1 1 65 65 TYR CB C 495 40.269 40.269 38.585 1.684 18053
3617 1 6 . 1 1 65 65 TYR H H 495 8.462 8.462 8.681 -0.219 18053
3618 1 6 . 1 1 66 66 LYS N N 496 128.108 128.108 125.909 2.199 18053
3619 1 6 . 1 1 66 66 LYS HA H 496 4.822 4.822 4.698 0.124 18053
3620 1 6 . 1 1 66 66 LYS C C 496 174.906 174.906 174.911 -0.005 18053
3621 1 6 . 1 1 66 66 LYS CA C 496 53.739 53.739 55.024 -1.285 18053
3622 1 6 . 1 1 66 66 LYS CB C 496 34.782 34.782 33.289 1.493 18053
3623 1 6 . 1 1 66 66 LYS H H 496 7.010 7.010 7.505 -0.495 18053
3624 1 6 . 1 1 67 67 PHE N N 497 125.299 125.299 121.501 3.798 18053
3625 1 6 . 1 1 67 67 PHE HA H 497 3.932 3.932 4.250 -0.318 18053
3626 1 6 . 1 1 67 67 PHE C C 497 177.990 177.990 175.329 2.661 18053
3627 1 6 . 1 1 67 67 PHE CA C 497 59.007 59.007 57.321 1.686 18053
3628 1 6 . 1 1 67 67 PHE CB C 497 40.981 40.981 40.796 0.185 18053
3629 1 6 . 1 1 67 67 PHE H H 497 8.509 8.509 8.307 0.202 18053
3630 1 6 . 1 1 68 68 THR N N 498 116.191 116.191 111.439 4.752 18053
3631 1 6 . 1 1 68 68 THR HA H 498 4.417 4.417 4.636 -0.219 18053
3632 1 6 . 1 1 68 68 THR CA C 498 60.855 60.855 59.210 1.645 18053
3633 1 6 . 1 1 68 68 THR CB C 498 68.019 68.019 69.427 -1.408 18053
3634 1 6 . 1 1 68 68 THR H H 498 8.688 8.688 8.382 0.306 18053
3635 1 6 . 1 1 69 69 PRO HA H 499 3.948 3.948 4.929 -0.981 18053
3636 1 6 . 1 1 69 69 PRO C C 499 177.444 177.444 176.501 0.943 18053
3637 1 6 . 1 1 69 69 PRO CA C 499 66.077 66.077 63.551 2.526 18053
3638 1 6 . 1 1 69 69 PRO CB C 499 32.776 32.776 31.972 0.804 18053
3639 1 6 . 1 1 70 70 LYS N N 500 113.552 113.552 116.171 -2.619 18053
3640 1 6 . 1 1 70 70 LYS HA H 500 4.385 4.385 4.276 0.109 18053
3641 1 6 . 1 1 70 70 LYS C C 500 176.325 176.325 175.759 0.566 18053
3642 1 6 . 1 1 70 70 LYS CA C 500 54.995 54.995 56.072 -1.077 18053
3643 1 6 . 1 1 70 70 LYS CB C 500 31.793 31.793 32.621 -0.828 18053
3644 1 6 . 1 1 70 70 LYS H H 500 8.016 8.016 8.072 -0.056 18053
3645 1 6 . 1 1 71 71 TYR N N 501 121.860 121.860 122.600 -0.740 18053
3646 1 6 . 1 1 71 71 TYR HA H 501 3.730 3.730 4.446 -0.716 18053
3647 1 6 . 1 1 71 71 TYR C C 501 174.838 174.838 173.725 1.113 18053
3648 1 6 . 1 1 71 71 TYR CA C 501 62.310 62.310 58.373 3.937 18053
3649 1 6 . 1 1 71 71 TYR CB C 501 38.781 38.781 39.043 -0.262 18053
3650 1 6 . 1 1 71 71 TYR H H 501 7.460 7.460 7.648 -0.188 18053
3651 1 6 . 1 1 72 72 ILE N N 502 129.487 129.487 127.671 1.816 18053
3652 1 6 . 1 1 72 72 ILE HA H 502 3.928 3.928 4.144 -0.216 18053
3653 1 6 . 1 1 72 72 ILE C C 502 172.968 172.968 173.829 -0.861 18053
3654 1 6 . 1 1 72 72 ILE CA C 502 59.308 59.308 59.686 -0.378 18053
3655 1 6 . 1 1 72 72 ILE CB C 502 40.910 40.910 39.821 1.089 18053
3656 1 6 . 1 1 72 72 ILE H H 502 7.168 7.168 8.278 -1.110 18053
3657 1 6 . 1 1 73 73 LEU N N 503 128.278 128.278 127.852 0.426 18053
3658 1 6 . 1 1 73 73 LEU HA H 503 4.493 4.493 4.235 0.258 18053
3659 1 6 . 1 1 73 73 LEU C C 503 175.834 175.834 175.346 0.488 18053
3660 1 6 . 1 1 73 73 LEU CA C 503 51.965 51.965 54.326 -2.361 18053
3661 1 6 . 1 1 73 73 LEU CB C 503 42.548 42.548 43.403 -0.855 18053
3662 1 6 . 1 1 73 73 LEU H H 503 8.483 8.483 8.087 0.396 18053
3663 1 6 . 1 1 74 74 ARG N N 504 129.589 129.589 124.283 5.306 18053
3664 1 6 . 1 1 74 74 ARG HA H 504 3.743 3.743 4.745 -1.002 18053
3665 1 6 . 1 1 74 74 ARG C C 504 175.233 175.233 176.148 -0.915 18053
3666 1 6 . 1 1 74 74 ARG CA C 504 56.851 56.851 54.481 2.370 18053
3667 1 6 . 1 1 74 74 ARG CB C 504 30.292 30.292 31.303 -1.011 18053
3668 1 6 . 1 1 74 74 ARG H H 504 8.673 8.673 8.304 0.369 18053
3669 1 6 . 1 1 75 75 ALA N N 505 123.205 123.205 123.091 0.114 18053
3670 1 6 . 1 1 75 75 ALA HA H 505 3.522 3.522 4.144 -0.622 18053
3671 1 6 . 1 1 75 75 ALA C C 505 178.441 178.441 178.265 0.176 18053
3672 1 6 . 1 1 75 75 ALA CA C 505 53.794 53.794 53.159 0.635 18053
3673 1 6 . 1 1 75 75 ALA CB C 505 18.910 18.910 18.575 0.335 18053
3674 1 6 . 1 1 75 75 ALA H H 505 8.564 8.564 8.434 0.130 18053
3675 1 6 . 1 1 76 76 GLY N N 506 112.241 112.241 114.150 -1.909 18053
3676 1 6 . 1 1 76 76 GLY C C 506 174.278 174.278 174.727 -0.449 18053
3677 1 6 . 1 1 76 76 GLY CA C 506 46.725 46.725 45.885 0.840 18053
3678 1 6 . 1 1 76 76 GLY H H 506 7.381 7.381 8.562 -1.181 18053
3679 1 6 . 1 1 77 77 GLN N N 507 117.382 117.382 119.037 -1.655 18053
3680 1 6 . 1 1 77 77 GLN HA H 507 4.364 4.364 4.680 -0.316 18053
3681 1 6 . 1 1 77 77 GLN C C 507 173.937 173.937 174.652 -0.715 18053
3682 1 6 . 1 1 77 77 GLN CA C 507 54.558 54.558 54.220 0.338 18053
3683 1 6 . 1 1 77 77 GLN CB C 507 30.073 30.073 30.959 -0.885 18053
3684 1 6 . 1 1 77 77 GLN H H 507 7.996 7.996 7.563 0.433 18053
3685 1 6 . 1 1 78 78 MET N N 508 116.957 116.957 114.996 1.961 18053
3686 1 6 . 1 1 78 78 MET HA H 508 5.388 5.388 4.786 0.602 18053
3687 1 6 . 1 1 78 78 MET C C 508 175.807 175.807 173.542 2.265 18053
3688 1 6 . 1 1 78 78 MET CA C 508 54.067 54.067 54.975 -0.908 18053
3689 1 6 . 1 1 78 78 MET CB C 508 37.198 37.198 36.449 0.750 18053
3690 1 6 . 1 1 78 78 MET H H 508 8.092 8.092 8.215 -0.123 18053
3691 1 6 . 1 1 79 79 VAL N N 509 119.340 119.340 120.654 -1.314 18053
3692 1 6 . 1 1 79 79 VAL HA H 509 4.956 4.956 4.861 0.095 18053
3693 1 6 . 1 1 79 79 VAL C C 509 172.217 172.217 174.334 -2.117 18053
3694 1 6 . 1 1 79 79 VAL CA C 509 59.471 59.471 60.913 -1.442 18053
3695 1 6 . 1 1 79 79 VAL CB C 509 33.676 33.676 35.561 -1.885 18053
3696 1 6 . 1 1 79 79 VAL H H 509 8.534 8.534 8.439 0.095 18053
3697 1 6 . 1 1 80 80 THR N N 510 124.533 124.533 126.494 -1.961 18053
3698 1 6 . 1 1 80 80 THR HA H 510 4.586 4.586 4.905 -0.320 18053
3699 1 6 . 1 1 80 80 THR C C 510 172.215 172.215 173.982 -1.767 18053
3700 1 6 . 1 1 80 80 THR CA C 510 62.119 62.119 61.980 0.139 18053
3701 1 6 . 1 1 80 80 THR CB C 510 69.407 69.407 69.210 0.197 18053
3702 1 6 . 1 1 80 80 THR H H 510 8.301 8.301 8.821 -0.520 18053
3703 1 6 . 1 1 81 81 VAL N N 511 127.002 127.002 128.600 -1.598 18053
3704 1 6 . 1 1 81 81 VAL HA H 511 4.596 4.596 4.741 -0.145 18053
3705 1 6 . 1 1 81 81 VAL C C 511 176.667 176.667 175.603 1.064 18053
3706 1 6 . 1 1 81 81 VAL CA C 511 61.382 61.382 62.809 -1.427 18053
3707 1 6 . 1 1 81 81 VAL CB C 511 30.945 30.945 31.485 -0.540 18053
3708 1 6 . 1 1 81 81 VAL H H 511 8.796 8.796 8.728 0.068 18053
3709 1 6 . 1 1 82 82 TRP N N 512 131.479 131.479 129.405 2.074 18053
3710 1 6 . 1 1 82 82 TRP HA H 512 5.338 5.338 5.458 -0.120 18053
3711 1 6 . 1 1 82 82 TRP C C 512 176.885 176.885 175.448 1.437 18053
3712 1 6 . 1 1 82 82 TRP CA C 512 56.442 56.442 56.565 -0.123 18053
3713 1 6 . 1 1 82 82 TRP CB C 512 30.701 30.701 31.867 -1.166 18053
3714 1 6 . 1 1 82 82 TRP H H 512 9.924 9.924 8.681 1.243 18053
3715 1 6 . 1 1 83 83 ALA N N 513 123.954 123.954 120.205 3.749 18053
3716 1 6 . 1 1 83 83 ALA HA H 513 4.308 4.308 4.676 -0.368 18053
3717 1 6 . 1 1 83 83 ALA C C 513 178.140 178.140 176.702 1.438 18053
3718 1 6 . 1 1 83 83 ALA CA C 513 52.211 52.211 50.032 2.179 18053
3719 1 6 . 1 1 83 83 ALA CB C 513 18.745 18.745 21.427 -2.682 18053
3720 1 6 . 1 1 83 83 ALA H H 513 9.048 9.048 8.523 0.525 18053
3721 1 6 . 1 1 84 84 ALA N N 514 125.146 125.146 123.050 2.096 18053
3722 1 6 . 1 1 84 84 ALA HA H 514 3.951 3.951 4.196 -0.245 18053
3723 1 6 . 1 1 84 84 ALA C C 514 179.519 179.519 179.511 0.008 18053
3724 1 6 . 1 1 84 84 ALA CA C 514 54.804 54.804 54.536 0.268 18053
3725 1 6 . 1 1 84 84 ALA CB C 514 18.582 18.582 19.240 -0.658 18053
3726 1 6 . 1 1 84 84 ALA H H 514 8.341 8.341 8.065 0.276 18053
3727 1 6 . 1 1 85 85 GLY N N 515 103.388 103.388 105.707 -2.319 18053
3728 1 6 . 1 1 85 85 GLY C C 515 174.674 174.674 174.802 -0.128 18053
3729 1 6 . 1 1 85 85 GLY CA C 515 45.878 45.878 45.489 0.389 18053
3730 1 6 . 1 1 85 85 GLY H H 515 7.996 7.996 7.963 0.033 18053
3731 1 6 . 1 1 86 86 ALA N N 516 120.140 120.140 123.240 -3.100 18053
3732 1 6 . 1 1 86 86 ALA HA H 516 4.344 4.344 4.481 -0.137 18053
3733 1 6 . 1 1 86 86 ALA C C 516 177.690 177.690 177.861 -0.171 18053
3734 1 6 . 1 1 86 86 ALA CA C 516 53.139 53.139 51.947 1.192 18053
3735 1 6 . 1 1 86 86 ALA CB C 516 20.547 20.547 19.327 1.220 18053
3736 1 6 . 1 1 86 86 ALA H H 516 7.474 7.474 7.503 -0.029 18053
3737 1 6 . 1 1 87 87 GLY N N 517 105.720 105.720 107.219 -1.499 18053
3738 1 6 . 1 1 87 87 GLY C C 517 173.650 173.650 174.166 -0.516 18053
3739 1 6 . 1 1 87 87 GLY CA C 517 46.014 46.014 45.413 0.601 18053
3740 1 6 . 1 1 87 87 GLY H H 517 7.779 7.779 7.829 -0.050 18053
3741 1 6 . 1 1 88 88 VAL N N 518 121.537 121.537 119.723 1.814 18053
3742 1 6 . 1 1 88 88 VAL HA H 518 3.585 3.585 4.160 -0.575 18053
3743 1 6 . 1 1 88 88 VAL C C 518 174.851 174.851 174.723 0.128 18053
3744 1 6 . 1 1 88 88 VAL CA C 518 61.274 61.274 60.893 0.381 18053
3745 1 6 . 1 1 88 88 VAL CB C 518 33.376 33.376 33.542 -0.166 18053
3746 1 6 . 1 1 88 88 VAL H H 518 7.499 7.499 7.568 -0.069 18053
3747 1 6 . 1 1 89 89 ALA N N 519 128.295 128.295 129.557 -1.262 18053
3748 1 6 . 1 1 89 89 ALA HA H 519 4.192 4.192 4.470 -0.278 18053
3749 1 6 . 1 1 89 89 ALA C C 519 176.680 176.680 176.315 0.365 18053
3750 1 6 . 1 1 89 89 ALA CA C 519 51.283 51.283 51.057 0.226 18053
3751 1 6 . 1 1 89 89 ALA CB C 519 19.292 19.292 19.727 -0.435 18053
3752 1 6 . 1 1 89 89 ALA H H 519 7.960 7.960 8.011 -0.051 18053
3753 1 6 . 1 1 90 90 HIS N N 520 122.643 122.643 122.486 0.157 18053
3754 1 6 . 1 1 90 90 HIS HA H 520 4.033 4.033 4.305 -0.272 18053
3755 1 6 . 1 1 90 90 HIS C C 520 175.793 175.793 174.592 1.201 18053
3756 1 6 . 1 1 90 90 HIS CA C 520 58.653 58.653 56.464 2.189 18053
3757 1 6 . 1 1 90 90 HIS CB C 520 32.285 32.285 29.702 2.583 18053
3758 1 6 . 1 1 90 90 HIS H H 520 8.394 8.394 8.768 -0.374 18053
3759 1 6 . 1 1 91 91 SER N N 521 121.247 121.247 123.404 -2.157 18053
3760 1 6 . 1 1 91 91 SER HA H 521 4.629 4.629 4.682 -0.053 18053
3761 1 6 . 1 1 91 91 SER CA C 521 55.843 55.843 55.922 -0.079 18053
3762 1 6 . 1 1 91 91 SER CB C 521 62.367 62.367 63.521 -1.154 18053
3763 1 6 . 1 1 91 91 SER H H 521 8.569 8.569 8.400 0.169 18053
3764 1 6 . 1 1 92 92 PRO HA H 522 4.002 4.002 4.823 -0.821 18053
3765 1 6 . 1 1 92 92 PRO CA C 522 62.244 62.244 62.038 0.206 18053
3766 1 6 . 1 1 92 92 PRO CB C 522 30.931 30.931 31.318 -0.387 18053
3767 1 6 . 1 1 93 93 PRO HA H 523 4.672 4.672 4.839 -0.167 18053
3768 1 6 . 1 1 93 93 PRO C C 523 177.786 177.786 177.322 0.464 18053
3769 1 6 . 1 1 93 93 PRO CA C 523 64.003 64.003 63.395 0.608 18053
3770 1 6 . 1 1 93 93 PRO CB C 523 34.905 34.905 32.428 2.477 18053
3771 1 6 . 1 1 94 94 SER N N 524 117.212 117.212 118.104 -0.892 18053
3772 1 6 . 1 1 94 94 SER HA H 524 4.678 4.678 4.652 0.026 18053
3773 1 6 . 1 1 94 94 SER C C 524 174.851 174.851 174.728 0.123 18053
3774 1 6 . 1 1 94 94 SER CA C 524 61.874 61.874 60.257 1.617 18053
3775 1 6 . 1 1 94 94 SER CB C 524 64.057 64.057 63.961 0.096 18053
3776 1 6 . 1 1 94 94 SER H H 524 8.463 8.463 7.765 0.698 18053
3777 1 6 . 1 1 95 95 THR N N 525 121.588 121.588 120.693 0.895 18053
3778 1 6 . 1 1 95 95 THR HA H 525 4.859 4.859 4.854 0.005 18053
3779 1 6 . 1 1 95 95 THR C C 525 172.094 172.094 173.233 -1.139 18053
3780 1 6 . 1 1 95 95 THR CA C 525 62.309 62.309 63.018 -0.709 18053
3781 1 6 . 1 1 95 95 THR CB C 525 70.281 70.281 68.594 1.687 18053
3782 1 6 . 1 1 95 95 THR H H 525 7.631 7.631 8.007 -0.376 18053
3783 1 6 . 1 1 96 96 LEU N N 526 127.274 127.274 130.215 -2.941 18053
3784 1 6 . 1 1 96 96 LEU HA H 526 5.131 5.131 4.867 0.264 18053
3785 1 6 . 1 1 96 96 LEU C C 526 175.916 175.916 176.049 -0.133 18053
3786 1 6 . 1 1 96 96 LEU CA C 526 52.075 52.075 54.038 -1.963 18053
3787 1 6 . 1 1 96 96 LEU CB C 526 43.790 43.790 42.706 1.084 18053
3788 1 6 . 1 1 96 96 LEU H H 526 8.977 8.977 8.241 0.736 18053
3789 1 6 . 1 1 97 97 VAL N N 527 124.056 124.056 124.228 -0.172 18053
3790 1 6 . 1 1 97 97 VAL HA H 527 4.869 4.869 4.268 0.601 18053
3791 1 6 . 1 1 97 97 VAL C C 527 176.230 176.230 175.205 1.025 18053
3792 1 6 . 1 1 97 97 VAL CA C 527 61.519 61.519 61.669 -0.150 18053
3793 1 6 . 1 1 97 97 VAL CB C 527 33.704 33.704 32.573 1.131 18053
3794 1 6 . 1 1 97 97 VAL H H 527 10.724 10.724 8.481 2.243 18053
3795 1 6 . 1 1 98 98 TRP N N 528 132.586 132.586 131.883 0.703 18053
3796 1 6 . 1 1 98 98 TRP HA H 528 4.965 4.965 4.305 0.660 18053
3797 1 6 . 1 1 98 98 TRP C C 528 173.391 173.391 174.298 -0.907 18053
3798 1 6 . 1 1 98 98 TRP CA C 528 53.303 53.303 55.010 -1.707 18053
3799 1 6 . 1 1 98 98 TRP CB C 528 28.245 28.245 27.692 0.553 18053
3800 1 6 . 1 1 98 98 TRP H H 528 9.400 9.400 8.564 0.836 18053
3801 1 6 . 1 1 99 99 LYS N N 529 126.644 126.644 127.624 -0.980 18053
3802 1 6 . 1 1 99 99 LYS HA H 529 3.839 3.839 4.144 -0.305 18053
3803 1 6 . 1 1 99 99 LYS C C 529 177.581 177.581 177.036 0.545 18053
3804 1 6 . 1 1 99 99 LYS CA C 529 58.543 58.543 57.038 1.505 18053
3805 1 6 . 1 1 99 99 LYS CB C 529 32.176 32.176 32.307 -0.131 18053
3806 1 6 . 1 1 99 99 LYS H H 529 8.153 8.153 7.904 0.249 18053
3807 1 6 . 1 1 100 100 GLY N N 530 110.385 110.385 113.896 -3.511 18053
3808 1 6 . 1 1 100 100 GLY C C 530 172.367 172.367 173.585 -1.218 18053
3809 1 6 . 1 1 100 100 GLY CA C 530 45.278 45.278 44.715 0.563 18053
3810 1 6 . 1 1 100 100 GLY H H 530 8.363 8.363 8.532 -0.169 18053
3811 1 6 . 1 1 101 101 GLN N N 531 121.162 121.162 122.400 -1.238 18053
3812 1 6 . 1 1 101 101 GLN HA H 531 3.972 3.972 4.325 -0.353 18053
3813 1 6 . 1 1 101 101 GLN CA C 531 52.620 52.620 54.388 -1.768 18053
3814 1 6 . 1 1 101 101 GLN CB C 531 27.595 27.595 28.302 -0.707 18053
3815 1 6 . 1 1 101 101 GLN H H 531 6.815 6.815 7.359 -0.544 18053
3816 1 6 . 1 1 102 102 SER N N 532 122.728 122.728 122.561 0.167 18053
3817 1 6 . 1 1 102 102 SER HA H 532 3.866 3.866 4.439 -0.573 18053
3818 1 6 . 1 1 102 102 SER C C 532 174.537 174.537 176.350 -1.813 18053
3819 1 6 . 1 1 102 102 SER CA C 532 61.983 61.983 60.484 1.499 18053
3820 1 6 . 1 1 102 102 SER CB C 532 62.802 62.802 63.389 -0.587 18053
3821 1 6 . 1 1 102 102 SER H H 532 8.662 8.662 8.936 -0.274 18053
3822 1 6 . 1 1 103 103 SER N N 533 110.811 110.811 117.378 -6.567 18053
3823 1 6 . 1 1 103 103 SER HA H 533 4.240 4.240 4.203 0.037 18053
3824 1 6 . 1 1 103 103 SER C C 533 174.087 174.087 174.611 -0.524 18053
3825 1 6 . 1 1 103 103 SER CA C 533 56.633 56.633 59.679 -3.046 18053
3826 1 6 . 1 1 103 103 SER CB C 533 64.658 64.658 63.475 1.183 18053
3827 1 6 . 1 1 103 103 SER H H 533 7.134 7.134 8.051 -0.917 18053
3828 1 6 . 1 1 104 104 TRP N N 534 126.133 126.133 122.902 3.231 18053
3829 1 6 . 1 1 104 104 TRP HA H 534 4.098 4.098 4.220 -0.122 18053
3830 1 6 . 1 1 104 104 TRP C C 534 176.066 176.066 175.913 0.153 18053
3831 1 6 . 1 1 104 104 TRP CA C 534 60.127 60.127 57.220 2.907 18053
3832 1 6 . 1 1 104 104 TRP CB C 534 28.764 28.764 28.800 -0.036 18053
3833 1 6 . 1 1 104 104 TRP H H 534 9.764 9.764 7.986 1.778 18053
3834 1 6 . 1 1 105 105 GLY N N 535 105.907 105.907 108.202 -2.295 18053
3835 1 6 . 1 1 105 105 GLY C C 535 172.217 172.217 174.346 -2.129 18053
3836 1 6 . 1 1 105 105 GLY CA C 535 44.240 44.240 45.058 -0.818 18053
3837 1 6 . 1 1 105 105 GLY H H 535 8.095 8.095 7.679 0.416 18053
3838 1 6 . 1 1 106 106 THR N N 536 111.253 111.253 113.841 -2.588 18053
3839 1 6 . 1 1 106 106 THR HA H 536 3.859 3.859 4.052 -0.193 18053
3840 1 6 . 1 1 106 106 THR C C 536 172.872 172.872 173.910 -1.038 18053
3841 1 6 . 1 1 106 106 THR CA C 536 59.635 59.635 61.774 -2.139 18053
3842 1 6 . 1 1 106 106 THR CB C 536 70.526 70.526 69.224 1.302 18053
3843 1 6 . 1 1 106 106 THR H H 536 7.913 7.913 7.727 0.186 18053
3844 1 6 . 1 1 107 107 GLY N N 537 107.712 107.712 110.273 -2.561 18053
3845 1 6 . 1 1 107 107 GLY C C 537 172.709 172.709 173.739 -1.030 18053
3846 1 6 . 1 1 107 107 GLY CA C 537 45.166 45.166 45.122 0.044 18053
3847 1 6 . 1 1 107 107 GLY H H 537 7.533 7.533 7.425 0.108 18053
3848 1 6 . 1 1 108 108 GLU N N 538 118.864 118.864 119.059 -0.195 18053
3849 1 6 . 1 1 108 108 GLU HA H 538 4.136 4.136 4.251 -0.115 18053
3850 1 6 . 1 1 108 108 GLU C C 538 176.353 176.353 175.436 0.917 18053
3851 1 6 . 1 1 108 108 GLU CA C 538 58.352 58.352 57.653 0.699 18053
3852 1 6 . 1 1 108 108 GLU CB C 538 30.156 30.156 30.494 -0.338 18053
3853 1 6 . 1 1 108 108 GLU H H 538 8.558 8.558 8.718 -0.160 18053
3854 1 6 . 1 1 109 109 SER N N 539 110.419 110.419 113.737 -3.318 18053
3855 1 6 . 1 1 109 109 SER HA H 539 4.963 4.963 5.288 -0.325 18053
3856 1 6 . 1 1 109 109 SER C C 539 173.787 173.787 172.786 1.001 18053
3857 1 6 . 1 1 109 109 SER CA C 539 57.125 57.125 57.346 -0.221 18053
3858 1 6 . 1 1 109 109 SER CB C 539 64.439 64.439 64.921 -0.482 18053
3859 1 6 . 1 1 109 109 SER H H 539 7.620 7.620 7.823 -0.203 18053
3860 1 6 . 1 1 110 110 PHE N N 540 118.778 118.778 119.357 -0.579 18053
3861 1 6 . 1 1 110 110 PHE HA H 540 5.081 5.081 5.225 -0.144 18053
3862 1 6 . 1 1 110 110 PHE C C 540 176.052 176.052 172.959 3.093 18053
3863 1 6 . 1 1 110 110 PHE CA C 540 56.789 56.789 56.294 0.495 18053
3864 1 6 . 1 1 110 110 PHE CB C 540 40.760 40.760 42.218 -1.458 18053
3865 1 6 . 1 1 110 110 PHE H H 540 8.318 8.318 8.833 -0.515 18053
3866 1 6 . 1 1 112 112 THR HA H 542 5.468 5.468 5.325 0.143 18053
3867 1 6 . 1 1 112 112 THR C C 542 172.381 172.381 173.651 -1.270 18053
3868 1 6 . 1 1 112 112 THR CA C 542 61.818 61.818 62.331 -0.513 18053
3869 1 6 . 1 1 112 112 THR CB C 542 70.990 70.990 69.373 1.617 18053
3870 1 6 . 1 1 113 113 VAL N N 543 124.771 124.771 127.795 -3.024 18053
3871 1 6 . 1 1 113 113 VAL HA H 543 4.864 4.864 4.441 0.423 18053
3872 1 6 . 1 1 113 113 VAL C C 543 173.132 173.132 173.798 -0.666 18053
3873 1 6 . 1 1 113 113 VAL CA C 543 60.099 60.099 60.799 -0.700 18053
3874 1 6 . 1 1 113 113 VAL CB C 543 36.433 36.433 34.775 1.659 18053
3875 1 6 . 1 1 113 113 VAL H H 543 9.380 9.380 9.053 0.327 18053
3876 1 6 . 1 1 114 114 LEU N N 544 128.789 128.789 129.082 -0.293 18053
3877 1 6 . 1 1 114 114 LEU HA H 544 5.320 5.320 4.904 0.416 18053
3878 1 6 . 1 1 114 114 LEU C C 544 174.237 174.237 174.787 -0.550 18053
3879 1 6 . 1 1 114 114 LEU CA C 544 53.193 53.193 53.601 -0.408 18053
3880 1 6 . 1 1 114 114 LEU CB C 544 45.879 45.879 44.078 1.801 18053
3881 1 6 . 1 1 114 114 LEU H H 544 8.948 8.948 8.555 0.393 18053
3882 1 6 . 1 1 115 115 VAL N N 545 127.002 127.002 127.138 -0.136 18053
3883 1 6 . 1 1 115 115 VAL HA H 545 4.854 4.854 4.598 0.256 18053
3884 1 6 . 1 1 115 115 VAL C C 545 175.206 175.206 174.891 0.315 18053
3885 1 6 . 1 1 115 115 VAL CA C 545 59.334 59.334 60.390 -1.056 18053
3886 1 6 . 1 1 115 115 VAL CB C 545 34.495 34.495 34.418 0.077 18053
3887 1 6 . 1 1 115 115 VAL H H 545 9.564 9.564 8.691 0.873 18053
3888 1 6 . 1 1 116 116 ASN N N 546 121.179 121.179 122.373 -1.194 18053
3889 1 6 . 1 1 116 116 ASN HA H 546 2.897 2.897 3.549 -0.652 18053
3890 1 6 . 1 1 116 116 ASN C C 546 176.885 176.885 175.023 1.862 18053
3891 1 6 . 1 1 116 116 ASN CA C 546 50.409 50.409 50.906 -0.497 18053
3892 1 6 . 1 1 116 116 ASN CB C 546 36.639 36.639 40.223 -3.584 18053
3893 1 6 . 1 1 116 116 ASN H H 546 8.016 8.016 7.803 0.213 18053
3894 1 6 . 1 1 117 117 ALA N N 547 119.834 119.834 121.201 -1.367 18053
3895 1 6 . 1 1 117 117 ALA HA H 547 3.866 3.866 4.027 -0.161 18053
3896 1 6 . 1 1 117 117 ALA C C 547 177.772 177.772 178.526 -0.754 18053
3897 1 6 . 1 1 117 117 ALA CA C 547 54.504 54.504 54.497 0.007 18053
3898 1 6 . 1 1 117 117 ALA CB C 547 18.200 18.200 18.647 -0.447 18053
3899 1 6 . 1 1 117 117 ALA H H 547 6.444 6.444 8.213 -1.769 18053
3900 1 6 . 1 1 118 118 ASP N N 548 115.646 115.646 117.486 -1.840 18053
3901 1 6 . 1 1 118 118 ASP HA H 548 4.644 4.644 4.393 0.251 18053
3902 1 6 . 1 1 118 118 ASP C C 548 176.052 176.052 177.251 -1.199 18053
3903 1 6 . 1 1 118 118 ASP CA C 548 54.067 54.067 55.654 -1.587 18053
3904 1 6 . 1 1 118 118 ASP CB C 548 41.674 41.674 41.236 0.438 18053
3905 1 6 . 1 1 118 118 ASP H H 548 7.181 7.181 8.100 -0.919 18053
3906 1 6 . 1 1 119 119 GLY N N 549 107.167 107.167 106.379 0.788 18053
3907 1 6 . 1 1 119 119 GLY C C 549 173.841 173.841 174.428 -0.587 18053
3908 1 6 . 1 1 119 119 GLY CA C 549 45.455 45.455 44.606 0.849 18053
3909 1 6 . 1 1 119 119 GLY H H 549 7.738 7.738 7.401 0.337 18053
3910 1 6 . 1 1 120 120 GLU N N 550 121.196 121.196 121.064 0.132 18053
3911 1 6 . 1 1 120 120 GLU HA H 550 4.112 4.112 4.231 -0.119 18053
3912 1 6 . 1 1 120 120 GLU C C 550 175.588 175.588 175.735 -0.147 18053
3913 1 6 . 1 1 120 120 GLU CA C 550 54.831 54.831 55.948 -1.117 18053
3914 1 6 . 1 1 120 120 GLU CB C 550 29.937 29.937 30.230 -0.293 18053
3915 1 6 . 1 1 120 120 GLU H H 550 7.587 7.587 7.740 -0.153 18053
3916 1 6 . 1 1 121 121 GLU N N 551 123.886 123.886 124.292 -0.406 18053
3917 1 6 . 1 1 121 121 GLU HA H 551 4.276 4.276 4.285 -0.009 18053
3918 1 6 . 1 1 121 121 GLU C C 551 176.817 176.817 176.511 0.306 18053
3919 1 6 . 1 1 121 121 GLU CA C 551 56.796 56.796 56.425 0.372 18053
3920 1 6 . 1 1 121 121 GLU CB C 551 28.955 28.955 29.202 -0.247 18053
3921 1 6 . 1 1 121 121 GLU H H 551 8.697 8.697 8.676 0.021 18053
3922 1 6 . 1 1 122 122 VAL N N 552 120.055 120.055 119.534 0.521 18053
3923 1 6 . 1 1 122 122 VAL HA H 552 4.364 4.364 4.061 0.303 18053
3924 1 6 . 1 1 122 122 VAL C C 552 175.998 175.998 175.374 0.624 18053
3925 1 6 . 1 1 122 122 VAL CA C 552 61.655 61.655 62.607 -0.952 18053
3926 1 6 . 1 1 122 122 VAL CB C 552 33.049 33.049 32.426 0.623 18053
3927 1 6 . 1 1 122 122 VAL H H 552 8.845 8.845 8.121 0.724 18053
3928 1 6 . 1 1 123 123 ALA N N 553 122.098 122.098 121.329 0.769 18053
3929 1 6 . 1 1 123 123 ALA HA H 553 4.890 4.890 4.716 0.174 18053
3930 1 6 . 1 1 123 123 ALA C C 553 175.261 175.261 175.302 -0.041 18053
3931 1 6 . 1 1 123 123 ALA CA C 553 52.757 52.757 51.526 1.231 18053
3932 1 6 . 1 1 123 123 ALA CB C 553 22.267 22.267 22.047 0.220 18053
3933 1 6 . 1 1 123 123 ALA H H 553 7.788 7.788 7.710 0.078 18053
3934 1 6 . 1 1 124 124 MET N N 554 118.217 118.217 119.646 -1.429 18053
3935 1 6 . 1 1 124 124 MET HA H 554 5.286 5.286 5.218 0.068 18053
3936 1 6 . 1 1 124 124 MET C C 554 174.428 174.428 174.259 0.169 18053
3937 1 6 . 1 1 124 124 MET CA C 554 55.104 55.104 55.743 -0.639 18053
3938 1 6 . 1 1 124 124 MET CB C 554 35.342 35.342 37.028 -1.685 18053
3939 1 6 . 1 1 124 124 MET H H 554 8.693 8.693 8.604 0.089 18053
3940 1 6 . 1 1 125 125 ARG N N 555 122.132 122.132 124.346 -2.214 18053
3941 1 6 . 1 1 125 125 ARG HA H 555 4.900 4.900 4.694 0.206 18053
3942 1 6 . 1 1 125 125 ARG CA C 555 56.388 56.388 55.902 0.486 18053
3943 1 6 . 1 1 125 125 ARG CB C 555 34.378 34.378 33.346 1.032 18053
3944 1 6 . 1 1 125 125 ARG H H 555 8.919 8.919 8.919 -0.000 18053
3945 1 6 . 1 1 126 126 THR HA H 556 4.685 4.685 4.375 0.310 18053
3946 1 6 . 1 1 126 126 THR C C 556 172.436 172.436 172.995 -0.559 18053
3947 1 6 . 1 1 126 126 THR CA C 556 61.382 61.382 62.982 -1.600 18053
3948 1 6 . 1 1 126 126 THR CB C 556 70.444 70.444 68.816 1.628 18053
3949 1 6 . 1 1 127 127 VAL N N 557 124.976 124.976 126.397 -1.421 18053
3950 1 6 . 1 1 127 127 VAL HA H 557 4.146 4.146 4.343 -0.197 18053
3951 1 6 . 1 1 127 127 VAL C C 557 173.937 173.937 172.935 1.002 18053
3952 1 6 . 1 1 127 127 VAL CA C 557 61.109 61.109 59.744 1.365 18053
3953 1 6 . 1 1 127 127 VAL CB C 557 33.759 33.759 33.347 0.412 18053
3954 1 6 . 1 1 127 127 VAL H H 557 8.127 8.127 8.366 -0.239 18053
3955 1 6 . 1 1 128 128 LYS N N 558 125.384 125.384 126.522 -1.138 18053
3956 1 6 . 1 1 128 128 LYS HA H 558 4.706 4.706 4.914 -0.208 18053
3957 1 6 . 1 1 128 128 LYS C C 558 175.534 175.534 175.116 0.418 18053
3958 1 6 . 1 1 128 128 LYS CA C 558 54.886 54.886 53.177 1.709 18053
3959 1 6 . 1 1 128 128 LYS CB C 558 34.673 34.673 35.196 -0.523 18053
3960 1 6 . 1 1 128 128 LYS H H 558 8.289 8.289 8.197 0.092 18053
3961 1 6 . 1 1 129 129 LYS N N 559 124.005 124.005 123.097 0.908 18053
3962 1 6 . 1 1 129 129 LYS HA H 559 4.310 4.310 4.333 -0.023 18053
3963 1 6 . 1 1 129 129 LYS C C 559 176.571 176.571 175.943 0.628 18053
3964 1 6 . 1 1 129 129 LYS CA C 559 56.742 56.742 56.704 0.038 18053
3965 1 6 . 1 1 129 129 LYS CB C 559 33.362 33.362 32.118 1.244 18053
3966 1 6 . 1 1 129 129 LYS H H 559 8.461 8.461 8.422 0.039 18053
3967 1 6 . 1 1 130 130 SER N N 560 117.195 117.195 121.005 -3.810 18053
3968 1 6 . 1 1 130 130 SER HA H 560 4.384 4.384 4.560 -0.176 18053
3969 1 6 . 1 1 130 130 SER C C 560 174.565 174.565 173.698 0.867 18053
3970 1 6 . 1 1 130 130 SER CA C 560 58.434 58.434 58.524 -0.090 18053
3971 1 6 . 1 1 130 130 SER CB C 560 63.812 63.812 64.049 -0.236 18053
3972 1 6 . 1 1 130 130 SER H H 560 8.465 8.465 8.614 -0.149 18053
3973 1 6 . 1 1 131 131 SER N N 561 118.149 118.149 118.577 -0.428 18053
3974 1 6 . 1 1 131 131 SER HA H 561 4.412 4.412 4.697 -0.285 18053
3975 1 6 . 1 1 131 131 SER C C 561 174.456 174.456 174.127 0.329 18053
3976 1 6 . 1 1 131 131 SER CA C 561 58.489 58.489 57.583 0.906 18053
3977 1 6 . 1 1 131 131 SER CB C 561 63.811 63.811 64.428 -0.617 18053
3978 1 6 . 1 1 131 131 SER H H 561 8.336 8.336 7.930 0.406 18053
3979 1 6 . 1 1 132 132 VAL N N 562 121.332 121.332 121.477 -0.145 18053
3980 1 6 . 1 1 132 132 VAL HA H 562 4.035 4.035 4.162 -0.127 18053
3981 1 6 . 1 1 132 132 VAL C C 562 176.066 176.066 175.957 0.109 18053
3982 1 6 . 1 1 132 132 VAL CA C 562 62.446 62.446 62.297 0.149 18053
3983 1 6 . 1 1 132 132 VAL CB C 562 32.394 32.394 31.863 0.531 18053
3984 1 6 . 1 1 132 132 VAL H H 562 7.982 7.982 8.572 -0.590 18053
3985 1 6 . 1 1 133 133 MET N N 563 124.022 124.022 118.633 5.389 18053
3986 1 6 . 1 1 133 133 MET HA H 563 4.385 4.385 4.476 -0.091 18053
3987 1 6 . 1 1 133 133 MET C C 563 176.039 176.039 175.676 0.363 18053
3988 1 6 . 1 1 133 133 MET CA C 563 55.350 55.350 56.121 -0.771 18053
3989 1 6 . 1 1 133 133 MET CB C 563 32.503 32.503 33.002 -0.499 18053
3990 1 6 . 1 1 133 133 MET H H 563 8.295 8.295 7.626 0.669 18053
3991 1 6 . 1 1 134 134 ARG N N 564 122.677 122.677 121.890 0.787 18053
3992 1 6 . 1 1 134 134 ARG HA H 564 4.262 4.262 4.490 -0.228 18053
3993 1 6 . 1 1 134 134 ARG C C 564 176.298 176.298 176.365 -0.067 18053
3994 1 6 . 1 1 134 134 ARG CA C 564 56.087 56.087 55.137 0.950 18053
3995 1 6 . 1 1 134 134 ARG CB C 564 30.702 30.702 30.651 0.051 18053
3996 1 6 . 1 1 134 134 ARG H H 564 8.295 8.295 8.273 0.022 18053
3997 1 6 . 1 1 135 135 GLU N N 565 121.945 121.945 120.276 1.669 18053
3998 1 6 . 1 1 135 135 GLU HA H 565 4.160 4.160 4.016 0.144 18053
3999 1 6 . 1 1 135 135 GLU C C 565 176.080 176.080 174.995 1.085 18053
4000 1 6 . 1 1 135 135 GLU CA C 565 56.906 56.906 56.788 0.118 18053
4001 1 6 . 1 1 135 135 GLU CB C 565 29.774 29.774 28.577 1.197 18053
4002 1 6 . 1 1 135 135 GLU H H 565 8.470 8.470 8.731 -0.261 18053
4003 1 6 . 1 1 136 136 ASN N N 566 118.761 118.761 118.572 0.189 18053
4004 1 6 . 1 1 136 136 ASN HA H 566 4.617 4.617 4.834 -0.217 18053
4005 1 6 . 1 1 136 136 ASN C C 566 175.315 175.315 174.963 0.352 18053
4006 1 6 . 1 1 136 136 ASN CA C 566 53.193 53.193 53.157 0.036 18053
4007 1 6 . 1 1 136 136 ASN CB C 566 38.836 38.836 39.499 -0.663 18053
4008 1 6 . 1 1 136 136 ASN H H 566 8.341 8.341 8.202 0.139 18053
4009 1 6 . 1 1 137 137 GLU N N 567 121.349 121.349 122.215 -0.866 18053
4010 1 6 . 1 1 137 137 GLU HA H 567 4.152 4.152 4.514 -0.362 18053
4011 1 6 . 1 1 137 137 GLU C C 567 176.243 176.243 175.926 0.317 18053
4012 1 6 . 1 1 137 137 GLU CA C 567 56.906 56.906 56.380 0.526 18053
4013 1 6 . 1 1 137 137 GLU CB C 567 29.992 29.992 30.363 -0.371 18053
4014 1 6 . 1 1 137 137 GLU H H 567 8.349 8.349 8.693 -0.344 18053
4015 1 6 . 1 1 138 138 ASN N N 568 118.761 118.761 118.895 -0.134 18053
4016 1 6 . 1 1 138 138 ASN HA H 568 4.712 4.712 4.978 -0.266 18053
4017 1 6 . 1 1 138 138 ASN C C 568 174.551 174.551 174.613 -0.062 18053
4018 1 6 . 1 1 138 138 ASN CA C 568 53.193 53.193 53.092 0.102 18053
4019 1 6 . 1 1 138 138 ASN CB C 568 39.327 39.327 39.364 -0.037 18053
4020 1 6 . 1 1 138 138 ASN H H 568 8.397 8.397 7.941 0.456 18053
4021 1 7 . 1 1 20 20 ALA N N 450 125.180 125.180 126.358 -1.178 18053
4022 1 7 . 1 1 20 20 ALA HA H 450 4.706 4.706 4.680 0.026 18053
4023 1 7 . 1 1 20 20 ALA C C 450 177.226 177.226 176.502 0.724 18053
4024 1 7 . 1 1 20 20 ALA CA C 450 52.757 52.757 52.013 0.744 18053
4025 1 7 . 1 1 20 20 ALA CB C 450 20.411 20.411 20.685 -0.274 18053
4026 1 7 . 1 1 20 20 ALA H H 450 8.484 8.484 8.252 0.232 18053
4027 1 7 . 1 1 21 21 SER N N 451 115.714 115.714 118.818 -3.104 18053
4028 1 7 . 1 1 21 21 SER HA H 451 4.513 4.513 4.523 -0.010 18053
4029 1 7 . 1 1 21 21 SER C C 451 174.742 174.742 175.508 -0.766 18053
4030 1 7 . 1 1 21 21 SER CA C 451 58.516 58.516 58.169 0.347 18053
4031 1 7 . 1 1 21 21 SER CB C 451 64.159 64.159 62.336 1.823 18053
4032 1 7 . 1 1 21 21 SER H H 451 8.487 8.487 8.213 0.274 18053
4033 1 7 . 1 1 22 22 GLY N N 452 111.509 111.509 114.981 -3.472 18053
4034 1 7 . 1 1 22 22 GLY C C 452 174.401 174.401 174.584 -0.183 18053
4035 1 7 . 1 1 22 22 GLY CA C 452 45.059 45.059 46.331 -1.272 18053
4036 1 7 . 1 1 22 22 GLY H H 452 8.198 8.198 8.379 -0.181 18053
4037 1 7 . 1 1 23 23 SER N N 453 116.191 116.191 114.059 2.132 18053
4038 1 7 . 1 1 23 23 SER HA H 453 4.364 4.364 4.484 -0.120 18053
4039 1 7 . 1 1 23 23 SER C C 453 173.432 173.432 173.363 0.069 18053
4040 1 7 . 1 1 23 23 SER CA C 453 59.744 59.744 58.754 0.990 18053
4041 1 7 . 1 1 23 23 SER CB C 453 64.335 64.335 64.659 -0.324 18053
4042 1 7 . 1 1 23 23 SER H H 453 8.494 8.494 8.150 0.344 18053
4043 1 7 . 1 1 24 24 VAL N N 454 121.656 121.656 122.717 -1.061 18053
4044 1 7 . 1 1 24 24 VAL HA H 454 5.035 5.035 4.475 0.560 18053
4045 1 7 . 1 1 24 24 VAL C C 454 174.606 174.606 174.625 -0.019 18053
4046 1 7 . 1 1 24 24 VAL CA C 454 61.055 61.055 61.120 -0.065 18053
4047 1 7 . 1 1 24 24 VAL CB C 454 32.503 32.503 33.469 -0.966 18053
4048 1 7 . 1 1 24 24 VAL H H 454 7.830 7.830 7.469 0.361 18053
4049 1 7 . 1 1 25 25 SER N N 455 119.323 119.323 114.617 4.706 18053
4050 1 7 . 1 1 25 25 SER HA H 455 4.672 4.672 4.943 -0.271 18053
4051 1 7 . 1 1 25 25 SER C C 455 174.426 174.426 173.000 1.426 18053
4052 1 7 . 1 1 25 25 SER CA C 455 55.268 55.268 56.634 -1.366 18053
4053 1 7 . 1 1 25 25 SER CB C 455 65.162 65.162 66.019 -0.857 18053
4054 1 7 . 1 1 25 25 SER H H 455 9.065 9.065 8.769 0.296 18053
4055 1 7 . 1 1 26 26 ILE N N 456 119.468 119.468 125.430 -5.962 18053
4056 1 7 . 1 1 26 26 ILE HA H 456 4.180 4.180 4.257 -0.077 18053
4057 1 7 . 1 1 26 26 ILE C C 456 175.506 175.506 175.451 0.055 18053
4058 1 7 . 1 1 26 26 ILE CA C 456 61.328 61.328 62.002 -0.674 18053
4059 1 7 . 1 1 26 26 ILE CB C 456 37.962 37.962 37.273 0.689 18053
4060 1 7 . 1 1 26 26 ILE H H 456 8.295 8.295 8.849 -0.554 18053
4061 1 7 . 1 1 27 27 GLU N N 457 129.726 129.726 129.774 -0.048 18053
4062 1 7 . 1 1 27 27 GLU HA H 457 4.228 4.228 4.332 -0.104 18053
4063 1 7 . 1 1 27 27 GLU C C 457 175.179 175.179 176.326 -1.147 18053
4064 1 7 . 1 1 27 27 GLU CA C 457 55.432 55.432 57.406 -1.974 18053
4065 1 7 . 1 1 27 27 GLU CB C 457 30.142 30.142 31.224 -1.082 18053
4066 1 7 . 1 1 27 27 GLU H H 457 8.393 8.393 8.696 -0.303 18053
4067 1 7 . 1 1 28 28 GLU N N 458 117.076 117.076 116.634 0.442 18053
4068 1 7 . 1 1 28 28 GLU HA H 458 4.168 4.168 4.706 -0.538 18053
4069 1 7 . 1 1 28 28 GLU C C 458 174.701 174.701 175.033 -0.332 18053
4070 1 7 . 1 1 28 28 GLU CA C 458 56.906 56.906 55.086 1.820 18053
4071 1 7 . 1 1 28 28 GLU CB C 458 31.848 31.848 34.183 -2.335 18053
4072 1 7 . 1 1 28 28 GLU H H 458 7.489 7.489 8.030 -0.541 18053
4073 1 7 . 1 1 29 29 ILE N N 459 122.183 122.183 119.586 2.597 18053
4074 1 7 . 1 1 29 29 ILE HA H 459 3.764 3.764 4.023 -0.259 18053
4075 1 7 . 1 1 29 29 ILE C C 459 174.169 174.169 174.363 -0.194 18053
4076 1 7 . 1 1 29 29 ILE CA C 459 59.526 59.526 59.514 0.012 18053
4077 1 7 . 1 1 29 29 ILE CB C 459 40.309 40.309 41.888 -1.579 18053
4078 1 7 . 1 1 29 29 ILE H H 459 8.126 8.126 8.247 -0.121 18053
4079 1 7 . 1 1 30 30 ASP N N 460 123.205 123.205 123.429 -0.224 18053
4080 1 7 . 1 1 30 30 ASP HA H 460 4.183 4.183 4.076 0.107 18053
4081 1 7 . 1 1 30 30 ASP C C 460 178.318 178.318 177.659 0.659 18053
4082 1 7 . 1 1 30 30 ASP CA C 460 53.930 53.930 53.743 0.187 18053
4083 1 7 . 1 1 30 30 ASP CB C 460 42.807 42.807 42.209 0.598 18053
4084 1 7 . 1 1 30 30 ASP H H 460 6.704 6.704 7.503 -0.799 18053
4085 1 7 . 1 1 31 31 LEU N N 461 128.551 128.551 119.945 8.606 18053
4086 1 7 . 1 1 31 31 LEU HA H 461 4.064 4.064 4.056 0.008 18053
4087 1 7 . 1 1 31 31 LEU C C 461 177.513 177.513 178.089 -0.576 18053
4088 1 7 . 1 1 31 31 LEU CA C 461 57.124 57.124 57.298 -0.174 18053
4089 1 7 . 1 1 31 31 LEU CB C 461 41.237 41.237 41.486 -0.249 18053
4090 1 7 . 1 1 31 31 LEU H H 461 9.012 9.012 8.502 0.510 18053
4091 1 7 . 1 1 32 32 GLU N N 462 115.101 115.101 118.212 -3.111 18053
4092 1 7 . 1 1 32 32 GLU HA H 462 4.283 4.283 4.499 -0.216 18053
4093 1 7 . 1 1 32 32 GLU C C 462 177.062 177.062 177.099 -0.037 18053
4094 1 7 . 1 1 32 32 GLU CA C 462 55.759 55.759 56.829 -1.070 18053
4095 1 7 . 1 1 32 32 GLU CB C 462 29.569 29.569 31.302 -1.733 18053
4096 1 7 . 1 1 32 32 GLU H H 462 7.588 7.588 8.069 -0.481 18053
4097 1 7 . 1 1 33 33 GLY N N 463 106.299 106.299 107.191 -0.892 18053
4098 1 7 . 1 1 33 33 GLY C C 463 174.824 174.824 174.570 0.254 18053
4099 1 7 . 1 1 33 33 GLY CA C 463 46.806 46.806 44.886 1.919 18053
4100 1 7 . 1 1 33 33 GLY H H 463 7.372 7.372 8.146 -0.774 18053
4101 1 7 . 1 1 34 34 LYS N N 464 118.744 118.744 118.583 0.161 18053
4102 1 7 . 1 1 34 34 LYS HA H 464 4.562 4.562 4.463 0.099 18053
4103 1 7 . 1 1 34 34 LYS C C 464 177.076 177.076 174.971 2.105 18053
4104 1 7 . 1 1 34 34 LYS CA C 464 59.963 59.963 56.893 3.070 18053
4105 1 7 . 1 1 34 34 LYS CB C 464 33.111 33.111 33.588 -0.477 18053
4106 1 7 . 1 1 34 34 LYS H H 464 9.547 9.547 8.153 1.394 18053
4107 1 7 . 1 1 35 35 PHE N N 465 109.125 109.125 113.076 -3.951 18053
4108 1 7 . 1 1 35 35 PHE HA H 465 5.514 5.514 5.218 0.296 18053
4109 1 7 . 1 1 35 35 PHE C C 465 174.183 174.183 172.931 1.252 18053
4110 1 7 . 1 1 35 35 PHE CA C 465 56.632 56.632 55.260 1.372 18053
4111 1 7 . 1 1 35 35 PHE CB C 465 40.599 40.599 41.080 -0.481 18053
4112 1 7 . 1 1 35 35 PHE H H 465 6.740 6.740 7.060 -0.320 18053
4113 1 7 . 1 1 36 36 VAL N N 466 119.579 119.579 119.991 -0.412 18053
4114 1 7 . 1 1 36 36 VAL HA H 466 3.709 3.709 4.268 -0.559 18053
4115 1 7 . 1 1 36 36 VAL C C 466 172.668 172.668 174.433 -1.765 18053
4116 1 7 . 1 1 36 36 VAL CA C 466 62.692 62.692 61.254 1.438 18053
4117 1 7 . 1 1 36 36 VAL CB C 466 36.215 36.215 34.400 1.815 18053
4118 1 7 . 1 1 36 36 VAL H H 466 7.628 7.628 8.732 -1.104 18053
4119 1 7 . 1 1 37 37 GLN N N 467 126.831 126.831 128.038 -1.207 18053
4120 1 7 . 1 1 37 37 GLN HA H 467 5.449 5.449 4.768 0.681 18053
4121 1 7 . 1 1 37 37 GLN C C 467 174.797 174.797 174.583 0.214 18053
4122 1 7 . 1 1 37 37 GLN CA C 467 54.121 54.121 55.083 -0.962 18053
4123 1 7 . 1 1 37 37 GLN CB C 467 34.623 34.623 29.332 5.291 18053
4124 1 7 . 1 1 37 37 GLN H H 467 8.392 8.392 8.566 -0.174 18053
4125 1 7 . 1 1 38 38 LEU N N 468 123.018 123.018 130.030 -7.012 18053
4126 1 7 . 1 1 38 38 LEU HA H 468 5.422 5.422 4.987 0.435 18053
4127 1 7 . 1 1 38 38 LEU C C 468 175.588 175.588 174.287 1.301 18053
4128 1 7 . 1 1 38 38 LEU CA C 468 52.702 52.702 54.123 -1.421 18053
4129 1 7 . 1 1 38 38 LEU CB C 468 45.046 45.046 45.429 -0.383 18053
4130 1 7 . 1 1 38 38 LEU H H 468 9.103 9.103 9.270 -0.167 18053
4131 1 7 . 1 1 39 39 LYS N N 469 118.983 118.983 126.190 -7.207 18053
4132 1 7 . 1 1 39 39 LYS HA H 469 4.852 4.852 4.845 0.007 18053
4133 1 7 . 1 1 39 39 LYS C C 469 173.309 173.309 174.538 -1.229 18053
4134 1 7 . 1 1 39 39 LYS CA C 469 54.994 54.994 54.482 0.512 18053
4135 1 7 . 1 1 39 39 LYS CB C 469 38.246 38.246 35.852 2.394 18053
4136 1 7 . 1 1 39 39 LYS H H 469 8.496 8.496 8.929 -0.433 18053
4137 1 7 . 1 1 40 40 ASN N N 470 121.758 121.758 122.828 -1.070 18053
4138 1 7 . 1 1 40 40 ASN HA H 470 4.788 4.788 4.722 0.066 18053
4139 1 7 . 1 1 40 40 ASN C C 470 174.496 174.496 174.428 0.068 18053
4140 1 7 . 1 1 40 40 ASN CA C 470 51.119 51.119 52.559 -1.440 18053
4141 1 7 . 1 1 40 40 ASN CB C 470 37.559 37.559 40.010 -2.451 18053
4142 1 7 . 1 1 40 40 ASN H H 470 8.283 8.283 8.618 -0.335 18053
4143 1 7 . 1 1 41 41 ASN N N 471 122.422 122.422 122.999 -0.577 18053
4144 1 7 . 1 1 41 41 ASN HA H 471 4.588 4.588 4.820 -0.232 18053
4145 1 7 . 1 1 41 41 ASN C C 471 174.810 174.810 174.508 0.302 18053
4146 1 7 . 1 1 41 41 ASN CA C 471 53.985 53.985 52.694 1.291 18053
4147 1 7 . 1 1 41 41 ASN CB C 471 39.600 39.600 40.279 -0.680 18053
4148 1 7 . 1 1 41 41 ASN H H 471 8.681 8.681 8.486 0.195 18053
4149 1 7 . 1 1 42 42 SER N N 472 116.446 116.446 116.704 -0.258 18053
4150 1 7 . 1 1 42 42 SER HA H 472 4.719 4.719 4.529 0.190 18053
4151 1 7 . 1 1 42 42 SER C C 472 172.804 172.804 174.795 -1.991 18053
4152 1 7 . 1 1 42 42 SER CA C 472 57.288 57.288 57.910 -0.622 18053
4153 1 7 . 1 1 42 42 SER CB C 472 66.241 66.241 64.963 1.278 18053
4154 1 7 . 1 1 42 42 SER H H 472 8.370 8.370 7.918 0.452 18053
4155 1 7 . 1 1 43 43 ASP N N 473 117.706 117.706 122.919 -5.213 18053
4156 1 7 . 1 1 43 43 ASP HA H 473 4.474 4.474 4.514 -0.040 18053
4157 1 7 . 1 1 43 43 ASP C C 473 175.343 175.343 176.294 -0.951 18053
4158 1 7 . 1 1 43 43 ASP CA C 473 53.521 53.521 55.938 -2.417 18053
4159 1 7 . 1 1 43 43 ASP CB C 473 40.322 40.322 40.862 -0.540 18053
4160 1 7 . 1 1 43 43 ASP H H 473 8.254 8.254 8.711 -0.457 18053
4161 1 7 . 1 1 44 44 LYS N N 474 120.209 120.209 118.366 1.843 18053
4162 1 7 . 1 1 44 44 LYS HA H 474 4.569 4.569 4.486 0.083 18053
4163 1 7 . 1 1 44 44 LYS C C 474 175.397 175.397 174.966 0.431 18053
4164 1 7 . 1 1 44 44 LYS CA C 474 54.012 54.012 54.234 -0.223 18053
4165 1 7 . 1 1 44 44 LYS CB C 474 35.383 35.383 34.358 1.025 18053
4166 1 7 . 1 1 44 44 LYS H H 474 8.305 8.305 7.404 0.901 18053
4167 1 7 . 1 1 45 45 ASP N N 475 124.993 124.993 118.275 6.718 18053
4168 1 7 . 1 1 45 45 ASP HA H 475 3.975 3.975 4.369 -0.394 18053
4169 1 7 . 1 1 45 45 ASP C C 475 174.810 174.810 175.776 -0.966 18053
4170 1 7 . 1 1 45 45 ASP CA C 475 54.995 54.995 54.231 0.764 18053
4171 1 7 . 1 1 45 45 ASP CB C 475 40.364 40.364 39.814 0.550 18053
4172 1 7 . 1 1 45 45 ASP H H 475 8.722 8.722 8.372 0.350 18053
4173 1 7 . 1 1 46 46 GLN N N 476 120.549 120.549 125.185 -4.636 18053
4174 1 7 . 1 1 46 46 GLN HA H 476 4.436 4.436 4.277 0.159 18053
4175 1 7 . 1 1 46 46 GLN C C 476 174.019 174.019 175.706 -1.687 18053
4176 1 7 . 1 1 46 46 GLN CA C 476 53.138 53.138 55.025 -1.887 18053
4177 1 7 . 1 1 46 46 GLN CB C 476 31.466 31.466 29.350 2.116 18053
4178 1 7 . 1 1 46 46 GLN H H 476 7.878 7.878 8.145 -0.267 18053
4179 1 7 . 1 1 47 47 SER N N 477 121.537 121.537 121.915 -0.378 18053
4180 1 7 . 1 1 47 47 SER HA H 477 4.229 4.229 4.207 0.022 18053
4181 1 7 . 1 1 47 47 SER C C 477 174.565 174.565 173.779 0.786 18053
4182 1 7 . 1 1 47 47 SER CA C 477 58.706 58.706 58.704 0.002 18053
4183 1 7 . 1 1 47 47 SER CB C 477 62.965 62.965 62.643 0.322 18053
4184 1 7 . 1 1 47 47 SER H H 477 8.748 8.748 8.699 0.049 18053
4185 1 7 . 1 1 48 48 LEU N N 478 127.751 127.751 126.337 1.414 18053
4186 1 7 . 1 1 48 48 LEU HA H 478 2.631 2.631 4.327 -1.696 18053
4187 1 7 . 1 1 48 48 LEU C C 478 176.789 176.789 177.090 -0.301 18053
4188 1 7 . 1 1 48 48 LEU CA C 478 52.102 52.102 54.691 -2.589 18053
4189 1 7 . 1 1 48 48 LEU CB C 478 42.343 42.343 44.017 -1.675 18053
4190 1 7 . 1 1 48 48 LEU H H 478 7.856 7.856 7.610 0.246 18053
4191 1 7 . 1 1 49 49 GLY N N 479 107.525 107.525 108.678 -1.153 18053
4192 1 7 . 1 1 49 49 GLY C C 479 176.653 176.653 175.487 1.166 18053
4193 1 7 . 1 1 49 49 GLY CA C 479 48.062 48.062 45.788 2.273 18053
4194 1 7 . 1 1 49 49 GLY H H 479 7.728 7.728 8.719 -0.991 18053
4195 1 7 . 1 1 50 50 ASN N N 480 117.059 117.059 119.898 -2.839 18053
4196 1 7 . 1 1 50 50 ASN HA H 480 4.255 4.255 4.591 -0.336 18053
4197 1 7 . 1 1 50 50 ASN C C 480 174.961 174.961 175.342 -0.381 18053
4198 1 7 . 1 1 50 50 ASN CA C 480 56.360 56.360 54.888 1.472 18053
4199 1 7 . 1 1 50 50 ASN CB C 480 37.416 37.416 39.032 -1.615 18053
4200 1 7 . 1 1 50 50 ASN H H 480 7.552 7.552 8.742 -1.190 18053
4201 1 7 . 1 1 51 51 TRP N N 481 122.166 122.166 117.725 4.441 18053
4202 1 7 . 1 1 51 51 TRP HA H 481 4.477 4.477 5.144 -0.667 18053
4203 1 7 . 1 1 51 51 TRP C C 481 175.575 175.575 175.551 0.024 18053
4204 1 7 . 1 1 51 51 TRP CA C 481 58.762 58.762 57.144 1.618 18053
4205 1 7 . 1 1 51 51 TRP CB C 481 28.041 28.041 31.238 -3.197 18053
4206 1 7 . 1 1 51 51 TRP H H 481 8.914 8.914 7.697 1.217 18053
4207 1 7 . 1 1 52 52 ARG N N 482 116.480 116.480 115.787 0.693 18053
4208 1 7 . 1 1 52 52 ARG HA H 482 5.968 5.968 5.281 0.687 18053
4209 1 7 . 1 1 52 52 ARG C C 482 175.807 175.807 174.656 1.151 18053
4210 1 7 . 1 1 52 52 ARG CA C 482 54.121 54.121 55.304 -1.183 18053
4211 1 7 . 1 1 52 52 ARG CB C 482 35.124 35.124 34.247 0.877 18053
4212 1 7 . 1 1 52 52 ARG H H 482 9.147 9.147 9.270 -0.123 18053
4213 1 7 . 1 1 53 53 ILE N N 483 119.579 119.579 124.189 -4.610 18053
4214 1 7 . 1 1 53 53 ILE HA H 483 4.985 4.985 5.112 -0.127 18053
4215 1 7 . 1 1 53 53 ILE C C 483 175.670 175.670 175.820 -0.150 18053
4216 1 7 . 1 1 53 53 ILE CA C 483 60.400 60.400 60.581 -0.181 18053
4217 1 7 . 1 1 53 53 ILE CB C 483 40.227 40.227 38.683 1.544 18053
4218 1 7 . 1 1 53 53 ILE H H 483 9.000 9.000 8.794 0.206 18053
4219 1 7 . 1 1 54 54 LYS N N 484 124.737 124.737 127.827 -3.090 18053
4220 1 7 . 1 1 54 54 LYS HA H 484 5.463 5.463 5.055 0.408 18053
4221 1 7 . 1 1 54 54 LYS C C 484 175.575 175.575 176.531 -0.956 18053
4222 1 7 . 1 1 54 54 LYS CA C 484 54.613 54.613 56.316 -1.702 18053
4223 1 7 . 1 1 54 54 LYS CB C 484 35.041 35.041 34.062 0.979 18053
4224 1 7 . 1 1 54 54 LYS H H 484 9.678 9.678 8.799 0.879 18053
4225 1 7 . 1 1 55 55 ARG N N 485 124.090 124.090 120.344 3.746 18053
4226 1 7 . 1 1 55 55 ARG HA H 485 5.525 5.525 5.128 0.397 18053
4227 1 7 . 1 1 55 55 ARG C C 485 174.155 174.155 174.167 -0.012 18053
4228 1 7 . 1 1 55 55 ARG CA C 485 53.903 53.903 55.746 -1.843 18053
4229 1 7 . 1 1 55 55 ARG H H 485 9.314 9.314 8.911 0.403 18053
4230 1 7 . 1 1 56 56 GLN N N 486 126.576 126.576 124.093 2.483 18053
4231 1 7 . 1 1 56 56 GLN HA H 486 4.842 4.842 5.058 -0.216 18053
4232 1 7 . 1 1 56 56 GLN C C 486 174.991 174.991 175.046 -0.055 18053
4233 1 7 . 1 1 56 56 GLN CA C 486 54.831 54.831 54.339 0.492 18053
4234 1 7 . 1 1 56 56 GLN CB C 486 31.465 31.465 29.538 1.927 18053
4235 1 7 . 1 1 56 56 GLN H H 486 8.831 8.831 8.417 0.414 18053
4236 1 7 . 1 1 57 57 VAL N N 487 126.712 126.712 124.707 2.005 18053
4237 1 7 . 1 1 57 57 VAL HA H 487 4.266 4.266 4.481 -0.215 18053
4238 1 7 . 1 1 57 57 VAL C C 487 175.916 175.916 177.880 -1.964 18053
4239 1 7 . 1 1 57 57 VAL CA C 487 61.820 61.820 61.293 0.527 18053
4240 1 7 . 1 1 57 57 VAL CB C 487 32.803 32.803 32.911 -0.108 18053
4241 1 7 . 1 1 57 57 VAL H H 487 8.786 8.786 8.720 0.066 18053
4242 1 7 . 1 1 58 58 LEU N N 488 127.274 127.274 122.722 4.552 18053
4243 1 7 . 1 1 58 58 LEU HA H 488 4.085 4.085 4.225 -0.140 18053
4244 1 7 . 1 1 58 58 LEU C C 488 177.158 177.158 177.537 -0.379 18053
4245 1 7 . 1 1 58 58 LEU CA C 488 56.906 56.906 57.682 -0.776 18053
4246 1 7 . 1 1 58 58 LEU CB C 488 41.374 41.374 41.688 -0.314 18053
4247 1 7 . 1 1 58 58 LEU H H 488 8.316 8.316 8.194 0.121 18053
4248 1 7 . 1 1 59 59 GLU N N 489 119.647 119.647 118.076 1.571 18053
4249 1 7 . 1 1 59 59 GLU HA H 489 4.112 4.112 4.308 -0.196 18053
4250 1 7 . 1 1 59 59 GLU C C 489 176.230 176.230 176.918 -0.688 18053
4251 1 7 . 1 1 59 59 GLU CA C 489 57.015 57.015 56.360 0.655 18053
4252 1 7 . 1 1 59 59 GLU CB C 489 28.149 28.149 29.475 -1.326 18053
4253 1 7 . 1 1 59 59 GLU H H 489 8.636 8.636 8.075 0.561 18053
4254 1 7 . 1 1 60 60 GLY N N 490 108.819 108.819 107.271 1.548 18053
4255 1 7 . 1 1 60 60 GLY C C 490 173.568 173.568 173.932 -0.364 18053
4256 1 7 . 1 1 60 60 GLY CA C 490 44.773 44.773 45.272 -0.499 18053
4257 1 7 . 1 1 60 60 GLY H H 490 8.160 8.160 7.841 0.319 18053
4258 1 7 . 1 1 61 61 GLU N N 491 121.009 121.009 123.671 -2.662 18053
4259 1 7 . 1 1 61 61 GLU HA H 491 4.323 4.323 4.202 0.121 18053
4260 1 7 . 1 1 61 61 GLU C C 491 175.725 175.725 175.622 0.103 18053
4261 1 7 . 1 1 61 61 GLU CA C 491 56.196 56.196 56.422 -0.226 18053
4262 1 7 . 1 1 61 61 GLU CB C 491 30.865 30.865 28.907 1.958 18053
4263 1 7 . 1 1 61 61 GLU H H 491 8.320 8.320 8.289 0.031 18053
4264 1 7 . 1 1 62 62 GLU N N 492 123.426 123.426 125.261 -1.835 18053
4265 1 7 . 1 1 62 62 GLU HA H 492 5.054 5.054 5.165 -0.111 18053
4266 1 7 . 1 1 62 62 GLU C C 492 175.930 175.930 176.366 -0.436 18053
4267 1 7 . 1 1 62 62 GLU CA C 492 55.650 55.650 54.786 0.864 18053
4268 1 7 . 1 1 62 62 GLU CB C 492 32.312 32.312 29.476 2.836 18053
4269 1 7 . 1 1 62 62 GLU H H 492 8.594 8.594 8.582 0.012 18053
4270 1 7 . 1 1 63 63 ILE N N 493 119.732 119.732 117.453 2.279 18053
4271 1 7 . 1 1 63 63 ILE HA H 493 4.788 4.788 4.686 0.102 18053
4272 1 7 . 1 1 63 63 ILE C C 493 174.647 174.647 174.051 0.596 18053
4273 1 7 . 1 1 63 63 ILE CA C 493 60.181 60.181 59.401 0.780 18053
4274 1 7 . 1 1 63 63 ILE CB C 493 41.183 41.183 40.918 0.265 18053
4275 1 7 . 1 1 63 63 ILE H H 493 8.523 8.523 8.024 0.498 18053
4276 1 7 . 1 1 64 64 ALA N N 494 122.166 122.166 122.846 -0.680 18053
4277 1 7 . 1 1 64 64 ALA HA H 494 5.521 5.521 4.940 0.581 18053
4278 1 7 . 1 1 64 64 ALA C C 494 174.606 174.606 175.774 -1.168 18053
4279 1 7 . 1 1 64 64 ALA CA C 494 51.528 51.528 51.626 -0.098 18053
4280 1 7 . 1 1 64 64 ALA CB C 494 22.239 22.239 21.523 0.716 18053
4281 1 7 . 1 1 64 64 ALA H H 494 8.741 8.741 8.170 0.571 18053
4282 1 7 . 1 1 65 65 TYR N N 495 126.729 126.729 126.890 -0.161 18053
4283 1 7 . 1 1 65 65 TYR HA H 495 3.094 3.094 3.499 -0.405 18053
4284 1 7 . 1 1 65 65 TYR C C 495 173.036 173.036 173.990 -0.954 18053
4285 1 7 . 1 1 65 65 TYR CA C 495 56.905 56.905 56.911 -0.006 18053
4286 1 7 . 1 1 65 65 TYR CB C 495 40.269 40.269 38.185 2.084 18053
4287 1 7 . 1 1 65 65 TYR H H 495 8.462 8.462 8.576 -0.114 18053
4288 1 7 . 1 1 66 66 LYS N N 496 128.108 128.108 126.678 1.430 18053
4289 1 7 . 1 1 66 66 LYS HA H 496 4.822 4.822 4.045 0.777 18053
4290 1 7 . 1 1 66 66 LYS C C 496 174.906 174.906 174.737 0.169 18053
4291 1 7 . 1 1 66 66 LYS CA C 496 53.739 53.739 55.486 -1.747 18053
4292 1 7 . 1 1 66 66 LYS CB C 496 34.782 34.782 33.231 1.551 18053
4293 1 7 . 1 1 66 66 LYS H H 496 7.010 7.010 7.279 -0.269 18053
4294 1 7 . 1 1 67 67 PHE N N 497 125.299 125.299 120.637 4.662 18053
4295 1 7 . 1 1 67 67 PHE HA H 497 3.932 3.932 4.261 -0.329 18053
4296 1 7 . 1 1 67 67 PHE C C 497 177.990 177.990 175.422 2.568 18053
4297 1 7 . 1 1 67 67 PHE CA C 497 59.007 59.007 56.801 2.206 18053
4298 1 7 . 1 1 67 67 PHE CB C 497 40.981 40.981 40.708 0.273 18053
4299 1 7 . 1 1 67 67 PHE H H 497 8.509 8.509 7.907 0.602 18053
4300 1 7 . 1 1 68 68 THR N N 498 116.191 116.191 111.459 4.732 18053
4301 1 7 . 1 1 68 68 THR HA H 498 4.417 4.417 4.745 -0.328 18053
4302 1 7 . 1 1 68 68 THR CA C 498 60.855 60.855 58.854 2.001 18053
4303 1 7 . 1 1 68 68 THR CB C 498 68.019 68.019 69.763 -1.744 18053
4304 1 7 . 1 1 68 68 THR H H 498 8.688 8.688 8.254 0.434 18053
4305 1 7 . 1 1 69 69 PRO HA H 499 3.948 3.948 4.453 -0.505 18053
4306 1 7 . 1 1 69 69 PRO C C 499 177.444 177.444 177.096 0.348 18053
4307 1 7 . 1 1 69 69 PRO CA C 499 66.077 66.077 64.927 1.150 18053
4308 1 7 . 1 1 69 69 PRO CB C 499 32.776 32.776 31.931 0.845 18053
4309 1 7 . 1 1 70 70 LYS N N 500 113.552 113.552 114.961 -1.409 18053
4310 1 7 . 1 1 70 70 LYS HA H 500 4.385 4.385 4.127 0.258 18053
4311 1 7 . 1 1 70 70 LYS C C 500 176.325 176.325 176.692 -0.367 18053
4312 1 7 . 1 1 70 70 LYS CA C 500 54.995 54.995 56.987 -1.992 18053
4313 1 7 . 1 1 70 70 LYS CB C 500 31.793 31.793 31.715 0.078 18053
4314 1 7 . 1 1 70 70 LYS H H 500 8.016 8.016 7.947 0.069 18053
4315 1 7 . 1 1 71 71 TYR N N 501 121.860 121.860 121.671 0.189 18053
4316 1 7 . 1 1 71 71 TYR HA H 501 3.730 3.730 4.349 -0.619 18053
4317 1 7 . 1 1 71 71 TYR C C 501 174.838 174.838 174.018 0.820 18053
4318 1 7 . 1 1 71 71 TYR CA C 501 62.310 62.310 59.465 2.845 18053
4319 1 7 . 1 1 71 71 TYR CB C 501 38.781 38.781 39.122 -0.341 18053
4320 1 7 . 1 1 71 71 TYR H H 501 7.460 7.460 7.726 -0.266 18053
4321 1 7 . 1 1 72 72 ILE N N 502 129.487 129.487 128.195 1.292 18053
4322 1 7 . 1 1 72 72 ILE HA H 502 3.928 3.928 4.411 -0.483 18053
4323 1 7 . 1 1 72 72 ILE C C 502 172.968 172.968 173.653 -0.685 18053
4324 1 7 . 1 1 72 72 ILE CA C 502 59.308 59.308 59.665 -0.357 18053
4325 1 7 . 1 1 72 72 ILE CB C 502 40.910 40.910 40.855 0.055 18053
4326 1 7 . 1 1 72 72 ILE H H 502 7.168 7.168 7.896 -0.728 18053
4327 1 7 . 1 1 73 73 LEU N N 503 128.278 128.278 128.690 -0.412 18053
4328 1 7 . 1 1 73 73 LEU HA H 503 4.493 4.493 4.576 -0.083 18053
4329 1 7 . 1 1 73 73 LEU C C 503 175.834 175.834 175.411 0.423 18053
4330 1 7 . 1 1 73 73 LEU CA C 503 51.965 51.965 53.208 -1.243 18053
4331 1 7 . 1 1 73 73 LEU CB C 503 42.548 42.548 44.026 -1.478 18053
4332 1 7 . 1 1 73 73 LEU H H 503 8.483 8.483 8.267 0.216 18053
4333 1 7 . 1 1 74 74 ARG N N 504 129.589 129.589 125.129 4.460 18053
4334 1 7 . 1 1 74 74 ARG HA H 504 3.743 3.743 4.153 -0.410 18053
4335 1 7 . 1 1 74 74 ARG C C 504 175.233 175.233 175.684 -0.451 18053
4336 1 7 . 1 1 74 74 ARG CA C 504 56.851 56.851 55.811 1.040 18053
4337 1 7 . 1 1 74 74 ARG CB C 504 30.292 30.292 30.620 -0.328 18053
4338 1 7 . 1 1 74 74 ARG H H 504 8.673 8.673 8.370 0.303 18053
4339 1 7 . 1 1 75 75 ALA N N 505 123.205 123.205 124.939 -1.734 18053
4340 1 7 . 1 1 75 75 ALA HA H 505 3.522 3.522 4.284 -0.762 18053
4341 1 7 . 1 1 75 75 ALA C C 505 178.441 178.441 178.136 0.305 18053
4342 1 7 . 1 1 75 75 ALA CA C 505 53.794 53.794 53.286 0.508 18053
4343 1 7 . 1 1 75 75 ALA CB C 505 18.910 18.910 18.181 0.729 18053
4344 1 7 . 1 1 75 75 ALA H H 505 8.564 8.564 8.513 0.051 18053
4345 1 7 . 1 1 76 76 GLY N N 506 112.241 112.241 111.792 0.449 18053
4346 1 7 . 1 1 76 76 GLY C C 506 174.278 174.278 175.001 -0.723 18053
4347 1 7 . 1 1 76 76 GLY CA C 506 46.725 46.725 45.289 1.436 18053
4348 1 7 . 1 1 76 76 GLY H H 506 7.381 7.381 8.810 -1.429 18053
4349 1 7 . 1 1 77 77 GLN N N 507 117.382 117.382 120.575 -3.193 18053
4350 1 7 . 1 1 77 77 GLN HA H 507 4.364 4.364 4.544 -0.180 18053
4351 1 7 . 1 1 77 77 GLN C C 507 173.937 173.937 175.006 -1.069 18053
4352 1 7 . 1 1 77 77 GLN CA C 507 54.558 54.558 55.057 -0.499 18053
4353 1 7 . 1 1 77 77 GLN CB C 507 30.073 30.073 29.822 0.251 18053
4354 1 7 . 1 1 77 77 GLN H H 507 7.996 7.996 7.617 0.379 18053
4355 1 7 . 1 1 78 78 MET N N 508 116.957 116.957 113.079 3.878 18053
4356 1 7 . 1 1 78 78 MET HA H 508 5.388 5.388 5.088 0.300 18053
4357 1 7 . 1 1 78 78 MET C C 508 175.807 175.807 174.089 1.718 18053
4358 1 7 . 1 1 78 78 MET CA C 508 54.067 54.067 54.719 -0.652 18053
4359 1 7 . 1 1 78 78 MET CB C 508 37.198 37.198 36.475 0.723 18053
4360 1 7 . 1 1 78 78 MET H H 508 8.092 8.092 8.088 0.004 18053
4361 1 7 . 1 1 79 79 VAL N N 509 119.340 119.340 121.992 -2.652 18053
4362 1 7 . 1 1 79 79 VAL HA H 509 4.956 4.956 4.784 0.172 18053
4363 1 7 . 1 1 79 79 VAL C C 509 172.217 172.217 174.445 -2.228 18053
4364 1 7 . 1 1 79 79 VAL CA C 509 59.471 59.471 59.986 -0.515 18053
4365 1 7 . 1 1 79 79 VAL CB C 509 33.676 33.676 35.250 -1.574 18053
4366 1 7 . 1 1 79 79 VAL H H 509 8.534 8.534 8.833 -0.299 18053
4367 1 7 . 1 1 80 80 THR N N 510 124.533 124.533 126.503 -1.970 18053
4368 1 7 . 1 1 80 80 THR HA H 510 4.586 4.586 4.835 -0.249 18053
4369 1 7 . 1 1 80 80 THR C C 510 172.215 172.215 174.120 -1.905 18053
4370 1 7 . 1 1 80 80 THR CA C 510 62.119 62.119 61.877 0.242 18053
4371 1 7 . 1 1 80 80 THR CB C 510 69.407 69.407 69.157 0.250 18053
4372 1 7 . 1 1 80 80 THR H H 510 8.301 8.301 8.723 -0.422 18053
4373 1 7 . 1 1 81 81 VAL N N 511 127.002 127.002 128.376 -1.374 18053
4374 1 7 . 1 1 81 81 VAL HA H 511 4.596 4.596 4.555 0.041 18053
4375 1 7 . 1 1 81 81 VAL C C 511 176.667 176.667 175.710 0.957 18053
4376 1 7 . 1 1 81 81 VAL CA C 511 61.382 61.382 63.075 -1.693 18053
4377 1 7 . 1 1 81 81 VAL CB C 511 30.945 30.945 31.067 -0.122 18053
4378 1 7 . 1 1 81 81 VAL H H 511 8.796 8.796 8.855 -0.059 18053
4379 1 7 . 1 1 82 82 TRP N N 512 131.479 131.479 129.584 1.895 18053
4380 1 7 . 1 1 82 82 TRP HA H 512 5.338 5.338 5.489 -0.151 18053
4381 1 7 . 1 1 82 82 TRP C C 512 176.885 176.885 175.725 1.160 18053
4382 1 7 . 1 1 82 82 TRP CA C 512 56.442 56.442 56.889 -0.447 18053
4383 1 7 . 1 1 82 82 TRP CB C 512 30.701 30.701 31.193 -0.492 18053
4384 1 7 . 1 1 82 82 TRP H H 512 9.924 9.924 9.377 0.547 18053
4385 1 7 . 1 1 83 83 ALA N N 513 123.954 123.954 120.437 3.517 18053
4386 1 7 . 1 1 83 83 ALA HA H 513 4.308 4.308 4.834 -0.526 18053
4387 1 7 . 1 1 83 83 ALA C C 513 178.140 178.140 176.939 1.201 18053
4388 1 7 . 1 1 83 83 ALA CA C 513 52.211 52.211 50.237 1.974 18053
4389 1 7 . 1 1 83 83 ALA CB C 513 18.745 18.745 21.509 -2.764 18053
4390 1 7 . 1 1 83 83 ALA H H 513 9.048 9.048 8.661 0.387 18053
4391 1 7 . 1 1 84 84 ALA N N 514 125.146 125.146 122.559 2.587 18053
4392 1 7 . 1 1 84 84 ALA HA H 514 3.951 3.951 4.064 -0.113 18053
4393 1 7 . 1 1 84 84 ALA C C 514 179.519 179.519 178.704 0.815 18053
4394 1 7 . 1 1 84 84 ALA CA C 514 54.804 54.804 54.629 0.175 18053
4395 1 7 . 1 1 84 84 ALA CB C 514 18.582 18.582 19.061 -0.479 18053
4396 1 7 . 1 1 84 84 ALA H H 514 8.341 8.341 8.161 0.180 18053
4397 1 7 . 1 1 85 85 GLY N N 515 103.388 103.388 105.224 -1.836 18053
4398 1 7 . 1 1 85 85 GLY C C 515 174.674 174.674 175.302 -0.628 18053
4399 1 7 . 1 1 85 85 GLY CA C 515 45.878 45.878 45.801 0.077 18053
4400 1 7 . 1 1 85 85 GLY H H 515 7.996 7.996 7.682 0.314 18053
4401 1 7 . 1 1 86 86 ALA N N 516 120.140 120.140 122.354 -2.214 18053
4402 1 7 . 1 1 86 86 ALA HA H 516 4.344 4.344 4.288 0.056 18053
4403 1 7 . 1 1 86 86 ALA C C 516 177.690 177.690 178.261 -0.571 18053
4404 1 7 . 1 1 86 86 ALA CA C 516 53.139 53.139 52.610 0.529 18053
4405 1 7 . 1 1 86 86 ALA CB C 516 20.547 20.547 19.026 1.521 18053
4406 1 7 . 1 1 86 86 ALA H H 516 7.474 7.474 7.926 -0.452 18053
4407 1 7 . 1 1 87 87 GLY N N 517 105.720 105.720 107.601 -1.881 18053
4408 1 7 . 1 1 87 87 GLY C C 517 173.650 173.650 175.031 -1.381 18053
4409 1 7 . 1 1 87 87 GLY CA C 517 46.014 46.014 45.408 0.605 18053
4410 1 7 . 1 1 87 87 GLY H H 517 7.779 7.779 7.639 0.140 18053
4411 1 7 . 1 1 88 88 VAL N N 518 121.537 121.537 119.426 2.111 18053
4412 1 7 . 1 1 88 88 VAL HA H 518 3.585 3.585 3.986 -0.401 18053
4413 1 7 . 1 1 88 88 VAL C C 518 174.851 174.851 175.258 -0.407 18053
4414 1 7 . 1 1 88 88 VAL CA C 518 61.274 61.274 61.271 0.003 18053
4415 1 7 . 1 1 88 88 VAL CB C 518 33.376 33.376 32.589 0.787 18053
4416 1 7 . 1 1 88 88 VAL H H 518 7.499 7.499 7.697 -0.198 18053
4417 1 7 . 1 1 89 89 ALA N N 519 128.295 128.295 128.430 -0.135 18053
4418 1 7 . 1 1 89 89 ALA HA H 519 4.192 4.192 4.270 -0.078 18053
4419 1 7 . 1 1 89 89 ALA C C 519 176.680 176.680 176.598 0.082 18053
4420 1 7 . 1 1 89 89 ALA CA C 519 51.283 51.283 51.783 -0.500 18053
4421 1 7 . 1 1 89 89 ALA CB C 519 19.292 19.292 18.985 0.307 18053
4422 1 7 . 1 1 89 89 ALA H H 519 7.960 7.960 8.207 -0.247 18053
4423 1 7 . 1 1 90 90 HIS N N 520 122.643 122.643 124.496 -1.853 18053
4424 1 7 . 1 1 90 90 HIS HA H 520 4.033 4.033 4.362 -0.329 18053
4425 1 7 . 1 1 90 90 HIS C C 520 175.793 175.793 174.385 1.408 18053
4426 1 7 . 1 1 90 90 HIS CA C 520 58.653 58.653 56.060 2.593 18053
4427 1 7 . 1 1 90 90 HIS CB C 520 32.285 32.285 29.901 2.384 18053
4428 1 7 . 1 1 90 90 HIS H H 520 8.394 8.394 8.887 -0.493 18053
4429 1 7 . 1 1 91 91 SER N N 521 121.247 121.247 123.652 -2.405 18053
4430 1 7 . 1 1 91 91 SER HA H 521 4.629 4.629 4.704 -0.075 18053
4431 1 7 . 1 1 91 91 SER CA C 521 55.843 55.843 55.816 0.027 18053
4432 1 7 . 1 1 91 91 SER CB C 521 62.367 62.367 63.459 -1.092 18053
4433 1 7 . 1 1 91 91 SER H H 521 8.569 8.569 8.205 0.364 18053
4434 1 7 . 1 1 92 92 PRO HA H 522 4.002 4.002 4.828 -0.826 18053
4435 1 7 . 1 1 92 92 PRO CA C 522 62.244 62.244 62.305 -0.061 18053
4436 1 7 . 1 1 92 92 PRO CB C 522 30.931 30.931 31.449 -0.518 18053
4437 1 7 . 1 1 93 93 PRO HA H 523 4.672 4.672 4.730 -0.058 18053
4438 1 7 . 1 1 93 93 PRO C C 523 177.786 177.786 178.228 -0.442 18053
4439 1 7 . 1 1 93 93 PRO CA C 523 64.003 64.003 64.106 -0.103 18053
4440 1 7 . 1 1 93 93 PRO CB C 523 34.905 34.905 32.094 2.811 18053
4441 1 7 . 1 1 94 94 SER N N 524 117.212 117.212 116.295 0.917 18053
4442 1 7 . 1 1 94 94 SER HA H 524 4.678 4.678 4.383 0.295 18053
4443 1 7 . 1 1 94 94 SER C C 524 174.851 174.851 174.473 0.378 18053
4444 1 7 . 1 1 94 94 SER CA C 524 61.874 61.874 61.569 0.305 18053
4445 1 7 . 1 1 94 94 SER CB C 524 64.057 64.057 63.569 0.488 18053
4446 1 7 . 1 1 94 94 SER H H 524 8.463 8.463 8.271 0.192 18053
4447 1 7 . 1 1 95 95 THR N N 525 121.588 121.588 118.038 3.550 18053
4448 1 7 . 1 1 95 95 THR HA H 525 4.859 4.859 5.103 -0.244 18053
4449 1 7 . 1 1 95 95 THR C C 525 172.094 172.094 173.006 -0.912 18053
4450 1 7 . 1 1 95 95 THR CA C 525 62.309 62.309 61.738 0.571 18053
4451 1 7 . 1 1 95 95 THR CB C 525 70.281 70.281 70.412 -0.131 18053
4452 1 7 . 1 1 95 95 THR H H 525 7.631 7.631 7.855 -0.224 18053
4453 1 7 . 1 1 96 96 LEU N N 526 127.274 127.274 128.999 -1.725 18053
4454 1 7 . 1 1 96 96 LEU HA H 526 5.131 5.131 4.966 0.165 18053
4455 1 7 . 1 1 96 96 LEU C C 526 175.916 175.916 175.492 0.424 18053
4456 1 7 . 1 1 96 96 LEU CA C 526 52.075 52.075 54.201 -2.126 18053
4457 1 7 . 1 1 96 96 LEU CB C 526 43.790 43.790 43.951 -0.161 18053
4458 1 7 . 1 1 96 96 LEU H H 526 8.977 8.977 8.406 0.571 18053
4459 1 7 . 1 1 97 97 VAL N N 527 124.056 124.056 121.508 2.548 18053
4460 1 7 . 1 1 97 97 VAL HA H 527 4.869 4.869 4.505 0.364 18053
4461 1 7 . 1 1 97 97 VAL C C 527 176.230 176.230 175.390 0.840 18053
4462 1 7 . 1 1 97 97 VAL CA C 527 61.519 61.519 61.546 -0.027 18053
4463 1 7 . 1 1 97 97 VAL CB C 527 33.704 33.704 32.859 0.845 18053
4464 1 7 . 1 1 97 97 VAL H H 527 10.724 10.724 8.083 2.641 18053
4465 1 7 . 1 1 98 98 TRP N N 528 132.586 132.586 131.394 1.192 18053
4466 1 7 . 1 1 98 98 TRP HA H 528 4.965 4.965 4.337 0.628 18053
4467 1 7 . 1 1 98 98 TRP C C 528 173.391 173.391 174.796 -1.405 18053
4468 1 7 . 1 1 98 98 TRP CA C 528 53.303 53.303 55.296 -1.993 18053
4469 1 7 . 1 1 98 98 TRP CB C 528 28.245 28.245 28.354 -0.108 18053
4470 1 7 . 1 1 98 98 TRP H H 528 9.400 9.400 8.866 0.534 18053
4471 1 7 . 1 1 99 99 LYS N N 529 126.644 126.644 128.989 -2.345 18053
4472 1 7 . 1 1 99 99 LYS HA H 529 3.839 3.839 4.124 -0.285 18053
4473 1 7 . 1 1 99 99 LYS C C 529 177.581 177.581 177.314 0.267 18053
4474 1 7 . 1 1 99 99 LYS CA C 529 58.543 58.543 57.557 0.986 18053
4475 1 7 . 1 1 99 99 LYS CB C 529 32.176 32.176 32.884 -0.708 18053
4476 1 7 . 1 1 99 99 LYS H H 529 8.153 8.153 8.034 0.119 18053
4477 1 7 . 1 1 100 100 GLY N N 530 110.385 110.385 112.209 -1.824 18053
4478 1 7 . 1 1 100 100 GLY C C 530 172.367 172.367 173.754 -1.387 18053
4479 1 7 . 1 1 100 100 GLY CA C 530 45.278 45.278 44.949 0.329 18053
4480 1 7 . 1 1 100 100 GLY H H 530 8.363 8.363 8.517 -0.154 18053
4481 1 7 . 1 1 101 101 GLN N N 531 121.162 121.162 121.396 -0.234 18053
4482 1 7 . 1 1 101 101 GLN HA H 531 3.972 3.972 4.222 -0.250 18053
4483 1 7 . 1 1 101 101 GLN CA C 531 52.620 52.620 53.477 -0.857 18053
4484 1 7 . 1 1 101 101 GLN CB C 531 27.595 27.595 28.633 -1.038 18053
4485 1 7 . 1 1 101 101 GLN H H 531 6.815 6.815 7.254 -0.439 18053
4486 1 7 . 1 1 102 102 SER N N 532 122.728 122.728 122.368 0.360 18053
4487 1 7 . 1 1 102 102 SER HA H 532 3.866 3.866 4.372 -0.506 18053
4488 1 7 . 1 1 102 102 SER C C 532 174.537 174.537 176.101 -1.564 18053
4489 1 7 . 1 1 102 102 SER CA C 532 61.983 61.983 61.548 0.435 18053
4490 1 7 . 1 1 102 102 SER CB C 532 62.802 62.802 63.174 -0.372 18053
4491 1 7 . 1 1 102 102 SER H H 532 8.662 8.662 8.631 0.031 18053
4492 1 7 . 1 1 103 103 SER N N 533 110.811 110.811 118.935 -8.124 18053
4493 1 7 . 1 1 103 103 SER HA H 533 4.240 4.240 4.339 -0.099 18053
4494 1 7 . 1 1 103 103 SER C C 533 174.087 174.087 174.564 -0.477 18053
4495 1 7 . 1 1 103 103 SER CA C 533 56.633 56.633 58.913 -2.280 18053
4496 1 7 . 1 1 103 103 SER CB C 533 64.658 64.658 63.517 1.141 18053
4497 1 7 . 1 1 103 103 SER H H 533 7.134 7.134 8.041 -0.907 18053
4498 1 7 . 1 1 104 104 TRP N N 534 126.133 126.133 121.372 4.761 18053
4499 1 7 . 1 1 104 104 TRP HA H 534 4.098 4.098 4.218 -0.120 18053
4500 1 7 . 1 1 104 104 TRP C C 534 176.066 176.066 175.705 0.361 18053
4501 1 7 . 1 1 104 104 TRP CA C 534 60.127 60.127 57.172 2.955 18053
4502 1 7 . 1 1 104 104 TRP CB C 534 28.764 28.764 28.910 -0.146 18053
4503 1 7 . 1 1 104 104 TRP H H 534 9.764 9.764 7.901 1.863 18053
4504 1 7 . 1 1 105 105 GLY N N 535 105.907 105.907 104.856 1.051 18053
4505 1 7 . 1 1 105 105 GLY C C 535 172.217 172.217 173.993 -1.776 18053
4506 1 7 . 1 1 105 105 GLY CA C 535 44.240 44.240 44.956 -0.716 18053
4507 1 7 . 1 1 105 105 GLY H H 535 8.095 8.095 8.395 -0.300 18053
4508 1 7 . 1 1 106 106 THR N N 536 111.253 111.253 114.641 -3.388 18053
4509 1 7 . 1 1 106 106 THR HA H 536 3.859 3.859 4.162 -0.303 18053
4510 1 7 . 1 1 106 106 THR C C 536 172.872 172.872 173.965 -1.093 18053
4511 1 7 . 1 1 106 106 THR CA C 536 59.635 59.635 62.815 -3.180 18053
4512 1 7 . 1 1 106 106 THR CB C 536 70.526 70.526 70.162 0.364 18053
4513 1 7 . 1 1 106 106 THR H H 536 7.913 7.913 7.596 0.317 18053
4514 1 7 . 1 1 107 107 GLY N N 537 107.712 107.712 112.965 -5.253 18053
4515 1 7 . 1 1 107 107 GLY C C 537 172.709 172.709 173.055 -0.346 18053
4516 1 7 . 1 1 107 107 GLY CA C 537 45.166 45.166 45.637 -0.471 18053
4517 1 7 . 1 1 107 107 GLY H H 537 7.533 7.533 7.944 -0.411 18053
4518 1 7 . 1 1 108 108 GLU N N 538 118.864 118.864 119.333 -0.469 18053
4519 1 7 . 1 1 108 108 GLU HA H 538 4.136 4.136 4.270 -0.134 18053
4520 1 7 . 1 1 108 108 GLU C C 538 176.353 176.353 175.803 0.550 18053
4521 1 7 . 1 1 108 108 GLU CA C 538 58.352 58.352 57.805 0.547 18053
4522 1 7 . 1 1 108 108 GLU CB C 538 30.156 30.156 30.625 -0.469 18053
4523 1 7 . 1 1 108 108 GLU H H 538 8.558 8.558 8.636 -0.078 18053
4524 1 7 . 1 1 109 109 SER N N 539 110.419 110.419 112.825 -2.406 18053
4525 1 7 . 1 1 109 109 SER HA H 539 4.963 4.963 4.583 0.380 18053
4526 1 7 . 1 1 109 109 SER C C 539 173.787 173.787 172.751 1.036 18053
4527 1 7 . 1 1 109 109 SER CA C 539 57.125 57.125 57.889 -0.764 18053
4528 1 7 . 1 1 109 109 SER CB C 539 64.439 64.439 64.868 -0.429 18053
4529 1 7 . 1 1 109 109 SER H H 539 7.620 7.620 7.937 -0.317 18053
4530 1 7 . 1 1 110 110 PHE N N 540 118.778 118.778 119.852 -1.074 18053
4531 1 7 . 1 1 110 110 PHE HA H 540 5.081 5.081 5.345 -0.264 18053
4532 1 7 . 1 1 110 110 PHE C C 540 176.052 176.052 173.418 2.634 18053
4533 1 7 . 1 1 110 110 PHE CA C 540 56.789 56.789 55.814 0.975 18053
4534 1 7 . 1 1 110 110 PHE CB C 540 40.760 40.760 42.116 -1.356 18053
4535 1 7 . 1 1 110 110 PHE H H 540 8.318 8.318 8.075 0.243 18053
4536 1 7 . 1 1 112 112 THR HA H 542 5.468 5.468 4.858 0.610 18053
4537 1 7 . 1 1 112 112 THR C C 542 172.381 172.381 174.082 -1.701 18053
4538 1 7 . 1 1 112 112 THR CA C 542 61.818 61.818 63.163 -1.345 18053
4539 1 7 . 1 1 112 112 THR CB C 542 70.990 70.990 68.914 2.076 18053
4540 1 7 . 1 1 113 113 VAL N N 543 124.771 124.771 128.663 -3.892 18053
4541 1 7 . 1 1 113 113 VAL HA H 543 4.864 4.864 4.320 0.544 18053
4542 1 7 . 1 1 113 113 VAL C C 543 173.132 173.132 174.133 -1.001 18053
4543 1 7 . 1 1 113 113 VAL CA C 543 60.099 60.099 61.447 -1.348 18053
4544 1 7 . 1 1 113 113 VAL CB C 543 36.433 36.433 33.604 2.829 18053
4545 1 7 . 1 1 113 113 VAL H H 543 9.380 9.380 8.570 0.810 18053
4546 1 7 . 1 1 114 114 LEU N N 544 128.789 128.789 129.583 -0.794 18053
4547 1 7 . 1 1 114 114 LEU HA H 544 5.320 5.320 5.068 0.252 18053
4548 1 7 . 1 1 114 114 LEU C C 544 174.237 174.237 175.392 -1.155 18053
4549 1 7 . 1 1 114 114 LEU CA C 544 53.193 53.193 53.958 -0.765 18053
4550 1 7 . 1 1 114 114 LEU CB C 544 45.879 45.879 43.611 2.268 18053
4551 1 7 . 1 1 114 114 LEU H H 544 8.948 8.948 8.302 0.646 18053
4552 1 7 . 1 1 115 115 VAL N N 545 127.002 127.002 127.493 -0.491 18053
4553 1 7 . 1 1 115 115 VAL HA H 545 4.854 4.854 4.545 0.309 18053
4554 1 7 . 1 1 115 115 VAL C C 545 175.206 175.206 174.626 0.580 18053
4555 1 7 . 1 1 115 115 VAL CA C 545 59.334 59.334 60.615 -1.281 18053
4556 1 7 . 1 1 115 115 VAL CB C 545 34.495 34.495 34.488 0.007 18053
4557 1 7 . 1 1 115 115 VAL H H 545 9.564 9.564 8.954 0.610 18053
4558 1 7 . 1 1 116 116 ASN N N 546 121.179 121.179 123.567 -2.388 18053
4559 1 7 . 1 1 116 116 ASN HA H 546 2.897 2.897 3.900 -1.003 18053
4560 1 7 . 1 1 116 116 ASN C C 546 176.885 176.885 175.862 1.023 18053
4561 1 7 . 1 1 116 116 ASN CA C 546 50.409 50.409 51.030 -0.621 18053
4562 1 7 . 1 1 116 116 ASN CB C 546 36.639 36.639 39.602 -2.963 18053
4563 1 7 . 1 1 116 116 ASN H H 546 8.016 8.016 7.797 0.219 18053
4564 1 7 . 1 1 117 117 ALA N N 547 119.834 119.834 122.112 -2.278 18053
4565 1 7 . 1 1 117 117 ALA HA H 547 3.866 3.866 4.077 -0.211 18053
4566 1 7 . 1 1 117 117 ALA C C 547 177.772 177.772 178.022 -0.250 18053
4567 1 7 . 1 1 117 117 ALA CA C 547 54.504 54.504 54.447 0.057 18053
4568 1 7 . 1 1 117 117 ALA CB C 547 18.200 18.200 18.420 -0.220 18053
4569 1 7 . 1 1 117 117 ALA H H 547 6.444 6.444 7.893 -1.449 18053
4570 1 7 . 1 1 118 118 ASP N N 548 115.646 115.646 117.516 -1.870 18053
4571 1 7 . 1 1 118 118 ASP HA H 548 4.644 4.644 4.417 0.227 18053
4572 1 7 . 1 1 118 118 ASP C C 548 176.052 176.052 177.317 -1.265 18053
4573 1 7 . 1 1 118 118 ASP CA C 548 54.067 54.067 54.958 -0.890 18053
4574 1 7 . 1 1 118 118 ASP CB C 548 41.674 41.674 41.149 0.525 18053
4575 1 7 . 1 1 118 118 ASP H H 548 7.181 7.181 8.152 -0.971 18053
4576 1 7 . 1 1 119 119 GLY N N 549 107.167 107.167 106.396 0.771 18053
4577 1 7 . 1 1 119 119 GLY C C 549 173.841 173.841 173.779 0.062 18053
4578 1 7 . 1 1 119 119 GLY CA C 549 45.455 45.455 44.672 0.783 18053
4579 1 7 . 1 1 119 119 GLY H H 549 7.738 7.738 7.646 0.092 18053
4580 1 7 . 1 1 120 120 GLU N N 550 121.196 121.196 121.941 -0.745 18053
4581 1 7 . 1 1 120 120 GLU HA H 550 4.112 4.112 4.194 -0.082 18053
4582 1 7 . 1 1 120 120 GLU C C 550 175.588 175.588 176.016 -0.428 18053
4583 1 7 . 1 1 120 120 GLU CA C 550 54.831 54.831 56.286 -1.455 18053
4584 1 7 . 1 1 120 120 GLU CB C 550 29.937 29.937 29.960 -0.023 18053
4585 1 7 . 1 1 120 120 GLU H H 550 7.587 7.587 7.783 -0.196 18053
4586 1 7 . 1 1 121 121 GLU N N 551 123.886 123.886 125.533 -1.647 18053
4587 1 7 . 1 1 121 121 GLU HA H 551 4.276 4.276 4.271 0.005 18053
4588 1 7 . 1 1 121 121 GLU C C 551 176.817 176.817 176.423 0.394 18053
4589 1 7 . 1 1 121 121 GLU CA C 551 56.796 56.796 56.735 0.061 18053
4590 1 7 . 1 1 121 121 GLU CB C 551 28.955 28.955 29.233 -0.278 18053
4591 1 7 . 1 1 121 121 GLU H H 551 8.697 8.697 8.712 -0.015 18053
4592 1 7 . 1 1 122 122 VAL N N 552 120.055 120.055 121.088 -1.033 18053
4593 1 7 . 1 1 122 122 VAL HA H 552 4.364 4.364 3.967 0.397 18053
4594 1 7 . 1 1 122 122 VAL C C 552 175.998 175.998 175.496 0.502 18053
4595 1 7 . 1 1 122 122 VAL CA C 552 61.655 61.655 63.252 -1.597 18053
4596 1 7 . 1 1 122 122 VAL CB C 552 33.049 33.049 32.432 0.617 18053
4597 1 7 . 1 1 122 122 VAL H H 552 8.845 8.845 8.086 0.759 18053
4598 1 7 . 1 1 123 123 ALA N N 553 122.098 122.098 120.628 1.470 18053
4599 1 7 . 1 1 123 123 ALA HA H 553 4.890 4.890 4.669 0.221 18053
4600 1 7 . 1 1 123 123 ALA C C 553 175.261 175.261 175.094 0.167 18053
4601 1 7 . 1 1 123 123 ALA CA C 553 52.757 52.757 50.749 2.008 18053
4602 1 7 . 1 1 123 123 ALA CB C 553 22.267 22.267 22.022 0.245 18053
4603 1 7 . 1 1 123 123 ALA H H 553 7.788 7.788 7.766 0.022 18053
4604 1 7 . 1 1 124 124 MET N N 554 118.217 118.217 120.201 -1.984 18053
4605 1 7 . 1 1 124 124 MET HA H 554 5.286 5.286 4.641 0.645 18053
4606 1 7 . 1 1 124 124 MET C C 554 174.428 174.428 174.425 0.003 18053
4607 1 7 . 1 1 124 124 MET CA C 554 55.104 55.104 55.998 -0.894 18053
4608 1 7 . 1 1 124 124 MET CB C 554 35.342 35.342 35.950 -0.608 18053
4609 1 7 . 1 1 124 124 MET H H 554 8.693 8.693 8.361 0.332 18053
4610 1 7 . 1 1 125 125 ARG N N 555 122.132 122.132 127.232 -5.100 18053
4611 1 7 . 1 1 125 125 ARG HA H 555 4.900 4.900 4.716 0.184 18053
4612 1 7 . 1 1 125 125 ARG CA C 555 56.388 56.388 55.582 0.806 18053
4613 1 7 . 1 1 125 125 ARG CB C 555 34.378 34.378 32.798 1.580 18053
4614 1 7 . 1 1 125 125 ARG H H 555 8.919 8.919 8.780 0.139 18053
4615 1 7 . 1 1 126 126 THR HA H 556 4.685 4.685 4.480 0.205 18053
4616 1 7 . 1 1 126 126 THR C C 556 172.436 172.436 173.699 -1.263 18053
4617 1 7 . 1 1 126 126 THR CA C 556 61.382 61.382 63.182 -1.800 18053
4618 1 7 . 1 1 126 126 THR CB C 556 70.444 70.444 68.899 1.545 18053
4619 1 7 . 1 1 127 127 VAL N N 557 124.976 124.976 128.863 -3.887 18053
4620 1 7 . 1 1 127 127 VAL HA H 557 4.146 4.146 4.035 0.111 18053
4621 1 7 . 1 1 127 127 VAL C C 557 173.937 173.937 173.997 -0.060 18053
4622 1 7 . 1 1 127 127 VAL CA C 557 61.109 61.109 60.858 0.251 18053
4623 1 7 . 1 1 127 127 VAL CB C 557 33.759 33.759 32.840 0.919 18053
4624 1 7 . 1 1 127 127 VAL H H 557 8.127 8.127 8.182 -0.056 18053
4625 1 7 . 1 1 128 128 LYS N N 558 125.384 125.384 127.499 -2.115 18053
4626 1 7 . 1 1 128 128 LYS HA H 558 4.706 4.706 4.218 0.488 18053
4627 1 7 . 1 1 128 128 LYS C C 558 175.534 175.534 175.786 -0.252 18053
4628 1 7 . 1 1 128 128 LYS CA C 558 54.886 54.886 54.670 0.216 18053
4629 1 7 . 1 1 128 128 LYS CB C 558 34.673 34.673 33.119 1.554 18053
4630 1 7 . 1 1 128 128 LYS H H 558 8.289 8.289 8.490 -0.201 18053
4631 1 7 . 1 1 129 129 LYS N N 559 124.005 124.005 124.817 -0.812 18053
4632 1 7 . 1 1 129 129 LYS HA H 559 4.310 4.310 4.341 -0.031 18053
4633 1 7 . 1 1 129 129 LYS C C 559 176.571 176.571 177.192 -0.621 18053
4634 1 7 . 1 1 129 129 LYS CA C 559 56.742 56.742 57.005 -0.263 18053
4635 1 7 . 1 1 129 129 LYS CB C 559 33.362 33.362 32.056 1.306 18053
4636 1 7 . 1 1 129 129 LYS H H 559 8.461 8.461 7.894 0.567 18053
4637 1 7 . 1 1 130 130 SER N N 560 117.195 117.195 121.052 -3.857 18053
4638 1 7 . 1 1 130 130 SER HA H 560 4.384 4.384 4.315 0.069 18053
4639 1 7 . 1 1 130 130 SER C C 560 174.565 174.565 174.729 -0.164 18053
4640 1 7 . 1 1 130 130 SER CA C 560 58.434 58.434 59.822 -1.388 18053
4641 1 7 . 1 1 130 130 SER CB C 560 63.812 63.812 63.651 0.161 18053
4642 1 7 . 1 1 130 130 SER H H 560 8.465 8.465 8.514 -0.049 18053
4643 1 7 . 1 1 131 131 SER N N 561 118.149 118.149 111.773 6.376 18053
4644 1 7 . 1 1 131 131 SER HA H 561 4.412 4.412 4.542 -0.130 18053
4645 1 7 . 1 1 131 131 SER C C 561 174.456 174.456 172.751 1.705 18053
4646 1 7 . 1 1 131 131 SER CA C 561 58.489 58.489 56.944 1.546 18053
4647 1 7 . 1 1 131 131 SER CB C 561 63.811 63.811 64.389 -0.578 18053
4648 1 7 . 1 1 131 131 SER H H 561 8.336 8.336 7.414 0.922 18053
4649 1 7 . 1 1 132 132 VAL N N 562 121.332 121.332 117.396 3.936 18053
4650 1 7 . 1 1 132 132 VAL HA H 562 4.035 4.035 4.482 -0.447 18053
4651 1 7 . 1 1 132 132 VAL C C 562 176.066 176.066 175.292 0.774 18053
4652 1 7 . 1 1 132 132 VAL CA C 562 62.446 62.446 61.924 0.522 18053
4653 1 7 . 1 1 132 132 VAL CB C 562 32.394 32.394 32.640 -0.246 18053
4654 1 7 . 1 1 132 132 VAL H H 562 7.982 7.982 8.332 -0.350 18053
4655 1 7 . 1 1 133 133 MET N N 563 124.022 124.022 121.051 2.971 18053
4656 1 7 . 1 1 133 133 MET HA H 563 4.385 4.385 4.678 -0.293 18053
4657 1 7 . 1 1 133 133 MET C C 563 176.039 176.039 175.463 0.576 18053
4658 1 7 . 1 1 133 133 MET CA C 563 55.350 55.350 55.493 -0.143 18053
4659 1 7 . 1 1 133 133 MET CB C 563 32.503 32.503 33.620 -1.117 18053
4660 1 7 . 1 1 133 133 MET H H 563 8.295 8.295 7.674 0.621 18053
4661 1 7 . 1 1 134 134 ARG N N 564 122.677 122.677 120.690 1.987 18053
4662 1 7 . 1 1 134 134 ARG HA H 564 4.262 4.262 4.117 0.145 18053
4663 1 7 . 1 1 134 134 ARG C C 564 176.298 176.298 174.457 1.841 18053
4664 1 7 . 1 1 134 134 ARG CA C 564 56.087 56.087 56.545 -0.458 18053
4665 1 7 . 1 1 134 134 ARG CB C 564 30.702 30.702 31.020 -0.318 18053
4666 1 7 . 1 1 134 134 ARG H H 564 8.295 8.295 8.460 -0.165 18053
4667 1 7 . 1 1 135 135 GLU N N 565 121.945 121.945 123.958 -2.013 18053
4668 1 7 . 1 1 135 135 GLU HA H 565 4.160 4.160 4.635 -0.475 18053
4669 1 7 . 1 1 135 135 GLU C C 565 176.080 176.080 175.843 0.237 18053
4670 1 7 . 1 1 135 135 GLU CA C 565 56.906 56.906 55.987 0.919 18053
4671 1 7 . 1 1 135 135 GLU CB C 565 29.774 29.774 30.640 -0.866 18053
4672 1 7 . 1 1 135 135 GLU H H 565 8.470 8.470 8.574 -0.104 18053
4673 1 7 . 1 1 136 136 ASN N N 566 118.761 118.761 122.135 -3.374 18053
4674 1 7 . 1 1 136 136 ASN HA H 566 4.617 4.617 4.882 -0.265 18053
4675 1 7 . 1 1 136 136 ASN C C 566 175.315 175.315 175.734 -0.419 18053
4676 1 7 . 1 1 136 136 ASN CA C 566 53.193 53.193 53.873 -0.680 18053
4677 1 7 . 1 1 136 136 ASN CB C 566 38.836 38.836 39.233 -0.397 18053
4678 1 7 . 1 1 136 136 ASN H H 566 8.341 8.341 8.898 -0.557 18053
4679 1 7 . 1 1 137 137 GLU N N 567 121.349 121.349 121.422 -0.073 18053
4680 1 7 . 1 1 137 137 GLU HA H 567 4.152 4.152 4.595 -0.443 18053
4681 1 7 . 1 1 137 137 GLU C C 567 176.243 176.243 176.450 -0.207 18053
4682 1 7 . 1 1 137 137 GLU CA C 567 56.906 56.906 57.217 -0.311 18053
4683 1 7 . 1 1 137 137 GLU CB C 567 29.992 29.992 30.297 -0.305 18053
4684 1 7 . 1 1 137 137 GLU H H 567 8.349 8.349 8.265 0.084 18053
4685 1 7 . 1 1 138 138 ASN N N 568 118.761 118.761 118.298 0.463 18053
4686 1 7 . 1 1 138 138 ASN HA H 568 4.712 4.712 4.532 0.180 18053
4687 1 7 . 1 1 138 138 ASN C C 568 174.551 174.551 174.441 0.110 18053
4688 1 7 . 1 1 138 138 ASN CA C 568 53.193 53.193 52.655 0.538 18053
4689 1 7 . 1 1 138 138 ASN CB C 568 39.327 39.327 38.206 1.121 18053
4690 1 7 . 1 1 138 138 ASN H H 568 8.397 8.397 8.333 0.064 18053
4691 1 8 . 1 1 20 20 ALA N N 450 125.180 125.180 127.122 -1.942 18053
4692 1 8 . 1 1 20 20 ALA HA H 450 4.706 4.706 4.579 0.127 18053
4693 1 8 . 1 1 20 20 ALA C C 450 177.226 177.226 176.668 0.558 18053
4694 1 8 . 1 1 20 20 ALA CA C 450 52.757 52.757 51.989 0.768 18053
4695 1 8 . 1 1 20 20 ALA CB C 450 20.411 20.411 18.636 1.775 18053
4696 1 8 . 1 1 20 20 ALA H H 450 8.484 8.484 8.439 0.045 18053
4697 1 8 . 1 1 21 21 SER N N 451 115.714 115.714 116.857 -1.143 18053
4698 1 8 . 1 1 21 21 SER HA H 451 4.513 4.513 4.473 0.040 18053
4699 1 8 . 1 1 21 21 SER C C 451 174.742 174.742 174.935 -0.193 18053
4700 1 8 . 1 1 21 21 SER CA C 451 58.516 58.516 57.188 1.328 18053
4701 1 8 . 1 1 21 21 SER CB C 451 64.159 64.159 64.371 -0.212 18053
4702 1 8 . 1 1 21 21 SER H H 451 8.487 8.487 7.802 0.685 18053
4703 1 8 . 1 1 22 22 GLY N N 452 111.509 111.509 114.094 -2.585 18053
4704 1 8 . 1 1 22 22 GLY C C 452 174.401 174.401 175.073 -0.672 18053
4705 1 8 . 1 1 22 22 GLY CA C 452 45.059 45.059 45.522 -0.463 18053
4706 1 8 . 1 1 22 22 GLY H H 452 8.198 8.198 8.655 -0.457 18053
4707 1 8 . 1 1 23 23 SER N N 453 116.191 116.191 115.252 0.939 18053
4708 1 8 . 1 1 23 23 SER HA H 453 4.364 4.364 4.391 -0.027 18053
4709 1 8 . 1 1 23 23 SER C C 453 173.432 173.432 174.168 -0.736 18053
4710 1 8 . 1 1 23 23 SER CA C 453 59.744 59.744 60.383 -0.639 18053
4711 1 8 . 1 1 23 23 SER CB C 453 64.335 64.335 63.700 0.635 18053
4712 1 8 . 1 1 23 23 SER H H 453 8.494 8.494 8.499 -0.005 18053
4713 1 8 . 1 1 24 24 VAL N N 454 121.656 121.656 117.569 4.087 18053
4714 1 8 . 1 1 24 24 VAL HA H 454 5.035 5.035 4.509 0.526 18053
4715 1 8 . 1 1 24 24 VAL C C 454 174.606 174.606 174.794 -0.188 18053
4716 1 8 . 1 1 24 24 VAL CA C 454 61.055 61.055 60.203 0.852 18053
4717 1 8 . 1 1 24 24 VAL CB C 454 32.503 32.503 34.364 -1.861 18053
4718 1 8 . 1 1 24 24 VAL H H 454 7.830 7.830 7.691 0.139 18053
4719 1 8 . 1 1 25 25 SER N N 455 119.323 119.323 117.024 2.299 18053
4720 1 8 . 1 1 25 25 SER HA H 455 4.672 4.672 4.905 -0.233 18053
4721 1 8 . 1 1 25 25 SER C C 455 174.426 174.426 173.223 1.203 18053
4722 1 8 . 1 1 25 25 SER CA C 455 55.268 55.268 55.239 0.029 18053
4723 1 8 . 1 1 25 25 SER CB C 455 65.162 65.162 65.913 -0.751 18053
4724 1 8 . 1 1 25 25 SER H H 455 9.065 9.065 8.679 0.386 18053
4725 1 8 . 1 1 26 26 ILE N N 456 119.468 119.468 124.924 -5.456 18053
4726 1 8 . 1 1 26 26 ILE HA H 456 4.180 4.180 4.028 0.152 18053
4727 1 8 . 1 1 26 26 ILE C C 456 175.506 175.506 175.235 0.271 18053
4728 1 8 . 1 1 26 26 ILE CA C 456 61.328 61.328 62.373 -1.045 18053
4729 1 8 . 1 1 26 26 ILE CB C 456 37.962 37.962 37.394 0.568 18053
4730 1 8 . 1 1 26 26 ILE H H 456 8.295 8.295 8.696 -0.401 18053
4731 1 8 . 1 1 27 27 GLU N N 457 129.726 129.726 129.132 0.594 18053
4732 1 8 . 1 1 27 27 GLU HA H 457 4.228 4.228 4.288 -0.060 18053
4733 1 8 . 1 1 27 27 GLU C C 457 175.179 175.179 176.472 -1.293 18053
4734 1 8 . 1 1 27 27 GLU CA C 457 55.432 55.432 57.635 -2.203 18053
4735 1 8 . 1 1 27 27 GLU CB C 457 30.142 30.142 30.804 -0.662 18053
4736 1 8 . 1 1 27 27 GLU H H 457 8.393 8.393 8.457 -0.064 18053
4737 1 8 . 1 1 28 28 GLU N N 458 117.076 117.076 116.572 0.504 18053
4738 1 8 . 1 1 28 28 GLU HA H 458 4.168 4.168 4.679 -0.511 18053
4739 1 8 . 1 1 28 28 GLU C C 458 174.701 174.701 174.780 -0.079 18053
4740 1 8 . 1 1 28 28 GLU CA C 458 56.906 56.906 55.022 1.884 18053
4741 1 8 . 1 1 28 28 GLU CB C 458 31.848 31.848 34.082 -2.234 18053
4742 1 8 . 1 1 28 28 GLU H H 458 7.489 7.489 7.865 -0.376 18053
4743 1 8 . 1 1 29 29 ILE N N 459 122.183 122.183 118.838 3.345 18053
4744 1 8 . 1 1 29 29 ILE HA H 459 3.764 3.764 3.916 -0.152 18053
4745 1 8 . 1 1 29 29 ILE C C 459 174.169 174.169 174.494 -0.325 18053
4746 1 8 . 1 1 29 29 ILE CA C 459 59.526 59.526 59.338 0.188 18053
4747 1 8 . 1 1 29 29 ILE CB C 459 40.309 40.309 41.325 -1.016 18053
4748 1 8 . 1 1 29 29 ILE H H 459 8.126 8.126 8.146 -0.020 18053
4749 1 8 . 1 1 30 30 ASP N N 460 123.205 123.205 122.945 0.260 18053
4750 1 8 . 1 1 30 30 ASP HA H 460 4.183 4.183 4.077 0.106 18053
4751 1 8 . 1 1 30 30 ASP C C 460 178.318 178.318 177.790 0.528 18053
4752 1 8 . 1 1 30 30 ASP CA C 460 53.930 53.930 54.024 -0.094 18053
4753 1 8 . 1 1 30 30 ASP CB C 460 42.807 42.807 42.242 0.565 18053
4754 1 8 . 1 1 30 30 ASP H H 460 6.704 6.704 7.499 -0.795 18053
4755 1 8 . 1 1 31 31 LEU N N 461 128.551 128.551 122.389 6.162 18053
4756 1 8 . 1 1 31 31 LEU HA H 461 4.064 4.064 4.068 -0.004 18053
4757 1 8 . 1 1 31 31 LEU C C 461 177.513 177.513 177.660 -0.147 18053
4758 1 8 . 1 1 31 31 LEU CA C 461 57.124 57.124 56.704 0.420 18053
4759 1 8 . 1 1 31 31 LEU CB C 461 41.237 41.237 41.626 -0.389 18053
4760 1 8 . 1 1 31 31 LEU H H 461 9.012 9.012 8.309 0.703 18053
4761 1 8 . 1 1 32 32 GLU N N 462 115.101 115.101 116.902 -1.801 18053
4762 1 8 . 1 1 32 32 GLU HA H 462 4.283 4.283 4.392 -0.109 18053
4763 1 8 . 1 1 32 32 GLU C C 462 177.062 177.062 176.922 0.140 18053
4764 1 8 . 1 1 32 32 GLU CA C 462 55.759 55.759 56.846 -1.087 18053
4765 1 8 . 1 1 32 32 GLU CB C 462 29.569 29.569 31.085 -1.516 18053
4766 1 8 . 1 1 32 32 GLU H H 462 7.588 7.588 8.276 -0.688 18053
4767 1 8 . 1 1 33 33 GLY N N 463 106.299 106.299 106.777 -0.478 18053
4768 1 8 . 1 1 33 33 GLY C C 463 174.824 174.824 175.219 -0.395 18053
4769 1 8 . 1 1 33 33 GLY CA C 463 46.806 46.806 45.233 1.573 18053
4770 1 8 . 1 1 33 33 GLY H H 463 7.372 7.372 8.208 -0.836 18053
4771 1 8 . 1 1 34 34 LYS N N 464 118.744 118.744 119.151 -0.407 18053
4772 1 8 . 1 1 34 34 LYS HA H 464 4.562 4.562 4.412 0.150 18053
4773 1 8 . 1 1 34 34 LYS C C 464 177.076 177.076 175.213 1.863 18053
4774 1 8 . 1 1 34 34 LYS CA C 464 59.963 59.963 57.953 2.010 18053
4775 1 8 . 1 1 34 34 LYS CB C 464 33.111 33.111 33.310 -0.199 18053
4776 1 8 . 1 1 34 34 LYS H H 464 9.547 9.547 8.348 1.199 18053
4777 1 8 . 1 1 35 35 PHE N N 465 109.125 109.125 112.899 -3.774 18053
4778 1 8 . 1 1 35 35 PHE HA H 465 5.514 5.514 5.326 0.188 18053
4779 1 8 . 1 1 35 35 PHE C C 465 174.183 174.183 172.714 1.469 18053
4780 1 8 . 1 1 35 35 PHE CA C 465 56.632 56.632 55.578 1.054 18053
4781 1 8 . 1 1 35 35 PHE CB C 465 40.599 40.599 40.985 -0.386 18053
4782 1 8 . 1 1 35 35 PHE H H 465 6.740 6.740 7.184 -0.444 18053
4783 1 8 . 1 1 36 36 VAL N N 466 119.579 119.579 119.758 -0.179 18053
4784 1 8 . 1 1 36 36 VAL HA H 466 3.709 3.709 4.152 -0.443 18053
4785 1 8 . 1 1 36 36 VAL C C 466 172.668 172.668 174.352 -1.684 18053
4786 1 8 . 1 1 36 36 VAL CA C 466 62.692 62.692 61.270 1.422 18053
4787 1 8 . 1 1 36 36 VAL CB C 466 36.215 36.215 34.114 2.101 18053
4788 1 8 . 1 1 36 36 VAL H H 466 7.628 7.628 8.984 -1.356 18053
4789 1 8 . 1 1 37 37 GLN N N 467 126.831 126.831 127.725 -0.894 18053
4790 1 8 . 1 1 37 37 GLN HA H 467 5.449 5.449 4.657 0.792 18053
4791 1 8 . 1 1 37 37 GLN C C 467 174.797 174.797 174.709 0.088 18053
4792 1 8 . 1 1 37 37 GLN CA C 467 54.121 54.121 54.847 -0.726 18053
4793 1 8 . 1 1 37 37 GLN CB C 467 34.623 34.623 28.886 5.737 18053
4794 1 8 . 1 1 37 37 GLN H H 467 8.392 8.392 8.271 0.121 18053
4795 1 8 . 1 1 38 38 LEU N N 468 123.018 123.018 127.680 -4.662 18053
4796 1 8 . 1 1 38 38 LEU HA H 468 5.422 5.422 5.083 0.339 18053
4797 1 8 . 1 1 38 38 LEU C C 468 175.588 175.588 176.207 -0.619 18053
4798 1 8 . 1 1 38 38 LEU CA C 468 52.702 52.702 53.827 -1.125 18053
4799 1 8 . 1 1 38 38 LEU CB C 468 45.046 45.046 44.452 0.594 18053
4800 1 8 . 1 1 38 38 LEU H H 468 9.103 9.103 8.685 0.418 18053
4801 1 8 . 1 1 39 39 LYS N N 469 118.983 118.983 120.614 -1.631 18053
4802 1 8 . 1 1 39 39 LYS HA H 469 4.852 4.852 4.671 0.181 18053
4803 1 8 . 1 1 39 39 LYS C C 469 173.309 173.309 174.397 -1.088 18053
4804 1 8 . 1 1 39 39 LYS CA C 469 54.994 54.994 54.547 0.447 18053
4805 1 8 . 1 1 39 39 LYS CB C 469 38.246 38.246 36.491 1.755 18053
4806 1 8 . 1 1 39 39 LYS H H 469 8.496 8.496 8.872 -0.376 18053
4807 1 8 . 1 1 40 40 ASN N N 470 121.758 121.758 124.791 -3.033 18053
4808 1 8 . 1 1 40 40 ASN HA H 470 4.788 4.788 4.721 0.067 18053
4809 1 8 . 1 1 40 40 ASN C C 470 174.496 174.496 175.099 -0.603 18053
4810 1 8 . 1 1 40 40 ASN CA C 470 51.119 51.119 52.514 -1.395 18053
4811 1 8 . 1 1 40 40 ASN CB C 470 37.559 37.559 38.995 -1.436 18053
4812 1 8 . 1 1 40 40 ASN H H 470 8.283 8.283 8.753 -0.470 18053
4813 1 8 . 1 1 41 41 ASN N N 471 122.422 122.422 124.469 -2.047 18053
4814 1 8 . 1 1 41 41 ASN HA H 471 4.588 4.588 4.651 -0.063 18053
4815 1 8 . 1 1 41 41 ASN C C 471 174.810 174.810 175.482 -0.672 18053
4816 1 8 . 1 1 41 41 ASN CA C 471 53.985 53.985 53.574 0.411 18053
4817 1 8 . 1 1 41 41 ASN CB C 471 39.600 39.600 38.599 1.001 18053
4818 1 8 . 1 1 41 41 ASN H H 471 8.681 8.681 8.412 0.269 18053
4819 1 8 . 1 1 42 42 SER N N 472 116.446 116.446 116.070 0.376 18053
4820 1 8 . 1 1 42 42 SER HA H 472 4.719 4.719 4.336 0.383 18053
4821 1 8 . 1 1 42 42 SER C C 472 172.804 172.804 175.224 -2.420 18053
4822 1 8 . 1 1 42 42 SER CA C 472 57.288 57.288 59.483 -2.195 18053
4823 1 8 . 1 1 42 42 SER CB C 472 66.241 66.241 64.162 2.079 18053
4824 1 8 . 1 1 42 42 SER H H 472 8.370 8.370 7.630 0.740 18053
4825 1 8 . 1 1 43 43 ASP N N 473 117.706 117.706 121.868 -4.162 18053
4826 1 8 . 1 1 43 43 ASP HA H 473 4.474 4.474 4.462 0.012 18053
4827 1 8 . 1 1 43 43 ASP C C 473 175.343 175.343 175.493 -0.150 18053
4828 1 8 . 1 1 43 43 ASP CA C 473 53.521 53.521 55.828 -2.307 18053
4829 1 8 . 1 1 43 43 ASP CB C 473 40.322 40.322 41.198 -0.876 18053
4830 1 8 . 1 1 43 43 ASP H H 473 8.254 8.254 8.607 -0.353 18053
4831 1 8 . 1 1 44 44 LYS N N 474 120.209 120.209 116.633 3.576 18053
4832 1 8 . 1 1 44 44 LYS HA H 474 4.569 4.569 4.435 0.134 18053
4833 1 8 . 1 1 44 44 LYS C C 474 175.397 175.397 174.697 0.700 18053
4834 1 8 . 1 1 44 44 LYS CA C 474 54.012 54.012 54.536 -0.524 18053
4835 1 8 . 1 1 44 44 LYS CB C 474 35.383 35.383 33.818 1.565 18053
4836 1 8 . 1 1 44 44 LYS H H 474 8.305 8.305 7.328 0.977 18053
4837 1 8 . 1 1 45 45 ASP N N 475 124.993 124.993 120.794 4.199 18053
4838 1 8 . 1 1 45 45 ASP HA H 475 3.975 3.975 4.504 -0.529 18053
4839 1 8 . 1 1 45 45 ASP C C 475 174.810 174.810 175.891 -1.081 18053
4840 1 8 . 1 1 45 45 ASP CA C 475 54.995 54.995 55.849 -0.854 18053
4841 1 8 . 1 1 45 45 ASP CB C 475 40.364 40.364 40.255 0.109 18053
4842 1 8 . 1 1 45 45 ASP H H 475 8.722 8.722 8.532 0.190 18053
4843 1 8 . 1 1 46 46 GLN N N 476 120.549 120.549 126.584 -6.035 18053
4844 1 8 . 1 1 46 46 GLN HA H 476 4.436 4.436 4.392 0.044 18053
4845 1 8 . 1 1 46 46 GLN C C 476 174.019 174.019 175.194 -1.175 18053
4846 1 8 . 1 1 46 46 GLN CA C 476 53.138 53.138 54.308 -1.170 18053
4847 1 8 . 1 1 46 46 GLN CB C 476 31.466 31.466 29.351 2.115 18053
4848 1 8 . 1 1 46 46 GLN H H 476 7.878 7.878 8.143 -0.265 18053
4849 1 8 . 1 1 47 47 SER N N 477 121.537 121.537 121.876 -0.339 18053
4850 1 8 . 1 1 47 47 SER HA H 477 4.229 4.229 4.268 -0.039 18053
4851 1 8 . 1 1 47 47 SER C C 477 174.565 174.565 173.796 0.769 18053
4852 1 8 . 1 1 47 47 SER CA C 477 58.706 58.706 58.215 0.491 18053
4853 1 8 . 1 1 47 47 SER CB C 477 62.965 62.965 63.091 -0.126 18053
4854 1 8 . 1 1 47 47 SER H H 477 8.748 8.748 8.667 0.081 18053
4855 1 8 . 1 1 48 48 LEU N N 478 127.751 127.751 125.101 2.650 18053
4856 1 8 . 1 1 48 48 LEU HA H 478 2.631 2.631 4.370 -1.739 18053
4857 1 8 . 1 1 48 48 LEU C C 478 176.789 176.789 176.463 0.326 18053
4858 1 8 . 1 1 48 48 LEU CA C 478 52.102 52.102 54.225 -2.123 18053
4859 1 8 . 1 1 48 48 LEU CB C 478 42.343 42.343 43.858 -1.515 18053
4860 1 8 . 1 1 48 48 LEU H H 478 7.856 7.856 7.719 0.137 18053
4861 1 8 . 1 1 49 49 GLY N N 479 107.525 107.525 108.701 -1.176 18053
4862 1 8 . 1 1 49 49 GLY C C 479 176.653 176.653 175.540 1.113 18053
4863 1 8 . 1 1 49 49 GLY CA C 479 48.062 48.062 45.835 2.227 18053
4864 1 8 . 1 1 49 49 GLY H H 479 7.728 7.728 8.756 -1.028 18053
4865 1 8 . 1 1 50 50 ASN N N 480 117.059 117.059 119.802 -2.743 18053
4866 1 8 . 1 1 50 50 ASN HA H 480 4.255 4.255 4.608 -0.353 18053
4867 1 8 . 1 1 50 50 ASN C C 480 174.961 174.961 174.878 0.083 18053
4868 1 8 . 1 1 50 50 ASN CA C 480 56.360 56.360 55.105 1.255 18053
4869 1 8 . 1 1 50 50 ASN CB C 480 37.416 37.416 38.769 -1.353 18053
4870 1 8 . 1 1 50 50 ASN H H 480 7.552 7.552 8.731 -1.179 18053
4871 1 8 . 1 1 51 51 TRP N N 481 122.166 122.166 119.312 2.854 18053
4872 1 8 . 1 1 51 51 TRP HA H 481 4.477 4.477 4.674 -0.197 18053
4873 1 8 . 1 1 51 51 TRP C C 481 175.575 175.575 175.883 -0.308 18053
4874 1 8 . 1 1 51 51 TRP CA C 481 58.762 58.762 58.161 0.601 18053
4875 1 8 . 1 1 51 51 TRP CB C 481 28.041 28.041 29.988 -1.947 18053
4876 1 8 . 1 1 51 51 TRP H H 481 8.914 8.914 8.167 0.747 18053
4877 1 8 . 1 1 52 52 ARG N N 482 116.480 116.480 117.031 -0.551 18053
4878 1 8 . 1 1 52 52 ARG HA H 482 5.968 5.968 5.203 0.765 18053
4879 1 8 . 1 1 52 52 ARG C C 482 175.807 175.807 174.801 1.006 18053
4880 1 8 . 1 1 52 52 ARG CA C 482 54.121 54.121 55.083 -0.962 18053
4881 1 8 . 1 1 52 52 ARG CB C 482 35.124 35.124 33.787 1.337 18053
4882 1 8 . 1 1 52 52 ARG H H 482 9.147 9.147 8.858 0.289 18053
4883 1 8 . 1 1 53 53 ILE N N 483 119.579 119.579 123.907 -4.328 18053
4884 1 8 . 1 1 53 53 ILE HA H 483 4.985 4.985 5.002 -0.017 18053
4885 1 8 . 1 1 53 53 ILE C C 483 175.670 175.670 175.664 0.006 18053
4886 1 8 . 1 1 53 53 ILE CA C 483 60.400 60.400 60.571 -0.171 18053
4887 1 8 . 1 1 53 53 ILE CB C 483 40.227 40.227 40.014 0.213 18053
4888 1 8 . 1 1 53 53 ILE H H 483 9.000 9.000 8.786 0.214 18053
4889 1 8 . 1 1 54 54 LYS N N 484 124.737 124.737 126.563 -1.826 18053
4890 1 8 . 1 1 54 54 LYS HA H 484 5.463 5.463 5.213 0.250 18053
4891 1 8 . 1 1 54 54 LYS C C 484 175.575 175.575 175.870 -0.295 18053
4892 1 8 . 1 1 54 54 LYS CA C 484 54.613 54.613 55.056 -0.443 18053
4893 1 8 . 1 1 54 54 LYS CB C 484 35.041 35.041 33.994 1.047 18053
4894 1 8 . 1 1 54 54 LYS H H 484 9.678 9.678 8.573 1.105 18053
4895 1 8 . 1 1 55 55 ARG N N 485 124.090 124.090 126.361 -2.271 18053
4896 1 8 . 1 1 55 55 ARG HA H 485 5.525 5.525 4.851 0.674 18053
4897 1 8 . 1 1 55 55 ARG C C 485 174.155 174.155 175.401 -1.246 18053
4898 1 8 . 1 1 55 55 ARG CA C 485 53.903 53.903 54.327 -0.424 18053
4899 1 8 . 1 1 55 55 ARG H H 485 9.314 9.314 8.768 0.546 18053
4900 1 8 . 1 1 56 56 GLN N N 486 126.576 126.576 124.799 1.777 18053
4901 1 8 . 1 1 56 56 GLN HA H 486 4.842 4.842 4.588 0.254 18053
4902 1 8 . 1 1 56 56 GLN C C 486 174.991 174.991 174.753 0.238 18053
4903 1 8 . 1 1 56 56 GLN CA C 486 54.831 54.831 55.429 -0.598 18053
4904 1 8 . 1 1 56 56 GLN CB C 486 31.465 31.465 29.379 2.086 18053
4905 1 8 . 1 1 56 56 GLN H H 486 8.831 8.831 8.690 0.141 18053
4906 1 8 . 1 1 57 57 VAL N N 487 126.712 126.712 124.063 2.649 18053
4907 1 8 . 1 1 57 57 VAL HA H 487 4.266 4.266 4.288 -0.022 18053
4908 1 8 . 1 1 57 57 VAL C C 487 175.916 175.916 177.437 -1.521 18053
4909 1 8 . 1 1 57 57 VAL CA C 487 61.820 61.820 61.495 0.325 18053
4910 1 8 . 1 1 57 57 VAL CB C 487 32.803 32.803 32.585 0.218 18053
4911 1 8 . 1 1 57 57 VAL H H 487 8.786 8.786 8.506 0.280 18053
4912 1 8 . 1 1 58 58 LEU N N 488 127.274 127.274 126.366 0.908 18053
4913 1 8 . 1 1 58 58 LEU HA H 488 4.085 4.085 4.174 -0.089 18053
4914 1 8 . 1 1 58 58 LEU C C 488 177.158 177.158 177.848 -0.690 18053
4915 1 8 . 1 1 58 58 LEU CA C 488 56.906 56.906 57.757 -0.851 18053
4916 1 8 . 1 1 58 58 LEU CB C 488 41.374 41.374 41.630 -0.256 18053
4917 1 8 . 1 1 58 58 LEU H H 488 8.316 8.316 8.269 0.047 18053
4918 1 8 . 1 1 59 59 GLU N N 489 119.647 119.647 118.799 0.848 18053
4919 1 8 . 1 1 59 59 GLU HA H 489 4.112 4.112 4.206 -0.094 18053
4920 1 8 . 1 1 59 59 GLU C C 489 176.230 176.230 177.194 -0.964 18053
4921 1 8 . 1 1 59 59 GLU CA C 489 57.015 57.015 56.471 0.544 18053
4922 1 8 . 1 1 59 59 GLU CB C 489 28.149 28.149 29.694 -1.545 18053
4923 1 8 . 1 1 59 59 GLU H H 489 8.636 8.636 8.156 0.480 18053
4924 1 8 . 1 1 60 60 GLY N N 490 108.819 108.819 107.353 1.466 18053
4925 1 8 . 1 1 60 60 GLY C C 490 173.568 173.568 173.935 -0.367 18053
4926 1 8 . 1 1 60 60 GLY CA C 490 44.773 44.773 44.621 0.152 18053
4927 1 8 . 1 1 60 60 GLY H H 490 8.160 8.160 7.788 0.372 18053
4928 1 8 . 1 1 61 61 GLU N N 491 121.009 121.009 121.468 -0.459 18053
4929 1 8 . 1 1 61 61 GLU HA H 491 4.323 4.323 4.576 -0.253 18053
4930 1 8 . 1 1 61 61 GLU C C 491 175.725 175.725 175.236 0.489 18053
4931 1 8 . 1 1 61 61 GLU CA C 491 56.196 56.196 55.142 1.054 18053
4932 1 8 . 1 1 61 61 GLU CB C 491 30.865 30.865 30.743 0.122 18053
4933 1 8 . 1 1 61 61 GLU H H 491 8.320 8.320 7.950 0.370 18053
4934 1 8 . 1 1 62 62 GLU N N 492 123.426 123.426 124.251 -0.825 18053
4935 1 8 . 1 1 62 62 GLU HA H 492 5.054 5.054 4.978 0.076 18053
4936 1 8 . 1 1 62 62 GLU C C 492 175.930 175.930 176.520 -0.590 18053
4937 1 8 . 1 1 62 62 GLU CA C 492 55.650 55.650 55.347 0.303 18053
4938 1 8 . 1 1 62 62 GLU CB C 492 32.312 32.312 29.015 3.297 18053
4939 1 8 . 1 1 62 62 GLU H H 492 8.594 8.594 8.770 -0.176 18053
4940 1 8 . 1 1 63 63 ILE N N 493 119.732 119.732 118.874 0.858 18053
4941 1 8 . 1 1 63 63 ILE HA H 493 4.788 4.788 4.580 0.208 18053
4942 1 8 . 1 1 63 63 ILE C C 493 174.647 174.647 174.715 -0.068 18053
4943 1 8 . 1 1 63 63 ILE CA C 493 60.181 60.181 60.724 -0.543 18053
4944 1 8 . 1 1 63 63 ILE CB C 493 41.183 41.183 39.758 1.425 18053
4945 1 8 . 1 1 63 63 ILE H H 493 8.523 8.523 7.901 0.622 18053
4946 1 8 . 1 1 64 64 ALA N N 494 122.166 122.166 124.696 -2.530 18053
4947 1 8 . 1 1 64 64 ALA HA H 494 5.521 5.521 5.428 0.093 18053
4948 1 8 . 1 1 64 64 ALA C C 494 174.606 174.606 176.022 -1.416 18053
4949 1 8 . 1 1 64 64 ALA CA C 494 51.528 51.528 50.766 0.762 18053
4950 1 8 . 1 1 64 64 ALA CB C 494 22.239 22.239 22.044 0.195 18053
4951 1 8 . 1 1 64 64 ALA H H 494 8.741 8.741 8.089 0.652 18053
4952 1 8 . 1 1 65 65 TYR N N 495 126.729 126.729 125.734 0.995 18053
4953 1 8 . 1 1 65 65 TYR HA H 495 3.094 3.094 3.998 -0.904 18053
4954 1 8 . 1 1 65 65 TYR C C 495 173.036 173.036 173.266 -0.230 18053
4955 1 8 . 1 1 65 65 TYR CA C 495 56.905 56.905 55.853 1.052 18053
4956 1 8 . 1 1 65 65 TYR CB C 495 40.269 40.269 40.355 -0.085 18053
4957 1 8 . 1 1 65 65 TYR H H 495 8.462 8.462 8.744 -0.282 18053
4958 1 8 . 1 1 66 66 LYS N N 496 128.108 128.108 126.935 1.173 18053
4959 1 8 . 1 1 66 66 LYS HA H 496 4.822 4.822 4.432 0.390 18053
4960 1 8 . 1 1 66 66 LYS C C 496 174.906 174.906 174.797 0.109 18053
4961 1 8 . 1 1 66 66 LYS CA C 496 53.739 53.739 54.957 -1.218 18053
4962 1 8 . 1 1 66 66 LYS CB C 496 34.782 34.782 33.196 1.586 18053
4963 1 8 . 1 1 66 66 LYS H H 496 7.010 7.010 7.668 -0.658 18053
4964 1 8 . 1 1 67 67 PHE N N 497 125.299 125.299 121.016 4.283 18053
4965 1 8 . 1 1 67 67 PHE HA H 497 3.932 3.932 4.175 -0.243 18053
4966 1 8 . 1 1 67 67 PHE C C 497 177.990 177.990 175.575 2.415 18053
4967 1 8 . 1 1 67 67 PHE CA C 497 59.007 59.007 57.721 1.286 18053
4968 1 8 . 1 1 67 67 PHE CB C 497 40.981 40.981 40.473 0.508 18053
4969 1 8 . 1 1 67 67 PHE H H 497 8.509 8.509 8.249 0.260 18053
4970 1 8 . 1 1 68 68 THR N N 498 116.191 116.191 112.281 3.910 18053
4971 1 8 . 1 1 68 68 THR HA H 498 4.417 4.417 4.597 -0.180 18053
4972 1 8 . 1 1 68 68 THR CA C 498 60.855 60.855 59.830 1.025 18053
4973 1 8 . 1 1 68 68 THR CB C 498 68.019 68.019 69.238 -1.219 18053
4974 1 8 . 1 1 68 68 THR H H 498 8.688 8.688 8.408 0.280 18053
4975 1 8 . 1 1 69 69 PRO HA H 499 3.948 3.948 4.702 -0.754 18053
4976 1 8 . 1 1 69 69 PRO C C 499 177.444 177.444 177.305 0.139 18053
4977 1 8 . 1 1 69 69 PRO CA C 499 66.077 66.077 64.618 1.459 18053
4978 1 8 . 1 1 69 69 PRO CB C 499 32.776 32.776 31.885 0.891 18053
4979 1 8 . 1 1 70 70 LYS N N 500 113.552 113.552 115.608 -2.056 18053
4980 1 8 . 1 1 70 70 LYS HA H 500 4.385 4.385 4.164 0.221 18053
4981 1 8 . 1 1 70 70 LYS C C 500 176.325 176.325 176.006 0.319 18053
4982 1 8 . 1 1 70 70 LYS CA C 500 54.995 54.995 56.654 -1.659 18053
4983 1 8 . 1 1 70 70 LYS CB C 500 31.793 31.793 32.007 -0.214 18053
4984 1 8 . 1 1 70 70 LYS H H 500 8.016 8.016 8.268 -0.252 18053
4985 1 8 . 1 1 71 71 TYR N N 501 121.860 121.860 121.368 0.492 18053
4986 1 8 . 1 1 71 71 TYR HA H 501 3.730 3.730 4.478 -0.748 18053
4987 1 8 . 1 1 71 71 TYR C C 501 174.838 174.838 173.742 1.096 18053
4988 1 8 . 1 1 71 71 TYR CA C 501 62.310 62.310 58.845 3.465 18053
4989 1 8 . 1 1 71 71 TYR CB C 501 38.781 38.781 39.681 -0.900 18053
4990 1 8 . 1 1 71 71 TYR H H 501 7.460 7.460 7.711 -0.251 18053
4991 1 8 . 1 1 72 72 ILE N N 502 129.487 129.487 125.979 3.508 18053
4992 1 8 . 1 1 72 72 ILE HA H 502 3.928 3.928 4.426 -0.498 18053
4993 1 8 . 1 1 72 72 ILE C C 502 172.968 172.968 173.567 -0.599 18053
4994 1 8 . 1 1 72 72 ILE CA C 502 59.308 59.308 59.201 0.107 18053
4995 1 8 . 1 1 72 72 ILE CB C 502 40.910 40.910 41.981 -1.071 18053
4996 1 8 . 1 1 72 72 ILE H H 502 7.168 7.168 7.704 -0.536 18053
4997 1 8 . 1 1 73 73 LEU N N 503 128.278 128.278 125.874 2.404 18053
4998 1 8 . 1 1 73 73 LEU HA H 503 4.493 4.493 4.568 -0.075 18053
4999 1 8 . 1 1 73 73 LEU C C 503 175.834 175.834 175.054 0.780 18053
5000 1 8 . 1 1 73 73 LEU CA C 503 51.965 51.965 52.287 -0.322 18053
5001 1 8 . 1 1 73 73 LEU CB C 503 42.548 42.548 45.847 -3.299 18053
5002 1 8 . 1 1 73 73 LEU H H 503 8.483 8.483 8.473 0.010 18053
5003 1 8 . 1 1 74 74 ARG N N 504 129.589 129.589 123.949 5.640 18053
5004 1 8 . 1 1 74 74 ARG HA H 504 3.743 3.743 4.424 -0.681 18053
5005 1 8 . 1 1 74 74 ARG C C 504 175.233 175.233 176.270 -1.037 18053
5006 1 8 . 1 1 74 74 ARG CA C 504 56.851 56.851 55.670 1.181 18053
5007 1 8 . 1 1 74 74 ARG CB C 504 30.292 30.292 30.856 -0.564 18053
5008 1 8 . 1 1 74 74 ARG H H 504 8.673 8.673 8.327 0.346 18053
5009 1 8 . 1 1 75 75 ALA N N 505 123.205 123.205 124.049 -0.844 18053
5010 1 8 . 1 1 75 75 ALA HA H 505 3.522 3.522 4.218 -0.696 18053
5011 1 8 . 1 1 75 75 ALA C C 505 178.441 178.441 178.225 0.216 18053
5012 1 8 . 1 1 75 75 ALA CA C 505 53.794 53.794 52.931 0.863 18053
5013 1 8 . 1 1 75 75 ALA CB C 505 18.910 18.910 18.425 0.485 18053
5014 1 8 . 1 1 75 75 ALA H H 505 8.564 8.564 8.364 0.200 18053
5015 1 8 . 1 1 76 76 GLY N N 506 112.241 112.241 111.603 0.638 18053
5016 1 8 . 1 1 76 76 GLY C C 506 174.278 174.278 174.667 -0.389 18053
5017 1 8 . 1 1 76 76 GLY CA C 506 46.725 46.725 45.373 1.352 18053
5018 1 8 . 1 1 76 76 GLY H H 506 7.381 7.381 8.617 -1.236 18053
5019 1 8 . 1 1 77 77 GLN N N 507 117.382 117.382 119.068 -1.686 18053
5020 1 8 . 1 1 77 77 GLN HA H 507 4.364 4.364 4.628 -0.264 18053
5021 1 8 . 1 1 77 77 GLN C C 507 173.937 173.937 174.858 -0.921 18053
5022 1 8 . 1 1 77 77 GLN CA C 507 54.558 54.558 54.012 0.546 18053
5023 1 8 . 1 1 77 77 GLN CB C 507 30.073 30.073 29.888 0.185 18053
5024 1 8 . 1 1 77 77 GLN H H 507 7.996 7.996 7.582 0.414 18053
5025 1 8 . 1 1 78 78 MET N N 508 116.957 116.957 115.622 1.335 18053
5026 1 8 . 1 1 78 78 MET HA H 508 5.388 5.388 4.785 0.603 18053
5027 1 8 . 1 1 78 78 MET C C 508 175.807 175.807 174.040 1.767 18053
5028 1 8 . 1 1 78 78 MET CA C 508 54.067 54.067 54.392 -0.324 18053
5029 1 8 . 1 1 78 78 MET CB C 508 37.198 37.198 36.062 1.136 18053
5030 1 8 . 1 1 78 78 MET H H 508 8.092 8.092 8.536 -0.444 18053
5031 1 8 . 1 1 79 79 VAL N N 509 119.340 119.340 120.918 -1.578 18053
5032 1 8 . 1 1 79 79 VAL HA H 509 4.956 4.956 4.972 -0.016 18053
5033 1 8 . 1 1 79 79 VAL C C 509 172.217 172.217 174.563 -2.346 18053
5034 1 8 . 1 1 79 79 VAL CA C 509 59.471 59.471 60.460 -0.989 18053
5035 1 8 . 1 1 79 79 VAL CB C 509 33.676 33.676 34.343 -0.666 18053
5036 1 8 . 1 1 79 79 VAL H H 509 8.534 8.534 8.539 -0.005 18053
5037 1 8 . 1 1 80 80 THR N N 510 124.533 124.533 126.061 -1.528 18053
5038 1 8 . 1 1 80 80 THR HA H 510 4.586 4.586 4.787 -0.201 18053
5039 1 8 . 1 1 80 80 THR C C 510 172.215 172.215 174.254 -2.039 18053
5040 1 8 . 1 1 80 80 THR CA C 510 62.119 62.119 62.519 -0.400 18053
5041 1 8 . 1 1 80 80 THR CB C 510 69.407 69.407 68.813 0.594 18053
5042 1 8 . 1 1 80 80 THR H H 510 8.301 8.301 8.529 -0.228 18053
5043 1 8 . 1 1 81 81 VAL N N 511 127.002 127.002 127.550 -0.548 18053
5044 1 8 . 1 1 81 81 VAL HA H 511 4.596 4.596 4.652 -0.056 18053
5045 1 8 . 1 1 81 81 VAL C C 511 176.667 176.667 175.716 0.951 18053
5046 1 8 . 1 1 81 81 VAL CA C 511 61.382 61.382 61.719 -0.337 18053
5047 1 8 . 1 1 81 81 VAL CB C 511 30.945 30.945 31.081 -0.136 18053
5048 1 8 . 1 1 81 81 VAL H H 511 8.796 8.796 8.789 0.007 18053
5049 1 8 . 1 1 82 82 TRP N N 512 131.479 131.479 129.506 1.973 18053
5050 1 8 . 1 1 82 82 TRP HA H 512 5.338 5.338 5.366 -0.028 18053
5051 1 8 . 1 1 82 82 TRP C C 512 176.885 176.885 175.322 1.563 18053
5052 1 8 . 1 1 82 82 TRP CA C 512 56.442 56.442 57.070 -0.628 18053
5053 1 8 . 1 1 82 82 TRP CB C 512 30.701 30.701 31.369 -0.668 18053
5054 1 8 . 1 1 82 82 TRP H H 512 9.924 9.924 9.532 0.392 18053
5055 1 8 . 1 1 83 83 ALA N N 513 123.954 123.954 120.669 3.285 18053
5056 1 8 . 1 1 83 83 ALA HA H 513 4.308 4.308 4.595 -0.287 18053
5057 1 8 . 1 1 83 83 ALA C C 513 178.140 178.140 178.420 -0.280 18053
5058 1 8 . 1 1 83 83 ALA CA C 513 52.211 52.211 50.197 2.014 18053
5059 1 8 . 1 1 83 83 ALA CB C 513 18.745 18.745 20.624 -1.879 18053
5060 1 8 . 1 1 83 83 ALA H H 513 9.048 9.048 8.768 0.280 18053
5061 1 8 . 1 1 84 84 ALA N N 514 125.146 125.146 124.546 0.600 18053
5062 1 8 . 1 1 84 84 ALA HA H 514 3.951 3.951 4.045 -0.094 18053
5063 1 8 . 1 1 84 84 ALA C C 514 179.519 179.519 179.002 0.517 18053
5064 1 8 . 1 1 84 84 ALA CA C 514 54.804 54.804 54.874 -0.070 18053
5065 1 8 . 1 1 84 84 ALA CB C 514 18.582 18.582 18.915 -0.333 18053
5066 1 8 . 1 1 84 84 ALA H H 514 8.341 8.341 8.267 0.074 18053
5067 1 8 . 1 1 85 85 GLY N N 515 103.388 103.388 105.106 -1.718 18053
5068 1 8 . 1 1 85 85 GLY C C 515 174.674 174.674 174.686 -0.012 18053
5069 1 8 . 1 1 85 85 GLY CA C 515 45.878 45.878 45.294 0.584 18053
5070 1 8 . 1 1 85 85 GLY H H 515 7.996 7.996 7.834 0.162 18053
5071 1 8 . 1 1 86 86 ALA N N 516 120.140 120.140 123.370 -3.230 18053
5072 1 8 . 1 1 86 86 ALA HA H 516 4.344 4.344 4.471 -0.127 18053
5073 1 8 . 1 1 86 86 ALA C C 516 177.690 177.690 178.019 -0.329 18053
5074 1 8 . 1 1 86 86 ALA CA C 516 53.139 53.139 52.426 0.713 18053
5075 1 8 . 1 1 86 86 ALA CB C 516 20.547 20.547 19.714 0.833 18053
5076 1 8 . 1 1 86 86 ALA H H 516 7.474 7.474 7.544 -0.070 18053
5077 1 8 . 1 1 87 87 GLY N N 517 105.720 105.720 106.594 -0.874 18053
5078 1 8 . 1 1 87 87 GLY C C 517 173.650 173.650 174.532 -0.882 18053
5079 1 8 . 1 1 87 87 GLY CA C 517 46.014 46.014 45.073 0.941 18053
5080 1 8 . 1 1 87 87 GLY H H 517 7.779 7.779 7.858 -0.079 18053
5081 1 8 . 1 1 88 88 VAL N N 518 121.537 121.537 120.596 0.941 18053
5082 1 8 . 1 1 88 88 VAL HA H 518 3.585 3.585 3.950 -0.365 18053
5083 1 8 . 1 1 88 88 VAL C C 518 174.851 174.851 175.510 -0.659 18053
5084 1 8 . 1 1 88 88 VAL CA C 518 61.274 61.274 61.839 -0.565 18053
5085 1 8 . 1 1 88 88 VAL CB C 518 33.376 33.376 32.292 1.084 18053
5086 1 8 . 1 1 88 88 VAL H H 518 7.499 7.499 7.803 -0.304 18053
5087 1 8 . 1 1 89 89 ALA N N 519 128.295 128.295 130.002 -1.707 18053
5088 1 8 . 1 1 89 89 ALA HA H 519 4.192 4.192 4.358 -0.166 18053
5089 1 8 . 1 1 89 89 ALA C C 519 176.680 176.680 176.667 0.013 18053
5090 1 8 . 1 1 89 89 ALA CA C 519 51.283 51.283 51.433 -0.150 18053
5091 1 8 . 1 1 89 89 ALA CB C 519 19.292 19.292 19.180 0.112 18053
5092 1 8 . 1 1 89 89 ALA H H 519 7.960 7.960 8.078 -0.118 18053
5093 1 8 . 1 1 90 90 HIS N N 520 122.643 122.643 124.602 -1.959 18053
5094 1 8 . 1 1 90 90 HIS HA H 520 4.033 4.033 4.380 -0.347 18053
5095 1 8 . 1 1 90 90 HIS C C 520 175.793 175.793 174.399 1.394 18053
5096 1 8 . 1 1 90 90 HIS CA C 520 58.653 58.653 56.161 2.492 18053
5097 1 8 . 1 1 90 90 HIS CB C 520 32.285 32.285 29.823 2.462 18053
5098 1 8 . 1 1 90 90 HIS H H 520 8.394 8.394 8.913 -0.519 18053
5099 1 8 . 1 1 91 91 SER N N 521 121.247 121.247 123.619 -2.372 18053
5100 1 8 . 1 1 91 91 SER HA H 521 4.629 4.629 4.722 -0.093 18053
5101 1 8 . 1 1 91 91 SER CA C 521 55.843 55.843 55.833 0.010 18053
5102 1 8 . 1 1 91 91 SER CB C 521 62.367 62.367 63.489 -1.123 18053
5103 1 8 . 1 1 91 91 SER H H 521 8.569 8.569 8.286 0.283 18053
5104 1 8 . 1 1 92 92 PRO HA H 522 4.002 4.002 4.678 -0.676 18053
5105 1 8 . 1 1 92 92 PRO CA C 522 62.244 62.244 61.935 0.309 18053
5106 1 8 . 1 1 92 92 PRO CB C 522 30.931 30.931 31.696 -0.765 18053
5107 1 8 . 1 1 93 93 PRO HA H 523 4.672 4.672 4.621 0.051 18053
5108 1 8 . 1 1 93 93 PRO C C 523 177.786 177.786 178.808 -1.022 18053
5109 1 8 . 1 1 93 93 PRO CA C 523 64.003 64.003 64.169 -0.166 18053
5110 1 8 . 1 1 93 93 PRO CB C 523 34.905 34.905 32.184 2.721 18053
5111 1 8 . 1 1 94 94 SER N N 524 117.212 117.212 116.396 0.816 18053
5112 1 8 . 1 1 94 94 SER HA H 524 4.678 4.678 4.528 0.150 18053
5113 1 8 . 1 1 94 94 SER C C 524 174.851 174.851 175.454 -0.603 18053
5114 1 8 . 1 1 94 94 SER CA C 524 61.874 61.874 61.622 0.252 18053
5115 1 8 . 1 1 94 94 SER CB C 524 64.057 64.057 63.125 0.932 18053
5116 1 8 . 1 1 94 94 SER H H 524 8.463 8.463 8.527 -0.064 18053
5117 1 8 . 1 1 95 95 THR N N 525 121.588 121.588 119.771 1.817 18053
5118 1 8 . 1 1 95 95 THR HA H 525 4.859 4.859 4.821 0.038 18053
5119 1 8 . 1 1 95 95 THR C C 525 172.094 172.094 173.497 -1.403 18053
5120 1 8 . 1 1 95 95 THR CA C 525 62.309 62.309 62.998 -0.689 18053
5121 1 8 . 1 1 95 95 THR CB C 525 70.281 70.281 68.022 2.259 18053
5122 1 8 . 1 1 95 95 THR H H 525 7.631 7.631 7.754 -0.123 18053
5123 1 8 . 1 1 96 96 LEU N N 526 127.274 127.274 127.459 -0.185 18053
5124 1 8 . 1 1 96 96 LEU HA H 526 5.131 5.131 5.014 0.117 18053
5125 1 8 . 1 1 96 96 LEU C C 526 175.916 175.916 176.004 -0.088 18053
5126 1 8 . 1 1 96 96 LEU CA C 526 52.075 52.075 54.353 -2.278 18053
5127 1 8 . 1 1 96 96 LEU CB C 526 43.790 43.790 43.882 -0.092 18053
5128 1 8 . 1 1 96 96 LEU H H 526 8.977 8.977 8.063 0.914 18053
5129 1 8 . 1 1 97 97 VAL N N 527 124.056 124.056 119.177 4.879 18053
5130 1 8 . 1 1 97 97 VAL HA H 527 4.869 4.869 4.615 0.254 18053
5131 1 8 . 1 1 97 97 VAL C C 527 176.230 176.230 175.120 1.110 18053
5132 1 8 . 1 1 97 97 VAL CA C 527 61.519 61.519 60.943 0.576 18053
5133 1 8 . 1 1 97 97 VAL CB C 527 33.704 33.704 34.382 -0.678 18053
5134 1 8 . 1 1 97 97 VAL H H 527 10.724 10.724 7.888 2.836 18053
5135 1 8 . 1 1 98 98 TRP N N 528 132.586 132.586 131.143 1.443 18053
5136 1 8 . 1 1 98 98 TRP HA H 528 4.965 4.965 4.137 0.828 18053
5137 1 8 . 1 1 98 98 TRP C C 528 173.391 173.391 174.113 -0.722 18053
5138 1 8 . 1 1 98 98 TRP CA C 528 53.303 53.303 54.704 -1.401 18053
5139 1 8 . 1 1 98 98 TRP CB C 528 28.245 28.245 27.894 0.351 18053
5140 1 8 . 1 1 98 98 TRP H H 528 9.400 9.400 8.621 0.779 18053
5141 1 8 . 1 1 99 99 LYS N N 529 126.644 126.644 128.275 -1.631 18053
5142 1 8 . 1 1 99 99 LYS HA H 529 3.839 3.839 4.077 -0.238 18053
5143 1 8 . 1 1 99 99 LYS C C 529 177.581 177.581 177.256 0.325 18053
5144 1 8 . 1 1 99 99 LYS CA C 529 58.543 58.543 57.254 1.290 18053
5145 1 8 . 1 1 99 99 LYS CB C 529 32.176 32.176 32.851 -0.675 18053
5146 1 8 . 1 1 99 99 LYS H H 529 8.153 8.153 7.822 0.331 18053
5147 1 8 . 1 1 100 100 GLY N N 530 110.385 110.385 112.426 -2.041 18053
5148 1 8 . 1 1 100 100 GLY C C 530 172.367 172.367 173.537 -1.170 18053
5149 1 8 . 1 1 100 100 GLY CA C 530 45.278 45.278 44.810 0.467 18053
5150 1 8 . 1 1 100 100 GLY H H 530 8.363 8.363 8.504 -0.141 18053
5151 1 8 . 1 1 101 101 GLN N N 531 121.162 121.162 120.056 1.106 18053
5152 1 8 . 1 1 101 101 GLN HA H 531 3.972 3.972 4.220 -0.248 18053
5153 1 8 . 1 1 101 101 GLN CA C 531 52.620 52.620 53.273 -0.653 18053
5154 1 8 . 1 1 101 101 GLN CB C 531 27.595 27.595 28.780 -1.185 18053
5155 1 8 . 1 1 101 101 GLN H H 531 6.815 6.815 7.093 -0.278 18053
5156 1 8 . 1 1 102 102 SER N N 532 122.728 122.728 121.741 0.987 18053
5157 1 8 . 1 1 102 102 SER HA H 532 3.866 3.866 4.327 -0.461 18053
5158 1 8 . 1 1 102 102 SER C C 532 174.537 174.537 175.370 -0.833 18053
5159 1 8 . 1 1 102 102 SER CA C 532 61.983 61.983 61.563 0.420 18053
5160 1 8 . 1 1 102 102 SER CB C 532 62.802 62.802 63.328 -0.526 18053
5161 1 8 . 1 1 102 102 SER H H 532 8.662 8.662 8.693 -0.031 18053
5162 1 8 . 1 1 103 103 SER N N 533 110.811 110.811 116.207 -5.396 18053
5163 1 8 . 1 1 103 103 SER HA H 533 4.240 4.240 4.403 -0.163 18053
5164 1 8 . 1 1 103 103 SER C C 533 174.087 174.087 174.583 -0.496 18053
5165 1 8 . 1 1 103 103 SER CA C 533 56.633 56.633 59.025 -2.392 18053
5166 1 8 . 1 1 103 103 SER CB C 533 64.658 64.658 63.529 1.129 18053
5167 1 8 . 1 1 103 103 SER H H 533 7.134 7.134 8.108 -0.974 18053
5168 1 8 . 1 1 104 104 TRP N N 534 126.133 126.133 117.451 8.682 18053
5169 1 8 . 1 1 104 104 TRP HA H 534 4.098 4.098 4.281 -0.183 18053
5170 1 8 . 1 1 104 104 TRP C C 534 176.066 176.066 174.798 1.268 18053
5171 1 8 . 1 1 104 104 TRP CA C 534 60.127 60.127 56.951 3.176 18053
5172 1 8 . 1 1 104 104 TRP CB C 534 28.764 28.764 29.109 -0.345 18053
5173 1 8 . 1 1 104 104 TRP H H 534 9.764 9.764 8.015 1.749 18053
5174 1 8 . 1 1 105 105 GLY N N 535 105.907 105.907 104.357 1.550 18053
5175 1 8 . 1 1 105 105 GLY C C 535 172.217 172.217 172.981 -0.764 18053
5176 1 8 . 1 1 105 105 GLY CA C 535 44.240 44.240 44.965 -0.725 18053
5177 1 8 . 1 1 105 105 GLY H H 535 8.095 8.095 7.979 0.116 18053
5178 1 8 . 1 1 106 106 THR N N 536 111.253 111.253 114.995 -3.742 18053
5179 1 8 . 1 1 106 106 THR HA H 536 3.859 3.859 3.361 0.498 18053
5180 1 8 . 1 1 106 106 THR C C 536 172.872 172.872 172.685 0.187 18053
5181 1 8 . 1 1 106 106 THR CA C 536 59.635 59.635 60.421 -0.786 18053
5182 1 8 . 1 1 106 106 THR CB C 536 70.526 70.526 69.955 0.571 18053
5183 1 8 . 1 1 106 106 THR H H 536 7.913 7.913 8.027 -0.114 18053
5184 1 8 . 1 1 107 107 GLY N N 537 107.712 107.712 110.711 -2.999 18053
5185 1 8 . 1 1 107 107 GLY C C 537 172.709 172.709 173.554 -0.845 18053
5186 1 8 . 1 1 107 107 GLY CA C 537 45.166 45.166 45.246 -0.080 18053
5187 1 8 . 1 1 107 107 GLY H H 537 7.533 7.533 8.196 -0.663 18053
5188 1 8 . 1 1 108 108 GLU N N 538 118.864 118.864 120.500 -1.636 18053
5189 1 8 . 1 1 108 108 GLU HA H 538 4.136 4.136 4.130 0.006 18053
5190 1 8 . 1 1 108 108 GLU C C 538 176.353 176.353 175.433 0.920 18053
5191 1 8 . 1 1 108 108 GLU CA C 538 58.352 58.352 58.783 -0.431 18053
5192 1 8 . 1 1 108 108 GLU CB C 538 30.156 30.156 30.404 -0.248 18053
5193 1 8 . 1 1 108 108 GLU H H 538 8.558 8.558 8.775 -0.217 18053
5194 1 8 . 1 1 109 109 SER N N 539 110.419 110.419 111.517 -1.098 18053
5195 1 8 . 1 1 109 109 SER HA H 539 4.963 4.963 4.898 0.065 18053
5196 1 8 . 1 1 109 109 SER C C 539 173.787 173.787 172.798 0.989 18053
5197 1 8 . 1 1 109 109 SER CA C 539 57.125 57.125 57.413 -0.288 18053
5198 1 8 . 1 1 109 109 SER CB C 539 64.439 64.439 64.962 -0.523 18053
5199 1 8 . 1 1 109 109 SER H H 539 7.620 7.620 7.780 -0.160 18053
5200 1 8 . 1 1 110 110 PHE N N 540 118.778 118.778 118.681 0.097 18053
5201 1 8 . 1 1 110 110 PHE HA H 540 5.081 5.081 5.432 -0.351 18053
5202 1 8 . 1 1 110 110 PHE C C 540 176.052 176.052 173.211 2.841 18053
5203 1 8 . 1 1 110 110 PHE CA C 540 56.789 56.789 56.502 0.287 18053
5204 1 8 . 1 1 110 110 PHE CB C 540 40.760 40.760 42.671 -1.911 18053
5205 1 8 . 1 1 110 110 PHE H H 540 8.318 8.318 8.568 -0.250 18053
5206 1 8 . 1 1 112 112 THR HA H 542 5.468 5.468 5.102 0.366 18053
5207 1 8 . 1 1 112 112 THR C C 542 172.381 172.381 173.801 -1.420 18053
5208 1 8 . 1 1 112 112 THR CA C 542 61.818 61.818 62.143 -0.325 18053
5209 1 8 . 1 1 112 112 THR CB C 542 70.990 70.990 69.969 1.021 18053
5210 1 8 . 1 1 113 113 VAL N N 543 124.771 124.771 124.826 -0.055 18053
5211 1 8 . 1 1 113 113 VAL HA H 543 4.864 4.864 4.616 0.248 18053
5212 1 8 . 1 1 113 113 VAL C C 543 173.132 173.132 174.105 -0.973 18053
5213 1 8 . 1 1 113 113 VAL CA C 543 60.099 60.099 60.519 -0.420 18053
5214 1 8 . 1 1 113 113 VAL CB C 543 36.433 36.433 35.495 0.938 18053
5215 1 8 . 1 1 113 113 VAL H H 543 9.380 9.380 8.657 0.723 18053
5216 1 8 . 1 1 114 114 LEU N N 544 128.789 128.789 127.849 0.940 18053
5217 1 8 . 1 1 114 114 LEU HA H 544 5.320 5.320 4.970 0.350 18053
5218 1 8 . 1 1 114 114 LEU C C 544 174.237 174.237 174.747 -0.510 18053
5219 1 8 . 1 1 114 114 LEU CA C 544 53.193 53.193 53.817 -0.624 18053
5220 1 8 . 1 1 114 114 LEU CB C 544 45.879 45.879 44.929 0.950 18053
5221 1 8 . 1 1 114 114 LEU H H 544 8.948 8.948 8.759 0.189 18053
5222 1 8 . 1 1 115 115 VAL N N 545 127.002 127.002 127.047 -0.045 18053
5223 1 8 . 1 1 115 115 VAL HA H 545 4.854 4.854 4.696 0.158 18053
5224 1 8 . 1 1 115 115 VAL C C 545 175.206 175.206 175.299 -0.093 18053
5225 1 8 . 1 1 115 115 VAL CA C 545 59.334 59.334 60.483 -1.149 18053
5226 1 8 . 1 1 115 115 VAL CB C 545 34.495 34.495 33.847 0.648 18053
5227 1 8 . 1 1 115 115 VAL H H 545 9.564 9.564 9.037 0.527 18053
5228 1 8 . 1 1 116 116 ASN N N 546 121.179 121.179 121.793 -0.614 18053
5229 1 8 . 1 1 116 116 ASN HA H 546 2.897 2.897 3.771 -0.874 18053
5230 1 8 . 1 1 116 116 ASN C C 546 176.885 176.885 174.956 1.929 18053
5231 1 8 . 1 1 116 116 ASN CA C 546 50.409 50.409 50.964 -0.555 18053
5232 1 8 . 1 1 116 116 ASN CB C 546 36.639 36.639 40.007 -3.368 18053
5233 1 8 . 1 1 116 116 ASN H H 546 8.016 8.016 7.802 0.214 18053
5234 1 8 . 1 1 117 117 ALA N N 547 119.834 119.834 120.445 -0.611 18053
5235 1 8 . 1 1 117 117 ALA HA H 547 3.866 3.866 3.988 -0.122 18053
5236 1 8 . 1 1 117 117 ALA C C 547 177.772 177.772 178.591 -0.819 18053
5237 1 8 . 1 1 117 117 ALA CA C 547 54.504 54.504 54.502 0.002 18053
5238 1 8 . 1 1 117 117 ALA CB C 547 18.200 18.200 18.596 -0.396 18053
5239 1 8 . 1 1 117 117 ALA H H 547 6.444 6.444 8.166 -1.722 18053
5240 1 8 . 1 1 118 118 ASP N N 548 115.646 115.646 118.382 -2.736 18053
5241 1 8 . 1 1 118 118 ASP HA H 548 4.644 4.644 4.336 0.308 18053
5242 1 8 . 1 1 118 118 ASP C C 548 176.052 176.052 177.285 -1.233 18053
5243 1 8 . 1 1 118 118 ASP CA C 548 54.067 54.067 55.932 -1.865 18053
5244 1 8 . 1 1 118 118 ASP CB C 548 41.674 41.674 41.377 0.297 18053
5245 1 8 . 1 1 118 118 ASP H H 548 7.181 7.181 8.120 -0.939 18053
5246 1 8 . 1 1 119 119 GLY N N 549 107.167 107.167 104.976 2.191 18053
5247 1 8 . 1 1 119 119 GLY C C 549 173.841 173.841 174.131 -0.290 18053
5248 1 8 . 1 1 119 119 GLY CA C 549 45.455 45.455 44.666 0.790 18053
5249 1 8 . 1 1 119 119 GLY H H 549 7.738 7.738 8.165 -0.427 18053
5250 1 8 . 1 1 120 120 GLU N N 550 121.196 121.196 120.916 0.280 18053
5251 1 8 . 1 1 120 120 GLU HA H 550 4.112 4.112 4.226 -0.115 18053
5252 1 8 . 1 1 120 120 GLU C C 550 175.588 175.588 175.709 -0.121 18053
5253 1 8 . 1 1 120 120 GLU CA C 550 54.831 54.831 55.727 -0.896 18053
5254 1 8 . 1 1 120 120 GLU CB C 550 29.937 29.937 30.230 -0.293 18053
5255 1 8 . 1 1 120 120 GLU H H 550 7.587 7.587 7.700 -0.113 18053
5256 1 8 . 1 1 121 121 GLU N N 551 123.886 123.886 123.909 -0.023 18053
5257 1 8 . 1 1 121 121 GLU HA H 551 4.276 4.276 4.279 -0.003 18053
5258 1 8 . 1 1 121 121 GLU C C 551 176.817 176.817 176.494 0.323 18053
5259 1 8 . 1 1 121 121 GLU CA C 551 56.796 56.796 56.861 -0.065 18053
5260 1 8 . 1 1 121 121 GLU CB C 551 28.955 28.955 29.005 -0.050 18053
5261 1 8 . 1 1 121 121 GLU H H 551 8.697 8.697 8.705 -0.008 18053
5262 1 8 . 1 1 122 122 VAL N N 552 120.055 120.055 120.245 -0.190 18053
5263 1 8 . 1 1 122 122 VAL HA H 552 4.364 4.364 4.090 0.274 18053
5264 1 8 . 1 1 122 122 VAL C C 552 175.998 175.998 175.432 0.566 18053
5265 1 8 . 1 1 122 122 VAL CA C 552 61.655 61.655 62.567 -0.912 18053
5266 1 8 . 1 1 122 122 VAL CB C 552 33.049 33.049 32.628 0.421 18053
5267 1 8 . 1 1 122 122 VAL H H 552 8.845 8.845 8.146 0.699 18053
5268 1 8 . 1 1 123 123 ALA N N 553 122.098 122.098 121.274 0.824 18053
5269 1 8 . 1 1 123 123 ALA HA H 553 4.890 4.890 4.747 0.143 18053
5270 1 8 . 1 1 123 123 ALA C C 553 175.261 175.261 175.263 -0.002 18053
5271 1 8 . 1 1 123 123 ALA CA C 553 52.757 52.757 51.772 0.985 18053
5272 1 8 . 1 1 123 123 ALA CB C 553 22.267 22.267 21.922 0.345 18053
5273 1 8 . 1 1 123 123 ALA H H 553 7.788 7.788 7.615 0.173 18053
5274 1 8 . 1 1 124 124 MET N N 554 118.217 118.217 120.507 -2.290 18053
5275 1 8 . 1 1 124 124 MET HA H 554 5.286 5.286 5.328 -0.042 18053
5276 1 8 . 1 1 124 124 MET C C 554 174.428 174.428 174.207 0.221 18053
5277 1 8 . 1 1 124 124 MET CA C 554 55.104 55.104 55.805 -0.701 18053
5278 1 8 . 1 1 124 124 MET CB C 554 35.342 35.342 36.347 -1.005 18053
5279 1 8 . 1 1 124 124 MET H H 554 8.693 8.693 8.592 0.101 18053
5280 1 8 . 1 1 125 125 ARG N N 555 122.132 122.132 126.304 -4.172 18053
5281 1 8 . 1 1 125 125 ARG HA H 555 4.900 4.900 4.791 0.109 18053
5282 1 8 . 1 1 125 125 ARG CA C 555 56.388 56.388 55.920 0.468 18053
5283 1 8 . 1 1 125 125 ARG CB C 555 34.378 34.378 34.203 0.175 18053
5284 1 8 . 1 1 125 125 ARG H H 555 8.919 8.919 9.164 -0.245 18053
5285 1 8 . 1 1 126 126 THR HA H 556 4.685 4.685 4.291 0.394 18053
5286 1 8 . 1 1 126 126 THR C C 556 172.436 172.436 173.298 -0.862 18053
5287 1 8 . 1 1 126 126 THR CA C 556 61.382 61.382 61.944 -0.562 18053
5288 1 8 . 1 1 126 126 THR CB C 556 70.444 70.444 69.690 0.754 18053
5289 1 8 . 1 1 127 127 VAL N N 557 124.976 124.976 125.125 -0.149 18053
5290 1 8 . 1 1 127 127 VAL HA H 557 4.146 4.146 4.217 -0.071 18053
5291 1 8 . 1 1 127 127 VAL C C 557 173.937 173.937 173.169 0.768 18053
5292 1 8 . 1 1 127 127 VAL CA C 557 61.109 61.109 60.065 1.044 18053
5293 1 8 . 1 1 127 127 VAL CB C 557 33.759 33.759 34.537 -0.778 18053
5294 1 8 . 1 1 127 127 VAL H H 557 8.127 8.127 8.734 -0.607 18053
5295 1 8 . 1 1 128 128 LYS N N 558 125.384 125.384 129.220 -3.836 18053
5296 1 8 . 1 1 128 128 LYS HA H 558 4.706 4.706 4.413 0.293 18053
5297 1 8 . 1 1 128 128 LYS C C 558 175.534 175.534 175.842 -0.308 18053
5298 1 8 . 1 1 128 128 LYS CA C 558 54.886 54.886 54.497 0.389 18053
5299 1 8 . 1 1 128 128 LYS CB C 558 34.673 34.673 32.871 1.802 18053
5300 1 8 . 1 1 128 128 LYS H H 558 8.289 8.289 8.374 -0.085 18053
5301 1 8 . 1 1 129 129 LYS N N 559 124.005 124.005 127.990 -3.985 18053
5302 1 8 . 1 1 129 129 LYS HA H 559 4.310 4.310 4.293 0.017 18053
5303 1 8 . 1 1 129 129 LYS C C 559 176.571 176.571 177.088 -0.517 18053
5304 1 8 . 1 1 129 129 LYS CA C 559 56.742 56.742 56.277 0.465 18053
5305 1 8 . 1 1 129 129 LYS CB C 559 33.362 33.362 31.749 1.613 18053
5306 1 8 . 1 1 129 129 LYS H H 559 8.461 8.461 8.246 0.215 18053
5307 1 8 . 1 1 130 130 SER N N 560 117.195 117.195 121.883 -4.688 18053
5308 1 8 . 1 1 130 130 SER HA H 560 4.384 4.384 4.340 0.044 18053
5309 1 8 . 1 1 130 130 SER C C 560 174.565 174.565 173.957 0.608 18053
5310 1 8 . 1 1 130 130 SER CA C 560 58.434 58.434 59.937 -1.503 18053
5311 1 8 . 1 1 130 130 SER CB C 560 63.812 63.812 63.537 0.275 18053
5312 1 8 . 1 1 130 130 SER H H 560 8.465 8.465 8.338 0.127 18053
5313 1 8 . 1 1 131 131 SER N N 561 118.149 118.149 113.666 4.483 18053
5314 1 8 . 1 1 131 131 SER HA H 561 4.412 4.412 4.212 0.200 18053
5315 1 8 . 1 1 131 131 SER C C 561 174.456 174.456 174.194 0.262 18053
5316 1 8 . 1 1 131 131 SER CA C 561 58.489 58.489 58.986 -0.497 18053
5317 1 8 . 1 1 131 131 SER CB C 561 63.811 63.811 63.327 0.484 18053
5318 1 8 . 1 1 131 131 SER H H 561 8.336 8.336 7.886 0.450 18053
5319 1 8 . 1 1 132 132 VAL N N 562 121.332 121.332 120.505 0.827 18053
5320 1 8 . 1 1 132 132 VAL HA H 562 4.035 4.035 4.041 -0.006 18053
5321 1 8 . 1 1 132 132 VAL C C 562 176.066 176.066 176.101 -0.035 18053
5322 1 8 . 1 1 132 132 VAL CA C 562 62.446 62.446 63.100 -0.654 18053
5323 1 8 . 1 1 132 132 VAL CB C 562 32.394 32.394 31.767 0.627 18053
5324 1 8 . 1 1 132 132 VAL H H 562 7.982 7.982 8.182 -0.200 18053
5325 1 8 . 1 1 133 133 MET N N 563 124.022 124.022 118.418 5.604 18053
5326 1 8 . 1 1 133 133 MET HA H 563 4.385 4.385 4.704 -0.319 18053
5327 1 8 . 1 1 133 133 MET C C 563 176.039 176.039 174.913 1.126 18053
5328 1 8 . 1 1 133 133 MET CA C 563 55.350 55.350 54.655 0.695 18053
5329 1 8 . 1 1 133 133 MET CB C 563 32.503 32.503 33.823 -1.320 18053
5330 1 8 . 1 1 133 133 MET H H 563 8.295 8.295 7.459 0.836 18053
5331 1 8 . 1 1 134 134 ARG N N 564 122.677 122.677 120.910 1.767 18053
5332 1 8 . 1 1 134 134 ARG HA H 564 4.262 4.262 4.408 -0.146 18053
5333 1 8 . 1 1 134 134 ARG C C 564 176.298 176.298 175.884 0.414 18053
5334 1 8 . 1 1 134 134 ARG CA C 564 56.087 56.087 56.030 0.057 18053
5335 1 8 . 1 1 134 134 ARG CB C 564 30.702 30.702 31.414 -0.712 18053
5336 1 8 . 1 1 134 134 ARG H H 564 8.295 8.295 8.398 -0.103 18053
5337 1 8 . 1 1 135 135 GLU N N 565 121.945 121.945 122.690 -0.745 18053
5338 1 8 . 1 1 135 135 GLU HA H 565 4.160 4.160 4.374 -0.214 18053
5339 1 8 . 1 1 135 135 GLU C C 565 176.080 176.080 176.478 -0.398 18053
5340 1 8 . 1 1 135 135 GLU CA C 565 56.906 56.906 55.716 1.190 18053
5341 1 8 . 1 1 135 135 GLU CB C 565 29.774 29.774 29.964 -0.190 18053
5342 1 8 . 1 1 135 135 GLU H H 565 8.470 8.470 8.588 -0.118 18053
5343 1 8 . 1 1 136 136 ASN N N 566 118.761 118.761 124.083 -5.322 18053
5344 1 8 . 1 1 136 136 ASN HA H 566 4.617 4.617 4.750 -0.133 18053
5345 1 8 . 1 1 136 136 ASN C C 566 175.315 175.315 175.144 0.171 18053
5346 1 8 . 1 1 136 136 ASN CA C 566 53.193 53.193 52.903 0.290 18053
5347 1 8 . 1 1 136 136 ASN CB C 566 38.836 38.836 37.377 1.458 18053
5348 1 8 . 1 1 136 136 ASN H H 566 8.341 8.341 8.783 -0.442 18053
5349 1 8 . 1 1 137 137 GLU N N 567 121.349 121.349 122.859 -1.510 18053
5350 1 8 . 1 1 137 137 GLU HA H 567 4.152 4.152 4.106 0.046 18053
5351 1 8 . 1 1 137 137 GLU C C 567 176.243 176.243 176.860 -0.617 18053
5352 1 8 . 1 1 137 137 GLU CA C 567 56.906 56.906 58.875 -1.969 18053
5353 1 8 . 1 1 137 137 GLU CB C 567 29.992 29.992 30.047 -0.055 18053
5354 1 8 . 1 1 137 137 GLU H H 567 8.349 8.349 7.865 0.484 18053
5355 1 8 . 1 1 138 138 ASN N N 568 118.761 118.761 119.720 -0.959 18053
5356 1 8 . 1 1 138 138 ASN HA H 568 4.712 4.712 4.831 -0.119 18053
5357 1 8 . 1 1 138 138 ASN C C 568 174.551 174.551 174.617 -0.066 18053
5358 1 8 . 1 1 138 138 ASN CA C 568 53.193 53.193 52.703 0.490 18053
5359 1 8 . 1 1 138 138 ASN CB C 568 39.327 39.327 37.375 1.952 18053
5360 1 8 . 1 1 138 138 ASN H H 568 8.397 8.397 8.436 -0.039 18053
5361 1 9 . 1 1 20 20 ALA N N 450 125.180 125.180 130.132 -4.952 18053
5362 1 9 . 1 1 20 20 ALA HA H 450 4.706 4.706 4.614 0.092 18053
5363 1 9 . 1 1 20 20 ALA C C 450 177.226 177.226 176.584 0.642 18053
5364 1 9 . 1 1 20 20 ALA CA C 450 52.757 52.757 50.984 1.773 18053
5365 1 9 . 1 1 20 20 ALA CB C 450 20.411 20.411 18.862 1.549 18053
5366 1 9 . 1 1 20 20 ALA H H 450 8.484 8.484 8.566 -0.082 18053
5367 1 9 . 1 1 21 21 SER N N 451 115.714 115.714 118.596 -2.882 18053
5368 1 9 . 1 1 21 21 SER HA H 451 4.513 4.513 4.388 0.125 18053
5369 1 9 . 1 1 21 21 SER C C 451 174.742 174.742 175.287 -0.545 18053
5370 1 9 . 1 1 21 21 SER CA C 451 58.516 58.516 58.702 -0.186 18053
5371 1 9 . 1 1 21 21 SER CB C 451 64.159 64.159 62.926 1.233 18053
5372 1 9 . 1 1 21 21 SER H H 451 8.487 8.487 7.764 0.723 18053
5373 1 9 . 1 1 22 22 GLY N N 452 111.509 111.509 114.502 -2.993 18053
5374 1 9 . 1 1 22 22 GLY C C 452 174.401 174.401 175.269 -0.868 18053
5375 1 9 . 1 1 22 22 GLY CA C 452 45.059 45.059 46.029 -0.970 18053
5376 1 9 . 1 1 22 22 GLY H H 452 8.198 8.198 8.773 -0.575 18053
5377 1 9 . 1 1 23 23 SER N N 453 116.191 116.191 114.912 1.279 18053
5378 1 9 . 1 1 23 23 SER HA H 453 4.364 4.364 4.448 -0.084 18053
5379 1 9 . 1 1 23 23 SER C C 453 173.432 173.432 174.497 -1.065 18053
5380 1 9 . 1 1 23 23 SER CA C 453 59.744 59.744 61.236 -1.492 18053
5381 1 9 . 1 1 23 23 SER CB C 453 64.335 64.335 64.528 -0.193 18053
5382 1 9 . 1 1 23 23 SER H H 453 8.494 8.494 7.970 0.524 18053
5383 1 9 . 1 1 24 24 VAL N N 454 121.656 121.656 120.282 1.374 18053
5384 1 9 . 1 1 24 24 VAL HA H 454 5.035 5.035 4.496 0.539 18053
5385 1 9 . 1 1 24 24 VAL C C 454 174.606 174.606 174.897 -0.291 18053
5386 1 9 . 1 1 24 24 VAL CA C 454 61.055 61.055 61.461 -0.406 18053
5387 1 9 . 1 1 24 24 VAL CB C 454 32.503 32.503 34.789 -2.286 18053
5388 1 9 . 1 1 24 24 VAL H H 454 7.830 7.830 8.130 -0.300 18053
5389 1 9 . 1 1 25 25 SER N N 455 119.323 119.323 119.802 -0.479 18053
5390 1 9 . 1 1 25 25 SER HA H 455 4.672 4.672 4.876 -0.204 18053
5391 1 9 . 1 1 25 25 SER C C 455 174.426 174.426 173.238 1.188 18053
5392 1 9 . 1 1 25 25 SER CA C 455 55.268 55.268 56.774 -1.506 18053
5393 1 9 . 1 1 25 25 SER CB C 455 65.162 65.162 66.408 -1.246 18053
5394 1 9 . 1 1 25 25 SER H H 455 9.065 9.065 8.856 0.209 18053
5395 1 9 . 1 1 26 26 ILE N N 456 119.468 119.468 123.722 -4.254 18053
5396 1 9 . 1 1 26 26 ILE HA H 456 4.180 4.180 4.022 0.158 18053
5397 1 9 . 1 1 26 26 ILE C C 456 175.506 175.506 176.563 -1.057 18053
5398 1 9 . 1 1 26 26 ILE CA C 456 61.328 61.328 62.115 -0.787 18053
5399 1 9 . 1 1 26 26 ILE CB C 456 37.962 37.962 37.383 0.579 18053
5400 1 9 . 1 1 26 26 ILE H H 456 8.295 8.295 8.733 -0.438 18053
5401 1 9 . 1 1 27 27 GLU N N 457 129.726 129.726 130.490 -0.764 18053
5402 1 9 . 1 1 27 27 GLU HA H 457 4.228 4.228 4.251 -0.023 18053
5403 1 9 . 1 1 27 27 GLU C C 457 175.179 175.179 175.969 -0.790 18053
5404 1 9 . 1 1 27 27 GLU CA C 457 55.432 55.432 57.891 -2.459 18053
5405 1 9 . 1 1 27 27 GLU CB C 457 30.142 30.142 30.864 -0.722 18053
5406 1 9 . 1 1 27 27 GLU H H 457 8.393 8.393 8.699 -0.306 18053
5407 1 9 . 1 1 28 28 GLU N N 458 117.076 117.076 114.877 2.199 18053
5408 1 9 . 1 1 28 28 GLU HA H 458 4.168 4.168 4.645 -0.477 18053
5409 1 9 . 1 1 28 28 GLU C C 458 174.701 174.701 174.810 -0.109 18053
5410 1 9 . 1 1 28 28 GLU CA C 458 56.906 56.906 54.857 2.049 18053
5411 1 9 . 1 1 28 28 GLU CB C 458 31.848 31.848 34.120 -2.272 18053
5412 1 9 . 1 1 28 28 GLU H H 458 7.489 7.489 7.895 -0.406 18053
5413 1 9 . 1 1 29 29 ILE N N 459 122.183 122.183 119.091 3.092 18053
5414 1 9 . 1 1 29 29 ILE HA H 459 3.764 3.764 4.029 -0.265 18053
5415 1 9 . 1 1 29 29 ILE C C 459 174.169 174.169 174.430 -0.261 18053
5416 1 9 . 1 1 29 29 ILE CA C 459 59.526 59.526 59.370 0.156 18053
5417 1 9 . 1 1 29 29 ILE CB C 459 40.309 40.309 41.805 -1.496 18053
5418 1 9 . 1 1 29 29 ILE H H 459 8.126 8.126 8.332 -0.206 18053
5419 1 9 . 1 1 30 30 ASP N N 460 123.205 123.205 122.370 0.835 18053
5420 1 9 . 1 1 30 30 ASP HA H 460 4.183 4.183 4.183 -0.000 18053
5421 1 9 . 1 1 30 30 ASP C C 460 178.318 178.318 177.489 0.829 18053
5422 1 9 . 1 1 30 30 ASP CA C 460 53.930 53.930 53.774 0.156 18053
5423 1 9 . 1 1 30 30 ASP CB C 460 42.807 42.807 42.765 0.042 18053
5424 1 9 . 1 1 30 30 ASP H H 460 6.704 6.704 7.541 -0.837 18053
5425 1 9 . 1 1 31 31 LEU N N 461 128.551 128.551 120.379 8.172 18053
5426 1 9 . 1 1 31 31 LEU HA H 461 4.064 4.064 4.183 -0.119 18053
5427 1 9 . 1 1 31 31 LEU C C 461 177.513 177.513 176.991 0.522 18053
5428 1 9 . 1 1 31 31 LEU CA C 461 57.124 57.124 57.219 -0.095 18053
5429 1 9 . 1 1 31 31 LEU CB C 461 41.237 41.237 41.867 -0.630 18053
5430 1 9 . 1 1 31 31 LEU H H 461 9.012 9.012 8.379 0.633 18053
5431 1 9 . 1 1 32 32 GLU N N 462 115.101 115.101 116.816 -1.715 18053
5432 1 9 . 1 1 32 32 GLU HA H 462 4.283 4.283 4.396 -0.113 18053
5433 1 9 . 1 1 32 32 GLU C C 462 177.062 177.062 176.552 0.510 18053
5434 1 9 . 1 1 32 32 GLU CA C 462 55.759 55.759 56.957 -1.198 18053
5435 1 9 . 1 1 32 32 GLU CB C 462 29.569 29.569 31.336 -1.767 18053
5436 1 9 . 1 1 32 32 GLU H H 462 7.588 7.588 8.109 -0.521 18053
5437 1 9 . 1 1 33 33 GLY N N 463 106.299 106.299 106.124 0.175 18053
5438 1 9 . 1 1 33 33 GLY C C 463 174.824 174.824 174.700 0.124 18053
5439 1 9 . 1 1 33 33 GLY CA C 463 46.806 46.806 44.845 1.961 18053
5440 1 9 . 1 1 33 33 GLY H H 463 7.372 7.372 8.247 -0.875 18053
5441 1 9 . 1 1 34 34 LYS N N 464 118.744 118.744 118.737 0.007 18053
5442 1 9 . 1 1 34 34 LYS HA H 464 4.562 4.562 4.403 0.159 18053
5443 1 9 . 1 1 34 34 LYS C C 464 177.076 177.076 175.185 1.891 18053
5444 1 9 . 1 1 34 34 LYS CA C 464 59.963 59.963 57.434 2.529 18053
5445 1 9 . 1 1 34 34 LYS CB C 464 33.111 33.111 33.064 0.047 18053
5446 1 9 . 1 1 34 34 LYS H H 464 9.547 9.547 7.892 1.655 18053
5447 1 9 . 1 1 35 35 PHE N N 465 109.125 109.125 112.780 -3.655 18053
5448 1 9 . 1 1 35 35 PHE HA H 465 5.514 5.514 5.121 0.393 18053
5449 1 9 . 1 1 35 35 PHE C C 465 174.183 174.183 172.702 1.481 18053
5450 1 9 . 1 1 35 35 PHE CA C 465 56.632 56.632 55.630 1.002 18053
5451 1 9 . 1 1 35 35 PHE CB C 465 40.599 40.599 41.229 -0.630 18053
5452 1 9 . 1 1 35 35 PHE H H 465 6.740 6.740 7.069 -0.329 18053
5453 1 9 . 1 1 36 36 VAL N N 466 119.579 119.579 119.734 -0.155 18053
5454 1 9 . 1 1 36 36 VAL HA H 466 3.709 3.709 4.081 -0.372 18053
5455 1 9 . 1 1 36 36 VAL C C 466 172.668 172.668 174.037 -1.369 18053
5456 1 9 . 1 1 36 36 VAL CA C 466 62.692 62.692 61.143 1.549 18053
5457 1 9 . 1 1 36 36 VAL CB C 466 36.215 36.215 34.448 1.767 18053
5458 1 9 . 1 1 36 36 VAL H H 466 7.628 7.628 8.561 -0.933 18053
5459 1 9 . 1 1 37 37 GLN N N 467 126.831 126.831 127.896 -1.065 18053
5460 1 9 . 1 1 37 37 GLN HA H 467 5.449 5.449 4.766 0.683 18053
5461 1 9 . 1 1 37 37 GLN C C 467 174.797 174.797 174.846 -0.049 18053
5462 1 9 . 1 1 37 37 GLN CA C 467 54.121 54.121 54.960 -0.839 18053
5463 1 9 . 1 1 37 37 GLN CB C 467 34.623 34.623 29.330 5.293 18053
5464 1 9 . 1 1 37 37 GLN H H 467 8.392 8.392 8.407 -0.015 18053
5465 1 9 . 1 1 38 38 LEU N N 468 123.018 123.018 128.565 -5.547 18053
5466 1 9 . 1 1 38 38 LEU HA H 468 5.422 5.422 5.055 0.367 18053
5467 1 9 . 1 1 38 38 LEU C C 468 175.588 175.588 176.285 -0.697 18053
5468 1 9 . 1 1 38 38 LEU CA C 468 52.702 52.702 54.317 -1.615 18053
5469 1 9 . 1 1 38 38 LEU CB C 468 45.046 45.046 44.416 0.630 18053
5470 1 9 . 1 1 38 38 LEU H H 468 9.103 9.103 8.965 0.138 18053
5471 1 9 . 1 1 39 39 LYS N N 469 118.983 118.983 120.435 -1.452 18053
5472 1 9 . 1 1 39 39 LYS HA H 469 4.852 4.852 4.669 0.183 18053
5473 1 9 . 1 1 39 39 LYS C C 469 173.309 173.309 174.130 -0.821 18053
5474 1 9 . 1 1 39 39 LYS CA C 469 54.994 54.994 54.870 0.124 18053
5475 1 9 . 1 1 39 39 LYS CB C 469 38.246 38.246 36.095 2.151 18053
5476 1 9 . 1 1 39 39 LYS H H 469 8.496 8.496 8.913 -0.417 18053
5477 1 9 . 1 1 40 40 ASN N N 470 121.758 121.758 125.634 -3.876 18053
5478 1 9 . 1 1 40 40 ASN HA H 470 4.788 4.788 4.903 -0.115 18053
5479 1 9 . 1 1 40 40 ASN C C 470 174.496 174.496 174.933 -0.437 18053
5480 1 9 . 1 1 40 40 ASN CA C 470 51.119 51.119 52.316 -1.197 18053
5481 1 9 . 1 1 40 40 ASN CB C 470 37.559 37.559 39.274 -1.715 18053
5482 1 9 . 1 1 40 40 ASN H H 470 8.283 8.283 8.596 -0.313 18053
5483 1 9 . 1 1 41 41 ASN N N 471 122.422 122.422 123.085 -0.663 18053
5484 1 9 . 1 1 41 41 ASN HA H 471 4.588 4.588 4.748 -0.160 18053
5485 1 9 . 1 1 41 41 ASN C C 471 174.810 174.810 175.302 -0.492 18053
5486 1 9 . 1 1 41 41 ASN CA C 471 53.985 53.985 52.416 1.569 18053
5487 1 9 . 1 1 41 41 ASN CB C 471 39.600 39.600 38.085 1.515 18053
5488 1 9 . 1 1 41 41 ASN H H 471 8.681 8.681 8.234 0.447 18053
5489 1 9 . 1 1 42 42 SER N N 472 116.446 116.446 117.150 -0.704 18053
5490 1 9 . 1 1 42 42 SER HA H 472 4.719 4.719 4.403 0.316 18053
5491 1 9 . 1 1 42 42 SER C C 472 172.804 172.804 174.849 -2.045 18053
5492 1 9 . 1 1 42 42 SER CA C 472 57.288 57.288 58.527 -1.239 18053
5493 1 9 . 1 1 42 42 SER CB C 472 66.241 66.241 64.553 1.688 18053
5494 1 9 . 1 1 42 42 SER H H 472 8.370 8.370 7.653 0.717 18053
5495 1 9 . 1 1 43 43 ASP N N 473 117.706 117.706 121.583 -3.877 18053
5496 1 9 . 1 1 43 43 ASP HA H 473 4.474 4.474 4.577 -0.103 18053
5497 1 9 . 1 1 43 43 ASP C C 473 175.343 175.343 175.450 -0.107 18053
5498 1 9 . 1 1 43 43 ASP CA C 473 53.521 53.521 56.038 -2.517 18053
5499 1 9 . 1 1 43 43 ASP CB C 473 40.322 40.322 41.207 -0.885 18053
5500 1 9 . 1 1 43 43 ASP H H 473 8.254 8.254 8.844 -0.590 18053
5501 1 9 . 1 1 44 44 LYS N N 474 120.209 120.209 117.685 2.524 18053
5502 1 9 . 1 1 44 44 LYS HA H 474 4.569 4.569 4.523 0.046 18053
5503 1 9 . 1 1 44 44 LYS C C 474 175.397 175.397 174.796 0.601 18053
5504 1 9 . 1 1 44 44 LYS CA C 474 54.012 54.012 54.645 -0.633 18053
5505 1 9 . 1 1 44 44 LYS CB C 474 35.383 35.383 34.477 0.906 18053
5506 1 9 . 1 1 44 44 LYS H H 474 8.305 8.305 7.559 0.746 18053
5507 1 9 . 1 1 45 45 ASP N N 475 124.993 124.993 121.414 3.579 18053
5508 1 9 . 1 1 45 45 ASP HA H 475 3.975 3.975 4.451 -0.476 18053
5509 1 9 . 1 1 45 45 ASP C C 475 174.810 174.810 175.911 -1.101 18053
5510 1 9 . 1 1 45 45 ASP CA C 475 54.995 54.995 55.251 -0.256 18053
5511 1 9 . 1 1 45 45 ASP CB C 475 40.364 40.364 40.779 -0.415 18053
5512 1 9 . 1 1 45 45 ASP H H 475 8.722 8.722 8.524 0.198 18053
5513 1 9 . 1 1 46 46 GLN N N 476 120.549 120.549 125.341 -4.792 18053
5514 1 9 . 1 1 46 46 GLN HA H 476 4.436 4.436 4.453 -0.017 18053
5515 1 9 . 1 1 46 46 GLN C C 476 174.019 174.019 175.316 -1.297 18053
5516 1 9 . 1 1 46 46 GLN CA C 476 53.138 53.138 54.267 -1.129 18053
5517 1 9 . 1 1 46 46 GLN CB C 476 31.466 31.466 29.328 2.138 18053
5518 1 9 . 1 1 46 46 GLN H H 476 7.878 7.878 8.089 -0.211 18053
5519 1 9 . 1 1 47 47 SER N N 477 121.537 121.537 122.158 -0.621 18053
5520 1 9 . 1 1 47 47 SER HA H 477 4.229 4.229 4.293 -0.064 18053
5521 1 9 . 1 1 47 47 SER C C 477 174.565 174.565 173.873 0.692 18053
5522 1 9 . 1 1 47 47 SER CA C 477 58.706 58.706 58.178 0.528 18053
5523 1 9 . 1 1 47 47 SER CB C 477 62.965 62.965 62.972 -0.007 18053
5524 1 9 . 1 1 47 47 SER H H 477 8.748 8.748 8.687 0.061 18053
5525 1 9 . 1 1 48 48 LEU N N 478 127.751 127.751 125.120 2.631 18053
5526 1 9 . 1 1 48 48 LEU HA H 478 2.631 2.631 4.306 -1.675 18053
5527 1 9 . 1 1 48 48 LEU C C 478 176.789 176.789 176.666 0.123 18053
5528 1 9 . 1 1 48 48 LEU CA C 478 52.102 52.102 54.293 -2.191 18053
5529 1 9 . 1 1 48 48 LEU CB C 478 42.343 42.343 43.236 -0.893 18053
5530 1 9 . 1 1 48 48 LEU H H 478 7.856 7.856 7.719 0.137 18053
5531 1 9 . 1 1 49 49 GLY N N 479 107.525 107.525 107.316 0.209 18053
5532 1 9 . 1 1 49 49 GLY C C 479 176.653 176.653 175.257 1.396 18053
5533 1 9 . 1 1 49 49 GLY CA C 479 48.062 48.062 45.793 2.269 18053
5534 1 9 . 1 1 49 49 GLY H H 479 7.728 7.728 8.710 -0.982 18053
5535 1 9 . 1 1 50 50 ASN N N 480 117.059 117.059 119.645 -2.586 18053
5536 1 9 . 1 1 50 50 ASN HA H 480 4.255 4.255 4.579 -0.324 18053
5537 1 9 . 1 1 50 50 ASN C C 480 174.961 174.961 174.708 0.253 18053
5538 1 9 . 1 1 50 50 ASN CA C 480 56.360 56.360 53.940 2.420 18053
5539 1 9 . 1 1 50 50 ASN CB C 480 37.416 37.416 38.883 -1.467 18053
5540 1 9 . 1 1 50 50 ASN H H 480 7.552 7.552 8.726 -1.174 18053
5541 1 9 . 1 1 51 51 TRP N N 481 122.166 122.166 119.171 2.995 18053
5542 1 9 . 1 1 51 51 TRP HA H 481 4.477 4.477 4.720 -0.243 18053
5543 1 9 . 1 1 51 51 TRP C C 481 175.575 175.575 175.762 -0.187 18053
5544 1 9 . 1 1 51 51 TRP CA C 481 58.762 58.762 57.776 0.986 18053
5545 1 9 . 1 1 51 51 TRP CB C 481 28.041 28.041 29.811 -1.770 18053
5546 1 9 . 1 1 51 51 TRP H H 481 8.914 8.914 8.039 0.875 18053
5547 1 9 . 1 1 52 52 ARG N N 482 116.480 116.480 118.687 -2.207 18053
5548 1 9 . 1 1 52 52 ARG HA H 482 5.968 5.968 5.234 0.734 18053
5549 1 9 . 1 1 52 52 ARG C C 482 175.807 175.807 174.930 0.877 18053
5550 1 9 . 1 1 52 52 ARG CA C 482 54.121 54.121 54.587 -0.467 18053
5551 1 9 . 1 1 52 52 ARG CB C 482 35.124 35.124 34.148 0.976 18053
5552 1 9 . 1 1 52 52 ARG H H 482 9.147 9.147 8.769 0.378 18053
5553 1 9 . 1 1 53 53 ILE N N 483 119.579 119.579 125.219 -5.640 18053
5554 1 9 . 1 1 53 53 ILE HA H 483 4.985 4.985 4.914 0.071 18053
5555 1 9 . 1 1 53 53 ILE C C 483 175.670 175.670 175.965 -0.295 18053
5556 1 9 . 1 1 53 53 ILE CA C 483 60.400 60.400 60.659 -0.259 18053
5557 1 9 . 1 1 53 53 ILE CB C 483 40.227 40.227 38.304 1.923 18053
5558 1 9 . 1 1 53 53 ILE H H 483 9.000 9.000 8.706 0.294 18053
5559 1 9 . 1 1 54 54 LYS N N 484 124.737 124.737 128.680 -3.943 18053
5560 1 9 . 1 1 54 54 LYS HA H 484 5.463 5.463 4.929 0.534 18053
5561 1 9 . 1 1 54 54 LYS C C 484 175.575 175.575 176.346 -0.771 18053
5562 1 9 . 1 1 54 54 LYS CA C 484 54.613 54.613 56.678 -2.065 18053
5563 1 9 . 1 1 54 54 LYS CB C 484 35.041 35.041 33.779 1.262 18053
5564 1 9 . 1 1 54 54 LYS H H 484 9.678 9.678 8.677 1.001 18053
5565 1 9 . 1 1 55 55 ARG N N 485 124.090 124.090 122.814 1.276 18053
5566 1 9 . 1 1 55 55 ARG HA H 485 5.525 5.525 4.635 0.890 18053
5567 1 9 . 1 1 55 55 ARG C C 485 174.155 174.155 174.255 -0.100 18053
5568 1 9 . 1 1 55 55 ARG CA C 485 53.903 53.903 54.892 -0.989 18053
5569 1 9 . 1 1 55 55 ARG H H 485 9.314 9.314 8.765 0.549 18053
5570 1 9 . 1 1 56 56 GLN N N 486 126.576 126.576 125.434 1.142 18053
5571 1 9 . 1 1 56 56 GLN HA H 486 4.842 4.842 4.715 0.127 18053
5572 1 9 . 1 1 56 56 GLN C C 486 174.991 174.991 174.908 0.083 18053
5573 1 9 . 1 1 56 56 GLN CA C 486 54.831 54.831 55.173 -0.342 18053
5574 1 9 . 1 1 56 56 GLN CB C 486 31.465 31.465 29.416 2.049 18053
5575 1 9 . 1 1 56 56 GLN H H 486 8.831 8.831 8.455 0.376 18053
5576 1 9 . 1 1 57 57 VAL N N 487 126.712 126.712 123.491 3.221 18053
5577 1 9 . 1 1 57 57 VAL HA H 487 4.266 4.266 4.147 0.119 18053
5578 1 9 . 1 1 57 57 VAL C C 487 175.916 175.916 178.094 -2.178 18053
5579 1 9 . 1 1 57 57 VAL CA C 487 61.820 61.820 63.933 -2.113 18053
5580 1 9 . 1 1 57 57 VAL CB C 487 32.803 32.803 32.161 0.642 18053
5581 1 9 . 1 1 57 57 VAL H H 487 8.786 8.786 8.619 0.167 18053
5582 1 9 . 1 1 58 58 LEU N N 488 127.274 127.274 124.603 2.671 18053
5583 1 9 . 1 1 58 58 LEU HA H 488 4.085 4.085 4.111 -0.026 18053
5584 1 9 . 1 1 58 58 LEU C C 488 177.158 177.158 177.658 -0.500 18053
5585 1 9 . 1 1 58 58 LEU CA C 488 56.906 56.906 58.145 -1.239 18053
5586 1 9 . 1 1 58 58 LEU CB C 488 41.374 41.374 41.409 -0.035 18053
5587 1 9 . 1 1 58 58 LEU H H 488 8.316 8.316 8.440 -0.124 18053
5588 1 9 . 1 1 59 59 GLU N N 489 119.647 119.647 116.424 3.223 18053
5589 1 9 . 1 1 59 59 GLU HA H 489 4.112 4.112 4.234 -0.122 18053
5590 1 9 . 1 1 59 59 GLU C C 489 176.230 176.230 177.330 -1.100 18053
5591 1 9 . 1 1 59 59 GLU CA C 489 57.015 57.015 56.410 0.605 18053
5592 1 9 . 1 1 59 59 GLU CB C 489 28.149 28.149 29.701 -1.552 18053
5593 1 9 . 1 1 59 59 GLU H H 489 8.636 8.636 7.974 0.662 18053
5594 1 9 . 1 1 60 60 GLY N N 490 108.819 108.819 109.032 -0.213 18053
5595 1 9 . 1 1 60 60 GLY C C 490 173.568 173.568 173.515 0.053 18053
5596 1 9 . 1 1 60 60 GLY CA C 490 44.773 44.773 44.724 0.049 18053
5597 1 9 . 1 1 60 60 GLY H H 490 8.160 8.160 7.870 0.290 18053
5598 1 9 . 1 1 61 61 GLU N N 491 121.009 121.009 122.859 -1.850 18053
5599 1 9 . 1 1 61 61 GLU HA H 491 4.323 4.323 4.274 0.049 18053
5600 1 9 . 1 1 61 61 GLU C C 491 175.725 175.725 175.669 0.056 18053
5601 1 9 . 1 1 61 61 GLU CA C 491 56.196 56.196 57.030 -0.834 18053
5602 1 9 . 1 1 61 61 GLU CB C 491 30.865 30.865 29.628 1.237 18053
5603 1 9 . 1 1 61 61 GLU H H 491 8.320 8.320 8.593 -0.273 18053
5604 1 9 . 1 1 62 62 GLU N N 492 123.426 123.426 123.283 0.143 18053
5605 1 9 . 1 1 62 62 GLU HA H 492 5.054 5.054 5.600 -0.546 18053
5606 1 9 . 1 1 62 62 GLU C C 492 175.930 175.930 176.051 -0.121 18053
5607 1 9 . 1 1 62 62 GLU CA C 492 55.650 55.650 54.031 1.619 18053
5608 1 9 . 1 1 62 62 GLU CB C 492 32.312 32.312 32.628 -0.316 18053
5609 1 9 . 1 1 62 62 GLU H H 492 8.594 8.594 8.435 0.159 18053
5610 1 9 . 1 1 63 63 ILE N N 493 119.732 119.732 115.615 4.117 18053
5611 1 9 . 1 1 63 63 ILE HA H 493 4.788 4.788 4.806 -0.018 18053
5612 1 9 . 1 1 63 63 ILE C C 493 174.647 174.647 174.159 0.488 18053
5613 1 9 . 1 1 63 63 ILE CA C 493 60.181 60.181 59.358 0.823 18053
5614 1 9 . 1 1 63 63 ILE CB C 493 41.183 41.183 41.696 -0.513 18053
5615 1 9 . 1 1 63 63 ILE H H 493 8.523 8.523 8.235 0.288 18053
5616 1 9 . 1 1 64 64 ALA N N 494 122.166 122.166 124.585 -2.419 18053
5617 1 9 . 1 1 64 64 ALA HA H 494 5.521 5.521 5.082 0.439 18053
5618 1 9 . 1 1 64 64 ALA C C 494 174.606 174.606 176.227 -1.621 18053
5619 1 9 . 1 1 64 64 ALA CA C 494 51.528 51.528 51.012 0.516 18053
5620 1 9 . 1 1 64 64 ALA CB C 494 22.239 22.239 20.696 1.543 18053
5621 1 9 . 1 1 64 64 ALA H H 494 8.741 8.741 8.466 0.275 18053
5622 1 9 . 1 1 65 65 TYR N N 495 126.729 126.729 126.932 -0.203 18053
5623 1 9 . 1 1 65 65 TYR HA H 495 3.094 3.094 3.761 -0.667 18053
5624 1 9 . 1 1 65 65 TYR C C 495 173.036 173.036 173.792 -0.756 18053
5625 1 9 . 1 1 65 65 TYR CA C 495 56.905 56.905 56.415 0.490 18053
5626 1 9 . 1 1 65 65 TYR CB C 495 40.269 40.269 38.434 1.835 18053
5627 1 9 . 1 1 65 65 TYR H H 495 8.462 8.462 8.567 -0.105 18053
5628 1 9 . 1 1 66 66 LYS N N 496 128.108 128.108 126.051 2.057 18053
5629 1 9 . 1 1 66 66 LYS HA H 496 4.822 4.822 4.698 0.124 18053
5630 1 9 . 1 1 66 66 LYS C C 496 174.906 174.906 174.921 -0.015 18053
5631 1 9 . 1 1 66 66 LYS CA C 496 53.739 53.739 54.477 -0.738 18053
5632 1 9 . 1 1 66 66 LYS CB C 496 34.782 34.782 33.594 1.188 18053
5633 1 9 . 1 1 66 66 LYS H H 496 7.010 7.010 7.548 -0.538 18053
5634 1 9 . 1 1 67 67 PHE N N 497 125.299 125.299 121.949 3.350 18053
5635 1 9 . 1 1 67 67 PHE HA H 497 3.932 3.932 4.182 -0.250 18053
5636 1 9 . 1 1 67 67 PHE C C 497 177.990 177.990 175.279 2.711 18053
5637 1 9 . 1 1 67 67 PHE CA C 497 59.007 59.007 57.525 1.482 18053
5638 1 9 . 1 1 67 67 PHE CB C 497 40.981 40.981 39.964 1.018 18053
5639 1 9 . 1 1 67 67 PHE H H 497 8.509 8.509 8.201 0.308 18053
5640 1 9 . 1 1 68 68 THR N N 498 116.191 116.191 114.946 1.245 18053
5641 1 9 . 1 1 68 68 THR HA H 498 4.417 4.417 4.681 -0.264 18053
5642 1 9 . 1 1 68 68 THR CA C 498 60.855 60.855 58.138 2.717 18053
5643 1 9 . 1 1 68 68 THR CB C 498 68.019 68.019 70.147 -2.128 18053
5644 1 9 . 1 1 68 68 THR H H 498 8.688 8.688 8.287 0.401 18053
5645 1 9 . 1 1 69 69 PRO HA H 499 3.948 3.948 4.434 -0.486 18053
5646 1 9 . 1 1 69 69 PRO C C 499 177.444 177.444 177.508 -0.064 18053
5647 1 9 . 1 1 69 69 PRO CA C 499 66.077 66.077 64.877 1.200 18053
5648 1 9 . 1 1 69 69 PRO CB C 499 32.776 32.776 31.927 0.850 18053
5649 1 9 . 1 1 70 70 LYS N N 500 113.552 113.552 116.895 -3.343 18053
5650 1 9 . 1 1 70 70 LYS HA H 500 4.385 4.385 4.152 0.233 18053
5651 1 9 . 1 1 70 70 LYS C C 500 176.325 176.325 177.216 -0.891 18053
5652 1 9 . 1 1 70 70 LYS CA C 500 54.995 54.995 57.257 -2.262 18053
5653 1 9 . 1 1 70 70 LYS CB C 500 31.793 31.793 32.161 -0.368 18053
5654 1 9 . 1 1 70 70 LYS H H 500 8.016 8.016 7.806 0.210 18053
5655 1 9 . 1 1 71 71 TYR N N 501 121.860 121.860 121.106 0.754 18053
5656 1 9 . 1 1 71 71 TYR HA H 501 3.730 3.730 4.397 -0.667 18053
5657 1 9 . 1 1 71 71 TYR C C 501 174.838 174.838 174.193 0.645 18053
5658 1 9 . 1 1 71 71 TYR CA C 501 62.310 62.310 59.301 3.009 18053
5659 1 9 . 1 1 71 71 TYR CB C 501 38.781 38.781 39.536 -0.755 18053
5660 1 9 . 1 1 71 71 TYR H H 501 7.460 7.460 7.687 -0.227 18053
5661 1 9 . 1 1 72 72 ILE N N 502 129.487 129.487 125.202 4.285 18053
5662 1 9 . 1 1 72 72 ILE HA H 502 3.928 3.928 4.352 -0.424 18053
5663 1 9 . 1 1 72 72 ILE C C 502 172.968 172.968 173.662 -0.694 18053
5664 1 9 . 1 1 72 72 ILE CA C 502 59.308 59.308 59.622 -0.314 18053
5665 1 9 . 1 1 72 72 ILE CB C 502 40.910 40.910 42.214 -1.304 18053
5666 1 9 . 1 1 72 72 ILE H H 502 7.168 7.168 7.833 -0.665 18053
5667 1 9 . 1 1 73 73 LEU N N 503 128.278 128.278 125.019 3.259 18053
5668 1 9 . 1 1 73 73 LEU HA H 503 4.493 4.493 4.744 -0.251 18053
5669 1 9 . 1 1 73 73 LEU C C 503 175.834 175.834 174.873 0.961 18053
5670 1 9 . 1 1 73 73 LEU CA C 503 51.965 51.965 52.452 -0.487 18053
5671 1 9 . 1 1 73 73 LEU CB C 503 42.548 42.548 45.884 -3.336 18053
5672 1 9 . 1 1 73 73 LEU H H 503 8.483 8.483 8.664 -0.181 18053
5673 1 9 . 1 1 74 74 ARG N N 504 129.589 129.589 122.436 7.153 18053
5674 1 9 . 1 1 74 74 ARG HA H 504 3.743 3.743 4.561 -0.818 18053
5675 1 9 . 1 1 74 74 ARG C C 504 175.233 175.233 176.211 -0.978 18053
5676 1 9 . 1 1 74 74 ARG CA C 504 56.851 56.851 54.662 2.189 18053
5677 1 9 . 1 1 74 74 ARG CB C 504 30.292 30.292 30.999 -0.707 18053
5678 1 9 . 1 1 74 74 ARG H H 504 8.673 8.673 8.430 0.243 18053
5679 1 9 . 1 1 75 75 ALA N N 505 123.205 123.205 123.110 0.095 18053
5680 1 9 . 1 1 75 75 ALA HA H 505 3.522 3.522 4.160 -0.638 18053
5681 1 9 . 1 1 75 75 ALA C C 505 178.441 178.441 178.139 0.302 18053
5682 1 9 . 1 1 75 75 ALA CA C 505 53.794 53.794 53.144 0.650 18053
5683 1 9 . 1 1 75 75 ALA CB C 505 18.910 18.910 18.761 0.149 18053
5684 1 9 . 1 1 75 75 ALA H H 505 8.564 8.564 8.110 0.454 18053
5685 1 9 . 1 1 76 76 GLY N N 506 112.241 112.241 112.889 -0.648 18053
5686 1 9 . 1 1 76 76 GLY C C 506 174.278 174.278 174.736 -0.458 18053
5687 1 9 . 1 1 76 76 GLY CA C 506 46.725 46.725 45.897 0.828 18053
5688 1 9 . 1 1 76 76 GLY H H 506 7.381 7.381 8.315 -0.934 18053
5689 1 9 . 1 1 77 77 GLN N N 507 117.382 117.382 118.219 -0.837 18053
5690 1 9 . 1 1 77 77 GLN HA H 507 4.364 4.364 4.655 -0.291 18053
5691 1 9 . 1 1 77 77 GLN C C 507 173.937 173.937 174.509 -0.572 18053
5692 1 9 . 1 1 77 77 GLN CA C 507 54.558 54.558 53.813 0.745 18053
5693 1 9 . 1 1 77 77 GLN CB C 507 30.073 30.073 31.180 -1.107 18053
5694 1 9 . 1 1 77 77 GLN H H 507 7.996 7.996 7.652 0.344 18053
5695 1 9 . 1 1 78 78 MET N N 508 116.957 116.957 116.225 0.732 18053
5696 1 9 . 1 1 78 78 MET HA H 508 5.388 5.388 4.727 0.661 18053
5697 1 9 . 1 1 78 78 MET C C 508 175.807 175.807 173.818 1.989 18053
5698 1 9 . 1 1 78 78 MET CA C 508 54.067 54.067 54.628 -0.561 18053
5699 1 9 . 1 1 78 78 MET CB C 508 37.198 37.198 36.123 1.075 18053
5700 1 9 . 1 1 78 78 MET H H 508 8.092 8.092 8.229 -0.137 18053
5701 1 9 . 1 1 79 79 VAL N N 509 119.340 119.340 118.425 0.915 18053
5702 1 9 . 1 1 79 79 VAL HA H 509 4.956 4.956 4.864 0.092 18053
5703 1 9 . 1 1 79 79 VAL C C 509 172.217 172.217 173.951 -1.734 18053
5704 1 9 . 1 1 79 79 VAL CA C 509 59.471 59.471 60.213 -0.742 18053
5705 1 9 . 1 1 79 79 VAL CB C 509 33.676 33.676 35.156 -1.480 18053
5706 1 9 . 1 1 79 79 VAL H H 509 8.534 8.534 8.370 0.164 18053
5707 1 9 . 1 1 80 80 THR N N 510 124.533 124.533 124.356 0.177 18053
5708 1 9 . 1 1 80 80 THR HA H 510 4.586 4.586 4.926 -0.340 18053
5709 1 9 . 1 1 80 80 THR C C 510 172.215 172.215 173.807 -1.592 18053
5710 1 9 . 1 1 80 80 THR CA C 510 62.119 62.119 61.510 0.609 18053
5711 1 9 . 1 1 80 80 THR CB C 510 69.407 69.407 69.938 -0.531 18053
5712 1 9 . 1 1 80 80 THR H H 510 8.301 8.301 8.822 -0.521 18053
5713 1 9 . 1 1 81 81 VAL N N 511 127.002 127.002 127.413 -0.411 18053
5714 1 9 . 1 1 81 81 VAL HA H 511 4.596 4.596 4.494 0.102 18053
5715 1 9 . 1 1 81 81 VAL C C 511 176.667 176.667 175.951 0.716 18053
5716 1 9 . 1 1 81 81 VAL CA C 511 61.382 61.382 61.677 -0.295 18053
5717 1 9 . 1 1 81 81 VAL CB C 511 30.945 30.945 30.548 0.397 18053
5718 1 9 . 1 1 81 81 VAL H H 511 8.796 8.796 8.808 -0.012 18053
5719 1 9 . 1 1 82 82 TRP N N 512 131.479 131.479 129.636 1.843 18053
5720 1 9 . 1 1 82 82 TRP HA H 512 5.338 5.338 5.214 0.124 18053
5721 1 9 . 1 1 82 82 TRP C C 512 176.885 176.885 175.453 1.432 18053
5722 1 9 . 1 1 82 82 TRP CA C 512 56.442 56.442 57.386 -0.944 18053
5723 1 9 . 1 1 82 82 TRP CB C 512 30.701 30.701 31.079 -0.378 18053
5724 1 9 . 1 1 82 82 TRP H H 512 9.924 9.924 9.564 0.360 18053
5725 1 9 . 1 1 83 83 ALA N N 513 123.954 123.954 120.585 3.369 18053
5726 1 9 . 1 1 83 83 ALA HA H 513 4.308 4.308 4.712 -0.404 18053
5727 1 9 . 1 1 83 83 ALA C C 513 178.140 178.140 178.189 -0.049 18053
5728 1 9 . 1 1 83 83 ALA CA C 513 52.211 52.211 50.277 1.934 18053
5729 1 9 . 1 1 83 83 ALA CB C 513 18.745 18.745 20.476 -1.730 18053
5730 1 9 . 1 1 83 83 ALA H H 513 9.048 9.048 8.929 0.119 18053
5731 1 9 . 1 1 84 84 ALA N N 514 125.146 125.146 125.002 0.144 18053
5732 1 9 . 1 1 84 84 ALA HA H 514 3.951 3.951 4.103 -0.152 18053
5733 1 9 . 1 1 84 84 ALA C C 514 179.519 179.519 179.337 0.182 18053
5734 1 9 . 1 1 84 84 ALA CA C 514 54.804 54.804 54.816 -0.012 18053
5735 1 9 . 1 1 84 84 ALA CB C 514 18.582 18.582 18.912 -0.330 18053
5736 1 9 . 1 1 84 84 ALA H H 514 8.341 8.341 8.407 -0.066 18053
5737 1 9 . 1 1 85 85 GLY N N 515 103.388 103.388 105.013 -1.625 18053
5738 1 9 . 1 1 85 85 GLY C C 515 174.674 174.674 175.126 -0.452 18053
5739 1 9 . 1 1 85 85 GLY CA C 515 45.878 45.878 45.566 0.312 18053
5740 1 9 . 1 1 85 85 GLY H H 515 7.996 7.996 7.793 0.203 18053
5741 1 9 . 1 1 86 86 ALA N N 516 120.140 120.140 122.445 -2.305 18053
5742 1 9 . 1 1 86 86 ALA HA H 516 4.344 4.344 4.404 -0.060 18053
5743 1 9 . 1 1 86 86 ALA C C 516 177.690 177.690 178.202 -0.512 18053
5744 1 9 . 1 1 86 86 ALA CA C 516 53.139 53.139 52.556 0.584 18053
5745 1 9 . 1 1 86 86 ALA CB C 516 20.547 20.547 19.295 1.252 18053
5746 1 9 . 1 1 86 86 ALA H H 516 7.474 7.474 7.358 0.116 18053
5747 1 9 . 1 1 87 87 GLY N N 517 105.720 105.720 107.129 -1.409 18053
5748 1 9 . 1 1 87 87 GLY C C 517 173.650 173.650 174.070 -0.420 18053
5749 1 9 . 1 1 87 87 GLY CA C 517 46.014 46.014 45.183 0.831 18053
5750 1 9 . 1 1 87 87 GLY H H 517 7.779 7.779 7.958 -0.179 18053
5751 1 9 . 1 1 88 88 VAL N N 518 121.537 121.537 119.003 2.534 18053
5752 1 9 . 1 1 88 88 VAL HA H 518 3.585 3.585 4.179 -0.594 18053
5753 1 9 . 1 1 88 88 VAL C C 518 174.851 174.851 174.865 -0.014 18053
5754 1 9 . 1 1 88 88 VAL CA C 518 61.274 61.274 60.467 0.807 18053
5755 1 9 . 1 1 88 88 VAL CB C 518 33.376 33.376 33.716 -0.340 18053
5756 1 9 . 1 1 88 88 VAL H H 518 7.499 7.499 7.713 -0.214 18053
5757 1 9 . 1 1 89 89 ALA N N 519 128.295 128.295 129.544 -1.249 18053
5758 1 9 . 1 1 89 89 ALA HA H 519 4.192 4.192 4.353 -0.161 18053
5759 1 9 . 1 1 89 89 ALA C C 519 176.680 176.680 176.793 -0.113 18053
5760 1 9 . 1 1 89 89 ALA CA C 519 51.283 51.283 51.737 -0.454 18053
5761 1 9 . 1 1 89 89 ALA CB C 519 19.292 19.292 19.113 0.179 18053
5762 1 9 . 1 1 89 89 ALA H H 519 7.960 7.960 8.117 -0.157 18053
5763 1 9 . 1 1 90 90 HIS N N 520 122.643 122.643 124.869 -2.226 18053
5764 1 9 . 1 1 90 90 HIS HA H 520 4.033 4.033 4.406 -0.373 18053
5765 1 9 . 1 1 90 90 HIS C C 520 175.793 175.793 174.450 1.343 18053
5766 1 9 . 1 1 90 90 HIS CA C 520 58.653 58.653 56.012 2.641 18053
5767 1 9 . 1 1 90 90 HIS CB C 520 32.285 32.285 29.836 2.449 18053
5768 1 9 . 1 1 90 90 HIS H H 520 8.394 8.394 8.897 -0.503 18053
5769 1 9 . 1 1 91 91 SER N N 521 121.247 121.247 124.059 -2.812 18053
5770 1 9 . 1 1 91 91 SER HA H 521 4.629 4.629 4.738 -0.109 18053
5771 1 9 . 1 1 91 91 SER CA C 521 55.843 55.843 56.114 -0.271 18053
5772 1 9 . 1 1 91 91 SER CB C 521 62.367 62.367 63.635 -1.268 18053
5773 1 9 . 1 1 91 91 SER H H 521 8.569 8.569 8.603 -0.034 18053
5774 1 9 . 1 1 92 92 PRO HA H 522 4.002 4.002 4.793 -0.791 18053
5775 1 9 . 1 1 92 92 PRO CA C 522 62.244 62.244 62.205 0.039 18053
5776 1 9 . 1 1 92 92 PRO CB C 522 30.931 30.931 31.472 -0.541 18053
5777 1 9 . 1 1 93 93 PRO HA H 523 4.672 4.672 4.978 -0.306 18053
5778 1 9 . 1 1 93 93 PRO C C 523 177.786 177.786 176.117 1.669 18053
5779 1 9 . 1 1 93 93 PRO CA C 523 64.003 64.003 63.252 0.750 18053
5780 1 9 . 1 1 93 93 PRO CB C 523 34.905 34.905 32.213 2.692 18053
5781 1 9 . 1 1 94 94 SER N N 524 117.212 117.212 116.926 0.286 18053
5782 1 9 . 1 1 94 94 SER HA H 524 4.678 4.678 4.801 -0.123 18053
5783 1 9 . 1 1 94 94 SER C C 524 174.851 174.851 174.085 0.766 18053
5784 1 9 . 1 1 94 94 SER CA C 524 61.874 61.874 59.123 2.751 18053
5785 1 9 . 1 1 94 94 SER CB C 524 64.057 64.057 65.595 -1.538 18053
5786 1 9 . 1 1 94 94 SER H H 524 8.463 8.463 7.829 0.634 18053
5787 1 9 . 1 1 95 95 THR N N 525 121.588 121.588 120.149 1.439 18053
5788 1 9 . 1 1 95 95 THR HA H 525 4.859 4.859 5.040 -0.181 18053
5789 1 9 . 1 1 95 95 THR C C 525 172.094 172.094 173.217 -1.123 18053
5790 1 9 . 1 1 95 95 THR CA C 525 62.309 62.309 62.019 0.290 18053
5791 1 9 . 1 1 95 95 THR CB C 525 70.281 70.281 69.429 0.852 18053
5792 1 9 . 1 1 95 95 THR H H 525 7.631 7.631 8.178 -0.547 18053
5793 1 9 . 1 1 96 96 LEU N N 526 127.274 127.274 128.680 -1.406 18053
5794 1 9 . 1 1 96 96 LEU HA H 526 5.131 5.131 5.120 0.011 18053
5795 1 9 . 1 1 96 96 LEU C C 526 175.916 175.916 175.825 0.091 18053
5796 1 9 . 1 1 96 96 LEU CA C 526 52.075 52.075 54.106 -2.031 18053
5797 1 9 . 1 1 96 96 LEU CB C 526 43.790 43.790 44.117 -0.327 18053
5798 1 9 . 1 1 96 96 LEU H H 526 8.977 8.977 8.623 0.354 18053
5799 1 9 . 1 1 97 97 VAL N N 527 124.056 124.056 119.289 4.767 18053
5800 1 9 . 1 1 97 97 VAL HA H 527 4.869 4.869 4.592 0.277 18053
5801 1 9 . 1 1 97 97 VAL C C 527 176.230 176.230 174.916 1.314 18053
5802 1 9 . 1 1 97 97 VAL CA C 527 61.519 61.519 61.042 0.477 18053
5803 1 9 . 1 1 97 97 VAL CB C 527 33.704 33.704 34.231 -0.527 18053
5804 1 9 . 1 1 97 97 VAL H H 527 10.724 10.724 7.686 3.038 18053
5805 1 9 . 1 1 98 98 TRP N N 528 132.586 132.586 130.824 1.762 18053
5806 1 9 . 1 1 98 98 TRP HA H 528 4.965 4.965 4.296 0.669 18053
5807 1 9 . 1 1 98 98 TRP C C 528 173.391 173.391 174.819 -1.428 18053
5808 1 9 . 1 1 98 98 TRP CA C 528 53.303 53.303 54.814 -1.511 18053
5809 1 9 . 1 1 98 98 TRP CB C 528 28.245 28.245 28.356 -0.111 18053
5810 1 9 . 1 1 98 98 TRP H H 528 9.400 9.400 8.687 0.713 18053
5811 1 9 . 1 1 99 99 LYS N N 529 126.644 126.644 129.508 -2.864 18053
5812 1 9 . 1 1 99 99 LYS HA H 529 3.839 3.839 4.102 -0.263 18053
5813 1 9 . 1 1 99 99 LYS C C 529 177.581 177.581 177.360 0.221 18053
5814 1 9 . 1 1 99 99 LYS CA C 529 58.543 58.543 57.668 0.875 18053
5815 1 9 . 1 1 99 99 LYS CB C 529 32.176 32.176 32.922 -0.746 18053
5816 1 9 . 1 1 99 99 LYS H H 529 8.153 8.153 8.150 0.003 18053
5817 1 9 . 1 1 100 100 GLY N N 530 110.385 110.385 112.093 -1.708 18053
5818 1 9 . 1 1 100 100 GLY C C 530 172.367 172.367 173.890 -1.523 18053
5819 1 9 . 1 1 100 100 GLY CA C 530 45.278 45.278 44.955 0.323 18053
5820 1 9 . 1 1 100 100 GLY H H 530 8.363 8.363 8.559 -0.196 18053
5821 1 9 . 1 1 101 101 GLN N N 531 121.162 121.162 122.231 -1.069 18053
5822 1 9 . 1 1 101 101 GLN HA H 531 3.972 3.972 4.085 -0.113 18053
5823 1 9 . 1 1 101 101 GLN CA C 531 52.620 52.620 53.624 -1.004 18053
5824 1 9 . 1 1 101 101 GLN CB C 531 27.595 27.595 27.866 -0.271 18053
5825 1 9 . 1 1 101 101 GLN H H 531 6.815 6.815 7.236 -0.421 18053
5826 1 9 . 1 1 102 102 SER N N 532 122.728 122.728 122.263 0.465 18053
5827 1 9 . 1 1 102 102 SER HA H 532 3.866 3.866 4.345 -0.479 18053
5828 1 9 . 1 1 102 102 SER C C 532 174.537 174.537 176.135 -1.598 18053
5829 1 9 . 1 1 102 102 SER CA C 532 61.983 61.983 61.394 0.589 18053
5830 1 9 . 1 1 102 102 SER CB C 532 62.802 62.802 63.069 -0.267 18053
5831 1 9 . 1 1 102 102 SER H H 532 8.662 8.662 8.380 0.282 18053
5832 1 9 . 1 1 103 103 SER N N 533 110.811 110.811 117.992 -7.181 18053
5833 1 9 . 1 1 103 103 SER HA H 533 4.240 4.240 4.319 -0.079 18053
5834 1 9 . 1 1 103 103 SER C C 533 174.087 174.087 174.440 -0.353 18053
5835 1 9 . 1 1 103 103 SER CA C 533 56.633 56.633 58.899 -2.266 18053
5836 1 9 . 1 1 103 103 SER CB C 533 64.658 64.658 63.520 1.138 18053
5837 1 9 . 1 1 103 103 SER H H 533 7.134 7.134 7.970 -0.836 18053
5838 1 9 . 1 1 104 104 TRP N N 534 126.133 126.133 121.832 4.301 18053
5839 1 9 . 1 1 104 104 TRP HA H 534 4.098 4.098 4.182 -0.084 18053
5840 1 9 . 1 1 104 104 TRP C C 534 176.066 176.066 175.058 1.008 18053
5841 1 9 . 1 1 104 104 TRP CA C 534 60.127 60.127 57.540 2.587 18053
5842 1 9 . 1 1 104 104 TRP CB C 534 28.764 28.764 28.997 -0.233 18053
5843 1 9 . 1 1 104 104 TRP H H 534 9.764 9.764 7.752 2.012 18053
5844 1 9 . 1 1 105 105 GLY N N 535 105.907 105.907 105.719 0.188 18053
5845 1 9 . 1 1 105 105 GLY C C 535 172.217 172.217 174.720 -2.503 18053
5846 1 9 . 1 1 105 105 GLY CA C 535 44.240 44.240 44.653 -0.413 18053
5847 1 9 . 1 1 105 105 GLY H H 535 8.095 8.095 8.139 -0.044 18053
5848 1 9 . 1 1 106 106 THR N N 536 111.253 111.253 112.286 -1.033 18053
5849 1 9 . 1 1 106 106 THR HA H 536 3.859 3.859 4.400 -0.541 18053
5850 1 9 . 1 1 106 106 THR C C 536 172.872 172.872 175.266 -2.394 18053
5851 1 9 . 1 1 106 106 THR CA C 536 59.635 59.635 62.194 -2.559 18053
5852 1 9 . 1 1 106 106 THR CB C 536 70.526 70.526 69.661 0.865 18053
5853 1 9 . 1 1 106 106 THR H H 536 7.913 7.913 8.112 -0.199 18053
5854 1 9 . 1 1 107 107 GLY N N 537 107.712 107.712 113.050 -5.338 18053
5855 1 9 . 1 1 107 107 GLY C C 537 172.709 172.709 172.943 -0.234 18053
5856 1 9 . 1 1 107 107 GLY CA C 537 45.166 45.166 45.195 -0.029 18053
5857 1 9 . 1 1 107 107 GLY H H 537 7.533 7.533 8.368 -0.835 18053
5858 1 9 . 1 1 108 108 GLU N N 538 118.864 118.864 119.337 -0.473 18053
5859 1 9 . 1 1 108 108 GLU HA H 538 4.136 4.136 4.081 0.055 18053
5860 1 9 . 1 1 108 108 GLU C C 538 176.353 176.353 175.386 0.967 18053
5861 1 9 . 1 1 108 108 GLU CA C 538 58.352 58.352 57.468 0.884 18053
5862 1 9 . 1 1 108 108 GLU CB C 538 30.156 30.156 30.012 0.144 18053
5863 1 9 . 1 1 108 108 GLU H H 538 8.558 8.558 8.506 0.052 18053
5864 1 9 . 1 1 109 109 SER N N 539 110.419 110.419 111.613 -1.194 18053
5865 1 9 . 1 1 109 109 SER HA H 539 4.963 4.963 4.743 0.220 18053
5866 1 9 . 1 1 109 109 SER C C 539 173.787 173.787 172.065 1.722 18053
5867 1 9 . 1 1 109 109 SER CA C 539 57.125 57.125 57.284 -0.159 18053
5868 1 9 . 1 1 109 109 SER CB C 539 64.439 64.439 64.423 0.016 18053
5869 1 9 . 1 1 109 109 SER H H 539 7.620 7.620 7.412 0.208 18053
5870 1 9 . 1 1 110 110 PHE N N 540 118.778 118.778 120.159 -1.381 18053
5871 1 9 . 1 1 110 110 PHE HA H 540 5.081 5.081 5.311 -0.230 18053
5872 1 9 . 1 1 110 110 PHE C C 540 176.052 176.052 173.484 2.568 18053
5873 1 9 . 1 1 110 110 PHE CA C 540 56.789 56.789 56.090 0.699 18053
5874 1 9 . 1 1 110 110 PHE CB C 540 40.760 40.760 41.433 -0.673 18053
5875 1 9 . 1 1 110 110 PHE H H 540 8.318 8.318 8.719 -0.401 18053
5876 1 9 . 1 1 112 112 THR HA H 542 5.468 5.468 4.750 0.718 18053
5877 1 9 . 1 1 112 112 THR C C 542 172.381 172.381 173.369 -0.988 18053
5878 1 9 . 1 1 112 112 THR CA C 542 61.818 61.818 63.301 -1.483 18053
5879 1 9 . 1 1 112 112 THR CB C 542 70.990 70.990 69.792 1.198 18053
5880 1 9 . 1 1 113 113 VAL N N 543 124.771 124.771 126.408 -1.637 18053
5881 1 9 . 1 1 113 113 VAL HA H 543 4.864 4.864 4.435 0.429 18053
5882 1 9 . 1 1 113 113 VAL C C 543 173.132 173.132 173.885 -0.753 18053
5883 1 9 . 1 1 113 113 VAL CA C 543 60.099 60.099 61.079 -0.980 18053
5884 1 9 . 1 1 113 113 VAL CB C 543 36.433 36.433 34.927 1.506 18053
5885 1 9 . 1 1 113 113 VAL H H 543 9.380 9.380 8.721 0.659 18053
5886 1 9 . 1 1 114 114 LEU N N 544 128.789 128.789 127.190 1.599 18053
5887 1 9 . 1 1 114 114 LEU HA H 544 5.320 5.320 5.150 0.170 18053
5888 1 9 . 1 1 114 114 LEU C C 544 174.237 174.237 175.157 -0.920 18053
5889 1 9 . 1 1 114 114 LEU CA C 544 53.193 53.193 53.696 -0.503 18053
5890 1 9 . 1 1 114 114 LEU CB C 544 45.879 45.879 44.828 1.051 18053
5891 1 9 . 1 1 114 114 LEU H H 544 8.948 8.948 8.545 0.403 18053
5892 1 9 . 1 1 115 115 VAL N N 545 127.002 127.002 126.627 0.375 18053
5893 1 9 . 1 1 115 115 VAL HA H 545 4.854 4.854 4.744 0.110 18053
5894 1 9 . 1 1 115 115 VAL C C 545 175.206 175.206 175.330 -0.124 18053
5895 1 9 . 1 1 115 115 VAL CA C 545 59.334 59.334 59.641 -0.307 18053
5896 1 9 . 1 1 115 115 VAL CB C 545 34.495 34.495 33.757 0.738 18053
5897 1 9 . 1 1 115 115 VAL H H 545 9.564 9.564 9.044 0.520 18053
5898 1 9 . 1 1 116 116 ASN N N 546 121.179 121.179 121.318 -0.139 18053
5899 1 9 . 1 1 116 116 ASN HA H 546 2.897 2.897 3.602 -0.705 18053
5900 1 9 . 1 1 116 116 ASN C C 546 176.885 176.885 174.498 2.387 18053
5901 1 9 . 1 1 116 116 ASN CA C 546 50.409 50.409 51.108 -0.699 18053
5902 1 9 . 1 1 116 116 ASN CB C 546 36.639 36.639 40.023 -3.384 18053
5903 1 9 . 1 1 116 116 ASN H H 546 8.016 8.016 7.935 0.081 18053
5904 1 9 . 1 1 117 117 ALA N N 547 119.834 119.834 121.336 -1.502 18053
5905 1 9 . 1 1 117 117 ALA HA H 547 3.866 3.866 3.944 -0.078 18053
5906 1 9 . 1 1 117 117 ALA C C 547 177.772 177.772 178.197 -0.425 18053
5907 1 9 . 1 1 117 117 ALA CA C 547 54.504 54.504 54.349 0.156 18053
5908 1 9 . 1 1 117 117 ALA CB C 547 18.200 18.200 18.374 -0.174 18053
5909 1 9 . 1 1 117 117 ALA H H 547 6.444 6.444 7.824 -1.380 18053
5910 1 9 . 1 1 118 118 ASP N N 548 115.646 115.646 117.990 -2.344 18053
5911 1 9 . 1 1 118 118 ASP HA H 548 4.644 4.644 4.371 0.273 18053
5912 1 9 . 1 1 118 118 ASP C C 548 176.052 176.052 177.421 -1.369 18053
5913 1 9 . 1 1 118 118 ASP CA C 548 54.067 54.067 55.575 -1.508 18053
5914 1 9 . 1 1 118 118 ASP CB C 548 41.674 41.674 41.304 0.370 18053
5915 1 9 . 1 1 118 118 ASP H H 548 7.181 7.181 8.038 -0.857 18053
5916 1 9 . 1 1 119 119 GLY N N 549 107.167 107.167 105.850 1.317 18053
5917 1 9 . 1 1 119 119 GLY C C 549 173.841 173.841 173.424 0.417 18053
5918 1 9 . 1 1 119 119 GLY CA C 549 45.455 45.455 44.607 0.848 18053
5919 1 9 . 1 1 119 119 GLY H H 549 7.738 7.738 7.548 0.190 18053
5920 1 9 . 1 1 120 120 GLU N N 550 121.196 121.196 121.557 -0.361 18053
5921 1 9 . 1 1 120 120 GLU HA H 550 4.112 4.112 4.242 -0.130 18053
5922 1 9 . 1 1 120 120 GLU C C 550 175.588 175.588 175.550 0.038 18053
5923 1 9 . 1 1 120 120 GLU CA C 550 54.831 54.831 55.957 -1.126 18053
5924 1 9 . 1 1 120 120 GLU CB C 550 29.937 29.937 30.548 -0.611 18053
5925 1 9 . 1 1 120 120 GLU H H 550 7.587 7.587 7.635 -0.048 18053
5926 1 9 . 1 1 121 121 GLU N N 551 123.886 123.886 123.990 -0.104 18053
5927 1 9 . 1 1 121 121 GLU HA H 551 4.276 4.276 4.354 -0.078 18053
5928 1 9 . 1 1 121 121 GLU C C 551 176.817 176.817 176.559 0.258 18053
5929 1 9 . 1 1 121 121 GLU CA C 551 56.796 56.796 56.196 0.600 18053
5930 1 9 . 1 1 121 121 GLU CB C 551 28.955 28.955 29.032 -0.077 18053
5931 1 9 . 1 1 121 121 GLU H H 551 8.697 8.697 8.706 -0.009 18053
5932 1 9 . 1 1 122 122 VAL N N 552 120.055 120.055 120.191 -0.136 18053
5933 1 9 . 1 1 122 122 VAL HA H 552 4.364 4.364 4.078 0.286 18053
5934 1 9 . 1 1 122 122 VAL C C 552 175.998 175.998 175.726 0.272 18053
5935 1 9 . 1 1 122 122 VAL CA C 552 61.655 61.655 63.101 -1.446 18053
5936 1 9 . 1 1 122 122 VAL CB C 552 33.049 33.049 31.935 1.114 18053
5937 1 9 . 1 1 122 122 VAL H H 552 8.845 8.845 8.217 0.628 18053
5938 1 9 . 1 1 123 123 ALA N N 553 122.098 122.098 121.763 0.335 18053
5939 1 9 . 1 1 123 123 ALA HA H 553 4.890 4.890 4.680 0.210 18053
5940 1 9 . 1 1 123 123 ALA C C 553 175.261 175.261 175.357 -0.096 18053
5941 1 9 . 1 1 123 123 ALA CA C 553 52.757 52.757 51.299 1.458 18053
5942 1 9 . 1 1 123 123 ALA CB C 553 22.267 22.267 21.934 0.333 18053
5943 1 9 . 1 1 123 123 ALA H H 553 7.788 7.788 7.809 -0.021 18053
5944 1 9 . 1 1 124 124 MET N N 554 118.217 118.217 119.827 -1.610 18053
5945 1 9 . 1 1 124 124 MET HA H 554 5.286 5.286 4.973 0.313 18053
5946 1 9 . 1 1 124 124 MET C C 554 174.428 174.428 174.116 0.312 18053
5947 1 9 . 1 1 124 124 MET CA C 554 55.104 55.104 55.934 -0.830 18053
5948 1 9 . 1 1 124 124 MET CB C 554 35.342 35.342 36.090 -0.748 18053
5949 1 9 . 1 1 124 124 MET H H 554 8.693 8.693 8.576 0.117 18053
5950 1 9 . 1 1 125 125 ARG N N 555 122.132 122.132 127.606 -5.474 18053
5951 1 9 . 1 1 125 125 ARG HA H 555 4.900 4.900 4.827 0.073 18053
5952 1 9 . 1 1 125 125 ARG CA C 555 56.388 56.388 55.196 1.192 18053
5953 1 9 . 1 1 125 125 ARG CB C 555 34.378 34.378 33.134 1.244 18053
5954 1 9 . 1 1 125 125 ARG H H 555 8.919 8.919 9.001 -0.082 18053
5955 1 9 . 1 1 126 126 THR HA H 556 4.685 4.685 4.679 0.006 18053
5956 1 9 . 1 1 126 126 THR C C 556 172.436 172.436 173.585 -1.149 18053
5957 1 9 . 1 1 126 126 THR CA C 556 61.382 61.382 62.646 -1.264 18053
5958 1 9 . 1 1 126 126 THR CB C 556 70.444 70.444 69.736 0.709 18053
5959 1 9 . 1 1 127 127 VAL N N 557 124.976 124.976 128.760 -3.784 18053
5960 1 9 . 1 1 127 127 VAL HA H 557 4.146 4.146 4.263 -0.117 18053
5961 1 9 . 1 1 127 127 VAL C C 557 173.937 173.937 173.743 0.194 18053
5962 1 9 . 1 1 127 127 VAL CA C 557 61.109 61.109 60.940 0.170 18053
5963 1 9 . 1 1 127 127 VAL CB C 557 33.759 33.759 33.912 -0.153 18053
5964 1 9 . 1 1 127 127 VAL H H 557 8.127 8.127 8.901 -0.774 18053
5965 1 9 . 1 1 128 128 LYS N N 558 125.384 125.384 126.148 -0.764 18053
5966 1 9 . 1 1 128 128 LYS HA H 558 4.706 4.706 4.568 0.138 18053
5967 1 9 . 1 1 128 128 LYS C C 558 175.534 175.534 175.558 -0.024 18053
5968 1 9 . 1 1 128 128 LYS CA C 558 54.886 54.886 53.196 1.690 18053
5969 1 9 . 1 1 128 128 LYS CB C 558 34.673 34.673 33.840 0.834 18053
5970 1 9 . 1 1 128 128 LYS H H 558 8.289 8.289 8.388 -0.099 18053
5971 1 9 . 1 1 129 129 LYS N N 559 124.005 124.005 126.064 -2.059 18053
5972 1 9 . 1 1 129 129 LYS HA H 559 4.310 4.310 4.138 0.172 18053
5973 1 9 . 1 1 129 129 LYS C C 559 176.571 176.571 176.148 0.423 18053
5974 1 9 . 1 1 129 129 LYS CA C 559 56.742 56.742 57.170 -0.429 18053
5975 1 9 . 1 1 129 129 LYS CB C 559 33.362 33.362 31.762 1.600 18053
5976 1 9 . 1 1 129 129 LYS H H 559 8.461 8.461 8.193 0.268 18053
5977 1 9 . 1 1 130 130 SER N N 560 117.195 117.195 120.451 -3.256 18053
5978 1 9 . 1 1 130 130 SER HA H 560 4.384 4.384 4.487 -0.103 18053
5979 1 9 . 1 1 130 130 SER C C 560 174.565 174.565 173.560 1.005 18053
5980 1 9 . 1 1 130 130 SER CA C 560 58.434 58.434 57.999 0.435 18053
5981 1 9 . 1 1 130 130 SER CB C 560 63.812 63.812 63.755 0.057 18053
5982 1 9 . 1 1 130 130 SER H H 560 8.465 8.465 8.253 0.212 18053
5983 1 9 . 1 1 131 131 SER N N 561 118.149 118.149 118.013 0.136 18053
5984 1 9 . 1 1 131 131 SER HA H 561 4.412 4.412 4.720 -0.308 18053
5985 1 9 . 1 1 131 131 SER C C 561 174.456 174.456 174.166 0.290 18053
5986 1 9 . 1 1 131 131 SER CA C 561 58.489 58.489 57.660 0.829 18053
5987 1 9 . 1 1 131 131 SER CB C 561 63.811 63.811 65.055 -1.244 18053
5988 1 9 . 1 1 131 131 SER H H 561 8.336 8.336 7.790 0.546 18053
5989 1 9 . 1 1 132 132 VAL N N 562 121.332 121.332 121.104 0.228 18053
5990 1 9 . 1 1 132 132 VAL HA H 562 4.035 4.035 4.196 -0.161 18053
5991 1 9 . 1 1 132 132 VAL C C 562 176.066 176.066 175.292 0.774 18053
5992 1 9 . 1 1 132 132 VAL CA C 562 62.446 62.446 62.011 0.435 18053
5993 1 9 . 1 1 132 132 VAL CB C 562 32.394 32.394 31.823 0.571 18053
5994 1 9 . 1 1 132 132 VAL H H 562 7.982 7.982 8.501 -0.519 18053
5995 1 9 . 1 1 133 133 MET N N 563 124.022 124.022 121.289 2.733 18053
5996 1 9 . 1 1 133 133 MET HA H 563 4.385 4.385 4.332 0.053 18053
5997 1 9 . 1 1 133 133 MET C C 563 176.039 176.039 176.038 0.001 18053
5998 1 9 . 1 1 133 133 MET CA C 563 55.350 55.350 55.962 -0.612 18053
5999 1 9 . 1 1 133 133 MET CB C 563 32.503 32.503 32.545 -0.042 18053
6000 1 9 . 1 1 133 133 MET H H 563 8.295 8.295 7.663 0.632 18053
6001 1 9 . 1 1 134 134 ARG N N 564 122.677 122.677 124.606 -1.929 18053
6002 1 9 . 1 1 134 134 ARG HA H 564 4.262 4.262 4.471 -0.209 18053
6003 1 9 . 1 1 134 134 ARG C C 564 176.298 176.298 175.381 0.917 18053
6004 1 9 . 1 1 134 134 ARG CA C 564 56.087 56.087 56.432 -0.345 18053
6005 1 9 . 1 1 134 134 ARG CB C 564 30.702 30.702 30.795 -0.093 18053
6006 1 9 . 1 1 134 134 ARG H H 564 8.295 8.295 8.303 -0.008 18053
6007 1 9 . 1 1 135 135 GLU N N 565 121.945 121.945 125.731 -3.786 18053
6008 1 9 . 1 1 135 135 GLU HA H 565 4.160 4.160 4.456 -0.296 18053
6009 1 9 . 1 1 135 135 GLU C C 565 176.080 176.080 174.362 1.718 18053
6010 1 9 . 1 1 135 135 GLU CA C 565 56.906 56.906 56.447 0.459 18053
6011 1 9 . 1 1 135 135 GLU CB C 565 29.774 29.774 31.267 -1.493 18053
6012 1 9 . 1 1 135 135 GLU H H 565 8.470 8.470 8.617 -0.147 18053
6013 1 9 . 1 1 136 136 ASN N N 566 118.761 118.761 122.333 -3.572 18053
6014 1 9 . 1 1 136 136 ASN HA H 566 4.617 4.617 4.981 -0.364 18053
6015 1 9 . 1 1 136 136 ASN C C 566 175.315 175.315 173.499 1.816 18053
6016 1 9 . 1 1 136 136 ASN CA C 566 53.193 53.193 53.057 0.136 18053
6017 1 9 . 1 1 136 136 ASN CB C 566 38.836 38.836 39.941 -1.105 18053
6018 1 9 . 1 1 136 136 ASN H H 566 8.341 8.341 8.426 -0.085 18053
6019 1 9 . 1 1 137 137 GLU N N 567 121.349 121.349 118.882 2.467 18053
6020 1 9 . 1 1 137 137 GLU HA H 567 4.152 4.152 4.231 -0.079 18053
6021 1 9 . 1 1 137 137 GLU C C 567 176.243 176.243 175.624 0.619 18053
6022 1 9 . 1 1 137 137 GLU CA C 567 56.906 56.906 56.805 0.101 18053
6023 1 9 . 1 1 137 137 GLU CB C 567 29.992 29.992 30.721 -0.729 18053
6024 1 9 . 1 1 137 137 GLU H H 567 8.349 8.349 8.608 -0.259 18053
6025 1 9 . 1 1 138 138 ASN N N 568 118.761 118.761 121.336 -2.575 18053
6026 1 9 . 1 1 138 138 ASN HA H 568 4.712 4.712 4.755 -0.043 18053
6027 1 9 . 1 1 138 138 ASN C C 568 174.551 174.551 175.521 -0.970 18053
6028 1 9 . 1 1 138 138 ASN CA C 568 53.193 53.193 53.482 -0.289 18053
6029 1 9 . 1 1 138 138 ASN CB C 568 39.327 39.327 37.385 1.942 18053
6030 1 9 . 1 1 138 138 ASN H H 568 8.397 8.397 8.320 0.077 18053
6031 1 10 . 1 1 20 20 ALA N N 450 125.180 125.180 125.311 -0.131 18053
6032 1 10 . 1 1 20 20 ALA HA H 450 4.706 4.706 4.650 0.056 18053
6033 1 10 . 1 1 20 20 ALA C C 450 177.226 177.226 176.301 0.925 18053
6034 1 10 . 1 1 20 20 ALA CA C 450 52.757 52.757 51.860 0.897 18053
6035 1 10 . 1 1 20 20 ALA CB C 450 20.411 20.411 20.289 0.122 18053
6036 1 10 . 1 1 20 20 ALA H H 450 8.484 8.484 8.456 0.028 18053
6037 1 10 . 1 1 21 21 SER N N 451 115.714 115.714 116.881 -1.167 18053
6038 1 10 . 1 1 21 21 SER HA H 451 4.513 4.513 4.321 0.192 18053
6039 1 10 . 1 1 21 21 SER C C 451 174.742 174.742 175.095 -0.353 18053
6040 1 10 . 1 1 21 21 SER CA C 451 58.516 58.516 58.361 0.155 18053
6041 1 10 . 1 1 21 21 SER CB C 451 64.159 64.159 62.131 2.028 18053
6042 1 10 . 1 1 21 21 SER H H 451 8.487 8.487 8.218 0.269 18053
6043 1 10 . 1 1 22 22 GLY N N 452 111.509 111.509 116.117 -4.608 18053
6044 1 10 . 1 1 22 22 GLY C C 452 174.401 174.401 174.847 -0.446 18053
6045 1 10 . 1 1 22 22 GLY CA C 452 45.059 45.059 45.086 -0.027 18053
6046 1 10 . 1 1 22 22 GLY H H 452 8.198 8.198 8.471 -0.273 18053
6047 1 10 . 1 1 23 23 SER N N 453 116.191 116.191 115.236 0.955 18053
6048 1 10 . 1 1 23 23 SER HA H 453 4.364 4.364 4.447 -0.083 18053
6049 1 10 . 1 1 23 23 SER C C 453 173.432 173.432 174.130 -0.698 18053
6050 1 10 . 1 1 23 23 SER CA C 453 59.744 59.744 61.120 -1.376 18053
6051 1 10 . 1 1 23 23 SER CB C 453 64.335 64.335 64.442 -0.107 18053
6052 1 10 . 1 1 23 23 SER H H 453 8.494 8.494 8.017 0.477 18053
6053 1 10 . 1 1 24 24 VAL N N 454 121.656 121.656 117.759 3.897 18053
6054 1 10 . 1 1 24 24 VAL HA H 454 5.035 5.035 4.271 0.764 18053
6055 1 10 . 1 1 24 24 VAL C C 454 174.606 174.606 174.779 -0.173 18053
6056 1 10 . 1 1 24 24 VAL CA C 454 61.055 61.055 60.778 0.278 18053
6057 1 10 . 1 1 24 24 VAL CB C 454 32.503 32.503 33.353 -0.850 18053
6058 1 10 . 1 1 24 24 VAL H H 454 7.830 7.830 8.017 -0.187 18053
6059 1 10 . 1 1 25 25 SER N N 455 119.323 119.323 117.940 1.383 18053
6060 1 10 . 1 1 25 25 SER HA H 455 4.672 4.672 4.932 -0.260 18053
6061 1 10 . 1 1 25 25 SER C C 455 174.426 174.426 173.287 1.139 18053
6062 1 10 . 1 1 25 25 SER CA C 455 55.268 55.268 55.161 0.107 18053
6063 1 10 . 1 1 25 25 SER CB C 455 65.162 65.162 65.156 0.007 18053
6064 1 10 . 1 1 25 25 SER H H 455 9.065 9.065 8.773 0.292 18053
6065 1 10 . 1 1 26 26 ILE N N 456 119.468 119.468 121.875 -2.407 18053
6066 1 10 . 1 1 26 26 ILE HA H 456 4.180 4.180 4.262 -0.082 18053
6067 1 10 . 1 1 26 26 ILE C C 456 175.506 175.506 175.375 0.131 18053
6068 1 10 . 1 1 26 26 ILE CA C 456 61.328 61.328 61.391 -0.063 18053
6069 1 10 . 1 1 26 26 ILE CB C 456 37.962 37.962 38.216 -0.254 18053
6070 1 10 . 1 1 26 26 ILE H H 456 8.295 8.295 8.639 -0.344 18053
6071 1 10 . 1 1 27 27 GLU N N 457 129.726 129.726 129.485 0.241 18053
6072 1 10 . 1 1 27 27 GLU HA H 457 4.228 4.228 4.316 -0.088 18053
6073 1 10 . 1 1 27 27 GLU C C 457 175.179 175.179 176.860 -1.681 18053
6074 1 10 . 1 1 27 27 GLU CA C 457 55.432 55.432 57.472 -2.040 18053
6075 1 10 . 1 1 27 27 GLU CB C 457 30.142 30.142 31.342 -1.200 18053
6076 1 10 . 1 1 27 27 GLU H H 457 8.393 8.393 8.871 -0.478 18053
6077 1 10 . 1 1 28 28 GLU N N 458 117.076 117.076 117.504 -0.428 18053
6078 1 10 . 1 1 28 28 GLU HA H 458 4.168 4.168 4.641 -0.473 18053
6079 1 10 . 1 1 28 28 GLU C C 458 174.701 174.701 175.117 -0.416 18053
6080 1 10 . 1 1 28 28 GLU CA C 458 56.906 56.906 54.340 2.566 18053
6081 1 10 . 1 1 28 28 GLU CB C 458 31.848 31.848 32.787 -0.939 18053
6082 1 10 . 1 1 28 28 GLU H H 458 7.489 7.489 8.165 -0.676 18053
6083 1 10 . 1 1 29 29 ILE N N 459 122.183 122.183 119.171 3.012 18053
6084 1 10 . 1 1 29 29 ILE HA H 459 3.764 3.764 4.085 -0.321 18053
6085 1 10 . 1 1 29 29 ILE C C 459 174.169 174.169 174.886 -0.717 18053
6086 1 10 . 1 1 29 29 ILE CA C 459 59.526 59.526 59.552 -0.026 18053
6087 1 10 . 1 1 29 29 ILE CB C 459 40.309 40.309 42.051 -1.742 18053
6088 1 10 . 1 1 29 29 ILE H H 459 8.126 8.126 8.202 -0.076 18053
6089 1 10 . 1 1 30 30 ASP N N 460 123.205 123.205 122.849 0.356 18053
6090 1 10 . 1 1 30 30 ASP HA H 460 4.183 4.183 4.150 0.033 18053
6091 1 10 . 1 1 30 30 ASP C C 460 178.318 178.318 177.437 0.881 18053
6092 1 10 . 1 1 30 30 ASP CA C 460 53.930 53.930 53.997 -0.067 18053
6093 1 10 . 1 1 30 30 ASP CB C 460 42.807 42.807 42.222 0.585 18053
6094 1 10 . 1 1 30 30 ASP H H 460 6.704 6.704 7.448 -0.744 18053
6095 1 10 . 1 1 31 31 LEU N N 461 128.551 128.551 121.700 6.851 18053
6096 1 10 . 1 1 31 31 LEU HA H 461 4.064 4.064 4.118 -0.054 18053
6097 1 10 . 1 1 31 31 LEU C C 461 177.513 177.513 177.450 0.063 18053
6098 1 10 . 1 1 31 31 LEU CA C 461 57.124 57.124 57.146 -0.022 18053
6099 1 10 . 1 1 31 31 LEU CB C 461 41.237 41.237 42.012 -0.775 18053
6100 1 10 . 1 1 31 31 LEU H H 461 9.012 9.012 8.267 0.745 18053
6101 1 10 . 1 1 32 32 GLU N N 462 115.101 115.101 117.080 -1.979 18053
6102 1 10 . 1 1 32 32 GLU HA H 462 4.283 4.283 4.321 -0.038 18053
6103 1 10 . 1 1 32 32 GLU C C 462 177.062 177.062 176.953 0.109 18053
6104 1 10 . 1 1 32 32 GLU CA C 462 55.759 55.759 57.007 -1.248 18053
6105 1 10 . 1 1 32 32 GLU CB C 462 29.569 29.569 30.777 -1.208 18053
6106 1 10 . 1 1 32 32 GLU H H 462 7.588 7.588 7.798 -0.210 18053
6107 1 10 . 1 1 33 33 GLY N N 463 106.299 106.299 106.660 -0.361 18053
6108 1 10 . 1 1 33 33 GLY C C 463 174.824 174.824 174.937 -0.113 18053
6109 1 10 . 1 1 33 33 GLY CA C 463 46.806 46.806 44.846 1.960 18053
6110 1 10 . 1 1 33 33 GLY H H 463 7.372 7.372 8.054 -0.682 18053
6111 1 10 . 1 1 34 34 LYS N N 464 118.744 118.744 119.132 -0.388 18053
6112 1 10 . 1 1 34 34 LYS HA H 464 4.562 4.562 4.305 0.257 18053
6113 1 10 . 1 1 34 34 LYS C C 464 177.076 177.076 175.078 1.998 18053
6114 1 10 . 1 1 34 34 LYS CA C 464 59.963 59.963 57.670 2.293 18053
6115 1 10 . 1 1 34 34 LYS CB C 464 33.111 33.111 33.406 -0.295 18053
6116 1 10 . 1 1 34 34 LYS H H 464 9.547 9.547 8.110 1.437 18053
6117 1 10 . 1 1 35 35 PHE N N 465 109.125 109.125 111.737 -2.612 18053
6118 1 10 . 1 1 35 35 PHE HA H 465 5.514 5.514 4.886 0.628 18053
6119 1 10 . 1 1 35 35 PHE C C 465 174.183 174.183 172.720 1.463 18053
6120 1 10 . 1 1 35 35 PHE CA C 465 56.632 56.632 55.312 1.320 18053
6121 1 10 . 1 1 35 35 PHE CB C 465 40.599 40.599 40.934 -0.336 18053
6122 1 10 . 1 1 35 35 PHE H H 465 6.740 6.740 6.972 -0.232 18053
6123 1 10 . 1 1 36 36 VAL N N 466 119.579 119.579 119.993 -0.414 18053
6124 1 10 . 1 1 36 36 VAL HA H 466 3.709 3.709 4.097 -0.388 18053
6125 1 10 . 1 1 36 36 VAL C C 466 172.668 172.668 174.338 -1.670 18053
6126 1 10 . 1 1 36 36 VAL CA C 466 62.692 62.692 61.132 1.560 18053
6127 1 10 . 1 1 36 36 VAL CB C 466 36.215 36.215 33.786 2.429 18053
6128 1 10 . 1 1 36 36 VAL H H 466 7.628 7.628 8.282 -0.654 18053
6129 1 10 . 1 1 37 37 GLN N N 467 126.831 126.831 128.592 -1.761 18053
6130 1 10 . 1 1 37 37 GLN HA H 467 5.449 5.449 4.794 0.655 18053
6131 1 10 . 1 1 37 37 GLN C C 467 174.797 174.797 174.738 0.059 18053
6132 1 10 . 1 1 37 37 GLN CA C 467 54.121 54.121 54.897 -0.776 18053
6133 1 10 . 1 1 37 37 GLN CB C 467 34.623 34.623 29.255 5.368 18053
6134 1 10 . 1 1 37 37 GLN H H 467 8.392 8.392 8.424 -0.032 18053
6135 1 10 . 1 1 38 38 LEU N N 468 123.018 123.018 127.899 -4.881 18053
6136 1 10 . 1 1 38 38 LEU HA H 468 5.422 5.422 4.918 0.504 18053
6137 1 10 . 1 1 38 38 LEU C C 468 175.588 175.588 175.832 -0.244 18053
6138 1 10 . 1 1 38 38 LEU CA C 468 52.702 52.702 53.992 -1.290 18053
6139 1 10 . 1 1 38 38 LEU CB C 468 45.046 45.046 44.241 0.805 18053
6140 1 10 . 1 1 38 38 LEU H H 468 9.103 9.103 9.183 -0.080 18053
6141 1 10 . 1 1 39 39 LYS N N 469 118.983 118.983 121.043 -2.060 18053
6142 1 10 . 1 1 39 39 LYS HA H 469 4.852 4.852 4.863 -0.011 18053
6143 1 10 . 1 1 39 39 LYS C C 469 173.309 173.309 174.588 -1.279 18053
6144 1 10 . 1 1 39 39 LYS CA C 469 54.994 54.994 54.421 0.573 18053
6145 1 10 . 1 1 39 39 LYS CB C 469 38.246 38.246 36.442 1.804 18053
6146 1 10 . 1 1 39 39 LYS H H 469 8.496 8.496 8.605 -0.109 18053
6147 1 10 . 1 1 40 40 ASN N N 470 121.758 121.758 124.163 -2.405 18053
6148 1 10 . 1 1 40 40 ASN HA H 470 4.788 4.788 4.917 -0.129 18053
6149 1 10 . 1 1 40 40 ASN C C 470 174.496 174.496 174.513 -0.017 18053
6150 1 10 . 1 1 40 40 ASN CA C 470 51.119 51.119 53.126 -2.007 18053
6151 1 10 . 1 1 40 40 ASN CB C 470 37.559 37.559 40.507 -2.947 18053
6152 1 10 . 1 1 40 40 ASN H H 470 8.283 8.283 8.751 -0.468 18053
6153 1 10 . 1 1 41 41 ASN N N 471 122.422 122.422 123.968 -1.546 18053
6154 1 10 . 1 1 41 41 ASN HA H 471 4.588 4.588 4.878 -0.290 18053
6155 1 10 . 1 1 41 41 ASN C C 471 174.810 174.810 174.729 0.081 18053
6156 1 10 . 1 1 41 41 ASN CA C 471 53.985 53.985 53.040 0.945 18053
6157 1 10 . 1 1 41 41 ASN CB C 471 39.600 39.600 39.526 0.074 18053
6158 1 10 . 1 1 41 41 ASN H H 471 8.681 8.681 8.346 0.335 18053
6159 1 10 . 1 1 42 42 SER N N 472 116.446 116.446 115.513 0.933 18053
6160 1 10 . 1 1 42 42 SER HA H 472 4.719 4.719 4.460 0.259 18053
6161 1 10 . 1 1 42 42 SER C C 472 172.804 172.804 174.621 -1.817 18053
6162 1 10 . 1 1 42 42 SER CA C 472 57.288 57.288 57.924 -0.636 18053
6163 1 10 . 1 1 42 42 SER CB C 472 66.241 66.241 64.455 1.786 18053
6164 1 10 . 1 1 42 42 SER H H 472 8.370 8.370 8.037 0.333 18053
6165 1 10 . 1 1 43 43 ASP N N 473 117.706 117.706 119.668 -1.962 18053
6166 1 10 . 1 1 43 43 ASP HA H 473 4.474 4.474 4.567 -0.093 18053
6167 1 10 . 1 1 43 43 ASP C C 473 175.343 175.343 175.782 -0.439 18053
6168 1 10 . 1 1 43 43 ASP CA C 473 53.521 53.521 55.099 -1.578 18053
6169 1 10 . 1 1 43 43 ASP CB C 473 40.322 40.322 41.316 -0.994 18053
6170 1 10 . 1 1 43 43 ASP H H 473 8.254 8.254 8.512 -0.258 18053
6171 1 10 . 1 1 44 44 LYS N N 474 120.209 120.209 119.728 0.481 18053
6172 1 10 . 1 1 44 44 LYS HA H 474 4.569 4.569 4.382 0.187 18053
6173 1 10 . 1 1 44 44 LYS C C 474 175.397 175.397 175.319 0.078 18053
6174 1 10 . 1 1 44 44 LYS CA C 474 54.012 54.012 54.681 -0.669 18053
6175 1 10 . 1 1 44 44 LYS CB C 474 35.383 35.383 34.137 1.246 18053
6176 1 10 . 1 1 44 44 LYS H H 474 8.305 8.305 7.541 0.764 18053
6177 1 10 . 1 1 45 45 ASP N N 475 124.993 124.993 120.068 4.925 18053
6178 1 10 . 1 1 45 45 ASP HA H 475 3.975 3.975 4.342 -0.367 18053
6179 1 10 . 1 1 45 45 ASP C C 475 174.810 174.810 175.814 -1.004 18053
6180 1 10 . 1 1 45 45 ASP CA C 475 54.995 54.995 54.037 0.958 18053
6181 1 10 . 1 1 45 45 ASP CB C 475 40.364 40.364 41.107 -0.743 18053
6182 1 10 . 1 1 45 45 ASP H H 475 8.722 8.722 8.317 0.405 18053
6183 1 10 . 1 1 46 46 GLN N N 476 120.549 120.549 122.375 -1.826 18053
6184 1 10 . 1 1 46 46 GLN HA H 476 4.436 4.436 4.420 0.016 18053
6185 1 10 . 1 1 46 46 GLN C C 476 174.019 174.019 175.114 -1.095 18053
6186 1 10 . 1 1 46 46 GLN CA C 476 53.138 53.138 54.103 -0.965 18053
6187 1 10 . 1 1 46 46 GLN CB C 476 31.466 31.466 29.601 1.865 18053
6188 1 10 . 1 1 46 46 GLN H H 476 7.878 7.878 8.062 -0.184 18053
6189 1 10 . 1 1 47 47 SER N N 477 121.537 121.537 121.025 0.512 18053
6190 1 10 . 1 1 47 47 SER HA H 477 4.229 4.229 4.130 0.099 18053
6191 1 10 . 1 1 47 47 SER C C 477 174.565 174.565 173.821 0.744 18053
6192 1 10 . 1 1 47 47 SER CA C 477 58.706 58.706 58.553 0.153 18053
6193 1 10 . 1 1 47 47 SER CB C 477 62.965 62.965 63.075 -0.110 18053
6194 1 10 . 1 1 47 47 SER H H 477 8.748 8.748 8.581 0.167 18053
6195 1 10 . 1 1 48 48 LEU N N 478 127.751 127.751 126.303 1.448 18053
6196 1 10 . 1 1 48 48 LEU HA H 478 2.631 2.631 4.321 -1.690 18053
6197 1 10 . 1 1 48 48 LEU C C 478 176.789 176.789 177.262 -0.473 18053
6198 1 10 . 1 1 48 48 LEU CA C 478 52.102 52.102 53.786 -1.684 18053
6199 1 10 . 1 1 48 48 LEU CB C 478 42.343 42.343 44.762 -2.419 18053
6200 1 10 . 1 1 48 48 LEU H H 478 7.856 7.856 7.502 0.354 18053
6201 1 10 . 1 1 49 49 GLY N N 479 107.525 107.525 107.305 0.220 18053
6202 1 10 . 1 1 49 49 GLY C C 479 176.653 176.653 175.332 1.321 18053
6203 1 10 . 1 1 49 49 GLY CA C 479 48.062 48.062 45.982 2.080 18053
6204 1 10 . 1 1 49 49 GLY H H 479 7.728 7.728 8.715 -0.987 18053
6205 1 10 . 1 1 50 50 ASN N N 480 117.059 117.059 119.149 -2.090 18053
6206 1 10 . 1 1 50 50 ASN HA H 480 4.255 4.255 4.571 -0.316 18053
6207 1 10 . 1 1 50 50 ASN C C 480 174.961 174.961 175.564 -0.603 18053
6208 1 10 . 1 1 50 50 ASN CA C 480 56.360 56.360 55.196 1.164 18053
6209 1 10 . 1 1 50 50 ASN CB C 480 37.416 37.416 39.000 -1.584 18053
6210 1 10 . 1 1 50 50 ASN H H 480 7.552 7.552 8.572 -1.020 18053
6211 1 10 . 1 1 51 51 TRP N N 481 122.166 122.166 117.780 4.386 18053
6212 1 10 . 1 1 51 51 TRP HA H 481 4.477 4.477 4.740 -0.263 18053
6213 1 10 . 1 1 51 51 TRP C C 481 175.575 175.575 175.744 -0.169 18053
6214 1 10 . 1 1 51 51 TRP CA C 481 58.762 58.762 58.060 0.702 18053
6215 1 10 . 1 1 51 51 TRP CB C 481 28.041 28.041 30.424 -2.383 18053
6216 1 10 . 1 1 51 51 TRP H H 481 8.914 8.914 7.699 1.215 18053
6217 1 10 . 1 1 52 52 ARG N N 482 116.480 116.480 115.229 1.251 18053
6218 1 10 . 1 1 52 52 ARG HA H 482 5.968 5.968 5.127 0.841 18053
6219 1 10 . 1 1 52 52 ARG C C 482 175.807 175.807 174.571 1.236 18053
6220 1 10 . 1 1 52 52 ARG CA C 482 54.121 54.121 55.276 -1.155 18053
6221 1 10 . 1 1 52 52 ARG CB C 482 35.124 35.124 33.863 1.261 18053
6222 1 10 . 1 1 52 52 ARG H H 482 9.147 9.147 9.264 -0.117 18053
6223 1 10 . 1 1 53 53 ILE N N 483 119.579 119.579 124.376 -4.797 18053
6224 1 10 . 1 1 53 53 ILE HA H 483 4.985 4.985 4.955 0.030 18053
6225 1 10 . 1 1 53 53 ILE C C 483 175.670 175.670 175.643 0.027 18053
6226 1 10 . 1 1 53 53 ILE CA C 483 60.400 60.400 60.478 -0.078 18053
6227 1 10 . 1 1 53 53 ILE CB C 483 40.227 40.227 39.344 0.883 18053
6228 1 10 . 1 1 53 53 ILE H H 483 9.000 9.000 8.824 0.176 18053
6229 1 10 . 1 1 54 54 LYS N N 484 124.737 124.737 128.125 -3.388 18053
6230 1 10 . 1 1 54 54 LYS HA H 484 5.463 5.463 4.794 0.669 18053
6231 1 10 . 1 1 54 54 LYS C C 484 175.575 175.575 175.770 -0.195 18053
6232 1 10 . 1 1 54 54 LYS CA C 484 54.613 54.613 56.480 -1.867 18053
6233 1 10 . 1 1 54 54 LYS CB C 484 35.041 35.041 33.836 1.205 18053
6234 1 10 . 1 1 54 54 LYS H H 484 9.678 9.678 8.742 0.936 18053
6235 1 10 . 1 1 55 55 ARG N N 485 124.090 124.090 125.332 -1.242 18053
6236 1 10 . 1 1 55 55 ARG HA H 485 5.525 5.525 5.213 0.312 18053
6237 1 10 . 1 1 55 55 ARG C C 485 174.155 174.155 174.342 -0.187 18053
6238 1 10 . 1 1 55 55 ARG CA C 485 53.903 53.903 55.455 -1.552 18053
6239 1 10 . 1 1 55 55 ARG H H 485 9.314 9.314 8.808 0.506 18053
6240 1 10 . 1 1 56 56 GLN N N 486 126.576 126.576 126.928 -0.352 18053
6241 1 10 . 1 1 56 56 GLN HA H 486 4.842 4.842 4.728 0.114 18053
6242 1 10 . 1 1 56 56 GLN C C 486 174.991 174.991 174.539 0.452 18053
6243 1 10 . 1 1 56 56 GLN CA C 486 54.831 54.831 54.347 0.484 18053
6244 1 10 . 1 1 56 56 GLN CB C 486 31.465 31.465 29.223 2.242 18053
6245 1 10 . 1 1 56 56 GLN H H 486 8.831 8.831 8.737 0.094 18053
6246 1 10 . 1 1 57 57 VAL N N 487 126.712 126.712 124.635 2.077 18053
6247 1 10 . 1 1 57 57 VAL HA H 487 4.266 4.266 4.206 0.060 18053
6248 1 10 . 1 1 57 57 VAL C C 487 175.916 175.916 177.664 -1.748 18053
6249 1 10 . 1 1 57 57 VAL CA C 487 61.820 61.820 61.702 0.118 18053
6250 1 10 . 1 1 57 57 VAL CB C 487 32.803 32.803 32.652 0.151 18053
6251 1 10 . 1 1 57 57 VAL H H 487 8.786 8.786 8.504 0.282 18053
6252 1 10 . 1 1 58 58 LEU N N 488 127.274 127.274 124.920 2.354 18053
6253 1 10 . 1 1 58 58 LEU HA H 488 4.085 4.085 4.167 -0.082 18053
6254 1 10 . 1 1 58 58 LEU C C 488 177.158 177.158 177.679 -0.521 18053
6255 1 10 . 1 1 58 58 LEU CA C 488 56.906 56.906 57.666 -0.760 18053
6256 1 10 . 1 1 58 58 LEU CB C 488 41.374 41.374 41.715 -0.341 18053
6257 1 10 . 1 1 58 58 LEU H H 488 8.316 8.316 8.502 -0.186 18053
6258 1 10 . 1 1 59 59 GLU N N 489 119.647 119.647 119.550 0.097 18053
6259 1 10 . 1 1 59 59 GLU HA H 489 4.112 4.112 4.179 -0.067 18053
6260 1 10 . 1 1 59 59 GLU C C 489 176.230 176.230 177.534 -1.304 18053
6261 1 10 . 1 1 59 59 GLU CA C 489 57.015 57.015 56.787 0.228 18053
6262 1 10 . 1 1 59 59 GLU CB C 489 28.149 28.149 29.241 -1.092 18053
6263 1 10 . 1 1 59 59 GLU H H 489 8.636 8.636 8.317 0.319 18053
6264 1 10 . 1 1 60 60 GLY N N 490 108.819 108.819 107.216 1.603 18053
6265 1 10 . 1 1 60 60 GLY C C 490 173.568 173.568 173.697 -0.129 18053
6266 1 10 . 1 1 60 60 GLY CA C 490 44.773 44.773 45.091 -0.318 18053
6267 1 10 . 1 1 60 60 GLY H H 490 8.160 8.160 8.067 0.093 18053
6268 1 10 . 1 1 61 61 GLU N N 491 121.009 121.009 122.351 -1.342 18053
6269 1 10 . 1 1 61 61 GLU HA H 491 4.323 4.323 4.326 -0.003 18053
6270 1 10 . 1 1 61 61 GLU C C 491 175.725 175.725 175.497 0.228 18053
6271 1 10 . 1 1 61 61 GLU CA C 491 56.196 56.196 55.577 0.619 18053
6272 1 10 . 1 1 61 61 GLU CB C 491 30.865 30.865 29.118 1.747 18053
6273 1 10 . 1 1 61 61 GLU H H 491 8.320 8.320 8.223 0.097 18053
6274 1 10 . 1 1 62 62 GLU N N 492 123.426 123.426 124.934 -1.508 18053
6275 1 10 . 1 1 62 62 GLU HA H 492 5.054 5.054 5.506 -0.452 18053
6276 1 10 . 1 1 62 62 GLU C C 492 175.930 175.930 176.312 -0.382 18053
6277 1 10 . 1 1 62 62 GLU CA C 492 55.650 55.650 54.728 0.922 18053
6278 1 10 . 1 1 62 62 GLU CB C 492 32.312 32.312 31.539 0.773 18053
6279 1 10 . 1 1 62 62 GLU H H 492 8.594 8.594 8.441 0.153 18053
6280 1 10 . 1 1 63 63 ILE N N 493 119.732 119.732 117.441 2.291 18053
6281 1 10 . 1 1 63 63 ILE HA H 493 4.788 4.788 4.758 0.030 18053
6282 1 10 . 1 1 63 63 ILE C C 493 174.647 174.647 174.123 0.524 18053
6283 1 10 . 1 1 63 63 ILE CA C 493 60.181 60.181 59.249 0.932 18053
6284 1 10 . 1 1 63 63 ILE CB C 493 41.183 41.183 41.629 -0.446 18053
6285 1 10 . 1 1 63 63 ILE H H 493 8.523 8.523 8.314 0.209 18053
6286 1 10 . 1 1 64 64 ALA N N 494 122.166 122.166 124.592 -2.426 18053
6287 1 10 . 1 1 64 64 ALA HA H 494 5.521 5.521 5.194 0.328 18053
6288 1 10 . 1 1 64 64 ALA C C 494 174.606 174.606 176.238 -1.632 18053
6289 1 10 . 1 1 64 64 ALA CA C 494 51.528 51.528 50.957 0.571 18053
6290 1 10 . 1 1 64 64 ALA CB C 494 22.239 22.239 20.642 1.597 18053
6291 1 10 . 1 1 64 64 ALA H H 494 8.741 8.741 8.431 0.310 18053
6292 1 10 . 1 1 65 65 TYR N N 495 126.729 126.729 127.535 -0.806 18053
6293 1 10 . 1 1 65 65 TYR HA H 495 3.094 3.094 3.628 -0.534 18053
6294 1 10 . 1 1 65 65 TYR C C 495 173.036 173.036 173.670 -0.634 18053
6295 1 10 . 1 1 65 65 TYR CA C 495 56.905 56.905 56.038 0.867 18053
6296 1 10 . 1 1 65 65 TYR CB C 495 40.269 40.269 38.636 1.633 18053
6297 1 10 . 1 1 65 65 TYR H H 495 8.462 8.462 8.403 0.059 18053
6298 1 10 . 1 1 66 66 LYS N N 496 128.108 128.108 127.095 1.013 18053
6299 1 10 . 1 1 66 66 LYS HA H 496 4.822 4.822 4.415 0.407 18053
6300 1 10 . 1 1 66 66 LYS C C 496 174.906 174.906 174.936 -0.030 18053
6301 1 10 . 1 1 66 66 LYS CA C 496 53.739 53.739 54.845 -1.106 18053
6302 1 10 . 1 1 66 66 LYS CB C 496 34.782 34.782 33.154 1.628 18053
6303 1 10 . 1 1 66 66 LYS H H 496 7.010 7.010 7.284 -0.274 18053
6304 1 10 . 1 1 67 67 PHE N N 497 125.299 125.299 121.221 4.078 18053
6305 1 10 . 1 1 67 67 PHE HA H 497 3.932 3.932 4.138 -0.206 18053
6306 1 10 . 1 1 67 67 PHE C C 497 177.990 177.990 175.781 2.209 18053
6307 1 10 . 1 1 67 67 PHE CA C 497 59.007 59.007 57.745 1.262 18053
6308 1 10 . 1 1 67 67 PHE CB C 497 40.981 40.981 40.308 0.673 18053
6309 1 10 . 1 1 67 67 PHE H H 497 8.509 8.509 8.170 0.339 18053
6310 1 10 . 1 1 68 68 THR N N 498 116.191 116.191 111.933 4.258 18053
6311 1 10 . 1 1 68 68 THR HA H 498 4.417 4.417 4.655 -0.238 18053
6312 1 10 . 1 1 68 68 THR CA C 498 60.855 60.855 59.166 1.689 18053
6313 1 10 . 1 1 68 68 THR CB C 498 68.019 68.019 69.530 -1.511 18053
6314 1 10 . 1 1 68 68 THR H H 498 8.688 8.688 8.445 0.243 18053
6315 1 10 . 1 1 69 69 PRO HA H 499 3.948 3.948 4.495 -0.547 18053
6316 1 10 . 1 1 69 69 PRO C C 499 177.444 177.444 176.913 0.531 18053
6317 1 10 . 1 1 69 69 PRO CA C 499 66.077 66.077 64.712 1.365 18053
6318 1 10 . 1 1 69 69 PRO CB C 499 32.776 32.776 31.882 0.894 18053
6319 1 10 . 1 1 70 70 LYS N N 500 113.552 113.552 116.364 -2.812 18053
6320 1 10 . 1 1 70 70 LYS HA H 500 4.385 4.385 4.246 0.139 18053
6321 1 10 . 1 1 70 70 LYS C C 500 176.325 176.325 176.173 0.152 18053
6322 1 10 . 1 1 70 70 LYS CA C 500 54.995 54.995 56.454 -1.459 18053
6323 1 10 . 1 1 70 70 LYS CB C 500 31.793 31.793 31.694 0.099 18053
6324 1 10 . 1 1 70 70 LYS H H 500 8.016 8.016 7.882 0.134 18053
6325 1 10 . 1 1 71 71 TYR N N 501 121.860 121.860 121.266 0.594 18053
6326 1 10 . 1 1 71 71 TYR HA H 501 3.730 3.730 4.584 -0.854 18053
6327 1 10 . 1 1 71 71 TYR C C 501 174.838 174.838 173.578 1.260 18053
6328 1 10 . 1 1 71 71 TYR CA C 501 62.310 62.310 57.947 4.363 18053
6329 1 10 . 1 1 71 71 TYR CB C 501 38.781 38.781 40.335 -1.554 18053
6330 1 10 . 1 1 71 71 TYR H H 501 7.460 7.460 7.775 -0.315 18053
6331 1 10 . 1 1 72 72 ILE N N 502 129.487 129.487 126.001 3.486 18053
6332 1 10 . 1 1 72 72 ILE HA H 502 3.928 3.928 4.155 -0.227 18053
6333 1 10 . 1 1 72 72 ILE C C 502 172.968 172.968 173.196 -0.228 18053
6334 1 10 . 1 1 72 72 ILE CA C 502 59.308 59.308 59.460 -0.152 18053
6335 1 10 . 1 1 72 72 ILE CB C 502 40.910 40.910 41.072 -0.162 18053
6336 1 10 . 1 1 72 72 ILE H H 502 7.168 7.168 8.080 -0.912 18053
6337 1 10 . 1 1 73 73 LEU N N 503 128.278 128.278 127.214 1.064 18053
6338 1 10 . 1 1 73 73 LEU HA H 503 4.493 4.493 4.508 -0.015 18053
6339 1 10 . 1 1 73 73 LEU C C 503 175.834 175.834 174.920 0.914 18053
6340 1 10 . 1 1 73 73 LEU CA C 503 51.965 51.965 52.992 -1.027 18053
6341 1 10 . 1 1 73 73 LEU CB C 503 42.548 42.548 43.702 -1.154 18053
6342 1 10 . 1 1 73 73 LEU H H 503 8.483 8.483 8.137 0.346 18053
6343 1 10 . 1 1 74 74 ARG N N 504 129.589 129.589 125.766 3.823 18053
6344 1 10 . 1 1 74 74 ARG HA H 504 3.743 3.743 4.246 -0.503 18053
6345 1 10 . 1 1 74 74 ARG C C 504 175.233 175.233 175.291 -0.058 18053
6346 1 10 . 1 1 74 74 ARG CA C 504 56.851 56.851 55.146 1.705 18053
6347 1 10 . 1 1 74 74 ARG CB C 504 30.292 30.292 30.976 -0.684 18053
6348 1 10 . 1 1 74 74 ARG H H 504 8.673 8.673 8.400 0.273 18053
6349 1 10 . 1 1 75 75 ALA N N 505 123.205 123.205 124.174 -0.969 18053
6350 1 10 . 1 1 75 75 ALA HA H 505 3.522 3.522 4.432 -0.910 18053
6351 1 10 . 1 1 75 75 ALA C C 505 178.441 178.441 178.371 0.070 18053
6352 1 10 . 1 1 75 75 ALA CA C 505 53.794 53.794 52.102 1.692 18053
6353 1 10 . 1 1 75 75 ALA CB C 505 18.910 18.910 18.784 0.126 18053
6354 1 10 . 1 1 75 75 ALA H H 505 8.564 8.564 8.313 0.251 18053
6355 1 10 . 1 1 76 76 GLY N N 506 112.241 112.241 111.410 0.831 18053
6356 1 10 . 1 1 76 76 GLY C C 506 174.278 174.278 174.600 -0.322 18053
6357 1 10 . 1 1 76 76 GLY CA C 506 46.725 46.725 45.575 1.150 18053
6358 1 10 . 1 1 76 76 GLY H H 506 7.381 7.381 8.723 -1.342 18053
6359 1 10 . 1 1 77 77 GLN N N 507 117.382 117.382 119.410 -2.028 18053
6360 1 10 . 1 1 77 77 GLN HA H 507 4.364 4.364 4.715 -0.351 18053
6361 1 10 . 1 1 77 77 GLN C C 507 173.937 173.937 174.766 -0.829 18053
6362 1 10 . 1 1 77 77 GLN CA C 507 54.558 54.558 53.888 0.670 18053
6363 1 10 . 1 1 77 77 GLN CB C 507 30.073 30.073 30.803 -0.730 18053
6364 1 10 . 1 1 77 77 GLN H H 507 7.996 7.996 7.566 0.430 18053
6365 1 10 . 1 1 78 78 MET N N 508 116.957 116.957 115.649 1.308 18053
6366 1 10 . 1 1 78 78 MET HA H 508 5.388 5.388 5.049 0.339 18053
6367 1 10 . 1 1 78 78 MET C C 508 175.807 175.807 174.196 1.611 18053
6368 1 10 . 1 1 78 78 MET CA C 508 54.067 54.067 54.536 -0.469 18053
6369 1 10 . 1 1 78 78 MET CB C 508 37.198 37.198 36.392 0.806 18053
6370 1 10 . 1 1 78 78 MET H H 508 8.092 8.092 8.315 -0.223 18053
6371 1 10 . 1 1 79 79 VAL N N 509 119.340 119.340 121.694 -2.354 18053
6372 1 10 . 1 1 79 79 VAL HA H 509 4.956 4.956 4.760 0.196 18053
6373 1 10 . 1 1 79 79 VAL C C 509 172.217 172.217 174.574 -2.357 18053
6374 1 10 . 1 1 79 79 VAL CA C 509 59.471 59.471 59.816 -0.345 18053
6375 1 10 . 1 1 79 79 VAL CB C 509 33.676 33.676 34.875 -1.199 18053
6376 1 10 . 1 1 79 79 VAL H H 509 8.534 8.534 8.332 0.202 18053
6377 1 10 . 1 1 80 80 THR N N 510 124.533 124.533 125.061 -0.528 18053
6378 1 10 . 1 1 80 80 THR HA H 510 4.586 4.586 4.655 -0.069 18053
6379 1 10 . 1 1 80 80 THR C C 510 172.215 172.215 174.219 -2.004 18053
6380 1 10 . 1 1 80 80 THR CA C 510 62.119 62.119 61.744 0.375 18053
6381 1 10 . 1 1 80 80 THR CB C 510 69.407 69.407 68.577 0.830 18053
6382 1 10 . 1 1 80 80 THR H H 510 8.301 8.301 8.752 -0.451 18053
6383 1 10 . 1 1 81 81 VAL N N 511 127.002 127.002 128.754 -1.752 18053
6384 1 10 . 1 1 81 81 VAL HA H 511 4.596 4.596 4.525 0.071 18053
6385 1 10 . 1 1 81 81 VAL C C 511 176.667 176.667 175.526 1.141 18053
6386 1 10 . 1 1 81 81 VAL CA C 511 61.382 61.382 62.011 -0.629 18053
6387 1 10 . 1 1 81 81 VAL CB C 511 30.945 30.945 31.187 -0.242 18053
6388 1 10 . 1 1 81 81 VAL H H 511 8.796 8.796 8.642 0.154 18053
6389 1 10 . 1 1 82 82 TRP N N 512 131.479 131.479 129.376 2.103 18053
6390 1 10 . 1 1 82 82 TRP HA H 512 5.338 5.338 5.135 0.203 18053
6391 1 10 . 1 1 82 82 TRP C C 512 176.885 176.885 175.411 1.474 18053
6392 1 10 . 1 1 82 82 TRP CA C 512 56.442 56.442 57.165 -0.723 18053
6393 1 10 . 1 1 82 82 TRP CB C 512 30.701 30.701 31.947 -1.246 18053
6394 1 10 . 1 1 82 82 TRP H H 512 9.924 9.924 8.463 1.461 18053
6395 1 10 . 1 1 83 83 ALA N N 513 123.954 123.954 120.537 3.417 18053
6396 1 10 . 1 1 83 83 ALA HA H 513 4.308 4.308 5.159 -0.851 18053
6397 1 10 . 1 1 83 83 ALA C C 513 178.140 178.140 178.109 0.031 18053
6398 1 10 . 1 1 83 83 ALA CA C 513 52.211 52.211 50.463 1.748 18053
6399 1 10 . 1 1 83 83 ALA CB C 513 18.745 18.745 20.816 -2.071 18053
6400 1 10 . 1 1 83 83 ALA H H 513 9.048 9.048 8.566 0.482 18053
6401 1 10 . 1 1 84 84 ALA N N 514 125.146 125.146 125.127 0.019 18053
6402 1 10 . 1 1 84 84 ALA HA H 514 3.951 3.951 4.249 -0.298 18053
6403 1 10 . 1 1 84 84 ALA C C 514 179.519 179.519 179.537 -0.018 18053
6404 1 10 . 1 1 84 84 ALA CA C 514 54.804 54.804 55.020 -0.216 18053
6405 1 10 . 1 1 84 84 ALA CB C 514 18.582 18.582 19.201 -0.619 18053
6406 1 10 . 1 1 84 84 ALA H H 514 8.341 8.341 8.383 -0.042 18053
6407 1 10 . 1 1 85 85 GLY N N 515 103.388 103.388 105.254 -1.866 18053
6408 1 10 . 1 1 85 85 GLY C C 515 174.674 174.674 174.647 0.027 18053
6409 1 10 . 1 1 85 85 GLY CA C 515 45.878 45.878 45.234 0.644 18053
6410 1 10 . 1 1 85 85 GLY H H 515 7.996 7.996 8.112 -0.116 18053
6411 1 10 . 1 1 86 86 ALA N N 516 120.140 120.140 123.178 -3.038 18053
6412 1 10 . 1 1 86 86 ALA HA H 516 4.344 4.344 4.561 -0.217 18053
6413 1 10 . 1 1 86 86 ALA C C 516 177.690 177.690 177.481 0.209 18053
6414 1 10 . 1 1 86 86 ALA CA C 516 53.139 53.139 51.644 1.495 18053
6415 1 10 . 1 1 86 86 ALA CB C 516 20.547 20.547 19.121 1.426 18053
6416 1 10 . 1 1 86 86 ALA H H 516 7.474 7.474 7.482 -0.008 18053
6417 1 10 . 1 1 87 87 GLY N N 517 105.720 105.720 108.315 -2.595 18053
6418 1 10 . 1 1 87 87 GLY C C 517 173.650 173.650 173.886 -0.236 18053
6419 1 10 . 1 1 87 87 GLY CA C 517 46.014 46.014 45.299 0.715 18053
6420 1 10 . 1 1 87 87 GLY H H 517 7.779 7.779 8.021 -0.242 18053
6421 1 10 . 1 1 88 88 VAL N N 518 121.537 121.537 119.581 1.956 18053
6422 1 10 . 1 1 88 88 VAL HA H 518 3.585 3.585 4.238 -0.653 18053
6423 1 10 . 1 1 88 88 VAL C C 518 174.851 174.851 173.634 1.217 18053
6424 1 10 . 1 1 88 88 VAL CA C 518 61.274 61.274 61.007 0.267 18053
6425 1 10 . 1 1 88 88 VAL CB C 518 33.376 33.376 33.921 -0.545 18053
6426 1 10 . 1 1 88 88 VAL H H 518 7.499 7.499 7.527 -0.028 18053
6427 1 10 . 1 1 89 89 ALA N N 519 128.295 128.295 129.687 -1.392 18053
6428 1 10 . 1 1 89 89 ALA HA H 519 4.192 4.192 4.584 -0.392 18053
6429 1 10 . 1 1 89 89 ALA C C 519 176.680 176.680 176.411 0.269 18053
6430 1 10 . 1 1 89 89 ALA CA C 519 51.283 51.283 50.682 0.601 18053
6431 1 10 . 1 1 89 89 ALA CB C 519 19.292 19.292 19.978 -0.686 18053
6432 1 10 . 1 1 89 89 ALA H H 519 7.960 7.960 8.128 -0.168 18053
6433 1 10 . 1 1 90 90 HIS N N 520 122.643 122.643 122.100 0.543 18053
6434 1 10 . 1 1 90 90 HIS HA H 520 4.033 4.033 4.462 -0.429 18053
6435 1 10 . 1 1 90 90 HIS C C 520 175.793 175.793 174.487 1.306 18053
6436 1 10 . 1 1 90 90 HIS CA C 520 58.653 58.653 56.536 2.116 18053
6437 1 10 . 1 1 90 90 HIS CB C 520 32.285 32.285 29.517 2.768 18053
6438 1 10 . 1 1 90 90 HIS H H 520 8.394 8.394 8.807 -0.413 18053
6439 1 10 . 1 1 91 91 SER N N 521 121.247 121.247 123.724 -2.477 18053
6440 1 10 . 1 1 91 91 SER HA H 521 4.629 4.629 4.721 -0.092 18053
6441 1 10 . 1 1 91 91 SER CA C 521 55.843 55.843 55.941 -0.098 18053
6442 1 10 . 1 1 91 91 SER CB C 521 62.367 62.367 63.636 -1.269 18053
6443 1 10 . 1 1 91 91 SER H H 521 8.569 8.569 8.388 0.181 18053
6444 1 10 . 1 1 92 92 PRO HA H 522 4.002 4.002 4.891 -0.889 18053
6445 1 10 . 1 1 92 92 PRO CA C 522 62.244 62.244 62.282 -0.038 18053
6446 1 10 . 1 1 92 92 PRO CB C 522 30.931 30.931 31.535 -0.604 18053
6447 1 10 . 1 1 93 93 PRO HA H 523 4.672 4.672 5.038 -0.366 18053
6448 1 10 . 1 1 93 93 PRO C C 523 177.786 177.786 177.654 0.132 18053
6449 1 10 . 1 1 93 93 PRO CA C 523 64.003 64.003 63.674 0.329 18053
6450 1 10 . 1 1 93 93 PRO CB C 523 34.905 34.905 32.685 2.220 18053
6451 1 10 . 1 1 94 94 SER N N 524 117.212 117.212 116.691 0.521 18053
6452 1 10 . 1 1 94 94 SER HA H 524 4.678 4.678 4.594 0.084 18053
6453 1 10 . 1 1 94 94 SER C C 524 174.851 174.851 174.333 0.518 18053
6454 1 10 . 1 1 94 94 SER CA C 524 61.874 61.874 60.165 1.709 18053
6455 1 10 . 1 1 94 94 SER CB C 524 64.057 64.057 64.281 -0.224 18053
6456 1 10 . 1 1 94 94 SER H H 524 8.463 8.463 8.059 0.404 18053
6457 1 10 . 1 1 95 95 THR N N 525 121.588 121.588 118.741 2.847 18053
6458 1 10 . 1 1 95 95 THR HA H 525 4.859 4.859 5.126 -0.267 18053
6459 1 10 . 1 1 95 95 THR C C 525 172.094 172.094 172.637 -0.543 18053
6460 1 10 . 1 1 95 95 THR CA C 525 62.309 62.309 61.894 0.415 18053
6461 1 10 . 1 1 95 95 THR CB C 525 70.281 70.281 70.607 -0.326 18053
6462 1 10 . 1 1 95 95 THR H H 525 7.631 7.631 7.916 -0.285 18053
6463 1 10 . 1 1 96 96 LEU N N 526 127.274 127.274 129.851 -2.577 18053
6464 1 10 . 1 1 96 96 LEU HA H 526 5.131 5.131 5.057 0.074 18053
6465 1 10 . 1 1 96 96 LEU C C 526 175.916 175.916 176.032 -0.116 18053
6466 1 10 . 1 1 96 96 LEU CA C 526 52.075 52.075 53.775 -1.700 18053
6467 1 10 . 1 1 96 96 LEU CB C 526 43.790 43.790 42.978 0.812 18053
6468 1 10 . 1 1 96 96 LEU H H 526 8.977 8.977 8.393 0.584 18053
6469 1 10 . 1 1 97 97 VAL N N 527 124.056 124.056 124.696 -0.640 18053
6470 1 10 . 1 1 97 97 VAL HA H 527 4.869 4.869 4.396 0.473 18053
6471 1 10 . 1 1 97 97 VAL C C 527 176.230 176.230 175.832 0.398 18053
6472 1 10 . 1 1 97 97 VAL CA C 527 61.519 61.519 62.105 -0.586 18053
6473 1 10 . 1 1 97 97 VAL CB C 527 33.704 33.704 32.679 1.025 18053
6474 1 10 . 1 1 97 97 VAL H H 527 10.724 10.724 8.653 2.071 18053
6475 1 10 . 1 1 98 98 TRP N N 528 132.586 132.586 131.870 0.716 18053
6476 1 10 . 1 1 98 98 TRP HA H 528 4.965 4.965 4.459 0.506 18053
6477 1 10 . 1 1 98 98 TRP C C 528 173.391 173.391 174.806 -1.415 18053
6478 1 10 . 1 1 98 98 TRP CA C 528 53.303 53.303 55.049 -1.746 18053
6479 1 10 . 1 1 98 98 TRP CB C 528 28.245 28.245 28.033 0.212 18053
6480 1 10 . 1 1 98 98 TRP H H 528 9.400 9.400 9.182 0.218 18053
6481 1 10 . 1 1 99 99 LYS N N 529 126.644 126.644 128.307 -1.663 18053
6482 1 10 . 1 1 99 99 LYS HA H 529 3.839 3.839 4.159 -0.320 18053
6483 1 10 . 1 1 99 99 LYS C C 529 177.581 177.581 177.117 0.464 18053
6484 1 10 . 1 1 99 99 LYS CA C 529 58.543 58.543 57.592 0.951 18053
6485 1 10 . 1 1 99 99 LYS CB C 529 32.176 32.176 32.295 -0.119 18053
6486 1 10 . 1 1 99 99 LYS H H 529 8.153 8.153 8.065 0.088 18053
6487 1 10 . 1 1 100 100 GLY N N 530 110.385 110.385 113.656 -3.271 18053
6488 1 10 . 1 1 100 100 GLY C C 530 172.367 172.367 173.857 -1.490 18053
6489 1 10 . 1 1 100 100 GLY CA C 530 45.278 45.278 44.725 0.553 18053
6490 1 10 . 1 1 100 100 GLY H H 530 8.363 8.363 8.540 -0.177 18053
6491 1 10 . 1 1 101 101 GLN N N 531 121.162 121.162 123.518 -2.356 18053
6492 1 10 . 1 1 101 101 GLN HA H 531 3.972 3.972 4.140 -0.168 18053
6493 1 10 . 1 1 101 101 GLN CA C 531 52.620 52.620 54.455 -1.835 18053
6494 1 10 . 1 1 101 101 GLN CB C 531 27.595 27.595 27.719 -0.124 18053
6495 1 10 . 1 1 101 101 GLN H H 531 6.815 6.815 7.410 -0.595 18053
6496 1 10 . 1 1 102 102 SER N N 532 122.728 122.728 121.978 0.750 18053
6497 1 10 . 1 1 102 102 SER HA H 532 3.866 3.866 4.368 -0.502 18053
6498 1 10 . 1 1 102 102 SER C C 532 174.537 174.537 175.772 -1.235 18053
6499 1 10 . 1 1 102 102 SER CA C 532 61.983 61.983 60.779 1.204 18053
6500 1 10 . 1 1 102 102 SER CB C 532 62.802 62.802 63.217 -0.415 18053
6501 1 10 . 1 1 102 102 SER H H 532 8.662 8.662 8.660 0.002 18053
6502 1 10 . 1 1 103 103 SER N N 533 110.811 110.811 114.426 -3.615 18053
6503 1 10 . 1 1 103 103 SER HA H 533 4.240 4.240 4.565 -0.325 18053
6504 1 10 . 1 1 103 103 SER C C 533 174.087 174.087 173.610 0.477 18053
6505 1 10 . 1 1 103 103 SER CA C 533 56.633 56.633 58.964 -2.331 18053
6506 1 10 . 1 1 103 103 SER CB C 533 64.658 64.658 64.045 0.613 18053
6507 1 10 . 1 1 103 103 SER H H 533 7.134 7.134 7.584 -0.450 18053
6508 1 10 . 1 1 104 104 TRP N N 534 126.133 126.133 119.571 6.562 18053
6509 1 10 . 1 1 104 104 TRP HA H 534 4.098 4.098 4.095 0.003 18053
6510 1 10 . 1 1 104 104 TRP C C 534 176.066 176.066 175.238 0.828 18053
6511 1 10 . 1 1 104 104 TRP CA C 534 60.127 60.127 58.256 1.871 18053
6512 1 10 . 1 1 104 104 TRP CB C 534 28.764 28.764 28.679 0.085 18053
6513 1 10 . 1 1 104 104 TRP H H 534 9.764 9.764 7.452 2.312 18053
6514 1 10 . 1 1 105 105 GLY N N 535 105.907 105.907 104.906 1.001 18053
6515 1 10 . 1 1 105 105 GLY C C 535 172.217 172.217 174.193 -1.976 18053
6516 1 10 . 1 1 105 105 GLY CA C 535 44.240 44.240 45.053 -0.813 18053
6517 1 10 . 1 1 105 105 GLY H H 535 8.095 8.095 7.578 0.517 18053
6518 1 10 . 1 1 106 106 THR N N 536 111.253 111.253 112.218 -0.965 18053
6519 1 10 . 1 1 106 106 THR HA H 536 3.859 3.859 4.289 -0.430 18053
6520 1 10 . 1 1 106 106 THR C C 536 172.872 172.872 174.432 -1.560 18053
6521 1 10 . 1 1 106 106 THR CA C 536 59.635 59.635 62.182 -2.547 18053
6522 1 10 . 1 1 106 106 THR CB C 536 70.526 70.526 69.506 1.020 18053
6523 1 10 . 1 1 106 106 THR H H 536 7.913 7.913 7.728 0.185 18053
6524 1 10 . 1 1 107 107 GLY N N 537 107.712 107.712 108.846 -1.134 18053
6525 1 10 . 1 1 107 107 GLY C C 537 172.709 172.709 172.929 -0.220 18053
6526 1 10 . 1 1 107 107 GLY CA C 537 45.166 45.166 45.181 -0.015 18053
6527 1 10 . 1 1 107 107 GLY H H 537 7.533 7.533 7.732 -0.199 18053
6528 1 10 . 1 1 108 108 GLU N N 538 118.864 118.864 119.980 -1.116 18053
6529 1 10 . 1 1 108 108 GLU HA H 538 4.136 4.136 4.289 -0.153 18053
6530 1 10 . 1 1 108 108 GLU C C 538 176.353 176.353 175.234 1.119 18053
6531 1 10 . 1 1 108 108 GLU CA C 538 58.352 58.352 57.831 0.521 18053
6532 1 10 . 1 1 108 108 GLU CB C 538 30.156 30.156 30.550 -0.394 18053
6533 1 10 . 1 1 108 108 GLU H H 538 8.558 8.558 8.886 -0.328 18053
6534 1 10 . 1 1 109 109 SER N N 539 110.419 110.419 112.375 -1.956 18053
6535 1 10 . 1 1 109 109 SER HA H 539 4.963 4.963 5.092 -0.129 18053
6536 1 10 . 1 1 109 109 SER C C 539 173.787 173.787 172.996 0.791 18053
6537 1 10 . 1 1 109 109 SER CA C 539 57.125 57.125 57.341 -0.216 18053
6538 1 10 . 1 1 109 109 SER CB C 539 64.439 64.439 65.271 -0.832 18053
6539 1 10 . 1 1 109 109 SER H H 539 7.620 7.620 7.845 -0.225 18053
6540 1 10 . 1 1 110 110 PHE N N 540 118.778 118.778 119.454 -0.676 18053
6541 1 10 . 1 1 110 110 PHE HA H 540 5.081 5.081 5.253 -0.172 18053
6542 1 10 . 1 1 110 110 PHE C C 540 176.052 176.052 173.667 2.385 18053
6543 1 10 . 1 1 110 110 PHE CA C 540 56.789 56.789 56.370 0.419 18053
6544 1 10 . 1 1 110 110 PHE CB C 540 40.760 40.760 42.129 -1.369 18053
6545 1 10 . 1 1 110 110 PHE H H 540 8.318 8.318 8.483 -0.165 18053
6546 1 10 . 1 1 112 112 THR HA H 542 5.468 5.468 5.200 0.268 18053
6547 1 10 . 1 1 112 112 THR C C 542 172.381 172.381 173.545 -1.164 18053
6548 1 10 . 1 1 112 112 THR CA C 542 61.818 61.818 62.111 -0.293 18053
6549 1 10 . 1 1 112 112 THR CB C 542 70.990 70.990 70.214 0.776 18053
6550 1 10 . 1 1 113 113 VAL N N 543 124.771 124.771 128.154 -3.383 18053
6551 1 10 . 1 1 113 113 VAL HA H 543 4.864 4.864 4.547 0.317 18053
6552 1 10 . 1 1 113 113 VAL C C 543 173.132 173.132 174.159 -1.027 18053
6553 1 10 . 1 1 113 113 VAL CA C 543 60.099 60.099 60.990 -0.891 18053
6554 1 10 . 1 1 113 113 VAL CB C 543 36.433 36.433 33.993 2.440 18053
6555 1 10 . 1 1 113 113 VAL H H 543 9.380 9.380 8.972 0.408 18053
6556 1 10 . 1 1 114 114 LEU N N 544 128.789 128.789 130.331 -1.542 18053
6557 1 10 . 1 1 114 114 LEU HA H 544 5.320 5.320 4.646 0.674 18053
6558 1 10 . 1 1 114 114 LEU C C 544 174.237 174.237 174.695 -0.458 18053
6559 1 10 . 1 1 114 114 LEU CA C 544 53.193 53.193 54.666 -1.473 18053
6560 1 10 . 1 1 114 114 LEU CB C 544 45.879 45.879 42.871 3.008 18053
6561 1 10 . 1 1 114 114 LEU H H 544 8.948 8.948 8.401 0.547 18053
6562 1 10 . 1 1 115 115 VAL N N 545 127.002 127.002 126.478 0.524 18053
6563 1 10 . 1 1 115 115 VAL HA H 545 4.854 4.854 4.363 0.491 18053
6564 1 10 . 1 1 115 115 VAL C C 545 175.206 175.206 174.098 1.108 18053
6565 1 10 . 1 1 115 115 VAL CA C 545 59.334 59.334 60.557 -1.223 18053
6566 1 10 . 1 1 115 115 VAL CB C 545 34.495 34.495 35.298 -0.803 18053
6567 1 10 . 1 1 115 115 VAL H H 545 9.564 9.564 8.786 0.778 18053
6568 1 10 . 1 1 116 116 ASN N N 546 121.179 121.179 123.453 -2.274 18053
6569 1 10 . 1 1 116 116 ASN HA H 546 2.897 2.897 3.608 -0.711 18053
6570 1 10 . 1 1 116 116 ASN C C 546 176.885 176.885 176.268 0.617 18053
6571 1 10 . 1 1 116 116 ASN CA C 546 50.409 50.409 51.303 -0.894 18053
6572 1 10 . 1 1 116 116 ASN CB C 546 36.639 36.639 39.910 -3.271 18053
6573 1 10 . 1 1 116 116 ASN H H 546 8.016 8.016 8.052 -0.036 18053
6574 1 10 . 1 1 117 117 ALA N N 547 119.834 119.834 125.541 -5.707 18053
6575 1 10 . 1 1 117 117 ALA HA H 547 3.866 3.866 4.030 -0.164 18053
6576 1 10 . 1 1 117 117 ALA C C 547 177.772 177.772 179.042 -1.270 18053
6577 1 10 . 1 1 117 117 ALA CA C 547 54.504 54.504 55.353 -0.849 18053
6578 1 10 . 1 1 117 117 ALA CB C 547 18.200 18.200 18.649 -0.449 18053
6579 1 10 . 1 1 117 117 ALA H H 547 6.444 6.444 8.598 -2.154 18053
6580 1 10 . 1 1 118 118 ASP N N 548 115.646 115.646 116.386 -0.740 18053
6581 1 10 . 1 1 118 118 ASP HA H 548 4.644 4.644 4.354 0.290 18053
6582 1 10 . 1 1 118 118 ASP C C 548 176.052 176.052 177.621 -1.569 18053
6583 1 10 . 1 1 118 118 ASP CA C 548 54.067 54.067 55.618 -1.551 18053
6584 1 10 . 1 1 118 118 ASP CB C 548 41.674 41.674 41.077 0.597 18053
6585 1 10 . 1 1 118 118 ASP H H 548 7.181 7.181 8.287 -1.106 18053
6586 1 10 . 1 1 119 119 GLY N N 549 107.167 107.167 106.527 0.640 18053
6587 1 10 . 1 1 119 119 GLY C C 549 173.841 173.841 173.218 0.623 18053
6588 1 10 . 1 1 119 119 GLY CA C 549 45.455 45.455 44.932 0.523 18053
6589 1 10 . 1 1 119 119 GLY H H 549 7.738 7.738 7.769 -0.031 18053
6590 1 10 . 1 1 120 120 GLU N N 550 121.196 121.196 120.598 0.598 18053
6591 1 10 . 1 1 120 120 GLU HA H 550 4.112 4.112 4.198 -0.086 18053
6592 1 10 . 1 1 120 120 GLU C C 550 175.588 175.588 175.771 -0.183 18053
6593 1 10 . 1 1 120 120 GLU CA C 550 54.831 54.831 55.958 -1.127 18053
6594 1 10 . 1 1 120 120 GLU CB C 550 29.937 29.937 29.410 0.527 18053
6595 1 10 . 1 1 120 120 GLU H H 550 7.587 7.587 8.303 -0.716 18053
6596 1 10 . 1 1 121 121 GLU N N 551 123.886 123.886 125.800 -1.914 18053
6597 1 10 . 1 1 121 121 GLU HA H 551 4.276 4.276 4.110 0.166 18053
6598 1 10 . 1 1 121 121 GLU C C 551 176.817 176.817 176.561 0.256 18053
6599 1 10 . 1 1 121 121 GLU CA C 551 56.796 56.796 56.781 0.015 18053
6600 1 10 . 1 1 121 121 GLU CB C 551 28.955 28.955 29.608 -0.653 18053
6601 1 10 . 1 1 121 121 GLU H H 551 8.697 8.697 8.706 -0.009 18053
6602 1 10 . 1 1 122 122 VAL N N 552 120.055 120.055 119.433 0.622 18053
6603 1 10 . 1 1 122 122 VAL HA H 552 4.364 4.364 4.186 0.178 18053
6604 1 10 . 1 1 122 122 VAL C C 552 175.998 175.998 175.254 0.744 18053
6605 1 10 . 1 1 122 122 VAL CA C 552 61.655 61.655 62.248 -0.593 18053
6606 1 10 . 1 1 122 122 VAL CB C 552 33.049 33.049 32.672 0.377 18053
6607 1 10 . 1 1 122 122 VAL H H 552 8.845 8.845 8.112 0.733 18053
6608 1 10 . 1 1 123 123 ALA N N 553 122.098 122.098 121.931 0.167 18053
6609 1 10 . 1 1 123 123 ALA HA H 553 4.890 4.890 4.690 0.200 18053
6610 1 10 . 1 1 123 123 ALA C C 553 175.261 175.261 175.172 0.089 18053
6611 1 10 . 1 1 123 123 ALA CA C 553 52.757 52.757 52.198 0.559 18053
6612 1 10 . 1 1 123 123 ALA CB C 553 22.267 22.267 21.764 0.503 18053
6613 1 10 . 1 1 123 123 ALA H H 553 7.788 7.788 7.811 -0.023 18053
6614 1 10 . 1 1 124 124 MET N N 554 118.217 118.217 117.979 0.238 18053
6615 1 10 . 1 1 124 124 MET HA H 554 5.286 5.286 5.245 0.041 18053
6616 1 10 . 1 1 124 124 MET C C 554 174.428 174.428 174.323 0.105 18053
6617 1 10 . 1 1 124 124 MET CA C 554 55.104 55.104 54.267 0.837 18053
6618 1 10 . 1 1 124 124 MET CB C 554 35.342 35.342 36.279 -0.937 18053
6619 1 10 . 1 1 124 124 MET H H 554 8.693 8.693 8.468 0.225 18053
6620 1 10 . 1 1 125 125 ARG N N 555 122.132 122.132 121.080 1.052 18053
6621 1 10 . 1 1 125 125 ARG HA H 555 4.900 4.900 4.626 0.274 18053
6622 1 10 . 1 1 125 125 ARG CA C 555 56.388 56.388 56.234 0.154 18053
6623 1 10 . 1 1 125 125 ARG CB C 555 34.378 34.378 33.552 0.826 18053
6624 1 10 . 1 1 125 125 ARG H H 555 8.919 8.919 9.052 -0.133 18053
6625 1 10 . 1 1 126 126 THR HA H 556 4.685 4.685 4.461 0.224 18053
6626 1 10 . 1 1 126 126 THR C C 556 172.436 172.436 173.995 -1.559 18053
6627 1 10 . 1 1 126 126 THR CA C 556 61.382 61.382 62.952 -1.570 18053
6628 1 10 . 1 1 126 126 THR CB C 556 70.444 70.444 69.376 1.068 18053
6629 1 10 . 1 1 127 127 VAL N N 557 124.976 124.976 125.866 -0.890 18053
6630 1 10 . 1 1 127 127 VAL HA H 557 4.146 4.146 4.149 -0.003 18053
6631 1 10 . 1 1 127 127 VAL C C 557 173.937 173.937 173.936 0.001 18053
6632 1 10 . 1 1 127 127 VAL CA C 557 61.109 61.109 60.249 0.860 18053
6633 1 10 . 1 1 127 127 VAL CB C 557 33.759 33.759 33.599 0.161 18053
6634 1 10 . 1 1 127 127 VAL H H 557 8.127 8.127 8.565 -0.438 18053
6635 1 10 . 1 1 128 128 LYS N N 558 125.384 125.384 123.321 2.063 18053
6636 1 10 . 1 1 128 128 LYS HA H 558 4.706 4.706 4.768 -0.062 18053
6637 1 10 . 1 1 128 128 LYS C C 558 175.534 175.534 175.692 -0.158 18053
6638 1 10 . 1 1 128 128 LYS CA C 558 54.886 54.886 53.821 1.065 18053
6639 1 10 . 1 1 128 128 LYS CB C 558 34.673 34.673 32.909 1.764 18053
6640 1 10 . 1 1 128 128 LYS H H 558 8.289 8.289 8.273 0.016 18053
6641 1 10 . 1 1 129 129 LYS N N 559 124.005 124.005 128.709 -4.704 18053
6642 1 10 . 1 1 129 129 LYS HA H 559 4.310 4.310 4.037 0.273 18053
6643 1 10 . 1 1 129 129 LYS C C 559 176.571 176.571 175.764 0.807 18053
6644 1 10 . 1 1 129 129 LYS CA C 559 56.742 56.742 58.230 -1.488 18053
6645 1 10 . 1 1 129 129 LYS CB C 559 33.362 33.362 31.996 1.366 18053
6646 1 10 . 1 1 129 129 LYS H H 559 8.461 8.461 8.479 -0.018 18053
6647 1 10 . 1 1 130 130 SER N N 560 117.195 117.195 119.280 -2.085 18053
6648 1 10 . 1 1 130 130 SER HA H 560 4.384 4.384 4.551 -0.167 18053
6649 1 10 . 1 1 130 130 SER C C 560 174.565 174.565 175.047 -0.482 18053
6650 1 10 . 1 1 130 130 SER CA C 560 58.434 58.434 58.227 0.207 18053
6651 1 10 . 1 1 130 130 SER CB C 560 63.812 63.812 63.720 0.092 18053
6652 1 10 . 1 1 130 130 SER H H 560 8.465 8.465 8.543 -0.078 18053
6653 1 10 . 1 1 131 131 SER N N 561 118.149 118.149 120.978 -2.829 18053
6654 1 10 . 1 1 131 131 SER HA H 561 4.412 4.412 4.407 0.005 18053
6655 1 10 . 1 1 131 131 SER C C 561 174.456 174.456 173.912 0.544 18053
6656 1 10 . 1 1 131 131 SER CA C 561 58.489 58.489 59.617 -1.128 18053
6657 1 10 . 1 1 131 131 SER CB C 561 63.811 63.811 63.883 -0.072 18053
6658 1 10 . 1 1 131 131 SER H H 561 8.336 8.336 8.368 -0.032 18053
6659 1 10 . 1 1 132 132 VAL N N 562 121.332 121.332 125.118 -3.786 18053
6660 1 10 . 1 1 132 132 VAL HA H 562 4.035 4.035 4.318 -0.283 18053
6661 1 10 . 1 1 132 132 VAL C C 562 176.066 176.066 174.547 1.519 18053
6662 1 10 . 1 1 132 132 VAL CA C 562 62.446 62.446 62.911 -0.465 18053
6663 1 10 . 1 1 132 132 VAL CB C 562 32.394 32.394 32.172 0.222 18053
6664 1 10 . 1 1 132 132 VAL H H 562 7.982 7.982 8.464 -0.482 18053
6665 1 10 . 1 1 133 133 MET N N 563 124.022 124.022 124.495 -0.473 18053
6666 1 10 . 1 1 133 133 MET HA H 563 4.385 4.385 4.883 -0.498 18053
6667 1 10 . 1 1 133 133 MET C C 563 176.039 176.039 175.834 0.205 18053
6668 1 10 . 1 1 133 133 MET CA C 563 55.350 55.350 54.375 0.975 18053
6669 1 10 . 1 1 133 133 MET CB C 563 32.503 32.503 34.521 -2.018 18053
6670 1 10 . 1 1 133 133 MET H H 563 8.295 8.295 7.993 0.302 18053
6671 1 10 . 1 1 134 134 ARG N N 564 122.677 122.677 121.989 0.688 18053
6672 1 10 . 1 1 134 134 ARG HA H 564 4.262 4.262 4.433 -0.171 18053
6673 1 10 . 1 1 134 134 ARG C C 564 176.298 176.298 176.020 0.278 18053
6674 1 10 . 1 1 134 134 ARG CA C 564 56.087 56.087 55.702 0.385 18053
6675 1 10 . 1 1 134 134 ARG CB C 564 30.702 30.702 30.610 0.092 18053
6676 1 10 . 1 1 134 134 ARG H H 564 8.295 8.295 8.359 -0.064 18053
6677 1 10 . 1 1 135 135 GLU N N 565 121.945 121.945 122.126 -0.181 18053
6678 1 10 . 1 1 135 135 GLU HA H 565 4.160 4.160 4.366 -0.206 18053
6679 1 10 . 1 1 135 135 GLU C C 565 176.080 176.080 176.344 -0.264 18053
6680 1 10 . 1 1 135 135 GLU CA C 565 56.906 56.906 56.347 0.559 18053
6681 1 10 . 1 1 135 135 GLU CB C 565 29.774 29.774 30.170 -0.396 18053
6682 1 10 . 1 1 135 135 GLU H H 565 8.470 8.470 8.498 -0.028 18053
6683 1 10 . 1 1 136 136 ASN N N 566 118.761 118.761 124.186 -5.425 18053
6684 1 10 . 1 1 136 136 ASN HA H 566 4.617 4.617 4.778 -0.161 18053
6685 1 10 . 1 1 136 136 ASN C C 566 175.315 175.315 175.477 -0.162 18053
6686 1 10 . 1 1 136 136 ASN CA C 566 53.193 53.193 52.231 0.962 18053
6687 1 10 . 1 1 136 136 ASN CB C 566 38.836 38.836 37.906 0.930 18053
6688 1 10 . 1 1 136 136 ASN H H 566 8.341 8.341 8.751 -0.410 18053
6689 1 10 . 1 1 137 137 GLU N N 567 121.349 121.349 120.864 0.485 18053
6690 1 10 . 1 1 137 137 GLU HA H 567 4.152 4.152 4.187 -0.035 18053
6691 1 10 . 1 1 137 137 GLU C C 567 176.243 176.243 176.639 -0.396 18053
6692 1 10 . 1 1 137 137 GLU CA C 567 56.906 56.906 57.249 -0.343 18053
6693 1 10 . 1 1 137 137 GLU CB C 567 29.992 29.992 29.934 0.058 18053
6694 1 10 . 1 1 137 137 GLU H H 567 8.349 8.349 7.924 0.425 18053
6695 1 10 . 1 1 138 138 ASN N N 568 118.761 118.761 117.821 0.940 18053
6696 1 10 . 1 1 138 138 ASN HA H 568 4.712 4.712 4.452 0.260 18053
6697 1 10 . 1 1 138 138 ASN C C 568 174.551 174.551 173.862 0.689 18053
6698 1 10 . 1 1 138 138 ASN CA C 568 53.193 53.193 53.923 -0.730 18053
6699 1 10 . 1 1 138 138 ASN CB C 568 39.327 39.327 37.735 1.592 18053
6700 1 10 . 1 1 138 138 ASN H H 568 8.397 8.397 8.313 0.084 18053
6701 1 11 . 1 1 20 20 ALA N N 450 125.180 125.180 125.116 0.064 18053
6702 1 11 . 1 1 20 20 ALA HA H 450 4.706 4.706 4.587 0.119 18053
6703 1 11 . 1 1 20 20 ALA C C 450 177.226 177.226 177.796 -0.570 18053
6704 1 11 . 1 1 20 20 ALA CA C 450 52.757 52.757 51.578 1.179 18053
6705 1 11 . 1 1 20 20 ALA CB C 450 20.411 20.411 19.500 0.911 18053
6706 1 11 . 1 1 20 20 ALA H H 450 8.484 8.484 8.212 0.272 18053
6707 1 11 . 1 1 21 21 SER N N 451 115.714 115.714 119.857 -4.143 18053
6708 1 11 . 1 1 21 21 SER HA H 451 4.513 4.513 4.389 0.124 18053
6709 1 11 . 1 1 21 21 SER C C 451 174.742 174.742 175.861 -1.119 18053
6710 1 11 . 1 1 21 21 SER CA C 451 58.516 58.516 57.987 0.528 18053
6711 1 11 . 1 1 21 21 SER CB C 451 64.159 64.159 61.871 2.288 18053
6712 1 11 . 1 1 21 21 SER H H 451 8.487 8.487 8.571 -0.084 18053
6713 1 11 . 1 1 22 22 GLY N N 452 111.509 111.509 115.117 -3.608 18053
6714 1 11 . 1 1 22 22 GLY C C 452 174.401 174.401 174.996 -0.595 18053
6715 1 11 . 1 1 22 22 GLY CA C 452 45.059 45.059 46.002 -0.943 18053
6716 1 11 . 1 1 22 22 GLY H H 452 8.198 8.198 8.607 -0.409 18053
6717 1 11 . 1 1 23 23 SER N N 453 116.191 116.191 115.145 1.046 18053
6718 1 11 . 1 1 23 23 SER HA H 453 4.364 4.364 4.181 0.183 18053
6719 1 11 . 1 1 23 23 SER C C 453 173.432 173.432 173.160 0.272 18053
6720 1 11 . 1 1 23 23 SER CA C 453 59.744 59.744 59.920 -0.176 18053
6721 1 11 . 1 1 23 23 SER CB C 453 64.335 64.335 62.998 1.337 18053
6722 1 11 . 1 1 23 23 SER H H 453 8.494 8.494 8.349 0.145 18053
6723 1 11 . 1 1 24 24 VAL N N 454 121.656 121.656 118.720 2.936 18053
6724 1 11 . 1 1 24 24 VAL HA H 454 5.035 5.035 4.388 0.647 18053
6725 1 11 . 1 1 24 24 VAL C C 454 174.606 174.606 174.991 -0.385 18053
6726 1 11 . 1 1 24 24 VAL CA C 454 61.055 61.055 61.188 -0.133 18053
6727 1 11 . 1 1 24 24 VAL CB C 454 32.503 32.503 33.620 -1.117 18053
6728 1 11 . 1 1 24 24 VAL H H 454 7.830 7.830 7.611 0.219 18053
6729 1 11 . 1 1 25 25 SER N N 455 119.323 119.323 120.568 -1.245 18053
6730 1 11 . 1 1 25 25 SER HA H 455 4.672 4.672 4.883 -0.211 18053
6731 1 11 . 1 1 25 25 SER C C 455 174.426 174.426 173.386 1.040 18053
6732 1 11 . 1 1 25 25 SER CA C 455 55.268 55.268 55.547 -0.279 18053
6733 1 11 . 1 1 25 25 SER CB C 455 65.162 65.162 65.701 -0.539 18053
6734 1 11 . 1 1 25 25 SER H H 455 9.065 9.065 8.752 0.313 18053
6735 1 11 . 1 1 26 26 ILE N N 456 119.468 119.468 121.957 -2.489 18053
6736 1 11 . 1 1 26 26 ILE HA H 456 4.180 4.180 4.184 -0.004 18053
6737 1 11 . 1 1 26 26 ILE C C 456 175.506 175.506 175.128 0.378 18053
6738 1 11 . 1 1 26 26 ILE CA C 456 61.328 61.328 61.327 0.001 18053
6739 1 11 . 1 1 26 26 ILE CB C 456 37.962 37.962 38.021 -0.059 18053
6740 1 11 . 1 1 26 26 ILE H H 456 8.295 8.295 8.544 -0.249 18053
6741 1 11 . 1 1 27 27 GLU N N 457 129.726 129.726 128.806 0.920 18053
6742 1 11 . 1 1 27 27 GLU HA H 457 4.228 4.228 4.223 0.005 18053
6743 1 11 . 1 1 27 27 GLU C C 457 175.179 175.179 176.345 -1.166 18053
6744 1 11 . 1 1 27 27 GLU CA C 457 55.432 55.432 58.050 -2.618 18053
6745 1 11 . 1 1 27 27 GLU CB C 457 30.142 30.142 30.512 -0.370 18053
6746 1 11 . 1 1 27 27 GLU H H 457 8.393 8.393 8.484 -0.091 18053
6747 1 11 . 1 1 28 28 GLU N N 458 117.076 117.076 115.948 1.128 18053
6748 1 11 . 1 1 28 28 GLU HA H 458 4.168 4.168 4.638 -0.470 18053
6749 1 11 . 1 1 28 28 GLU C C 458 174.701 174.701 174.559 0.142 18053
6750 1 11 . 1 1 28 28 GLU CA C 458 56.906 56.906 55.243 1.663 18053
6751 1 11 . 1 1 28 28 GLU CB C 458 31.848 31.848 34.038 -2.191 18053
6752 1 11 . 1 1 28 28 GLU H H 458 7.489 7.489 7.993 -0.504 18053
6753 1 11 . 1 1 29 29 ILE N N 459 122.183 122.183 119.834 2.349 18053
6754 1 11 . 1 1 29 29 ILE HA H 459 3.764 3.764 4.075 -0.311 18053
6755 1 11 . 1 1 29 29 ILE C C 459 174.169 174.169 174.259 -0.090 18053
6756 1 11 . 1 1 29 29 ILE CA C 459 59.526 59.526 59.730 -0.204 18053
6757 1 11 . 1 1 29 29 ILE CB C 459 40.309 40.309 40.817 -0.508 18053
6758 1 11 . 1 1 29 29 ILE H H 459 8.126 8.126 8.282 -0.156 18053
6759 1 11 . 1 1 30 30 ASP N N 460 123.205 123.205 124.757 -1.552 18053
6760 1 11 . 1 1 30 30 ASP HA H 460 4.183 4.183 4.286 -0.103 18053
6761 1 11 . 1 1 30 30 ASP C C 460 178.318 178.318 177.124 1.194 18053
6762 1 11 . 1 1 30 30 ASP CA C 460 53.930 53.930 53.210 0.720 18053
6763 1 11 . 1 1 30 30 ASP CB C 460 42.807 42.807 41.625 1.182 18053
6764 1 11 . 1 1 30 30 ASP H H 460 6.704 6.704 7.587 -0.883 18053
6765 1 11 . 1 1 31 31 LEU N N 461 128.551 128.551 123.411 5.140 18053
6766 1 11 . 1 1 31 31 LEU HA H 461 4.064 4.064 4.308 -0.244 18053
6767 1 11 . 1 1 31 31 LEU C C 461 177.513 177.513 177.669 -0.156 18053
6768 1 11 . 1 1 31 31 LEU CA C 461 57.124 57.124 56.254 0.870 18053
6769 1 11 . 1 1 31 31 LEU CB C 461 41.237 41.237 41.244 -0.007 18053
6770 1 11 . 1 1 31 31 LEU H H 461 9.012 9.012 8.396 0.617 18053
6771 1 11 . 1 1 32 32 GLU N N 462 115.101 115.101 119.264 -4.163 18053
6772 1 11 . 1 1 32 32 GLU HA H 462 4.283 4.283 4.278 0.005 18053
6773 1 11 . 1 1 32 32 GLU C C 462 177.062 177.062 177.012 0.050 18053
6774 1 11 . 1 1 32 32 GLU CA C 462 55.759 55.759 57.213 -1.454 18053
6775 1 11 . 1 1 32 32 GLU CB C 462 29.569 29.569 29.932 -0.363 18053
6776 1 11 . 1 1 32 32 GLU H H 462 7.588 7.588 7.859 -0.271 18053
6777 1 11 . 1 1 33 33 GLY N N 463 106.299 106.299 106.271 0.028 18053
6778 1 11 . 1 1 33 33 GLY C C 463 174.824 174.824 175.781 -0.957 18053
6779 1 11 . 1 1 33 33 GLY CA C 463 46.806 46.806 45.655 1.151 18053
6780 1 11 . 1 1 33 33 GLY H H 463 7.372 7.372 8.174 -0.802 18053
6781 1 11 . 1 1 34 34 LYS N N 464 118.744 118.744 118.512 0.232 18053
6782 1 11 . 1 1 34 34 LYS HA H 464 4.562 4.562 4.545 0.017 18053
6783 1 11 . 1 1 34 34 LYS C C 464 177.076 177.076 174.799 2.277 18053
6784 1 11 . 1 1 34 34 LYS CA C 464 59.963 59.963 55.975 3.988 18053
6785 1 11 . 1 1 34 34 LYS CB C 464 33.111 33.111 33.180 -0.069 18053
6786 1 11 . 1 1 34 34 LYS H H 464 9.547 9.547 8.355 1.192 18053
6787 1 11 . 1 1 35 35 PHE N N 465 109.125 109.125 112.699 -3.574 18053
6788 1 11 . 1 1 35 35 PHE HA H 465 5.514 5.514 5.796 -0.282 18053
6789 1 11 . 1 1 35 35 PHE C C 465 174.183 174.183 172.998 1.185 18053
6790 1 11 . 1 1 35 35 PHE CA C 465 56.632 56.632 55.579 1.053 18053
6791 1 11 . 1 1 35 35 PHE CB C 465 40.599 40.599 41.675 -1.076 18053
6792 1 11 . 1 1 35 35 PHE H H 465 6.740 6.740 6.933 -0.193 18053
6793 1 11 . 1 1 36 36 VAL N N 466 119.579 119.579 120.083 -0.504 18053
6794 1 11 . 1 1 36 36 VAL HA H 466 3.709 3.709 4.322 -0.613 18053
6795 1 11 . 1 1 36 36 VAL C C 466 172.668 172.668 174.489 -1.821 18053
6796 1 11 . 1 1 36 36 VAL CA C 466 62.692 62.692 61.530 1.162 18053
6797 1 11 . 1 1 36 36 VAL CB C 466 36.215 36.215 34.562 1.653 18053
6798 1 11 . 1 1 36 36 VAL H H 466 7.628 7.628 9.161 -1.533 18053
6799 1 11 . 1 1 37 37 GLN N N 467 126.831 126.831 127.800 -0.969 18053
6800 1 11 . 1 1 37 37 GLN HA H 467 5.449 5.449 4.947 0.502 18053
6801 1 11 . 1 1 37 37 GLN C C 467 174.797 174.797 175.166 -0.369 18053
6802 1 11 . 1 1 37 37 GLN CA C 467 54.121 54.121 54.709 -0.588 18053
6803 1 11 . 1 1 37 37 GLN CB C 467 34.623 34.623 29.378 5.245 18053
6804 1 11 . 1 1 37 37 GLN H H 467 8.392 8.392 8.553 -0.161 18053
6805 1 11 . 1 1 38 38 LEU N N 468 123.018 123.018 129.088 -6.070 18053
6806 1 11 . 1 1 38 38 LEU HA H 468 5.422 5.422 4.702 0.720 18053
6807 1 11 . 1 1 38 38 LEU C C 468 175.588 175.588 175.511 0.077 18053
6808 1 11 . 1 1 38 38 LEU CA C 468 52.702 52.702 54.234 -1.532 18053
6809 1 11 . 1 1 38 38 LEU CB C 468 45.046 45.046 43.712 1.334 18053
6810 1 11 . 1 1 38 38 LEU H H 468 9.103 9.103 8.849 0.254 18053
6811 1 11 . 1 1 39 39 LYS N N 469 118.983 118.983 121.997 -3.014 18053
6812 1 11 . 1 1 39 39 LYS HA H 469 4.852 4.852 4.678 0.174 18053
6813 1 11 . 1 1 39 39 LYS C C 469 173.309 173.309 174.851 -1.542 18053
6814 1 11 . 1 1 39 39 LYS CA C 469 54.994 54.994 54.216 0.778 18053
6815 1 11 . 1 1 39 39 LYS CB C 469 38.246 38.246 35.279 2.967 18053
6816 1 11 . 1 1 39 39 LYS H H 469 8.496 8.496 8.739 -0.243 18053
6817 1 11 . 1 1 40 40 ASN N N 470 121.758 121.758 123.958 -2.200 18053
6818 1 11 . 1 1 40 40 ASN HA H 470 4.788 4.788 4.877 -0.089 18053
6819 1 11 . 1 1 40 40 ASN C C 470 174.496 174.496 175.175 -0.679 18053
6820 1 11 . 1 1 40 40 ASN CA C 470 51.119 51.119 51.935 -0.816 18053
6821 1 11 . 1 1 40 40 ASN CB C 470 37.559 37.559 38.890 -1.331 18053
6822 1 11 . 1 1 40 40 ASN H H 470 8.283 8.283 8.550 -0.267 18053
6823 1 11 . 1 1 41 41 ASN N N 471 122.422 122.422 124.377 -1.955 18053
6824 1 11 . 1 1 41 41 ASN HA H 471 4.588 4.588 4.738 -0.150 18053
6825 1 11 . 1 1 41 41 ASN C C 471 174.810 174.810 175.235 -0.425 18053
6826 1 11 . 1 1 41 41 ASN CA C 471 53.985 53.985 53.541 0.444 18053
6827 1 11 . 1 1 41 41 ASN CB C 471 39.600 39.600 39.049 0.551 18053
6828 1 11 . 1 1 41 41 ASN H H 471 8.681 8.681 8.551 0.130 18053
6829 1 11 . 1 1 42 42 SER N N 472 116.446 116.446 114.843 1.603 18053
6830 1 11 . 1 1 42 42 SER HA H 472 4.719 4.719 4.461 0.258 18053
6831 1 11 . 1 1 42 42 SER C C 472 172.804 172.804 174.635 -1.831 18053
6832 1 11 . 1 1 42 42 SER CA C 472 57.288 57.288 57.663 -0.374 18053
6833 1 11 . 1 1 42 42 SER CB C 472 66.241 66.241 64.478 1.763 18053
6834 1 11 . 1 1 42 42 SER H H 472 8.370 8.370 7.638 0.732 18053
6835 1 11 . 1 1 43 43 ASP N N 473 117.706 117.706 122.350 -4.644 18053
6836 1 11 . 1 1 43 43 ASP HA H 473 4.474 4.474 4.659 -0.185 18053
6837 1 11 . 1 1 43 43 ASP C C 473 175.343 175.343 176.350 -1.007 18053
6838 1 11 . 1 1 43 43 ASP CA C 473 53.521 53.521 55.263 -1.742 18053
6839 1 11 . 1 1 43 43 ASP CB C 473 40.322 40.322 40.949 -0.627 18053
6840 1 11 . 1 1 43 43 ASP H H 473 8.254 8.254 8.766 -0.512 18053
6841 1 11 . 1 1 44 44 LYS N N 474 120.209 120.209 119.105 1.104 18053
6842 1 11 . 1 1 44 44 LYS HA H 474 4.569 4.569 4.451 0.118 18053
6843 1 11 . 1 1 44 44 LYS C C 474 175.397 175.397 174.559 0.838 18053
6844 1 11 . 1 1 44 44 LYS CA C 474 54.012 54.012 54.237 -0.225 18053
6845 1 11 . 1 1 44 44 LYS CB C 474 35.383 35.383 34.576 0.807 18053
6846 1 11 . 1 1 44 44 LYS H H 474 8.305 8.305 7.392 0.913 18053
6847 1 11 . 1 1 45 45 ASP N N 475 124.993 124.993 118.546 6.447 18053
6848 1 11 . 1 1 45 45 ASP HA H 475 3.975 3.975 4.422 -0.447 18053
6849 1 11 . 1 1 45 45 ASP C C 475 174.810 174.810 175.764 -0.954 18053
6850 1 11 . 1 1 45 45 ASP CA C 475 54.995 54.995 54.141 0.854 18053
6851 1 11 . 1 1 45 45 ASP CB C 475 40.364 40.364 40.502 -0.138 18053
6852 1 11 . 1 1 45 45 ASP H H 475 8.722 8.722 8.301 0.421 18053
6853 1 11 . 1 1 46 46 GLN N N 476 120.549 120.549 125.473 -4.924 18053
6854 1 11 . 1 1 46 46 GLN HA H 476 4.436 4.436 4.398 0.038 18053
6855 1 11 . 1 1 46 46 GLN C C 476 174.019 174.019 174.924 -0.905 18053
6856 1 11 . 1 1 46 46 GLN CA C 476 53.138 53.138 54.597 -1.459 18053
6857 1 11 . 1 1 46 46 GLN CB C 476 31.466 31.466 30.044 1.422 18053
6858 1 11 . 1 1 46 46 GLN H H 476 7.878 7.878 8.226 -0.348 18053
6859 1 11 . 1 1 47 47 SER N N 477 121.537 121.537 122.016 -0.479 18053
6860 1 11 . 1 1 47 47 SER HA H 477 4.229 4.229 4.315 -0.086 18053
6861 1 11 . 1 1 47 47 SER C C 477 174.565 174.565 173.995 0.570 18053
6862 1 11 . 1 1 47 47 SER CA C 477 58.706 58.706 58.639 0.067 18053
6863 1 11 . 1 1 47 47 SER CB C 477 62.965 62.965 62.924 0.041 18053
6864 1 11 . 1 1 47 47 SER H H 477 8.748 8.748 8.614 0.134 18053
6865 1 11 . 1 1 48 48 LEU N N 478 127.751 127.751 123.848 3.903 18053
6866 1 11 . 1 1 48 48 LEU HA H 478 2.631 2.631 4.078 -1.447 18053
6867 1 11 . 1 1 48 48 LEU C C 478 176.789 176.789 177.707 -0.918 18053
6868 1 11 . 1 1 48 48 LEU CA C 478 52.102 52.102 53.818 -1.716 18053
6869 1 11 . 1 1 48 48 LEU CB C 478 42.343 42.343 42.635 -0.292 18053
6870 1 11 . 1 1 48 48 LEU H H 478 7.856 7.856 7.990 -0.134 18053
6871 1 11 . 1 1 49 49 GLY N N 479 107.525 107.525 105.548 1.977 18053
6872 1 11 . 1 1 49 49 GLY C C 479 176.653 176.653 175.086 1.567 18053
6873 1 11 . 1 1 49 49 GLY CA C 479 48.062 48.062 45.668 2.394 18053
6874 1 11 . 1 1 49 49 GLY H H 479 7.728 7.728 8.870 -1.142 18053
6875 1 11 . 1 1 50 50 ASN N N 480 117.059 117.059 118.857 -1.798 18053
6876 1 11 . 1 1 50 50 ASN HA H 480 4.255 4.255 4.624 -0.369 18053
6877 1 11 . 1 1 50 50 ASN C C 480 174.961 174.961 174.871 0.090 18053
6878 1 11 . 1 1 50 50 ASN CA C 480 56.360 56.360 54.092 2.268 18053
6879 1 11 . 1 1 50 50 ASN CB C 480 37.416 37.416 38.581 -1.165 18053
6880 1 11 . 1 1 50 50 ASN H H 480 7.552 7.552 8.588 -1.036 18053
6881 1 11 . 1 1 51 51 TRP N N 481 122.166 122.166 118.691 3.475 18053
6882 1 11 . 1 1 51 51 TRP HA H 481 4.477 4.477 4.899 -0.422 18053
6883 1 11 . 1 1 51 51 TRP C C 481 175.575 175.575 175.648 -0.073 18053
6884 1 11 . 1 1 51 51 TRP CA C 481 58.762 58.762 57.781 0.981 18053
6885 1 11 . 1 1 51 51 TRP CB C 481 28.041 28.041 29.396 -1.355 18053
6886 1 11 . 1 1 51 51 TRP H H 481 8.914 8.914 7.946 0.968 18053
6887 1 11 . 1 1 52 52 ARG N N 482 116.480 116.480 120.711 -4.231 18053
6888 1 11 . 1 1 52 52 ARG HA H 482 5.968 5.968 5.178 0.790 18053
6889 1 11 . 1 1 52 52 ARG C C 482 175.807 175.807 175.147 0.660 18053
6890 1 11 . 1 1 52 52 ARG CA C 482 54.121 54.121 54.524 -0.403 18053
6891 1 11 . 1 1 52 52 ARG CB C 482 35.124 35.124 33.554 1.570 18053
6892 1 11 . 1 1 52 52 ARG H H 482 9.147 9.147 8.747 0.400 18053
6893 1 11 . 1 1 53 53 ILE N N 483 119.579 119.579 126.140 -6.561 18053
6894 1 11 . 1 1 53 53 ILE HA H 483 4.985 4.985 4.957 0.028 18053
6895 1 11 . 1 1 53 53 ILE C C 483 175.670 175.670 176.013 -0.343 18053
6896 1 11 . 1 1 53 53 ILE CA C 483 60.400 60.400 60.873 -0.473 18053
6897 1 11 . 1 1 53 53 ILE CB C 483 40.227 40.227 38.053 2.174 18053
6898 1 11 . 1 1 53 53 ILE H H 483 9.000 9.000 8.781 0.219 18053
6899 1 11 . 1 1 54 54 LYS N N 484 124.737 124.737 128.847 -4.110 18053
6900 1 11 . 1 1 54 54 LYS HA H 484 5.463 5.463 4.790 0.673 18053
6901 1 11 . 1 1 54 54 LYS C C 484 175.575 175.575 176.179 -0.604 18053
6902 1 11 . 1 1 54 54 LYS CA C 484 54.613 54.613 56.462 -1.849 18053
6903 1 11 . 1 1 54 54 LYS CB C 484 35.041 35.041 33.413 1.629 18053
6904 1 11 . 1 1 54 54 LYS H H 484 9.678 9.678 8.726 0.952 18053
6905 1 11 . 1 1 55 55 ARG N N 485 124.090 124.090 124.558 -0.468 18053
6906 1 11 . 1 1 55 55 ARG HA H 485 5.525 5.525 4.545 0.980 18053
6907 1 11 . 1 1 55 55 ARG C C 485 174.155 174.155 174.497 -0.342 18053
6908 1 11 . 1 1 55 55 ARG CA C 485 53.903 53.903 54.150 -0.247 18053
6909 1 11 . 1 1 55 55 ARG H H 485 9.314 9.314 8.544 0.770 18053
6910 1 11 . 1 1 56 56 GLN N N 486 126.576 126.576 125.847 0.729 18053
6911 1 11 . 1 1 56 56 GLN HA H 486 4.842 4.842 4.499 0.343 18053
6912 1 11 . 1 1 56 56 GLN C C 486 174.991 174.991 173.855 1.136 18053
6913 1 11 . 1 1 56 56 GLN CA C 486 54.831 54.831 55.063 -0.232 18053
6914 1 11 . 1 1 56 56 GLN CB C 486 31.465 31.465 29.852 1.613 18053
6915 1 11 . 1 1 56 56 GLN H H 486 8.831 8.831 8.455 0.376 18053
6916 1 11 . 1 1 57 57 VAL N N 487 126.712 126.712 125.169 1.543 18053
6917 1 11 . 1 1 57 57 VAL HA H 487 4.266 4.266 4.548 -0.282 18053
6918 1 11 . 1 1 57 57 VAL C C 487 175.916 175.916 177.891 -1.975 18053
6919 1 11 . 1 1 57 57 VAL CA C 487 61.820 61.820 60.451 1.369 18053
6920 1 11 . 1 1 57 57 VAL CB C 487 32.803 32.803 33.062 -0.259 18053
6921 1 11 . 1 1 57 57 VAL H H 487 8.786 8.786 8.349 0.437 18053
6922 1 11 . 1 1 58 58 LEU N N 488 127.274 127.274 124.349 2.925 18053
6923 1 11 . 1 1 58 58 LEU HA H 488 4.085 4.085 4.100 -0.015 18053
6924 1 11 . 1 1 58 58 LEU C C 488 177.158 177.158 177.704 -0.546 18053
6925 1 11 . 1 1 58 58 LEU CA C 488 56.906 56.906 57.866 -0.960 18053
6926 1 11 . 1 1 58 58 LEU CB C 488 41.374 41.374 41.756 -0.382 18053
6927 1 11 . 1 1 58 58 LEU H H 488 8.316 8.316 8.333 -0.017 18053
6928 1 11 . 1 1 59 59 GLU N N 489 119.647 119.647 118.444 1.203 18053
6929 1 11 . 1 1 59 59 GLU HA H 489 4.112 4.112 4.168 -0.056 18053
6930 1 11 . 1 1 59 59 GLU C C 489 176.230 176.230 177.250 -1.020 18053
6931 1 11 . 1 1 59 59 GLU CA C 489 57.015 57.015 57.328 -0.313 18053
6932 1 11 . 1 1 59 59 GLU CB C 489 28.149 28.149 29.630 -1.481 18053
6933 1 11 . 1 1 59 59 GLU H H 489 8.636 8.636 8.234 0.402 18053
6934 1 11 . 1 1 60 60 GLY N N 490 108.819 108.819 107.379 1.440 18053
6935 1 11 . 1 1 60 60 GLY C C 490 173.568 173.568 173.443 0.125 18053
6936 1 11 . 1 1 60 60 GLY CA C 490 44.773 44.773 45.000 -0.227 18053
6937 1 11 . 1 1 60 60 GLY H H 490 8.160 8.160 7.900 0.260 18053
6938 1 11 . 1 1 61 61 GLU N N 491 121.009 121.009 122.367 -1.358 18053
6939 1 11 . 1 1 61 61 GLU HA H 491 4.323 4.323 4.264 0.059 18053
6940 1 11 . 1 1 61 61 GLU C C 491 175.725 175.725 175.453 0.272 18053
6941 1 11 . 1 1 61 61 GLU CA C 491 56.196 56.196 55.549 0.647 18053
6942 1 11 . 1 1 61 61 GLU CB C 491 30.865 30.865 28.395 2.470 18053
6943 1 11 . 1 1 61 61 GLU H H 491 8.320 8.320 8.331 -0.011 18053
6944 1 11 . 1 1 62 62 GLU N N 492 123.426 123.426 124.893 -1.467 18053
6945 1 11 . 1 1 62 62 GLU HA H 492 5.054 5.054 5.198 -0.144 18053
6946 1 11 . 1 1 62 62 GLU C C 492 175.930 175.930 176.237 -0.307 18053
6947 1 11 . 1 1 62 62 GLU CA C 492 55.650 55.650 54.671 0.979 18053
6948 1 11 . 1 1 62 62 GLU CB C 492 32.312 32.312 30.079 2.233 18053
6949 1 11 . 1 1 62 62 GLU H H 492 8.594 8.594 8.335 0.259 18053
6950 1 11 . 1 1 63 63 ILE N N 493 119.732 119.732 118.871 0.861 18053
6951 1 11 . 1 1 63 63 ILE HA H 493 4.788 4.788 4.869 -0.081 18053
6952 1 11 . 1 1 63 63 ILE C C 493 174.647 174.647 174.594 0.053 18053
6953 1 11 . 1 1 63 63 ILE CA C 493 60.181 60.181 59.402 0.779 18053
6954 1 11 . 1 1 63 63 ILE CB C 493 41.183 41.183 40.999 0.184 18053
6955 1 11 . 1 1 63 63 ILE H H 493 8.523 8.523 8.379 0.144 18053
6956 1 11 . 1 1 64 64 ALA N N 494 122.166 122.166 121.938 0.228 18053
6957 1 11 . 1 1 64 64 ALA HA H 494 5.521 5.521 4.987 0.534 18053
6958 1 11 . 1 1 64 64 ALA C C 494 174.606 174.606 175.901 -1.295 18053
6959 1 11 . 1 1 64 64 ALA CA C 494 51.528 51.528 51.893 -0.365 18053
6960 1 11 . 1 1 64 64 ALA CB C 494 22.239 22.239 21.183 1.056 18053
6961 1 11 . 1 1 64 64 ALA H H 494 8.741 8.741 8.441 0.300 18053
6962 1 11 . 1 1 65 65 TYR N N 495 126.729 126.729 126.371 0.358 18053
6963 1 11 . 1 1 65 65 TYR HA H 495 3.094 3.094 3.626 -0.532 18053
6964 1 11 . 1 1 65 65 TYR C C 495 173.036 173.036 173.774 -0.738 18053
6965 1 11 . 1 1 65 65 TYR CA C 495 56.905 56.905 56.279 0.626 18053
6966 1 11 . 1 1 65 65 TYR CB C 495 40.269 40.269 38.640 1.629 18053
6967 1 11 . 1 1 65 65 TYR H H 495 8.462 8.462 8.665 -0.203 18053
6968 1 11 . 1 1 66 66 LYS N N 496 128.108 128.108 126.994 1.114 18053
6969 1 11 . 1 1 66 66 LYS HA H 496 4.822 4.822 4.478 0.344 18053
6970 1 11 . 1 1 66 66 LYS C C 496 174.906 174.906 174.848 0.058 18053
6971 1 11 . 1 1 66 66 LYS CA C 496 53.739 53.739 54.925 -1.185 18053
6972 1 11 . 1 1 66 66 LYS CB C 496 34.782 34.782 33.545 1.237 18053
6973 1 11 . 1 1 66 66 LYS H H 496 7.010 7.010 7.326 -0.316 18053
6974 1 11 . 1 1 67 67 PHE N N 497 125.299 125.299 121.672 3.627 18053
6975 1 11 . 1 1 67 67 PHE HA H 497 3.932 3.932 4.048 -0.116 18053
6976 1 11 . 1 1 67 67 PHE C C 497 177.990 177.990 175.711 2.279 18053
6977 1 11 . 1 1 67 67 PHE CA C 497 59.007 59.007 58.114 0.893 18053
6978 1 11 . 1 1 67 67 PHE CB C 497 40.981 40.981 40.119 0.862 18053
6979 1 11 . 1 1 67 67 PHE H H 497 8.509 8.509 8.173 0.336 18053
6980 1 11 . 1 1 68 68 THR N N 498 116.191 116.191 110.888 5.303 18053
6981 1 11 . 1 1 68 68 THR HA H 498 4.417 4.417 4.618 -0.201 18053
6982 1 11 . 1 1 68 68 THR CA C 498 60.855 60.855 59.550 1.305 18053
6983 1 11 . 1 1 68 68 THR CB C 498 68.019 68.019 69.217 -1.198 18053
6984 1 11 . 1 1 68 68 THR H H 498 8.688 8.688 8.233 0.455 18053
6985 1 11 . 1 1 69 69 PRO HA H 499 3.948 3.948 4.504 -0.556 18053
6986 1 11 . 1 1 69 69 PRO C C 499 177.444 177.444 177.275 0.169 18053
6987 1 11 . 1 1 69 69 PRO CA C 499 66.077 66.077 65.038 1.039 18053
6988 1 11 . 1 1 69 69 PRO CB C 499 32.776 32.776 31.773 1.003 18053
6989 1 11 . 1 1 70 70 LYS N N 500 113.552 113.552 113.767 -0.215 18053
6990 1 11 . 1 1 70 70 LYS HA H 500 4.385 4.385 4.163 0.222 18053
6991 1 11 . 1 1 70 70 LYS C C 500 176.325 176.325 176.254 0.071 18053
6992 1 11 . 1 1 70 70 LYS CA C 500 54.995 54.995 56.513 -1.518 18053
6993 1 11 . 1 1 70 70 LYS CB C 500 31.793 31.793 32.245 -0.452 18053
6994 1 11 . 1 1 70 70 LYS H H 500 8.016 8.016 8.235 -0.219 18053
6995 1 11 . 1 1 71 71 TYR N N 501 121.860 121.860 122.087 -0.227 18053
6996 1 11 . 1 1 71 71 TYR HA H 501 3.730 3.730 4.289 -0.559 18053
6997 1 11 . 1 1 71 71 TYR C C 501 174.838 174.838 174.029 0.809 18053
6998 1 11 . 1 1 71 71 TYR CA C 501 62.310 62.310 59.568 2.742 18053
6999 1 11 . 1 1 71 71 TYR CB C 501 38.781 38.781 39.003 -0.222 18053
7000 1 11 . 1 1 71 71 TYR H H 501 7.460 7.460 7.722 -0.262 18053
7001 1 11 . 1 1 72 72 ILE N N 502 129.487 129.487 127.580 1.907 18053
7002 1 11 . 1 1 72 72 ILE HA H 502 3.928 3.928 4.291 -0.363 18053
7003 1 11 . 1 1 72 72 ILE C C 502 172.968 172.968 173.406 -0.438 18053
7004 1 11 . 1 1 72 72 ILE CA C 502 59.308 59.308 59.439 -0.131 18053
7005 1 11 . 1 1 72 72 ILE CB C 502 40.910 40.910 41.618 -0.708 18053
7006 1 11 . 1 1 72 72 ILE H H 502 7.168 7.168 7.719 -0.551 18053
7007 1 11 . 1 1 73 73 LEU N N 503 128.278 128.278 126.644 1.634 18053
7008 1 11 . 1 1 73 73 LEU HA H 503 4.493 4.493 4.601 -0.108 18053
7009 1 11 . 1 1 73 73 LEU C C 503 175.834 175.834 174.976 0.858 18053
7010 1 11 . 1 1 73 73 LEU CA C 503 51.965 51.965 52.637 -0.672 18053
7011 1 11 . 1 1 73 73 LEU CB C 503 42.548 42.548 44.843 -2.295 18053
7012 1 11 . 1 1 73 73 LEU H H 503 8.483 8.483 8.352 0.131 18053
7013 1 11 . 1 1 74 74 ARG N N 504 129.589 129.589 124.641 4.948 18053
7014 1 11 . 1 1 74 74 ARG HA H 504 3.743 3.743 4.232 -0.489 18053
7015 1 11 . 1 1 74 74 ARG C C 504 175.233 175.233 175.459 -0.226 18053
7016 1 11 . 1 1 74 74 ARG CA C 504 56.851 56.851 55.233 1.618 18053
7017 1 11 . 1 1 74 74 ARG CB C 504 30.292 30.292 30.739 -0.447 18053
7018 1 11 . 1 1 74 74 ARG H H 504 8.673 8.673 8.371 0.302 18053
7019 1 11 . 1 1 75 75 ALA N N 505 123.205 123.205 125.656 -2.451 18053
7020 1 11 . 1 1 75 75 ALA HA H 505 3.522 3.522 3.967 -0.445 18053
7021 1 11 . 1 1 75 75 ALA C C 505 178.441 178.441 177.981 0.460 18053
7022 1 11 . 1 1 75 75 ALA CA C 505 53.794 53.794 53.051 0.743 18053
7023 1 11 . 1 1 75 75 ALA CB C 505 18.910 18.910 18.101 0.809 18053
7024 1 11 . 1 1 75 75 ALA H H 505 8.564 8.564 8.446 0.118 18053
7025 1 11 . 1 1 76 76 GLY N N 506 112.241 112.241 112.822 -0.581 18053
7026 1 11 . 1 1 76 76 GLY C C 506 174.278 174.278 174.165 0.113 18053
7027 1 11 . 1 1 76 76 GLY CA C 506 46.725 46.725 44.965 1.760 18053
7028 1 11 . 1 1 76 76 GLY H H 506 7.381 7.381 8.751 -1.370 18053
7029 1 11 . 1 1 77 77 GLN N N 507 117.382 117.382 119.266 -1.884 18053
7030 1 11 . 1 1 77 77 GLN HA H 507 4.364 4.364 4.667 -0.303 18053
7031 1 11 . 1 1 77 77 GLN C C 507 173.937 173.937 174.574 -0.637 18053
7032 1 11 . 1 1 77 77 GLN CA C 507 54.558 54.558 54.185 0.373 18053
7033 1 11 . 1 1 77 77 GLN CB C 507 30.073 30.073 30.655 -0.582 18053
7034 1 11 . 1 1 77 77 GLN H H 507 7.996 7.996 7.732 0.264 18053
7035 1 11 . 1 1 78 78 MET N N 508 116.957 116.957 115.011 1.946 18053
7036 1 11 . 1 1 78 78 MET HA H 508 5.388 5.388 5.160 0.228 18053
7037 1 11 . 1 1 78 78 MET C C 508 175.807 175.807 174.210 1.597 18053
7038 1 11 . 1 1 78 78 MET CA C 508 54.067 54.067 54.678 -0.611 18053
7039 1 11 . 1 1 78 78 MET CB C 508 37.198 37.198 36.114 1.084 18053
7040 1 11 . 1 1 78 78 MET H H 508 8.092 8.092 8.302 -0.210 18053
7041 1 11 . 1 1 79 79 VAL N N 509 119.340 119.340 124.402 -5.062 18053
7042 1 11 . 1 1 79 79 VAL HA H 509 4.956 4.956 4.896 0.060 18053
7043 1 11 . 1 1 79 79 VAL C C 509 172.217 172.217 175.074 -2.857 18053
7044 1 11 . 1 1 79 79 VAL CA C 509 59.471 59.471 60.265 -0.794 18053
7045 1 11 . 1 1 79 79 VAL CB C 509 33.676 33.676 34.493 -0.817 18053
7046 1 11 . 1 1 79 79 VAL H H 509 8.534 8.534 8.452 0.082 18053
7047 1 11 . 1 1 80 80 THR N N 510 124.533 124.533 126.890 -2.357 18053
7048 1 11 . 1 1 80 80 THR HA H 510 4.586 4.586 4.778 -0.192 18053
7049 1 11 . 1 1 80 80 THR C C 510 172.215 172.215 174.281 -2.066 18053
7050 1 11 . 1 1 80 80 THR CA C 510 62.119 62.119 62.415 -0.296 18053
7051 1 11 . 1 1 80 80 THR CB C 510 69.407 69.407 68.538 0.869 18053
7052 1 11 . 1 1 80 80 THR H H 510 8.301 8.301 8.797 -0.496 18053
7053 1 11 . 1 1 81 81 VAL N N 511 127.002 127.002 127.502 -0.500 18053
7054 1 11 . 1 1 81 81 VAL HA H 511 4.596 4.596 4.600 -0.004 18053
7055 1 11 . 1 1 81 81 VAL C C 511 176.667 176.667 175.601 1.066 18053
7056 1 11 . 1 1 81 81 VAL CA C 511 61.382 61.382 62.328 -0.946 18053
7057 1 11 . 1 1 81 81 VAL CB C 511 30.945 30.945 30.884 0.061 18053
7058 1 11 . 1 1 81 81 VAL H H 511 8.796 8.796 8.592 0.204 18053
7059 1 11 . 1 1 82 82 TRP N N 512 131.479 131.479 129.383 2.096 18053
7060 1 11 . 1 1 82 82 TRP HA H 512 5.338 5.338 5.504 -0.166 18053
7061 1 11 . 1 1 82 82 TRP C C 512 176.885 176.885 175.080 1.805 18053
7062 1 11 . 1 1 82 82 TRP CA C 512 56.442 56.442 56.388 0.054 18053
7063 1 11 . 1 1 82 82 TRP CB C 512 30.701 30.701 32.017 -1.316 18053
7064 1 11 . 1 1 82 82 TRP H H 512 9.924 9.924 9.203 0.721 18053
7065 1 11 . 1 1 83 83 ALA N N 513 123.954 123.954 120.578 3.376 18053
7066 1 11 . 1 1 83 83 ALA HA H 513 4.308 4.308 4.675 -0.367 18053
7067 1 11 . 1 1 83 83 ALA C C 513 178.140 178.140 176.953 1.187 18053
7068 1 11 . 1 1 83 83 ALA CA C 513 52.211 52.211 50.468 1.743 18053
7069 1 11 . 1 1 83 83 ALA CB C 513 18.745 18.745 20.743 -1.998 18053
7070 1 11 . 1 1 83 83 ALA H H 513 9.048 9.048 8.757 0.291 18053
7071 1 11 . 1 1 84 84 ALA N N 514 125.146 125.146 125.819 -0.673 18053
7072 1 11 . 1 1 84 84 ALA HA H 514 3.951 3.951 4.083 -0.132 18053
7073 1 11 . 1 1 84 84 ALA C C 514 179.519 179.519 179.618 -0.099 18053
7074 1 11 . 1 1 84 84 ALA CA C 514 54.804 54.804 54.629 0.175 18053
7075 1 11 . 1 1 84 84 ALA CB C 514 18.582 18.582 19.040 -0.458 18053
7076 1 11 . 1 1 84 84 ALA H H 514 8.341 8.341 8.199 0.142 18053
7077 1 11 . 1 1 85 85 GLY N N 515 103.388 103.388 105.634 -2.246 18053
7078 1 11 . 1 1 85 85 GLY C C 515 174.674 174.674 175.237 -0.563 18053
7079 1 11 . 1 1 85 85 GLY CA C 515 45.878 45.878 45.810 0.068 18053
7080 1 11 . 1 1 85 85 GLY H H 515 7.996 7.996 7.963 0.033 18053
7081 1 11 . 1 1 86 86 ALA N N 516 120.140 120.140 122.454 -2.314 18053
7082 1 11 . 1 1 86 86 ALA HA H 516 4.344 4.344 4.224 0.120 18053
7083 1 11 . 1 1 86 86 ALA C C 516 177.690 177.690 178.309 -0.619 18053
7084 1 11 . 1 1 86 86 ALA CA C 516 53.139 53.139 52.492 0.647 18053
7085 1 11 . 1 1 86 86 ALA CB C 516 20.547 20.547 19.146 1.401 18053
7086 1 11 . 1 1 86 86 ALA H H 516 7.474 7.474 7.203 0.271 18053
7087 1 11 . 1 1 87 87 GLY N N 517 105.720 105.720 107.334 -1.614 18053
7088 1 11 . 1 1 87 87 GLY C C 517 173.650 173.650 174.693 -1.043 18053
7089 1 11 . 1 1 87 87 GLY CA C 517 46.014 46.014 45.600 0.414 18053
7090 1 11 . 1 1 87 87 GLY H H 517 7.779 7.779 7.787 -0.008 18053
7091 1 11 . 1 1 88 88 VAL N N 518 121.537 121.537 119.041 2.496 18053
7092 1 11 . 1 1 88 88 VAL HA H 518 3.585 3.585 4.043 -0.458 18053
7093 1 11 . 1 1 88 88 VAL C C 518 174.851 174.851 175.209 -0.358 18053
7094 1 11 . 1 1 88 88 VAL CA C 518 61.274 61.274 60.884 0.390 18053
7095 1 11 . 1 1 88 88 VAL CB C 518 33.376 33.376 32.933 0.443 18053
7096 1 11 . 1 1 88 88 VAL H H 518 7.499 7.499 7.684 -0.185 18053
7097 1 11 . 1 1 89 89 ALA N N 519 128.295 128.295 128.799 -0.504 18053
7098 1 11 . 1 1 89 89 ALA HA H 519 4.192 4.192 4.217 -0.025 18053
7099 1 11 . 1 1 89 89 ALA C C 519 176.680 176.680 176.314 0.366 18053
7100 1 11 . 1 1 89 89 ALA CA C 519 51.283 51.283 52.071 -0.788 18053
7101 1 11 . 1 1 89 89 ALA CB C 519 19.292 19.292 19.018 0.274 18053
7102 1 11 . 1 1 89 89 ALA H H 519 7.960 7.960 8.101 -0.141 18053
7103 1 11 . 1 1 90 90 HIS N N 520 122.643 122.643 123.564 -0.921 18053
7104 1 11 . 1 1 90 90 HIS HA H 520 4.033 4.033 4.351 -0.318 18053
7105 1 11 . 1 1 90 90 HIS C C 520 175.793 175.793 174.579 1.214 18053
7106 1 11 . 1 1 90 90 HIS CA C 520 58.653 58.653 56.065 2.588 18053
7107 1 11 . 1 1 90 90 HIS CB C 520 32.285 32.285 30.331 1.954 18053
7108 1 11 . 1 1 90 90 HIS H H 520 8.394 8.394 8.630 -0.236 18053
7109 1 11 . 1 1 91 91 SER N N 521 121.247 121.247 122.591 -1.344 18053
7110 1 11 . 1 1 91 91 SER HA H 521 4.629 4.629 4.642 -0.013 18053
7111 1 11 . 1 1 91 91 SER CA C 521 55.843 55.843 56.608 -0.765 18053
7112 1 11 . 1 1 91 91 SER CB C 521 62.367 62.367 63.926 -1.559 18053
7113 1 11 . 1 1 91 91 SER H H 521 8.569 8.569 8.557 0.012 18053
7114 1 11 . 1 1 92 92 PRO HA H 522 4.002 4.002 5.051 -1.049 18053
7115 1 11 . 1 1 92 92 PRO CA C 522 62.244 62.244 62.112 0.132 18053
7116 1 11 . 1 1 92 92 PRO CB C 522 30.931 30.931 31.601 -0.670 18053
7117 1 11 . 1 1 93 93 PRO HA H 523 4.672 4.672 4.823 -0.151 18053
7118 1 11 . 1 1 93 93 PRO C C 523 177.786 177.786 178.233 -0.447 18053
7119 1 11 . 1 1 93 93 PRO CA C 523 64.003 64.003 64.182 -0.179 18053
7120 1 11 . 1 1 93 93 PRO CB C 523 34.905 34.905 32.576 2.329 18053
7121 1 11 . 1 1 94 94 SER N N 524 117.212 117.212 115.737 1.475 18053
7122 1 11 . 1 1 94 94 SER HA H 524 4.678 4.678 4.578 0.100 18053
7123 1 11 . 1 1 94 94 SER C C 524 174.851 174.851 174.687 0.164 18053
7124 1 11 . 1 1 94 94 SER CA C 524 61.874 61.874 60.881 0.993 18053
7125 1 11 . 1 1 94 94 SER CB C 524 64.057 64.057 63.725 0.332 18053
7126 1 11 . 1 1 94 94 SER H H 524 8.463 8.463 8.356 0.107 18053
7127 1 11 . 1 1 95 95 THR N N 525 121.588 121.588 117.844 3.744 18053
7128 1 11 . 1 1 95 95 THR HA H 525 4.859 4.859 4.999 -0.140 18053
7129 1 11 . 1 1 95 95 THR C C 525 172.094 172.094 172.564 -0.470 18053
7130 1 11 . 1 1 95 95 THR CA C 525 62.309 62.309 61.760 0.549 18053
7131 1 11 . 1 1 95 95 THR CB C 525 70.281 70.281 70.092 0.189 18053
7132 1 11 . 1 1 95 95 THR H H 525 7.631 7.631 7.949 -0.318 18053
7133 1 11 . 1 1 96 96 LEU N N 526 127.274 127.274 129.824 -2.550 18053
7134 1 11 . 1 1 96 96 LEU HA H 526 5.131 5.131 5.262 -0.131 18053
7135 1 11 . 1 1 96 96 LEU C C 526 175.916 175.916 174.680 1.236 18053
7136 1 11 . 1 1 96 96 LEU CA C 526 52.075 52.075 53.512 -1.437 18053
7137 1 11 . 1 1 96 96 LEU CB C 526 43.790 43.790 45.033 -1.243 18053
7138 1 11 . 1 1 96 96 LEU H H 526 8.977 8.977 8.304 0.673 18053
7139 1 11 . 1 1 97 97 VAL N N 527 124.056 124.056 125.635 -1.579 18053
7140 1 11 . 1 1 97 97 VAL HA H 527 4.869 4.869 4.434 0.435 18053
7141 1 11 . 1 1 97 97 VAL C C 527 176.230 176.230 174.631 1.599 18053
7142 1 11 . 1 1 97 97 VAL CA C 527 61.519 61.519 61.274 0.245 18053
7143 1 11 . 1 1 97 97 VAL CB C 527 33.704 33.704 33.755 -0.051 18053
7144 1 11 . 1 1 97 97 VAL H H 527 10.724 10.724 7.739 2.985 18053
7145 1 11 . 1 1 98 98 TRP N N 528 132.586 132.586 130.494 2.092 18053
7146 1 11 . 1 1 98 98 TRP HA H 528 4.965 4.965 4.099 0.866 18053
7147 1 11 . 1 1 98 98 TRP C C 528 173.391 173.391 174.705 -1.314 18053
7148 1 11 . 1 1 98 98 TRP CA C 528 53.303 53.303 55.142 -1.839 18053
7149 1 11 . 1 1 98 98 TRP CB C 528 28.245 28.245 28.456 -0.211 18053
7150 1 11 . 1 1 98 98 TRP H H 528 9.400 9.400 8.465 0.935 18053
7151 1 11 . 1 1 99 99 LYS N N 529 126.644 126.644 128.973 -2.329 18053
7152 1 11 . 1 1 99 99 LYS HA H 529 3.839 3.839 4.072 -0.233 18053
7153 1 11 . 1 1 99 99 LYS C C 529 177.581 177.581 176.941 0.640 18053
7154 1 11 . 1 1 99 99 LYS CA C 529 58.543 58.543 57.187 1.356 18053
7155 1 11 . 1 1 99 99 LYS CB C 529 32.176 32.176 32.158 0.017 18053
7156 1 11 . 1 1 99 99 LYS H H 529 8.153 8.153 8.002 0.151 18053
7157 1 11 . 1 1 100 100 GLY N N 530 110.385 110.385 113.882 -3.497 18053
7158 1 11 . 1 1 100 100 GLY C C 530 172.367 172.367 173.674 -1.307 18053
7159 1 11 . 1 1 100 100 GLY CA C 530 45.278 45.278 44.625 0.653 18053
7160 1 11 . 1 1 100 100 GLY H H 530 8.363 8.363 8.491 -0.128 18053
7161 1 11 . 1 1 101 101 GLN N N 531 121.162 121.162 122.179 -1.017 18053
7162 1 11 . 1 1 101 101 GLN HA H 531 3.972 3.972 4.245 -0.273 18053
7163 1 11 . 1 1 101 101 GLN CA C 531 52.620 52.620 54.814 -2.194 18053
7164 1 11 . 1 1 101 101 GLN CB C 531 27.595 27.595 28.820 -1.225 18053
7165 1 11 . 1 1 101 101 GLN H H 531 6.815 6.815 7.282 -0.467 18053
7166 1 11 . 1 1 102 102 SER N N 532 122.728 122.728 120.982 1.746 18053
7167 1 11 . 1 1 102 102 SER HA H 532 3.866 3.866 4.585 -0.719 18053
7168 1 11 . 1 1 102 102 SER C C 532 174.537 174.537 175.985 -1.448 18053
7169 1 11 . 1 1 102 102 SER CA C 532 61.983 61.983 60.354 1.629 18053
7170 1 11 . 1 1 102 102 SER CB C 532 62.802 62.802 63.728 -0.926 18053
7171 1 11 . 1 1 102 102 SER H H 532 8.662 8.662 8.817 -0.155 18053
7172 1 11 . 1 1 103 103 SER N N 533 110.811 110.811 116.327 -5.516 18053
7173 1 11 . 1 1 103 103 SER HA H 533 4.240 4.240 4.276 -0.036 18053
7174 1 11 . 1 1 103 103 SER C C 533 174.087 174.087 174.336 -0.249 18053
7175 1 11 . 1 1 103 103 SER CA C 533 56.633 56.633 58.780 -2.147 18053
7176 1 11 . 1 1 103 103 SER CB C 533 64.658 64.658 63.898 0.759 18053
7177 1 11 . 1 1 103 103 SER H H 533 7.134 7.134 7.799 -0.665 18053
7178 1 11 . 1 1 104 104 TRP N N 534 126.133 126.133 122.471 3.662 18053
7179 1 11 . 1 1 104 104 TRP HA H 534 4.098 4.098 4.215 -0.117 18053
7180 1 11 . 1 1 104 104 TRP C C 534 176.066 176.066 175.581 0.485 18053
7181 1 11 . 1 1 104 104 TRP CA C 534 60.127 60.127 57.304 2.823 18053
7182 1 11 . 1 1 104 104 TRP CB C 534 28.764 28.764 28.794 -0.030 18053
7183 1 11 . 1 1 104 104 TRP H H 534 9.764 9.764 7.973 1.790 18053
7184 1 11 . 1 1 105 105 GLY N N 535 105.907 105.907 105.161 0.746 18053
7185 1 11 . 1 1 105 105 GLY C C 535 172.217 172.217 173.540 -1.323 18053
7186 1 11 . 1 1 105 105 GLY CA C 535 44.240 44.240 45.205 -0.965 18053
7187 1 11 . 1 1 105 105 GLY H H 535 8.095 8.095 8.193 -0.098 18053
7188 1 11 . 1 1 106 106 THR N N 536 111.253 111.253 115.028 -3.775 18053
7189 1 11 . 1 1 106 106 THR HA H 536 3.859 3.859 3.552 0.307 18053
7190 1 11 . 1 1 106 106 THR C C 536 172.872 172.872 173.295 -0.423 18053
7191 1 11 . 1 1 106 106 THR CA C 536 59.635 59.635 60.401 -0.766 18053
7192 1 11 . 1 1 106 106 THR CB C 536 70.526 70.526 70.668 -0.142 18053
7193 1 11 . 1 1 106 106 THR H H 536 7.913 7.913 7.615 0.298 18053
7194 1 11 . 1 1 107 107 GLY N N 537 107.712 107.712 110.457 -2.745 18053
7195 1 11 . 1 1 107 107 GLY C C 537 172.709 172.709 173.116 -0.407 18053
7196 1 11 . 1 1 107 107 GLY CA C 537 45.166 45.166 45.598 -0.432 18053
7197 1 11 . 1 1 107 107 GLY H H 537 7.533 7.533 7.993 -0.460 18053
7198 1 11 . 1 1 108 108 GLU N N 538 118.864 118.864 119.717 -0.853 18053
7199 1 11 . 1 1 108 108 GLU HA H 538 4.136 4.136 4.211 -0.075 18053
7200 1 11 . 1 1 108 108 GLU C C 538 176.353 176.353 175.731 0.622 18053
7201 1 11 . 1 1 108 108 GLU CA C 538 58.352 58.352 58.480 -0.128 18053
7202 1 11 . 1 1 108 108 GLU CB C 538 30.156 30.156 30.150 0.006 18053
7203 1 11 . 1 1 108 108 GLU H H 538 8.558 8.558 8.545 0.013 18053
7204 1 11 . 1 1 109 109 SER N N 539 110.419 110.419 111.138 -0.719 18053
7205 1 11 . 1 1 109 109 SER HA H 539 4.963 4.963 4.593 0.370 18053
7206 1 11 . 1 1 109 109 SER C C 539 173.787 173.787 172.304 1.483 18053
7207 1 11 . 1 1 109 109 SER CA C 539 57.125 57.125 58.212 -1.087 18053
7208 1 11 . 1 1 109 109 SER CB C 539 64.439 64.439 65.579 -1.140 18053
7209 1 11 . 1 1 109 109 SER H H 539 7.620 7.620 7.619 0.001 18053
7210 1 11 . 1 1 110 110 PHE N N 540 118.778 118.778 118.827 -0.049 18053
7211 1 11 . 1 1 110 110 PHE HA H 540 5.081 5.081 5.297 -0.216 18053
7212 1 11 . 1 1 110 110 PHE C C 540 176.052 176.052 173.934 2.118 18053
7213 1 11 . 1 1 110 110 PHE CA C 540 56.789 56.789 56.272 0.517 18053
7214 1 11 . 1 1 110 110 PHE CB C 540 40.760 40.760 41.906 -1.146 18053
7215 1 11 . 1 1 110 110 PHE H H 540 8.318 8.318 8.779 -0.461 18053
7216 1 11 . 1 1 112 112 THR HA H 542 5.468 5.468 5.169 0.299 18053
7217 1 11 . 1 1 112 112 THR C C 542 172.381 172.381 173.553 -1.172 18053
7218 1 11 . 1 1 112 112 THR CA C 542 61.818 61.818 62.549 -0.731 18053
7219 1 11 . 1 1 112 112 THR CB C 542 70.990 70.990 69.574 1.416 18053
7220 1 11 . 1 1 113 113 VAL N N 543 124.771 124.771 127.013 -2.242 18053
7221 1 11 . 1 1 113 113 VAL HA H 543 4.864 4.864 4.667 0.198 18053
7222 1 11 . 1 1 113 113 VAL C C 543 173.132 173.132 173.854 -0.722 18053
7223 1 11 . 1 1 113 113 VAL CA C 543 60.099 60.099 60.679 -0.580 18053
7224 1 11 . 1 1 113 113 VAL CB C 543 36.433 36.433 35.303 1.130 18053
7225 1 11 . 1 1 113 113 VAL H H 543 9.380 9.380 8.898 0.482 18053
7226 1 11 . 1 1 114 114 LEU N N 544 128.789 128.789 129.461 -0.672 18053
7227 1 11 . 1 1 114 114 LEU HA H 544 5.320 5.320 4.844 0.476 18053
7228 1 11 . 1 1 114 114 LEU C C 544 174.237 174.237 174.740 -0.503 18053
7229 1 11 . 1 1 114 114 LEU CA C 544 53.193 53.193 53.725 -0.532 18053
7230 1 11 . 1 1 114 114 LEU CB C 544 45.879 45.879 43.166 2.712 18053
7231 1 11 . 1 1 114 114 LEU H H 544 8.948 8.948 8.684 0.264 18053
7232 1 11 . 1 1 115 115 VAL N N 545 127.002 127.002 127.176 -0.174 18053
7233 1 11 . 1 1 115 115 VAL HA H 545 4.854 4.854 4.677 0.177 18053
7234 1 11 . 1 1 115 115 VAL C C 545 175.206 175.206 175.090 0.116 18053
7235 1 11 . 1 1 115 115 VAL CA C 545 59.334 59.334 60.393 -1.059 18053
7236 1 11 . 1 1 115 115 VAL CB C 545 34.495 34.495 34.709 -0.214 18053
7237 1 11 . 1 1 115 115 VAL H H 545 9.564 9.564 8.807 0.757 18053
7238 1 11 . 1 1 116 116 ASN N N 546 121.179 121.179 121.106 0.073 18053
7239 1 11 . 1 1 116 116 ASN HA H 546 2.897 2.897 3.986 -1.089 18053
7240 1 11 . 1 1 116 116 ASN C C 546 176.885 176.885 174.633 2.252 18053
7241 1 11 . 1 1 116 116 ASN CA C 546 50.409 50.409 51.206 -0.797 18053
7242 1 11 . 1 1 116 116 ASN CB C 546 36.639 36.639 40.010 -3.371 18053
7243 1 11 . 1 1 116 116 ASN H H 546 8.016 8.016 7.883 0.133 18053
7244 1 11 . 1 1 117 117 ALA N N 547 119.834 119.834 121.133 -1.299 18053
7245 1 11 . 1 1 117 117 ALA HA H 547 3.866 3.866 4.021 -0.155 18053
7246 1 11 . 1 1 117 117 ALA C C 547 177.772 177.772 178.504 -0.732 18053
7247 1 11 . 1 1 117 117 ALA CA C 547 54.504 54.504 54.328 0.176 18053
7248 1 11 . 1 1 117 117 ALA CB C 547 18.200 18.200 18.617 -0.417 18053
7249 1 11 . 1 1 117 117 ALA H H 547 6.444 6.444 8.112 -1.668 18053
7250 1 11 . 1 1 118 118 ASP N N 548 115.646 115.646 117.445 -1.799 18053
7251 1 11 . 1 1 118 118 ASP HA H 548 4.644 4.644 4.397 0.247 18053
7252 1 11 . 1 1 118 118 ASP C C 548 176.052 176.052 177.384 -1.332 18053
7253 1 11 . 1 1 118 118 ASP CA C 548 54.067 54.067 55.481 -1.414 18053
7254 1 11 . 1 1 118 118 ASP CB C 548 41.674 41.674 41.336 0.338 18053
7255 1 11 . 1 1 118 118 ASP H H 548 7.181 7.181 8.156 -0.975 18053
7256 1 11 . 1 1 119 119 GLY N N 549 107.167 107.167 106.653 0.514 18053
7257 1 11 . 1 1 119 119 GLY C C 549 173.841 173.841 174.038 -0.197 18053
7258 1 11 . 1 1 119 119 GLY CA C 549 45.455 45.455 44.550 0.905 18053
7259 1 11 . 1 1 119 119 GLY H H 549 7.738 7.738 7.527 0.211 18053
7260 1 11 . 1 1 120 120 GLU N N 550 121.196 121.196 121.260 -0.064 18053
7261 1 11 . 1 1 120 120 GLU HA H 550 4.112 4.112 4.249 -0.137 18053
7262 1 11 . 1 1 120 120 GLU C C 550 175.588 175.588 175.082 0.506 18053
7263 1 11 . 1 1 120 120 GLU CA C 550 54.831 54.831 55.558 -0.727 18053
7264 1 11 . 1 1 120 120 GLU CB C 550 29.937 29.937 30.278 -0.341 18053
7265 1 11 . 1 1 120 120 GLU H H 550 7.587 7.587 7.798 -0.211 18053
7266 1 11 . 1 1 121 121 GLU N N 551 123.886 123.886 121.139 2.747 18053
7267 1 11 . 1 1 121 121 GLU HA H 551 4.276 4.276 4.365 -0.089 18053
7268 1 11 . 1 1 121 121 GLU C C 551 176.817 176.817 176.407 0.410 18053
7269 1 11 . 1 1 121 121 GLU CA C 551 56.796 56.796 55.914 0.881 18053
7270 1 11 . 1 1 121 121 GLU CB C 551 28.955 28.955 29.907 -0.952 18053
7271 1 11 . 1 1 121 121 GLU H H 551 8.697 8.697 8.684 0.013 18053
7272 1 11 . 1 1 122 122 VAL N N 552 120.055 120.055 120.265 -0.210 18053
7273 1 11 . 1 1 122 122 VAL HA H 552 4.364 4.364 3.976 0.388 18053
7274 1 11 . 1 1 122 122 VAL C C 552 175.998 175.998 175.469 0.529 18053
7275 1 11 . 1 1 122 122 VAL CA C 552 61.655 61.655 63.092 -1.437 18053
7276 1 11 . 1 1 122 122 VAL CB C 552 33.049 33.049 32.340 0.709 18053
7277 1 11 . 1 1 122 122 VAL H H 552 8.845 8.845 8.101 0.744 18053
7278 1 11 . 1 1 123 123 ALA N N 553 122.098 122.098 121.591 0.507 18053
7279 1 11 . 1 1 123 123 ALA HA H 553 4.890 4.890 4.680 0.210 18053
7280 1 11 . 1 1 123 123 ALA C C 553 175.261 175.261 175.257 0.004 18053
7281 1 11 . 1 1 123 123 ALA CA C 553 52.757 52.757 51.980 0.777 18053
7282 1 11 . 1 1 123 123 ALA CB C 553 22.267 22.267 21.983 0.284 18053
7283 1 11 . 1 1 123 123 ALA H H 553 7.788 7.788 7.615 0.173 18053
7284 1 11 . 1 1 124 124 MET N N 554 118.217 118.217 124.236 -6.019 18053
7285 1 11 . 1 1 124 124 MET HA H 554 5.286 5.286 4.738 0.548 18053
7286 1 11 . 1 1 124 124 MET C C 554 174.428 174.428 174.747 -0.319 18053
7287 1 11 . 1 1 124 124 MET CA C 554 55.104 55.104 55.173 -0.069 18053
7288 1 11 . 1 1 124 124 MET CB C 554 35.342 35.342 34.725 0.617 18053
7289 1 11 . 1 1 124 124 MET H H 554 8.693 8.693 8.580 0.113 18053
7290 1 11 . 1 1 125 125 ARG N N 555 122.132 122.132 128.936 -6.804 18053
7291 1 11 . 1 1 125 125 ARG HA H 555 4.900 4.900 4.734 0.166 18053
7292 1 11 . 1 1 125 125 ARG CA C 555 56.388 56.388 55.256 1.132 18053
7293 1 11 . 1 1 125 125 ARG CB C 555 34.378 34.378 32.558 1.820 18053
7294 1 11 . 1 1 125 125 ARG H H 555 8.919 8.919 8.865 0.054 18053
7295 1 11 . 1 1 126 126 THR HA H 556 4.685 4.685 4.405 0.280 18053
7296 1 11 . 1 1 126 126 THR C C 556 172.436 172.436 173.602 -1.166 18053
7297 1 11 . 1 1 126 126 THR CA C 556 61.382 61.382 63.232 -1.850 18053
7298 1 11 . 1 1 126 126 THR CB C 556 70.444 70.444 69.468 0.976 18053
7299 1 11 . 1 1 127 127 VAL N N 557 124.976 124.976 126.224 -1.248 18053
7300 1 11 . 1 1 127 127 VAL HA H 557 4.146 4.146 4.321 -0.175 18053
7301 1 11 . 1 1 127 127 VAL C C 557 173.937 173.937 173.008 0.929 18053
7302 1 11 . 1 1 127 127 VAL CA C 557 61.109 61.109 59.226 1.883 18053
7303 1 11 . 1 1 127 127 VAL CB C 557 33.759 33.759 35.145 -1.386 18053
7304 1 11 . 1 1 127 127 VAL H H 557 8.127 8.127 8.632 -0.505 18053
7305 1 11 . 1 1 128 128 LYS N N 558 125.384 125.384 126.658 -1.274 18053
7306 1 11 . 1 1 128 128 LYS HA H 558 4.706 4.706 4.324 0.382 18053
7307 1 11 . 1 1 128 128 LYS C C 558 175.534 175.534 175.355 0.179 18053
7308 1 11 . 1 1 128 128 LYS CA C 558 54.886 54.886 53.666 1.220 18053
7309 1 11 . 1 1 128 128 LYS CB C 558 34.673 34.673 33.323 1.350 18053
7310 1 11 . 1 1 128 128 LYS H H 558 8.289 8.289 8.230 0.059 18053
7311 1 11 . 1 1 129 129 LYS N N 559 124.005 124.005 125.342 -1.337 18053
7312 1 11 . 1 1 129 129 LYS HA H 559 4.310 4.310 4.130 0.180 18053
7313 1 11 . 1 1 129 129 LYS C C 559 176.571 176.571 176.153 0.418 18053
7314 1 11 . 1 1 129 129 LYS CA C 559 56.742 56.742 56.665 0.077 18053
7315 1 11 . 1 1 129 129 LYS CB C 559 33.362 33.362 31.281 2.081 18053
7316 1 11 . 1 1 129 129 LYS H H 559 8.461 8.461 8.189 0.272 18053
7317 1 11 . 1 1 130 130 SER N N 560 117.195 117.195 118.037 -0.842 18053
7318 1 11 . 1 1 130 130 SER HA H 560 4.384 4.384 4.582 -0.198 18053
7319 1 11 . 1 1 130 130 SER C C 560 174.565 174.565 174.962 -0.397 18053
7320 1 11 . 1 1 130 130 SER CA C 560 58.434 58.434 58.711 -0.277 18053
7321 1 11 . 1 1 130 130 SER CB C 560 63.812 63.812 63.838 -0.026 18053
7322 1 11 . 1 1 130 130 SER H H 560 8.465 8.465 8.037 0.428 18053
7323 1 11 . 1 1 131 131 SER N N 561 118.149 118.149 116.966 1.183 18053
7324 1 11 . 1 1 131 131 SER HA H 561 4.412 4.412 4.574 -0.162 18053
7325 1 11 . 1 1 131 131 SER C C 561 174.456 174.456 174.853 -0.397 18053
7326 1 11 . 1 1 131 131 SER CA C 561 58.489 58.489 57.191 1.298 18053
7327 1 11 . 1 1 131 131 SER CB C 561 63.811 63.811 64.051 -0.240 18053
7328 1 11 . 1 1 131 131 SER H H 561 8.336 8.336 7.637 0.699 18053
7329 1 11 . 1 1 132 132 VAL N N 562 121.332 121.332 123.014 -1.682 18053
7330 1 11 . 1 1 132 132 VAL HA H 562 4.035 4.035 4.258 -0.223 18053
7331 1 11 . 1 1 132 132 VAL C C 562 176.066 176.066 174.960 1.106 18053
7332 1 11 . 1 1 132 132 VAL CA C 562 62.446 62.446 60.922 1.524 18053
7333 1 11 . 1 1 132 132 VAL CB C 562 32.394 32.394 32.107 0.287 18053
7334 1 11 . 1 1 132 132 VAL H H 562 7.982 7.982 8.613 -0.631 18053
7335 1 11 . 1 1 133 133 MET N N 563 124.022 124.022 119.898 4.124 18053
7336 1 11 . 1 1 133 133 MET HA H 563 4.385 4.385 4.411 -0.026 18053
7337 1 11 . 1 1 133 133 MET C C 563 176.039 176.039 175.794 0.245 18053
7338 1 11 . 1 1 133 133 MET CA C 563 55.350 55.350 56.956 -1.605 18053
7339 1 11 . 1 1 133 133 MET CB C 563 32.503 32.503 33.051 -0.548 18053
7340 1 11 . 1 1 133 133 MET H H 563 8.295 8.295 7.364 0.931 18053
7341 1 11 . 1 1 134 134 ARG N N 564 122.677 122.677 120.397 2.280 18053
7342 1 11 . 1 1 134 134 ARG HA H 564 4.262 4.262 4.871 -0.609 18053
7343 1 11 . 1 1 134 134 ARG C C 564 176.298 176.298 175.619 0.679 18053
7344 1 11 . 1 1 134 134 ARG CA C 564 56.087 56.087 53.258 2.829 18053
7345 1 11 . 1 1 134 134 ARG CB C 564 30.702 30.702 31.665 -0.963 18053
7346 1 11 . 1 1 134 134 ARG H H 564 8.295 8.295 8.601 -0.306 18053
7347 1 11 . 1 1 135 135 GLU N N 565 121.945 121.945 119.482 2.463 18053
7348 1 11 . 1 1 135 135 GLU HA H 565 4.160 4.160 4.279 -0.119 18053
7349 1 11 . 1 1 135 135 GLU C C 565 176.080 176.080 177.291 -1.211 18053
7350 1 11 . 1 1 135 135 GLU CA C 565 56.906 56.906 57.404 -0.498 18053
7351 1 11 . 1 1 135 135 GLU CB C 565 29.774 29.774 29.656 0.118 18053
7352 1 11 . 1 1 135 135 GLU H H 565 8.470 8.470 8.590 -0.120 18053
7353 1 11 . 1 1 136 136 ASN N N 566 118.761 118.761 121.417 -2.656 18053
7354 1 11 . 1 1 136 136 ASN HA H 566 4.617 4.617 4.871 -0.254 18053
7355 1 11 . 1 1 136 136 ASN C C 566 175.315 175.315 175.904 -0.589 18053
7356 1 11 . 1 1 136 136 ASN CA C 566 53.193 53.193 56.587 -3.394 18053
7357 1 11 . 1 1 136 136 ASN CB C 566 38.836 38.836 37.578 1.258 18053
7358 1 11 . 1 1 136 136 ASN H H 566 8.341 8.341 9.390 -1.049 18053
7359 1 11 . 1 1 137 137 GLU N N 567 121.349 121.349 120.406 0.943 18053
7360 1 11 . 1 1 137 137 GLU HA H 567 4.152 4.152 4.110 0.042 18053
7361 1 11 . 1 1 137 137 GLU C C 567 176.243 176.243 177.619 -1.376 18053
7362 1 11 . 1 1 137 137 GLU CA C 567 56.906 56.906 58.224 -1.319 18053
7363 1 11 . 1 1 137 137 GLU CB C 567 29.992 29.992 30.223 -0.231 18053
7364 1 11 . 1 1 137 137 GLU H H 567 8.349 8.349 8.131 0.218 18053
7365 1 11 . 1 1 138 138 ASN N N 568 118.761 118.761 116.274 2.487 18053
7366 1 11 . 1 1 138 138 ASN HA H 568 4.712 4.712 4.555 0.157 18053
7367 1 11 . 1 1 138 138 ASN C C 568 174.551 174.551 174.616 -0.065 18053
7368 1 11 . 1 1 138 138 ASN CA C 568 53.193 53.193 55.003 -1.810 18053
7369 1 11 . 1 1 138 138 ASN CB C 568 39.327 39.327 38.078 1.249 18053
7370 1 11 . 1 1 138 138 ASN H H 568 8.397 8.397 8.128 0.269 18053
7371 1 12 . 1 1 20 20 ALA N N 450 125.180 125.180 126.736 -1.556 18053
7372 1 12 . 1 1 20 20 ALA HA H 450 4.706 4.706 4.359 0.347 18053
7373 1 12 . 1 1 20 20 ALA C C 450 177.226 177.226 176.983 0.243 18053
7374 1 12 . 1 1 20 20 ALA CA C 450 52.757 52.757 52.745 0.012 18053
7375 1 12 . 1 1 20 20 ALA CB C 450 20.411 20.411 18.097 2.314 18053
7376 1 12 . 1 1 20 20 ALA H H 450 8.484 8.484 8.383 0.101 18053
7377 1 12 . 1 1 21 21 SER N N 451 115.714 115.714 118.716 -3.002 18053
7378 1 12 . 1 1 21 21 SER HA H 451 4.513 4.513 4.545 -0.032 18053
7379 1 12 . 1 1 21 21 SER C C 451 174.742 174.742 175.409 -0.667 18053
7380 1 12 . 1 1 21 21 SER CA C 451 58.516 58.516 57.231 1.285 18053
7381 1 12 . 1 1 21 21 SER CB C 451 64.159 64.159 64.148 0.011 18053
7382 1 12 . 1 1 21 21 SER H H 451 8.487 8.487 7.829 0.658 18053
7383 1 12 . 1 1 22 22 GLY N N 452 111.509 111.509 115.446 -3.937 18053
7384 1 12 . 1 1 22 22 GLY C C 452 174.401 174.401 175.385 -0.984 18053
7385 1 12 . 1 1 22 22 GLY CA C 452 45.059 45.059 45.503 -0.444 18053
7386 1 12 . 1 1 22 22 GLY H H 452 8.198 8.198 8.995 -0.797 18053
7387 1 12 . 1 1 23 23 SER N N 453 116.191 116.191 115.655 0.536 18053
7388 1 12 . 1 1 23 23 SER HA H 453 4.364 4.364 4.350 0.014 18053
7389 1 12 . 1 1 23 23 SER C C 453 173.432 173.432 173.901 -0.469 18053
7390 1 12 . 1 1 23 23 SER CA C 453 59.744 59.744 61.231 -1.487 18053
7391 1 12 . 1 1 23 23 SER CB C 453 64.335 64.335 64.099 0.236 18053
7392 1 12 . 1 1 23 23 SER H H 453 8.494 8.494 8.576 -0.082 18053
7393 1 12 . 1 1 24 24 VAL N N 454 121.656 121.656 118.807 2.849 18053
7394 1 12 . 1 1 24 24 VAL HA H 454 5.035 5.035 4.609 0.426 18053
7395 1 12 . 1 1 24 24 VAL C C 454 174.606 174.606 175.134 -0.528 18053
7396 1 12 . 1 1 24 24 VAL CA C 454 61.055 61.055 61.476 -0.421 18053
7397 1 12 . 1 1 24 24 VAL CB C 454 32.503 32.503 34.989 -2.486 18053
7398 1 12 . 1 1 24 24 VAL H H 454 7.830 7.830 7.878 -0.048 18053
7399 1 12 . 1 1 25 25 SER N N 455 119.323 119.323 121.027 -1.704 18053
7400 1 12 . 1 1 25 25 SER HA H 455 4.672 4.672 4.922 -0.250 18053
7401 1 12 . 1 1 25 25 SER C C 455 174.426 174.426 173.236 1.190 18053
7402 1 12 . 1 1 25 25 SER CA C 455 55.268 55.268 56.782 -1.514 18053
7403 1 12 . 1 1 25 25 SER CB C 455 65.162 65.162 66.310 -1.148 18053
7404 1 12 . 1 1 25 25 SER H H 455 9.065 9.065 9.014 0.051 18053
7405 1 12 . 1 1 26 26 ILE N N 456 119.468 119.468 121.914 -2.446 18053
7406 1 12 . 1 1 26 26 ILE HA H 456 4.180 4.180 4.261 -0.081 18053
7407 1 12 . 1 1 26 26 ILE C C 456 175.506 175.506 175.895 -0.389 18053
7408 1 12 . 1 1 26 26 ILE CA C 456 61.328 61.328 61.406 -0.078 18053
7409 1 12 . 1 1 26 26 ILE CB C 456 37.962 37.962 38.163 -0.201 18053
7410 1 12 . 1 1 26 26 ILE H H 456 8.295 8.295 8.574 -0.279 18053
7411 1 12 . 1 1 27 27 GLU N N 457 129.726 129.726 129.110 0.616 18053
7412 1 12 . 1 1 27 27 GLU HA H 457 4.228 4.228 4.298 -0.070 18053
7413 1 12 . 1 1 27 27 GLU C C 457 175.179 175.179 176.219 -1.040 18053
7414 1 12 . 1 1 27 27 GLU CA C 457 55.432 55.432 57.308 -1.876 18053
7415 1 12 . 1 1 27 27 GLU CB C 457 30.142 30.142 30.823 -0.681 18053
7416 1 12 . 1 1 27 27 GLU H H 457 8.393 8.393 8.622 -0.229 18053
7417 1 12 . 1 1 28 28 GLU N N 458 117.076 117.076 117.211 -0.135 18053
7418 1 12 . 1 1 28 28 GLU HA H 458 4.168 4.168 4.564 -0.396 18053
7419 1 12 . 1 1 28 28 GLU C C 458 174.701 174.701 175.060 -0.359 18053
7420 1 12 . 1 1 28 28 GLU CA C 458 56.906 56.906 55.479 1.427 18053
7421 1 12 . 1 1 28 28 GLU CB C 458 31.848 31.848 32.881 -1.033 18053
7422 1 12 . 1 1 28 28 GLU H H 458 7.489 7.489 7.737 -0.248 18053
7423 1 12 . 1 1 29 29 ILE N N 459 122.183 122.183 121.695 0.488 18053
7424 1 12 . 1 1 29 29 ILE HA H 459 3.764 3.764 4.105 -0.341 18053
7425 1 12 . 1 1 29 29 ILE C C 459 174.169 174.169 174.230 -0.061 18053
7426 1 12 . 1 1 29 29 ILE CA C 459 59.526 59.526 60.082 -0.556 18053
7427 1 12 . 1 1 29 29 ILE CB C 459 40.309 40.309 40.612 -0.303 18053
7428 1 12 . 1 1 29 29 ILE H H 459 8.126 8.126 8.534 -0.408 18053
7429 1 12 . 1 1 30 30 ASP N N 460 123.205 123.205 125.468 -2.263 18053
7430 1 12 . 1 1 30 30 ASP HA H 460 4.183 4.183 4.361 -0.178 18053
7431 1 12 . 1 1 30 30 ASP C C 460 178.318 178.318 177.123 1.195 18053
7432 1 12 . 1 1 30 30 ASP CA C 460 53.930 53.930 52.715 1.215 18053
7433 1 12 . 1 1 30 30 ASP CB C 460 42.807 42.807 41.865 0.942 18053
7434 1 12 . 1 1 30 30 ASP H H 460 6.704 6.704 7.536 -0.832 18053
7435 1 12 . 1 1 31 31 LEU N N 461 128.551 128.551 123.482 5.069 18053
7436 1 12 . 1 1 31 31 LEU HA H 461 4.064 4.064 4.220 -0.156 18053
7437 1 12 . 1 1 31 31 LEU C C 461 177.513 177.513 178.043 -0.530 18053
7438 1 12 . 1 1 31 31 LEU CA C 461 57.124 57.124 56.580 0.544 18053
7439 1 12 . 1 1 31 31 LEU CB C 461 41.237 41.237 41.568 -0.331 18053
7440 1 12 . 1 1 31 31 LEU H H 461 9.012 9.012 8.402 0.610 18053
7441 1 12 . 1 1 32 32 GLU N N 462 115.101 115.101 120.342 -5.241 18053
7442 1 12 . 1 1 32 32 GLU HA H 462 4.283 4.283 4.150 0.133 18053
7443 1 12 . 1 1 32 32 GLU C C 462 177.062 177.062 177.394 -0.332 18053
7444 1 12 . 1 1 32 32 GLU CA C 462 55.759 55.759 57.468 -1.709 18053
7445 1 12 . 1 1 32 32 GLU CB C 462 29.569 29.569 29.293 0.276 18053
7446 1 12 . 1 1 32 32 GLU H H 462 7.588 7.588 7.846 -0.258 18053
7447 1 12 . 1 1 33 33 GLY N N 463 106.299 106.299 105.103 1.196 18053
7448 1 12 . 1 1 33 33 GLY C C 463 174.824 174.824 175.410 -0.586 18053
7449 1 12 . 1 1 33 33 GLY CA C 463 46.806 46.806 45.350 1.456 18053
7450 1 12 . 1 1 33 33 GLY H H 463 7.372 7.372 8.350 -0.978 18053
7451 1 12 . 1 1 34 34 LYS N N 464 118.744 118.744 119.039 -0.295 18053
7452 1 12 . 1 1 34 34 LYS HA H 464 4.562 4.562 4.379 0.183 18053
7453 1 12 . 1 1 34 34 LYS C C 464 177.076 177.076 174.877 2.199 18053
7454 1 12 . 1 1 34 34 LYS CA C 464 59.963 59.963 58.037 1.926 18053
7455 1 12 . 1 1 34 34 LYS CB C 464 33.111 33.111 33.483 -0.372 18053
7456 1 12 . 1 1 34 34 LYS H H 464 9.547 9.547 8.368 1.179 18053
7457 1 12 . 1 1 35 35 PHE N N 465 109.125 109.125 111.829 -2.704 18053
7458 1 12 . 1 1 35 35 PHE HA H 465 5.514 5.514 4.863 0.651 18053
7459 1 12 . 1 1 35 35 PHE C C 465 174.183 174.183 172.676 1.507 18053
7460 1 12 . 1 1 35 35 PHE CA C 465 56.632 56.632 54.867 1.765 18053
7461 1 12 . 1 1 35 35 PHE CB C 465 40.599 40.599 41.194 -0.595 18053
7462 1 12 . 1 1 35 35 PHE H H 465 6.740 6.740 6.815 -0.075 18053
7463 1 12 . 1 1 36 36 VAL N N 466 119.579 119.579 119.358 0.221 18053
7464 1 12 . 1 1 36 36 VAL HA H 466 3.709 3.709 4.076 -0.367 18053
7465 1 12 . 1 1 36 36 VAL C C 466 172.668 172.668 174.264 -1.596 18053
7466 1 12 . 1 1 36 36 VAL CA C 466 62.692 62.692 61.136 1.556 18053
7467 1 12 . 1 1 36 36 VAL CB C 466 36.215 36.215 34.577 1.638 18053
7468 1 12 . 1 1 36 36 VAL H H 466 7.628 7.628 8.178 -0.550 18053
7469 1 12 . 1 1 37 37 GLN N N 467 126.831 126.831 127.430 -0.599 18053
7470 1 12 . 1 1 37 37 GLN HA H 467 5.449 5.449 4.830 0.619 18053
7471 1 12 . 1 1 37 37 GLN C C 467 174.797 174.797 174.882 -0.085 18053
7472 1 12 . 1 1 37 37 GLN CA C 467 54.121 54.121 54.809 -0.689 18053
7473 1 12 . 1 1 37 37 GLN CB C 467 34.623 34.623 29.673 4.950 18053
7474 1 12 . 1 1 37 37 GLN H H 467 8.392 8.392 8.416 -0.024 18053
7475 1 12 . 1 1 38 38 LEU N N 468 123.018 123.018 127.217 -4.199 18053
7476 1 12 . 1 1 38 38 LEU HA H 468 5.422 5.422 5.131 0.291 18053
7477 1 12 . 1 1 38 38 LEU C C 468 175.588 175.588 176.122 -0.534 18053
7478 1 12 . 1 1 38 38 LEU CA C 468 52.702 52.702 53.683 -0.981 18053
7479 1 12 . 1 1 38 38 LEU CB C 468 45.046 45.046 44.652 0.394 18053
7480 1 12 . 1 1 38 38 LEU H H 468 9.103 9.103 8.827 0.276 18053
7481 1 12 . 1 1 39 39 LYS N N 469 118.983 118.983 120.009 -1.026 18053
7482 1 12 . 1 1 39 39 LYS HA H 469 4.852 4.852 4.895 -0.043 18053
7483 1 12 . 1 1 39 39 LYS C C 469 173.309 173.309 174.348 -1.039 18053
7484 1 12 . 1 1 39 39 LYS CA C 469 54.994 54.994 54.693 0.301 18053
7485 1 12 . 1 1 39 39 LYS CB C 469 38.246 38.246 36.502 1.744 18053
7486 1 12 . 1 1 39 39 LYS H H 469 8.496 8.496 8.705 -0.209 18053
7487 1 12 . 1 1 40 40 ASN N N 470 121.758 121.758 124.793 -3.035 18053
7488 1 12 . 1 1 40 40 ASN HA H 470 4.788 4.788 4.988 -0.200 18053
7489 1 12 . 1 1 40 40 ASN C C 470 174.496 174.496 175.574 -1.078 18053
7490 1 12 . 1 1 40 40 ASN CA C 470 51.119 51.119 52.293 -1.174 18053
7491 1 12 . 1 1 40 40 ASN CB C 470 37.559 37.559 39.181 -1.622 18053
7492 1 12 . 1 1 40 40 ASN H H 470 8.283 8.283 8.644 -0.361 18053
7493 1 12 . 1 1 41 41 ASN N N 471 122.422 122.422 124.706 -2.284 18053
7494 1 12 . 1 1 41 41 ASN HA H 471 4.588 4.588 4.691 -0.103 18053
7495 1 12 . 1 1 41 41 ASN C C 471 174.810 174.810 175.803 -0.993 18053
7496 1 12 . 1 1 41 41 ASN CA C 471 53.985 53.985 53.946 0.039 18053
7497 1 12 . 1 1 41 41 ASN CB C 471 39.600 39.600 38.848 0.752 18053
7498 1 12 . 1 1 41 41 ASN H H 471 8.681 8.681 8.541 0.140 18053
7499 1 12 . 1 1 42 42 SER N N 472 116.446 116.446 116.173 0.273 18053
7500 1 12 . 1 1 42 42 SER HA H 472 4.719 4.719 4.411 0.308 18053
7501 1 12 . 1 1 42 42 SER C C 472 172.804 172.804 174.651 -1.847 18053
7502 1 12 . 1 1 42 42 SER CA C 472 57.288 57.288 58.385 -1.097 18053
7503 1 12 . 1 1 42 42 SER CB C 472 66.241 66.241 64.651 1.590 18053
7504 1 12 . 1 1 42 42 SER H H 472 8.370 8.370 7.754 0.616 18053
7505 1 12 . 1 1 43 43 ASP N N 473 117.706 117.706 119.196 -1.490 18053
7506 1 12 . 1 1 43 43 ASP HA H 473 4.474 4.474 4.553 -0.079 18053
7507 1 12 . 1 1 43 43 ASP C C 473 175.343 175.343 175.398 -0.055 18053
7508 1 12 . 1 1 43 43 ASP CA C 473 53.521 53.521 55.257 -1.736 18053
7509 1 12 . 1 1 43 43 ASP CB C 473 40.322 40.322 41.052 -0.730 18053
7510 1 12 . 1 1 43 43 ASP H H 473 8.254 8.254 8.668 -0.414 18053
7511 1 12 . 1 1 44 44 LYS N N 474 120.209 120.209 117.309 2.900 18053
7512 1 12 . 1 1 44 44 LYS HA H 474 4.569 4.569 4.380 0.189 18053
7513 1 12 . 1 1 44 44 LYS C C 474 175.397 175.397 174.397 1.000 18053
7514 1 12 . 1 1 44 44 LYS CA C 474 54.012 54.012 54.642 -0.630 18053
7515 1 12 . 1 1 44 44 LYS CB C 474 35.383 35.383 34.000 1.383 18053
7516 1 12 . 1 1 44 44 LYS H H 474 8.305 8.305 7.331 0.974 18053
7517 1 12 . 1 1 45 45 ASP N N 475 124.993 124.993 118.065 6.928 18053
7518 1 12 . 1 1 45 45 ASP HA H 475 3.975 3.975 4.525 -0.550 18053
7519 1 12 . 1 1 45 45 ASP C C 475 174.810 174.810 175.699 -0.889 18053
7520 1 12 . 1 1 45 45 ASP CA C 475 54.995 54.995 54.077 0.918 18053
7521 1 12 . 1 1 45 45 ASP CB C 475 40.364 40.364 40.788 -0.424 18053
7522 1 12 . 1 1 45 45 ASP H H 475 8.722 8.722 8.294 0.428 18053
7523 1 12 . 1 1 46 46 GLN N N 476 120.549 120.549 123.828 -3.279 18053
7524 1 12 . 1 1 46 46 GLN HA H 476 4.436 4.436 4.540 -0.104 18053
7525 1 12 . 1 1 46 46 GLN C C 476 174.019 174.019 175.152 -1.133 18053
7526 1 12 . 1 1 46 46 GLN CA C 476 53.138 53.138 53.787 -0.649 18053
7527 1 12 . 1 1 46 46 GLN CB C 476 31.466 31.466 31.038 0.428 18053
7528 1 12 . 1 1 46 46 GLN H H 476 7.878 7.878 8.470 -0.593 18053
7529 1 12 . 1 1 47 47 SER N N 477 121.537 121.537 120.748 0.789 18053
7530 1 12 . 1 1 47 47 SER HA H 477 4.229 4.229 4.181 0.048 18053
7531 1 12 . 1 1 47 47 SER C C 477 174.565 174.565 173.357 1.208 18053
7532 1 12 . 1 1 47 47 SER CA C 477 58.706 58.706 58.724 -0.018 18053
7533 1 12 . 1 1 47 47 SER CB C 477 62.965 62.965 63.455 -0.490 18053
7534 1 12 . 1 1 47 47 SER H H 477 8.748 8.748 8.655 0.093 18053
7535 1 12 . 1 1 48 48 LEU N N 478 127.751 127.751 124.712 3.039 18053
7536 1 12 . 1 1 48 48 LEU HA H 478 2.631 2.631 4.294 -1.663 18053
7537 1 12 . 1 1 48 48 LEU C C 478 176.789 176.789 175.851 0.938 18053
7538 1 12 . 1 1 48 48 LEU CA C 478 52.102 52.102 53.838 -1.736 18053
7539 1 12 . 1 1 48 48 LEU CB C 478 42.343 42.343 44.612 -2.269 18053
7540 1 12 . 1 1 48 48 LEU H H 478 7.856 7.856 8.119 -0.263 18053
7541 1 12 . 1 1 49 49 GLY N N 479 107.525 107.525 109.395 -1.870 18053
7542 1 12 . 1 1 49 49 GLY C C 479 176.653 176.653 175.321 1.332 18053
7543 1 12 . 1 1 49 49 GLY CA C 479 48.062 48.062 45.965 2.097 18053
7544 1 12 . 1 1 49 49 GLY H H 479 7.728 7.728 8.781 -1.053 18053
7545 1 12 . 1 1 50 50 ASN N N 480 117.059 117.059 119.592 -2.533 18053
7546 1 12 . 1 1 50 50 ASN HA H 480 4.255 4.255 4.620 -0.365 18053
7547 1 12 . 1 1 50 50 ASN C C 480 174.961 174.961 174.882 0.079 18053
7548 1 12 . 1 1 50 50 ASN CA C 480 56.360 56.360 54.165 2.195 18053
7549 1 12 . 1 1 50 50 ASN CB C 480 37.416 37.416 38.756 -1.340 18053
7550 1 12 . 1 1 50 50 ASN H H 480 7.552 7.552 8.597 -1.045 18053
7551 1 12 . 1 1 51 51 TRP N N 481 122.166 122.166 118.934 3.232 18053
7552 1 12 . 1 1 51 51 TRP HA H 481 4.477 4.477 4.915 -0.438 18053
7553 1 12 . 1 1 51 51 TRP C C 481 175.575 175.575 175.847 -0.272 18053
7554 1 12 . 1 1 51 51 TRP CA C 481 58.762 58.762 57.536 1.226 18053
7555 1 12 . 1 1 51 51 TRP CB C 481 28.041 28.041 30.374 -2.333 18053
7556 1 12 . 1 1 51 51 TRP H H 481 8.914 8.914 8.107 0.807 18053
7557 1 12 . 1 1 52 52 ARG N N 482 116.480 116.480 116.259 0.221 18053
7558 1 12 . 1 1 52 52 ARG HA H 482 5.968 5.968 5.232 0.736 18053
7559 1 12 . 1 1 52 52 ARG C C 482 175.807 175.807 174.895 0.912 18053
7560 1 12 . 1 1 52 52 ARG CA C 482 54.121 54.121 55.512 -1.391 18053
7561 1 12 . 1 1 52 52 ARG CB C 482 35.124 35.124 33.549 1.575 18053
7562 1 12 . 1 1 52 52 ARG H H 482 9.147 9.147 9.141 0.006 18053
7563 1 12 . 1 1 53 53 ILE N N 483 119.579 119.579 125.476 -5.897 18053
7564 1 12 . 1 1 53 53 ILE HA H 483 4.985 4.985 4.819 0.166 18053
7565 1 12 . 1 1 53 53 ILE C C 483 175.670 175.670 175.796 -0.126 18053
7566 1 12 . 1 1 53 53 ILE CA C 483 60.400 60.400 61.122 -0.722 18053
7567 1 12 . 1 1 53 53 ILE CB C 483 40.227 40.227 38.574 1.653 18053
7568 1 12 . 1 1 53 53 ILE H H 483 9.000 9.000 8.898 0.102 18053
7569 1 12 . 1 1 54 54 LYS N N 484 124.737 124.737 127.817 -3.080 18053
7570 1 12 . 1 1 54 54 LYS HA H 484 5.463 5.463 5.136 0.327 18053
7571 1 12 . 1 1 54 54 LYS C C 484 175.575 175.575 176.080 -0.505 18053
7572 1 12 . 1 1 54 54 LYS CA C 484 54.613 54.613 55.809 -1.196 18053
7573 1 12 . 1 1 54 54 LYS CB C 484 35.041 35.041 34.126 0.915 18053
7574 1 12 . 1 1 54 54 LYS H H 484 9.678 9.678 8.488 1.190 18053
7575 1 12 . 1 1 55 55 ARG N N 485 124.090 124.090 123.520 0.570 18053
7576 1 12 . 1 1 55 55 ARG HA H 485 5.525 5.525 4.648 0.877 18053
7577 1 12 . 1 1 55 55 ARG C C 485 174.155 174.155 174.637 -0.482 18053
7578 1 12 . 1 1 55 55 ARG CA C 485 53.903 53.903 55.325 -1.422 18053
7579 1 12 . 1 1 55 55 ARG H H 485 9.314 9.314 8.760 0.554 18053
7580 1 12 . 1 1 56 56 GLN N N 486 126.576 126.576 128.468 -1.892 18053
7581 1 12 . 1 1 56 56 GLN HA H 486 4.842 4.842 4.595 0.247 18053
7582 1 12 . 1 1 56 56 GLN C C 486 174.991 174.991 174.627 0.364 18053
7583 1 12 . 1 1 56 56 GLN CA C 486 54.831 54.831 55.080 -0.249 18053
7584 1 12 . 1 1 56 56 GLN CB C 486 31.465 31.465 29.635 1.830 18053
7585 1 12 . 1 1 56 56 GLN H H 486 8.831 8.831 8.507 0.324 18053
7586 1 12 . 1 1 57 57 VAL N N 487 126.712 126.712 125.081 1.631 18053
7587 1 12 . 1 1 57 57 VAL HA H 487 4.266 4.266 4.033 0.233 18053
7588 1 12 . 1 1 57 57 VAL C C 487 175.916 175.916 177.870 -1.954 18053
7589 1 12 . 1 1 57 57 VAL CA C 487 61.820 61.820 63.222 -1.402 18053
7590 1 12 . 1 1 57 57 VAL CB C 487 32.803 32.803 32.466 0.337 18053
7591 1 12 . 1 1 57 57 VAL H H 487 8.786 8.786 8.180 0.606 18053
7592 1 12 . 1 1 58 58 LEU N N 488 127.274 127.274 122.905 4.369 18053
7593 1 12 . 1 1 58 58 LEU HA H 488 4.085 4.085 4.117 -0.032 18053
7594 1 12 . 1 1 58 58 LEU C C 488 177.158 177.158 178.092 -0.934 18053
7595 1 12 . 1 1 58 58 LEU CA C 488 56.906 56.906 58.097 -1.192 18053
7596 1 12 . 1 1 58 58 LEU CB C 488 41.374 41.374 41.569 -0.195 18053
7597 1 12 . 1 1 58 58 LEU H H 488 8.316 8.316 8.540 -0.224 18053
7598 1 12 . 1 1 59 59 GLU N N 489 119.647 119.647 117.929 1.718 18053
7599 1 12 . 1 1 59 59 GLU HA H 489 4.112 4.112 4.283 -0.171 18053
7600 1 12 . 1 1 59 59 GLU C C 489 176.230 176.230 177.395 -1.165 18053
7601 1 12 . 1 1 59 59 GLU CA C 489 57.015 57.015 55.859 1.156 18053
7602 1 12 . 1 1 59 59 GLU CB C 489 28.149 28.149 29.387 -1.238 18053
7603 1 12 . 1 1 59 59 GLU H H 489 8.636 8.636 8.120 0.516 18053
7604 1 12 . 1 1 60 60 GLY N N 490 108.819 108.819 108.531 0.288 18053
7605 1 12 . 1 1 60 60 GLY C C 490 173.568 173.568 174.082 -0.514 18053
7606 1 12 . 1 1 60 60 GLY CA C 490 44.773 44.773 45.441 -0.668 18053
7607 1 12 . 1 1 60 60 GLY H H 490 8.160 8.160 7.906 0.254 18053
7608 1 12 . 1 1 61 61 GLU N N 491 121.009 121.009 122.286 -1.277 18053
7609 1 12 . 1 1 61 61 GLU HA H 491 4.323 4.323 4.278 0.045 18053
7610 1 12 . 1 1 61 61 GLU C C 491 175.725 175.725 175.833 -0.108 18053
7611 1 12 . 1 1 61 61 GLU CA C 491 56.196 56.196 56.283 -0.087 18053
7612 1 12 . 1 1 61 61 GLU CB C 491 30.865 30.865 29.212 1.653 18053
7613 1 12 . 1 1 61 61 GLU H H 491 8.320 8.320 8.545 -0.225 18053
7614 1 12 . 1 1 62 62 GLU N N 492 123.426 123.426 124.710 -1.284 18053
7615 1 12 . 1 1 62 62 GLU HA H 492 5.054 5.054 4.976 0.078 18053
7616 1 12 . 1 1 62 62 GLU C C 492 175.930 175.930 176.513 -0.583 18053
7617 1 12 . 1 1 62 62 GLU CA C 492 55.650 55.650 54.914 0.736 18053
7618 1 12 . 1 1 62 62 GLU CB C 492 32.312 32.312 30.015 2.297 18053
7619 1 12 . 1 1 62 62 GLU H H 492 8.594 8.594 8.353 0.241 18053
7620 1 12 . 1 1 63 63 ILE N N 493 119.732 119.732 119.956 -0.224 18053
7621 1 12 . 1 1 63 63 ILE HA H 493 4.788 4.788 4.566 0.222 18053
7622 1 12 . 1 1 63 63 ILE C C 493 174.647 174.647 174.878 -0.231 18053
7623 1 12 . 1 1 63 63 ILE CA C 493 60.181 60.181 60.409 -0.228 18053
7624 1 12 . 1 1 63 63 ILE CB C 493 41.183 41.183 39.712 1.471 18053
7625 1 12 . 1 1 63 63 ILE H H 493 8.523 8.523 7.916 0.607 18053
7626 1 12 . 1 1 64 64 ALA N N 494 122.166 122.166 126.584 -4.418 18053
7627 1 12 . 1 1 64 64 ALA HA H 494 5.521 5.521 4.967 0.554 18053
7628 1 12 . 1 1 64 64 ALA C C 494 174.606 174.606 175.970 -1.364 18053
7629 1 12 . 1 1 64 64 ALA CA C 494 51.528 51.528 50.385 1.143 18053
7630 1 12 . 1 1 64 64 ALA CB C 494 22.239 22.239 20.434 1.805 18053
7631 1 12 . 1 1 64 64 ALA H H 494 8.741 8.741 8.245 0.496 18053
7632 1 12 . 1 1 65 65 TYR N N 495 126.729 126.729 126.996 -0.267 18053
7633 1 12 . 1 1 65 65 TYR HA H 495 3.094 3.094 3.274 -0.180 18053
7634 1 12 . 1 1 65 65 TYR C C 495 173.036 173.036 173.484 -0.448 18053
7635 1 12 . 1 1 65 65 TYR CA C 495 56.905 56.905 56.484 0.420 18053
7636 1 12 . 1 1 65 65 TYR CB C 495 40.269 40.269 38.609 1.660 18053
7637 1 12 . 1 1 65 65 TYR H H 495 8.462 8.462 8.395 0.067 18053
7638 1 12 . 1 1 66 66 LYS N N 496 128.108 128.108 126.551 1.557 18053
7639 1 12 . 1 1 66 66 LYS HA H 496 4.822 4.822 4.353 0.469 18053
7640 1 12 . 1 1 66 66 LYS C C 496 174.906 174.906 174.695 0.211 18053
7641 1 12 . 1 1 66 66 LYS CA C 496 53.739 53.739 54.843 -1.103 18053
7642 1 12 . 1 1 66 66 LYS CB C 496 34.782 34.782 33.903 0.880 18053
7643 1 12 . 1 1 66 66 LYS H H 496 7.010 7.010 7.196 -0.186 18053
7644 1 12 . 1 1 67 67 PHE N N 497 125.299 125.299 121.521 3.778 18053
7645 1 12 . 1 1 67 67 PHE HA H 497 3.932 3.932 4.308 -0.376 18053
7646 1 12 . 1 1 67 67 PHE C C 497 177.990 177.990 175.531 2.459 18053
7647 1 12 . 1 1 67 67 PHE CA C 497 59.007 59.007 57.225 1.782 18053
7648 1 12 . 1 1 67 67 PHE CB C 497 40.981 40.981 40.811 0.170 18053
7649 1 12 . 1 1 67 67 PHE H H 497 8.509 8.509 8.004 0.505 18053
7650 1 12 . 1 1 68 68 THR N N 498 116.191 116.191 111.564 4.627 18053
7651 1 12 . 1 1 68 68 THR HA H 498 4.417 4.417 4.671 -0.254 18053
7652 1 12 . 1 1 68 68 THR CA C 498 60.855 60.855 59.192 1.663 18053
7653 1 12 . 1 1 68 68 THR CB C 498 68.019 68.019 69.526 -1.507 18053
7654 1 12 . 1 1 68 68 THR H H 498 8.688 8.688 8.306 0.382 18053
7655 1 12 . 1 1 69 69 PRO HA H 499 3.948 3.948 4.514 -0.566 18053
7656 1 12 . 1 1 69 69 PRO C C 499 177.444 177.444 177.024 0.420 18053
7657 1 12 . 1 1 69 69 PRO CA C 499 66.077 66.077 64.835 1.242 18053
7658 1 12 . 1 1 69 69 PRO CB C 499 32.776 32.776 31.902 0.874 18053
7659 1 12 . 1 1 70 70 LYS N N 500 113.552 113.552 115.508 -1.956 18053
7660 1 12 . 1 1 70 70 LYS HA H 500 4.385 4.385 4.160 0.225 18053
7661 1 12 . 1 1 70 70 LYS C C 500 176.325 176.325 176.666 -0.341 18053
7662 1 12 . 1 1 70 70 LYS CA C 500 54.995 54.995 56.744 -1.749 18053
7663 1 12 . 1 1 70 70 LYS CB C 500 31.793 31.793 31.813 -0.020 18053
7664 1 12 . 1 1 70 70 LYS H H 500 8.016 8.016 7.866 0.150 18053
7665 1 12 . 1 1 71 71 TYR N N 501 121.860 121.860 121.579 0.281 18053
7666 1 12 . 1 1 71 71 TYR HA H 501 3.730 3.730 4.376 -0.646 18053
7667 1 12 . 1 1 71 71 TYR C C 501 174.838 174.838 174.158 0.680 18053
7668 1 12 . 1 1 71 71 TYR CA C 501 62.310 62.310 59.429 2.881 18053
7669 1 12 . 1 1 71 71 TYR CB C 501 38.781 38.781 39.674 -0.893 18053
7670 1 12 . 1 1 71 71 TYR H H 501 7.460 7.460 7.753 -0.293 18053
7671 1 12 . 1 1 72 72 ILE N N 502 129.487 129.487 125.542 3.945 18053
7672 1 12 . 1 1 72 72 ILE HA H 502 3.928 3.928 4.398 -0.470 18053
7673 1 12 . 1 1 72 72 ILE C C 502 172.968 172.968 173.992 -1.024 18053
7674 1 12 . 1 1 72 72 ILE CA C 502 59.308 59.308 59.332 -0.024 18053
7675 1 12 . 1 1 72 72 ILE CB C 502 40.910 40.910 41.760 -0.850 18053
7676 1 12 . 1 1 72 72 ILE H H 502 7.168 7.168 7.374 -0.206 18053
7677 1 12 . 1 1 73 73 LEU N N 503 128.278 128.278 127.754 0.524 18053
7678 1 12 . 1 1 73 73 LEU HA H 503 4.493 4.493 4.535 -0.042 18053
7679 1 12 . 1 1 73 73 LEU C C 503 175.834 175.834 175.420 0.414 18053
7680 1 12 . 1 1 73 73 LEU CA C 503 51.965 51.965 53.243 -1.278 18053
7681 1 12 . 1 1 73 73 LEU CB C 503 42.548 42.548 43.947 -1.399 18053
7682 1 12 . 1 1 73 73 LEU H H 503 8.483 8.483 8.524 -0.041 18053
7683 1 12 . 1 1 74 74 ARG N N 504 129.589 129.589 125.035 4.554 18053
7684 1 12 . 1 1 74 74 ARG HA H 504 3.743 3.743 4.179 -0.436 18053
7685 1 12 . 1 1 74 74 ARG C C 504 175.233 175.233 175.525 -0.292 18053
7686 1 12 . 1 1 74 74 ARG CA C 504 56.851 56.851 55.518 1.333 18053
7687 1 12 . 1 1 74 74 ARG CB C 504 30.292 30.292 30.983 -0.692 18053
7688 1 12 . 1 1 74 74 ARG H H 504 8.673 8.673 8.453 0.220 18053
7689 1 12 . 1 1 75 75 ALA N N 505 123.205 123.205 122.838 0.367 18053
7690 1 12 . 1 1 75 75 ALA HA H 505 3.522 3.522 4.133 -0.611 18053
7691 1 12 . 1 1 75 75 ALA C C 505 178.441 178.441 178.101 0.340 18053
7692 1 12 . 1 1 75 75 ALA CA C 505 53.794 53.794 53.335 0.459 18053
7693 1 12 . 1 1 75 75 ALA CB C 505 18.910 18.910 18.246 0.664 18053
7694 1 12 . 1 1 75 75 ALA H H 505 8.564 8.564 8.449 0.115 18053
7695 1 12 . 1 1 76 76 GLY N N 506 112.241 112.241 114.490 -2.249 18053
7696 1 12 . 1 1 76 76 GLY C C 506 174.278 174.278 174.874 -0.596 18053
7697 1 12 . 1 1 76 76 GLY CA C 506 46.725 46.725 45.406 1.319 18053
7698 1 12 . 1 1 76 76 GLY H H 506 7.381 7.381 8.501 -1.120 18053
7699 1 12 . 1 1 77 77 GLN N N 507 117.382 117.382 119.928 -2.546 18053
7700 1 12 . 1 1 77 77 GLN HA H 507 4.364 4.364 4.411 -0.047 18053
7701 1 12 . 1 1 77 77 GLN C C 507 173.937 173.937 175.398 -1.461 18053
7702 1 12 . 1 1 77 77 GLN CA C 507 54.558 54.558 55.514 -0.956 18053
7703 1 12 . 1 1 77 77 GLN CB C 507 30.073 30.073 29.953 0.120 18053
7704 1 12 . 1 1 77 77 GLN H H 507 7.996 7.996 7.591 0.405 18053
7705 1 12 . 1 1 78 78 MET N N 508 116.957 116.957 121.022 -4.065 18053
7706 1 12 . 1 1 78 78 MET HA H 508 5.388 5.388 5.092 0.296 18053
7707 1 12 . 1 1 78 78 MET C C 508 175.807 175.807 175.151 0.656 18053
7708 1 12 . 1 1 78 78 MET CA C 508 54.067 54.067 54.491 -0.424 18053
7709 1 12 . 1 1 78 78 MET CB C 508 37.198 37.198 35.819 1.379 18053
7710 1 12 . 1 1 78 78 MET H H 508 8.092 8.092 8.418 -0.326 18053
7711 1 12 . 1 1 79 79 VAL N N 509 119.340 119.340 125.748 -6.408 18053
7712 1 12 . 1 1 79 79 VAL HA H 509 4.956 4.956 4.721 0.235 18053
7713 1 12 . 1 1 79 79 VAL C C 509 172.217 172.217 174.595 -2.378 18053
7714 1 12 . 1 1 79 79 VAL CA C 509 59.471 59.471 60.215 -0.744 18053
7715 1 12 . 1 1 79 79 VAL CB C 509 33.676 33.676 34.368 -0.692 18053
7716 1 12 . 1 1 79 79 VAL H H 509 8.534 8.534 8.443 0.091 18053
7717 1 12 . 1 1 80 80 THR N N 510 124.533 124.533 126.894 -2.361 18053
7718 1 12 . 1 1 80 80 THR HA H 510 4.586 4.586 4.522 0.064 18053
7719 1 12 . 1 1 80 80 THR C C 510 172.215 172.215 174.031 -1.816 18053
7720 1 12 . 1 1 80 80 THR CA C 510 62.119 62.119 62.365 -0.246 18053
7721 1 12 . 1 1 80 80 THR CB C 510 69.407 69.407 68.751 0.656 18053
7722 1 12 . 1 1 80 80 THR H H 510 8.301 8.301 8.620 -0.319 18053
7723 1 12 . 1 1 81 81 VAL N N 511 127.002 127.002 128.444 -1.442 18053
7724 1 12 . 1 1 81 81 VAL HA H 511 4.596 4.596 4.546 0.050 18053
7725 1 12 . 1 1 81 81 VAL C C 511 176.667 176.667 175.401 1.266 18053
7726 1 12 . 1 1 81 81 VAL CA C 511 61.382 61.382 62.778 -1.396 18053
7727 1 12 . 1 1 81 81 VAL CB C 511 30.945 30.945 31.004 -0.059 18053
7728 1 12 . 1 1 81 81 VAL H H 511 8.796 8.796 8.353 0.443 18053
7729 1 12 . 1 1 82 82 TRP N N 512 131.479 131.479 129.233 2.246 18053
7730 1 12 . 1 1 82 82 TRP HA H 512 5.338 5.338 5.305 0.033 18053
7731 1 12 . 1 1 82 82 TRP C C 512 176.885 176.885 175.967 0.918 18053
7732 1 12 . 1 1 82 82 TRP CA C 512 56.442 56.442 56.943 -0.501 18053
7733 1 12 . 1 1 82 82 TRP CB C 512 30.701 30.701 31.157 -0.456 18053
7734 1 12 . 1 1 82 82 TRP H H 512 9.924 9.924 9.223 0.701 18053
7735 1 12 . 1 1 83 83 ALA N N 513 123.954 123.954 120.905 3.049 18053
7736 1 12 . 1 1 83 83 ALA HA H 513 4.308 4.308 4.946 -0.638 18053
7737 1 12 . 1 1 83 83 ALA C C 513 178.140 178.140 176.895 1.245 18053
7738 1 12 . 1 1 83 83 ALA CA C 513 52.211 52.211 50.697 1.514 18053
7739 1 12 . 1 1 83 83 ALA CB C 513 18.745 18.745 21.071 -2.326 18053
7740 1 12 . 1 1 83 83 ALA H H 513 9.048 9.048 8.359 0.689 18053
7741 1 12 . 1 1 84 84 ALA N N 514 125.146 125.146 122.275 2.871 18053
7742 1 12 . 1 1 84 84 ALA HA H 514 3.951 3.951 4.156 -0.205 18053
7743 1 12 . 1 1 84 84 ALA C C 514 179.519 179.519 179.412 0.107 18053
7744 1 12 . 1 1 84 84 ALA CA C 514 54.804 54.804 54.846 -0.042 18053
7745 1 12 . 1 1 84 84 ALA CB C 514 18.582 18.582 19.273 -0.691 18053
7746 1 12 . 1 1 84 84 ALA H H 514 8.341 8.341 8.147 0.194 18053
7747 1 12 . 1 1 85 85 GLY N N 515 103.388 103.388 104.308 -0.920 18053
7748 1 12 . 1 1 85 85 GLY C C 515 174.674 174.674 174.670 0.004 18053
7749 1 12 . 1 1 85 85 GLY CA C 515 45.878 45.878 44.703 1.175 18053
7750 1 12 . 1 1 85 85 GLY H H 515 7.996 7.996 7.794 0.202 18053
7751 1 12 . 1 1 86 86 ALA N N 516 120.140 120.140 122.328 -2.188 18053
7752 1 12 . 1 1 86 86 ALA HA H 516 4.344 4.344 4.455 -0.111 18053
7753 1 12 . 1 1 86 86 ALA C C 516 177.690 177.690 178.333 -0.643 18053
7754 1 12 . 1 1 86 86 ALA CA C 516 53.139 53.139 52.192 0.947 18053
7755 1 12 . 1 1 86 86 ALA CB C 516 20.547 20.547 18.576 1.971 18053
7756 1 12 . 1 1 86 86 ALA H H 516 7.474 7.474 7.174 0.300 18053
7757 1 12 . 1 1 87 87 GLY N N 517 105.720 105.720 107.574 -1.854 18053
7758 1 12 . 1 1 87 87 GLY C C 517 173.650 173.650 174.079 -0.429 18053
7759 1 12 . 1 1 87 87 GLY CA C 517 46.014 46.014 45.459 0.555 18053
7760 1 12 . 1 1 87 87 GLY H H 517 7.779 7.779 8.084 -0.305 18053
7761 1 12 . 1 1 88 88 VAL N N 518 121.537 121.537 118.192 3.345 18053
7762 1 12 . 1 1 88 88 VAL HA H 518 3.585 3.585 4.155 -0.570 18053
7763 1 12 . 1 1 88 88 VAL C C 518 174.851 174.851 174.490 0.361 18053
7764 1 12 . 1 1 88 88 VAL CA C 518 61.274 61.274 60.738 0.536 18053
7765 1 12 . 1 1 88 88 VAL CB C 518 33.376 33.376 33.263 0.113 18053
7766 1 12 . 1 1 88 88 VAL H H 518 7.499 7.499 7.608 -0.109 18053
7767 1 12 . 1 1 89 89 ALA N N 519 128.295 128.295 129.901 -1.606 18053
7768 1 12 . 1 1 89 89 ALA HA H 519 4.192 4.192 4.407 -0.215 18053
7769 1 12 . 1 1 89 89 ALA C C 519 176.680 176.680 176.684 -0.004 18053
7770 1 12 . 1 1 89 89 ALA CA C 519 51.283 51.283 51.572 -0.289 18053
7771 1 12 . 1 1 89 89 ALA CB C 519 19.292 19.292 19.529 -0.237 18053
7772 1 12 . 1 1 89 89 ALA H H 519 7.960 7.960 8.220 -0.260 18053
7773 1 12 . 1 1 90 90 HIS N N 520 122.643 122.643 123.136 -0.493 18053
7774 1 12 . 1 1 90 90 HIS HA H 520 4.033 4.033 4.406 -0.373 18053
7775 1 12 . 1 1 90 90 HIS C C 520 175.793 175.793 174.477 1.316 18053
7776 1 12 . 1 1 90 90 HIS CA C 520 58.653 58.653 56.304 2.349 18053
7777 1 12 . 1 1 90 90 HIS CB C 520 32.285 32.285 29.740 2.545 18053
7778 1 12 . 1 1 90 90 HIS H H 520 8.394 8.394 8.828 -0.434 18053
7779 1 12 . 1 1 91 91 SER N N 521 121.247 121.247 123.789 -2.542 18053
7780 1 12 . 1 1 91 91 SER HA H 521 4.629 4.629 4.721 -0.092 18053
7781 1 12 . 1 1 91 91 SER CA C 521 55.843 55.843 55.819 0.024 18053
7782 1 12 . 1 1 91 91 SER CB C 521 62.367 62.367 63.486 -1.119 18053
7783 1 12 . 1 1 91 91 SER H H 521 8.569 8.569 8.278 0.291 18053
7784 1 12 . 1 1 92 92 PRO HA H 522 4.002 4.002 4.807 -0.805 18053
7785 1 12 . 1 1 92 92 PRO CA C 522 62.244 62.244 62.403 -0.159 18053
7786 1 12 . 1 1 92 92 PRO CB C 522 30.931 30.931 31.465 -0.534 18053
7787 1 12 . 1 1 93 93 PRO HA H 523 4.672 4.672 4.990 -0.318 18053
7788 1 12 . 1 1 93 93 PRO C C 523 177.786 177.786 177.353 0.433 18053
7789 1 12 . 1 1 93 93 PRO CA C 523 64.003 64.003 63.460 0.543 18053
7790 1 12 . 1 1 93 93 PRO CB C 523 34.905 34.905 32.653 2.252 18053
7791 1 12 . 1 1 94 94 SER N N 524 117.212 117.212 116.146 1.066 18053
7792 1 12 . 1 1 94 94 SER HA H 524 4.678 4.678 4.623 0.055 18053
7793 1 12 . 1 1 94 94 SER C C 524 174.851 174.851 174.150 0.701 18053
7794 1 12 . 1 1 94 94 SER CA C 524 61.874 61.874 60.036 1.838 18053
7795 1 12 . 1 1 94 94 SER CB C 524 64.057 64.057 64.177 -0.120 18053
7796 1 12 . 1 1 94 94 SER H H 524 8.463 8.463 7.832 0.631 18053
7797 1 12 . 1 1 95 95 THR N N 525 121.588 121.588 118.311 3.277 18053
7798 1 12 . 1 1 95 95 THR HA H 525 4.859 4.859 5.092 -0.233 18053
7799 1 12 . 1 1 95 95 THR C C 525 172.094 172.094 172.875 -0.781 18053
7800 1 12 . 1 1 95 95 THR CA C 525 62.309 62.309 61.955 0.354 18053
7801 1 12 . 1 1 95 95 THR CB C 525 70.281 70.281 70.318 -0.037 18053
7802 1 12 . 1 1 95 95 THR H H 525 7.631 7.631 7.962 -0.331 18053
7803 1 12 . 1 1 96 96 LEU N N 526 127.274 127.274 128.366 -1.092 18053
7804 1 12 . 1 1 96 96 LEU HA H 526 5.131 5.131 5.062 0.069 18053
7805 1 12 . 1 1 96 96 LEU C C 526 175.916 175.916 175.370 0.546 18053
7806 1 12 . 1 1 96 96 LEU CA C 526 52.075 52.075 53.954 -1.879 18053
7807 1 12 . 1 1 96 96 LEU CB C 526 43.790 43.790 43.729 0.061 18053
7808 1 12 . 1 1 96 96 LEU H H 526 8.977 8.977 8.446 0.531 18053
7809 1 12 . 1 1 97 97 VAL N N 527 124.056 124.056 120.444 3.612 18053
7810 1 12 . 1 1 97 97 VAL HA H 527 4.869 4.869 4.653 0.216 18053
7811 1 12 . 1 1 97 97 VAL C C 527 176.230 176.230 175.549 0.681 18053
7812 1 12 . 1 1 97 97 VAL CA C 527 61.519 61.519 60.867 0.652 18053
7813 1 12 . 1 1 97 97 VAL CB C 527 33.704 33.704 33.332 0.372 18053
7814 1 12 . 1 1 97 97 VAL H H 527 10.724 10.724 8.228 2.496 18053
7815 1 12 . 1 1 98 98 TRP N N 528 132.586 132.586 131.352 1.234 18053
7816 1 12 . 1 1 98 98 TRP HA H 528 4.965 4.965 4.606 0.359 18053
7817 1 12 . 1 1 98 98 TRP C C 528 173.391 173.391 174.443 -1.052 18053
7818 1 12 . 1 1 98 98 TRP CA C 528 53.303 53.303 55.172 -1.869 18053
7819 1 12 . 1 1 98 98 TRP CB C 528 28.245 28.245 28.848 -0.602 18053
7820 1 12 . 1 1 98 98 TRP H H 528 9.400 9.400 9.107 0.293 18053
7821 1 12 . 1 1 99 99 LYS N N 529 126.644 126.644 128.489 -1.845 18053
7822 1 12 . 1 1 99 99 LYS HA H 529 3.839 3.839 4.180 -0.341 18053
7823 1 12 . 1 1 99 99 LYS C C 529 177.581 177.581 177.448 0.133 18053
7824 1 12 . 1 1 99 99 LYS CA C 529 58.543 58.543 57.618 0.925 18053
7825 1 12 . 1 1 99 99 LYS CB C 529 32.176 32.176 32.959 -0.783 18053
7826 1 12 . 1 1 99 99 LYS H H 529 8.153 8.153 8.082 0.071 18053
7827 1 12 . 1 1 100 100 GLY N N 530 110.385 110.385 112.143 -1.758 18053
7828 1 12 . 1 1 100 100 GLY C C 530 172.367 172.367 173.641 -1.274 18053
7829 1 12 . 1 1 100 100 GLY CA C 530 45.278 45.278 45.017 0.261 18053
7830 1 12 . 1 1 100 100 GLY H H 530 8.363 8.363 8.599 -0.236 18053
7831 1 12 . 1 1 101 101 GLN N N 531 121.162 121.162 120.377 0.785 18053
7832 1 12 . 1 1 101 101 GLN HA H 531 3.972 3.972 4.248 -0.276 18053
7833 1 12 . 1 1 101 101 GLN CA C 531 52.620 52.620 53.947 -1.327 18053
7834 1 12 . 1 1 101 101 GLN CB C 531 27.595 27.595 29.077 -1.482 18053
7835 1 12 . 1 1 101 101 GLN H H 531 6.815 6.815 7.264 -0.449 18053
7836 1 12 . 1 1 102 102 SER N N 532 122.728 122.728 123.185 -0.457 18053
7837 1 12 . 1 1 102 102 SER HA H 532 3.866 3.866 4.388 -0.522 18053
7838 1 12 . 1 1 102 102 SER C C 532 174.537 174.537 175.130 -0.593 18053
7839 1 12 . 1 1 102 102 SER CA C 532 61.983 61.983 60.930 1.053 18053
7840 1 12 . 1 1 102 102 SER CB C 532 62.802 62.802 63.130 -0.329 18053
7841 1 12 . 1 1 102 102 SER H H 532 8.662 8.662 8.749 -0.087 18053
7842 1 12 . 1 1 103 103 SER N N 533 110.811 110.811 113.346 -2.535 18053
7843 1 12 . 1 1 103 103 SER HA H 533 4.240 4.240 4.702 -0.462 18053
7844 1 12 . 1 1 103 103 SER C C 533 174.087 174.087 174.398 -0.311 18053
7845 1 12 . 1 1 103 103 SER CA C 533 56.633 56.633 57.726 -1.093 18053
7846 1 12 . 1 1 103 103 SER CB C 533 64.658 64.658 63.437 1.221 18053
7847 1 12 . 1 1 103 103 SER H H 533 7.134 7.134 7.772 -0.638 18053
7848 1 12 . 1 1 104 104 TRP N N 534 126.133 126.133 120.245 5.888 18053
7849 1 12 . 1 1 104 104 TRP HA H 534 4.098 4.098 4.130 -0.032 18053
7850 1 12 . 1 1 104 104 TRP C C 534 176.066 176.066 175.634 0.432 18053
7851 1 12 . 1 1 104 104 TRP CA C 534 60.127 60.127 58.059 2.068 18053
7852 1 12 . 1 1 104 104 TRP CB C 534 28.764 28.764 28.461 0.303 18053
7853 1 12 . 1 1 104 104 TRP H H 534 9.764 9.764 8.089 1.675 18053
7854 1 12 . 1 1 105 105 GLY N N 535 105.907 105.907 106.270 -0.363 18053
7855 1 12 . 1 1 105 105 GLY C C 535 172.217 172.217 174.885 -2.668 18053
7856 1 12 . 1 1 105 105 GLY CA C 535 44.240 44.240 44.837 -0.597 18053
7857 1 12 . 1 1 105 105 GLY H H 535 8.095 8.095 7.724 0.371 18053
7858 1 12 . 1 1 106 106 THR N N 536 111.253 111.253 114.324 -3.071 18053
7859 1 12 . 1 1 106 106 THR HA H 536 3.859 3.859 4.243 -0.384 18053
7860 1 12 . 1 1 106 106 THR C C 536 172.872 172.872 174.787 -1.915 18053
7861 1 12 . 1 1 106 106 THR CA C 536 59.635 59.635 63.184 -3.549 18053
7862 1 12 . 1 1 106 106 THR CB C 536 70.526 70.526 69.408 1.118 18053
7863 1 12 . 1 1 106 106 THR H H 536 7.913 7.913 7.634 0.279 18053
7864 1 12 . 1 1 107 107 GLY N N 537 107.712 107.712 112.784 -5.072 18053
7865 1 12 . 1 1 107 107 GLY C C 537 172.709 172.709 173.275 -0.566 18053
7866 1 12 . 1 1 107 107 GLY CA C 537 45.166 45.166 44.264 0.902 18053
7867 1 12 . 1 1 107 107 GLY H H 537 7.533 7.533 8.281 -0.748 18053
7868 1 12 . 1 1 108 108 GLU N N 538 118.864 118.864 120.200 -1.336 18053
7869 1 12 . 1 1 108 108 GLU HA H 538 4.136 4.136 4.150 -0.014 18053
7870 1 12 . 1 1 108 108 GLU C C 538 176.353 176.353 176.311 0.042 18053
7871 1 12 . 1 1 108 108 GLU CA C 538 58.352 58.352 58.164 0.188 18053
7872 1 12 . 1 1 108 108 GLU CB C 538 30.156 30.156 30.439 -0.283 18053
7873 1 12 . 1 1 108 108 GLU H H 538 8.558 8.558 8.622 -0.064 18053
7874 1 12 . 1 1 109 109 SER N N 539 110.419 110.419 114.963 -4.544 18053
7875 1 12 . 1 1 109 109 SER HA H 539 4.963 4.963 4.925 0.038 18053
7876 1 12 . 1 1 109 109 SER C C 539 173.787 173.787 172.898 0.889 18053
7877 1 12 . 1 1 109 109 SER CA C 539 57.125 57.125 57.544 -0.419 18053
7878 1 12 . 1 1 109 109 SER CB C 539 64.439 64.439 64.183 0.256 18053
7879 1 12 . 1 1 109 109 SER H H 539 7.620 7.620 7.801 -0.181 18053
7880 1 12 . 1 1 110 110 PHE N N 540 118.778 118.778 119.814 -1.036 18053
7881 1 12 . 1 1 110 110 PHE HA H 540 5.081 5.081 5.200 -0.119 18053
7882 1 12 . 1 1 110 110 PHE C C 540 176.052 176.052 173.419 2.633 18053
7883 1 12 . 1 1 110 110 PHE CA C 540 56.789 56.789 55.928 0.861 18053
7884 1 12 . 1 1 110 110 PHE CB C 540 40.760 40.760 42.062 -1.302 18053
7885 1 12 . 1 1 110 110 PHE H H 540 8.318 8.318 8.777 -0.459 18053
7886 1 12 . 1 1 112 112 THR HA H 542 5.468 5.468 4.717 0.751 18053
7887 1 12 . 1 1 112 112 THR C C 542 172.381 172.381 173.542 -1.161 18053
7888 1 12 . 1 1 112 112 THR CA C 542 61.818 61.818 63.863 -2.045 18053
7889 1 12 . 1 1 112 112 THR CB C 542 70.990 70.990 69.861 1.129 18053
7890 1 12 . 1 1 113 113 VAL N N 543 124.771 124.771 124.964 -0.193 18053
7891 1 12 . 1 1 113 113 VAL HA H 543 4.864 4.864 4.670 0.194 18053
7892 1 12 . 1 1 113 113 VAL C C 543 173.132 173.132 174.115 -0.983 18053
7893 1 12 . 1 1 113 113 VAL CA C 543 60.099 60.099 61.144 -1.045 18053
7894 1 12 . 1 1 113 113 VAL CB C 543 36.433 36.433 35.728 0.705 18053
7895 1 12 . 1 1 113 113 VAL H H 543 9.380 9.380 8.840 0.540 18053
7896 1 12 . 1 1 114 114 LEU N N 544 128.789 128.789 127.057 1.732 18053
7897 1 12 . 1 1 114 114 LEU HA H 544 5.320 5.320 5.147 0.173 18053
7898 1 12 . 1 1 114 114 LEU C C 544 174.237 174.237 175.012 -0.775 18053
7899 1 12 . 1 1 114 114 LEU CA C 544 53.193 53.193 53.647 -0.453 18053
7900 1 12 . 1 1 114 114 LEU CB C 544 45.879 45.879 45.190 0.689 18053
7901 1 12 . 1 1 114 114 LEU H H 544 8.948 8.948 8.634 0.314 18053
7902 1 12 . 1 1 115 115 VAL N N 545 127.002 127.002 125.727 1.275 18053
7903 1 12 . 1 1 115 115 VAL HA H 545 4.854 4.854 4.745 0.109 18053
7904 1 12 . 1 1 115 115 VAL C C 545 175.206 175.206 174.643 0.563 18053
7905 1 12 . 1 1 115 115 VAL CA C 545 59.334 59.334 60.168 -0.834 18053
7906 1 12 . 1 1 115 115 VAL CB C 545 34.495 34.495 35.736 -1.241 18053
7907 1 12 . 1 1 115 115 VAL H H 545 9.564 9.564 8.875 0.689 18053
7908 1 12 . 1 1 116 116 ASN N N 546 121.179 121.179 120.954 0.225 18053
7909 1 12 . 1 1 116 116 ASN HA H 546 2.897 2.897 4.214 -1.317 18053
7910 1 12 . 1 1 116 116 ASN C C 546 176.885 176.885 175.810 1.075 18053
7911 1 12 . 1 1 116 116 ASN CA C 546 50.409 50.409 51.176 -0.767 18053
7912 1 12 . 1 1 116 116 ASN CB C 546 36.639 36.639 39.506 -2.867 18053
7913 1 12 . 1 1 116 116 ASN H H 546 8.016 8.016 7.817 0.199 18053
7914 1 12 . 1 1 117 117 ALA N N 547 119.834 119.834 122.319 -2.485 18053
7915 1 12 . 1 1 117 117 ALA HA H 547 3.866 3.866 3.992 -0.126 18053
7916 1 12 . 1 1 117 117 ALA C C 547 177.772 177.772 178.417 -0.645 18053
7917 1 12 . 1 1 117 117 ALA CA C 547 54.504 54.504 54.407 0.097 18053
7918 1 12 . 1 1 117 117 ALA CB C 547 18.200 18.200 18.454 -0.254 18053
7919 1 12 . 1 1 117 117 ALA H H 547 6.444 6.444 8.223 -1.779 18053
7920 1 12 . 1 1 118 118 ASP N N 548 115.646 115.646 117.036 -1.390 18053
7921 1 12 . 1 1 118 118 ASP HA H 548 4.644 4.644 4.402 0.242 18053
7922 1 12 . 1 1 118 118 ASP C C 548 176.052 176.052 177.577 -1.525 18053
7923 1 12 . 1 1 118 118 ASP CA C 548 54.067 54.067 55.523 -1.456 18053
7924 1 12 . 1 1 118 118 ASP CB C 548 41.674 41.674 41.422 0.252 18053
7925 1 12 . 1 1 118 118 ASP H H 548 7.181 7.181 7.745 -0.564 18053
7926 1 12 . 1 1 119 119 GLY N N 549 107.167 107.167 106.559 0.608 18053
7927 1 12 . 1 1 119 119 GLY C C 549 173.841 173.841 173.905 -0.064 18053
7928 1 12 . 1 1 119 119 GLY CA C 549 45.455 45.455 44.671 0.784 18053
7929 1 12 . 1 1 119 119 GLY H H 549 7.738 7.738 7.701 0.037 18053
7930 1 12 . 1 1 120 120 GLU N N 550 121.196 121.196 121.123 0.073 18053
7931 1 12 . 1 1 120 120 GLU HA H 550 4.112 4.112 4.149 -0.037 18053
7932 1 12 . 1 1 120 120 GLU C C 550 175.588 175.588 176.300 -0.712 18053
7933 1 12 . 1 1 120 120 GLU CA C 550 54.831 54.831 56.309 -1.478 18053
7934 1 12 . 1 1 120 120 GLU CB C 550 29.937 29.937 29.892 0.045 18053
7935 1 12 . 1 1 120 120 GLU H H 550 7.587 7.587 7.766 -0.179 18053
7936 1 12 . 1 1 121 121 GLU N N 551 123.886 123.886 122.959 0.927 18053
7937 1 12 . 1 1 121 121 GLU HA H 551 4.276 4.276 4.190 0.086 18053
7938 1 12 . 1 1 121 121 GLU C C 551 176.817 176.817 175.812 1.005 18053
7939 1 12 . 1 1 121 121 GLU CA C 551 56.796 56.796 56.133 0.663 18053
7940 1 12 . 1 1 121 121 GLU CB C 551 28.955 28.955 28.481 0.474 18053
7941 1 12 . 1 1 121 121 GLU H H 551 8.697 8.697 8.579 0.118 18053
7942 1 12 . 1 1 122 122 VAL N N 552 120.055 120.055 122.918 -2.863 18053
7943 1 12 . 1 1 122 122 VAL HA H 552 4.364 4.364 3.768 0.596 18053
7944 1 12 . 1 1 122 122 VAL C C 552 175.998 175.998 175.263 0.735 18053
7945 1 12 . 1 1 122 122 VAL CA C 552 61.655 61.655 64.031 -2.376 18053
7946 1 12 . 1 1 122 122 VAL CB C 552 33.049 33.049 32.199 0.850 18053
7947 1 12 . 1 1 122 122 VAL H H 552 8.845 8.845 7.970 0.875 18053
7948 1 12 . 1 1 123 123 ALA N N 553 122.098 122.098 119.154 2.944 18053
7949 1 12 . 1 1 123 123 ALA HA H 553 4.890 4.890 4.649 0.241 18053
7950 1 12 . 1 1 123 123 ALA C C 553 175.261 175.261 174.874 0.387 18053
7951 1 12 . 1 1 123 123 ALA CA C 553 52.757 52.757 51.392 1.365 18053
7952 1 12 . 1 1 123 123 ALA CB C 553 22.267 22.267 21.756 0.511 18053
7953 1 12 . 1 1 123 123 ALA H H 553 7.788 7.788 7.852 -0.064 18053
7954 1 12 . 1 1 124 124 MET N N 554 118.217 118.217 121.725 -3.508 18053
7955 1 12 . 1 1 124 124 MET HA H 554 5.286 5.286 5.019 0.267 18053
7956 1 12 . 1 1 124 124 MET C C 554 174.428 174.428 174.475 -0.047 18053
7957 1 12 . 1 1 124 124 MET CA C 554 55.104 55.104 55.818 -0.714 18053
7958 1 12 . 1 1 124 124 MET CB C 554 35.342 35.342 36.140 -0.798 18053
7959 1 12 . 1 1 124 124 MET H H 554 8.693 8.693 8.431 0.262 18053
7960 1 12 . 1 1 125 125 ARG N N 555 122.132 122.132 127.279 -5.147 18053
7961 1 12 . 1 1 125 125 ARG HA H 555 4.900 4.900 4.839 0.061 18053
7962 1 12 . 1 1 125 125 ARG CA C 555 56.388 56.388 55.149 1.239 18053
7963 1 12 . 1 1 125 125 ARG CB C 555 34.378 34.378 33.577 0.801 18053
7964 1 12 . 1 1 125 125 ARG H H 555 8.919 8.919 9.087 -0.168 18053
7965 1 12 . 1 1 126 126 THR HA H 556 4.685 4.685 4.539 0.146 18053
7966 1 12 . 1 1 126 126 THR C C 556 172.436 172.436 173.737 -1.301 18053
7967 1 12 . 1 1 126 126 THR CA C 556 61.382 61.382 62.865 -1.483 18053
7968 1 12 . 1 1 126 126 THR CB C 556 70.444 70.444 69.693 0.751 18053
7969 1 12 . 1 1 127 127 VAL N N 557 124.976 124.976 125.190 -0.214 18053
7970 1 12 . 1 1 127 127 VAL HA H 557 4.146 4.146 4.299 -0.153 18053
7971 1 12 . 1 1 127 127 VAL C C 557 173.937 173.937 173.298 0.639 18053
7972 1 12 . 1 1 127 127 VAL CA C 557 61.109 61.109 60.270 0.839 18053
7973 1 12 . 1 1 127 127 VAL CB C 557 33.759 33.759 35.330 -1.571 18053
7974 1 12 . 1 1 127 127 VAL H H 557 8.127 8.127 8.881 -0.754 18053
7975 1 12 . 1 1 128 128 LYS N N 558 125.384 125.384 127.507 -2.123 18053
7976 1 12 . 1 1 128 128 LYS HA H 558 4.706 4.706 4.630 0.076 18053
7977 1 12 . 1 1 128 128 LYS C C 558 175.534 175.534 175.329 0.205 18053
7978 1 12 . 1 1 128 128 LYS CA C 558 54.886 54.886 53.398 1.488 18053
7979 1 12 . 1 1 128 128 LYS CB C 558 34.673 34.673 32.833 1.840 18053
7980 1 12 . 1 1 128 128 LYS H H 558 8.289 8.289 8.150 0.139 18053
7981 1 12 . 1 1 129 129 LYS N N 559 124.005 124.005 126.485 -2.480 18053
7982 1 12 . 1 1 129 129 LYS HA H 559 4.310 4.310 4.133 0.177 18053
7983 1 12 . 1 1 129 129 LYS C C 559 176.571 176.571 176.273 0.298 18053
7984 1 12 . 1 1 129 129 LYS CA C 559 56.742 56.742 56.755 -0.013 18053
7985 1 12 . 1 1 129 129 LYS CB C 559 33.362 33.362 32.114 1.248 18053
7986 1 12 . 1 1 129 129 LYS H H 559 8.461 8.461 8.057 0.404 18053
7987 1 12 . 1 1 130 130 SER N N 560 117.195 117.195 120.629 -3.434 18053
7988 1 12 . 1 1 130 130 SER HA H 560 4.384 4.384 4.283 0.101 18053
7989 1 12 . 1 1 130 130 SER C C 560 174.565 174.565 174.853 -0.288 18053
7990 1 12 . 1 1 130 130 SER CA C 560 58.434 58.434 60.020 -1.587 18053
7991 1 12 . 1 1 130 130 SER CB C 560 63.812 63.812 63.564 0.248 18053
7992 1 12 . 1 1 130 130 SER H H 560 8.465 8.465 8.732 -0.267 18053
7993 1 12 . 1 1 131 131 SER N N 561 118.149 118.149 111.317 6.832 18053
7994 1 12 . 1 1 131 131 SER HA H 561 4.412 4.412 4.510 -0.098 18053
7995 1 12 . 1 1 131 131 SER C C 561 174.456 174.456 173.073 1.383 18053
7996 1 12 . 1 1 131 131 SER CA C 561 58.489 58.489 57.441 1.048 18053
7997 1 12 . 1 1 131 131 SER CB C 561 63.811 63.811 63.901 -0.090 18053
7998 1 12 . 1 1 131 131 SER H H 561 8.336 8.336 7.649 0.687 18053
7999 1 12 . 1 1 132 132 VAL N N 562 121.332 121.332 124.700 -3.368 18053
8000 1 12 . 1 1 132 132 VAL HA H 562 4.035 4.035 4.115 -0.080 18053
8001 1 12 . 1 1 132 132 VAL C C 562 176.066 176.066 174.324 1.742 18053
8002 1 12 . 1 1 132 132 VAL CA C 562 62.446 62.446 63.025 -0.579 18053
8003 1 12 . 1 1 132 132 VAL CB C 562 32.394 32.394 30.929 1.465 18053
8004 1 12 . 1 1 132 132 VAL H H 562 7.982 7.982 8.560 -0.578 18053
8005 1 12 . 1 1 133 133 MET N N 563 124.022 124.022 123.070 0.952 18053
8006 1 12 . 1 1 133 133 MET HA H 563 4.385 4.385 4.699 -0.314 18053
8007 1 12 . 1 1 133 133 MET C C 563 176.039 176.039 174.149 1.890 18053
8008 1 12 . 1 1 133 133 MET CA C 563 55.350 55.350 54.461 0.889 18053
8009 1 12 . 1 1 133 133 MET CB C 563 32.503 32.503 34.654 -2.151 18053
8010 1 12 . 1 1 133 133 MET H H 563 8.295 8.295 7.846 0.449 18053
8011 1 12 . 1 1 134 134 ARG N N 564 122.677 122.677 124.681 -2.004 18053
8012 1 12 . 1 1 134 134 ARG HA H 564 4.262 4.262 4.408 -0.146 18053
8013 1 12 . 1 1 134 134 ARG C C 564 176.298 176.298 175.802 0.496 18053
8014 1 12 . 1 1 134 134 ARG CA C 564 56.087 56.087 56.199 -0.112 18053
8015 1 12 . 1 1 134 134 ARG CB C 564 30.702 30.702 31.216 -0.514 18053
8016 1 12 . 1 1 134 134 ARG H H 564 8.295 8.295 8.573 -0.278 18053
8017 1 12 . 1 1 135 135 GLU N N 565 121.945 121.945 124.383 -2.438 18053
8018 1 12 . 1 1 135 135 GLU HA H 565 4.160 4.160 4.427 -0.267 18053
8019 1 12 . 1 1 135 135 GLU C C 565 176.080 176.080 176.122 -0.042 18053
8020 1 12 . 1 1 135 135 GLU CA C 565 56.906 56.906 55.678 1.228 18053
8021 1 12 . 1 1 135 135 GLU CB C 565 29.774 29.774 31.073 -1.299 18053
8022 1 12 . 1 1 135 135 GLU H H 565 8.470 8.470 8.589 -0.119 18053
8023 1 12 . 1 1 136 136 ASN N N 566 118.761 118.761 119.965 -1.204 18053
8024 1 12 . 1 1 136 136 ASN HA H 566 4.617 4.617 4.433 0.184 18053
8025 1 12 . 1 1 136 136 ASN C C 566 175.315 175.315 176.206 -0.891 18053
8026 1 12 . 1 1 136 136 ASN CA C 566 53.193 53.193 54.941 -1.748 18053
8027 1 12 . 1 1 136 136 ASN CB C 566 38.836 38.836 38.348 0.488 18053
8028 1 12 . 1 1 136 136 ASN H H 566 8.341 8.341 8.657 -0.316 18053
8029 1 12 . 1 1 137 137 GLU N N 567 121.349 121.349 117.211 4.138 18053
8030 1 12 . 1 1 137 137 GLU HA H 567 4.152 4.152 3.874 0.278 18053
8031 1 12 . 1 1 137 137 GLU C C 567 176.243 176.243 176.271 -0.028 18053
8032 1 12 . 1 1 137 137 GLU CA C 567 56.906 56.906 58.602 -1.696 18053
8033 1 12 . 1 1 137 137 GLU CB C 567 29.992 29.992 28.671 1.321 18053
8034 1 12 . 1 1 137 137 GLU H H 567 8.349 8.349 8.713 -0.364 18053
8035 1 12 . 1 1 138 138 ASN N N 568 118.761 118.761 121.806 -3.045 18053
8036 1 12 . 1 1 138 138 ASN HA H 568 4.712 4.712 4.923 -0.211 18053
8037 1 12 . 1 1 138 138 ASN C C 568 174.551 174.551 174.372 0.179 18053
8038 1 12 . 1 1 138 138 ASN CA C 568 53.193 53.193 53.041 0.152 18053
8039 1 12 . 1 1 138 138 ASN CB C 568 39.327 39.327 39.194 0.133 18053
8040 1 12 . 1 1 138 138 ASN H H 568 8.397 8.397 8.270 0.127 18053
8041 1 13 . 1 1 20 20 ALA N N 450 125.180 125.180 126.585 -1.405 18053
8042 1 13 . 1 1 20 20 ALA HA H 450 4.706 4.706 4.451 0.255 18053
8043 1 13 . 1 1 20 20 ALA C C 450 177.226 177.226 177.681 -0.455 18053
8044 1 13 . 1 1 20 20 ALA CA C 450 52.757 52.757 52.375 0.382 18053
8045 1 13 . 1 1 20 20 ALA CB C 450 20.411 20.411 18.394 2.017 18053
8046 1 13 . 1 1 20 20 ALA H H 450 8.484 8.484 8.449 0.035 18053
8047 1 13 . 1 1 21 21 SER N N 451 115.714 115.714 118.448 -2.734 18053
8048 1 13 . 1 1 21 21 SER HA H 451 4.513 4.513 4.484 0.029 18053
8049 1 13 . 1 1 21 21 SER C C 451 174.742 174.742 175.551 -0.809 18053
8050 1 13 . 1 1 21 21 SER CA C 451 58.516 58.516 58.114 0.403 18053
8051 1 13 . 1 1 21 21 SER CB C 451 64.159 64.159 63.316 0.843 18053
8052 1 13 . 1 1 21 21 SER H H 451 8.487 8.487 7.978 0.509 18053
8053 1 13 . 1 1 22 22 GLY N N 452 111.509 111.509 115.115 -3.606 18053
8054 1 13 . 1 1 22 22 GLY C C 452 174.401 174.401 174.995 -0.594 18053
8055 1 13 . 1 1 22 22 GLY CA C 452 45.059 45.059 45.214 -0.155 18053
8056 1 13 . 1 1 22 22 GLY H H 452 8.198 8.198 8.970 -0.772 18053
8057 1 13 . 1 1 23 23 SER N N 453 116.191 116.191 118.388 -2.197 18053
8058 1 13 . 1 1 23 23 SER HA H 453 4.364 4.364 4.285 0.079 18053
8059 1 13 . 1 1 23 23 SER C C 453 173.432 173.432 174.778 -1.346 18053
8060 1 13 . 1 1 23 23 SER CA C 453 59.744 59.744 61.556 -1.812 18053
8061 1 13 . 1 1 23 23 SER CB C 453 64.335 64.335 63.960 0.375 18053
8062 1 13 . 1 1 23 23 SER H H 453 8.494 8.494 7.778 0.716 18053
8063 1 13 . 1 1 24 24 VAL N N 454 121.656 121.656 121.956 -0.300 18053
8064 1 13 . 1 1 24 24 VAL HA H 454 5.035 5.035 4.360 0.675 18053
8065 1 13 . 1 1 24 24 VAL C C 454 174.606 174.606 175.353 -0.747 18053
8066 1 13 . 1 1 24 24 VAL CA C 454 61.055 61.055 62.502 -1.446 18053
8067 1 13 . 1 1 24 24 VAL CB C 454 32.503 32.503 31.005 1.498 18053
8068 1 13 . 1 1 24 24 VAL H H 454 7.830 7.830 8.259 -0.429 18053
8069 1 13 . 1 1 25 25 SER N N 455 119.323 119.323 123.727 -4.404 18053
8070 1 13 . 1 1 25 25 SER HA H 455 4.672 4.672 4.751 -0.079 18053
8071 1 13 . 1 1 25 25 SER C C 455 174.426 174.426 173.733 0.693 18053
8072 1 13 . 1 1 25 25 SER CA C 455 55.268 55.268 56.501 -1.233 18053
8073 1 13 . 1 1 25 25 SER CB C 455 65.162 65.162 65.007 0.155 18053
8074 1 13 . 1 1 25 25 SER H H 455 9.065 9.065 8.763 0.302 18053
8075 1 13 . 1 1 26 26 ILE N N 456 119.468 119.468 125.998 -6.530 18053
8076 1 13 . 1 1 26 26 ILE HA H 456 4.180 4.180 4.023 0.157 18053
8077 1 13 . 1 1 26 26 ILE C C 456 175.506 175.506 175.985 -0.479 18053
8078 1 13 . 1 1 26 26 ILE CA C 456 61.328 61.328 62.285 -0.958 18053
8079 1 13 . 1 1 26 26 ILE CB C 456 37.962 37.962 36.732 1.230 18053
8080 1 13 . 1 1 26 26 ILE H H 456 8.295 8.295 8.808 -0.513 18053
8081 1 13 . 1 1 27 27 GLU N N 457 129.726 129.726 127.878 1.848 18053
8082 1 13 . 1 1 27 27 GLU HA H 457 4.228 4.228 4.297 -0.069 18053
8083 1 13 . 1 1 27 27 GLU C C 457 175.179 175.179 176.532 -1.353 18053
8084 1 13 . 1 1 27 27 GLU CA C 457 55.432 55.432 57.717 -2.285 18053
8085 1 13 . 1 1 27 27 GLU CB C 457 30.142 30.142 30.336 -0.194 18053
8086 1 13 . 1 1 27 27 GLU H H 457 8.393 8.393 8.429 -0.036 18053
8087 1 13 . 1 1 28 28 GLU N N 458 117.076 117.076 117.558 -0.482 18053
8088 1 13 . 1 1 28 28 GLU HA H 458 4.168 4.168 4.629 -0.461 18053
8089 1 13 . 1 1 28 28 GLU C C 458 174.701 174.701 174.792 -0.091 18053
8090 1 13 . 1 1 28 28 GLU CA C 458 56.906 56.906 55.157 1.749 18053
8091 1 13 . 1 1 28 28 GLU CB C 458 31.848 31.848 32.954 -1.106 18053
8092 1 13 . 1 1 28 28 GLU H H 458 7.489 7.489 7.965 -0.476 18053
8093 1 13 . 1 1 29 29 ILE N N 459 122.183 122.183 119.984 2.199 18053
8094 1 13 . 1 1 29 29 ILE HA H 459 3.764 3.764 4.223 -0.459 18053
8095 1 13 . 1 1 29 29 ILE C C 459 174.169 174.169 174.907 -0.738 18053
8096 1 13 . 1 1 29 29 ILE CA C 459 59.526 59.526 59.527 -0.001 18053
8097 1 13 . 1 1 29 29 ILE CB C 459 40.309 40.309 42.486 -2.177 18053
8098 1 13 . 1 1 29 29 ILE H H 459 8.126 8.126 8.312 -0.186 18053
8099 1 13 . 1 1 30 30 ASP N N 460 123.205 123.205 123.785 -0.580 18053
8100 1 13 . 1 1 30 30 ASP HA H 460 4.183 4.183 4.073 0.110 18053
8101 1 13 . 1 1 30 30 ASP C C 460 178.318 178.318 177.886 0.432 18053
8102 1 13 . 1 1 30 30 ASP CA C 460 53.930 53.930 54.080 -0.150 18053
8103 1 13 . 1 1 30 30 ASP CB C 460 42.807 42.807 42.043 0.764 18053
8104 1 13 . 1 1 30 30 ASP H H 460 6.704 6.704 7.344 -0.640 18053
8105 1 13 . 1 1 31 31 LEU N N 461 128.551 128.551 121.411 7.140 18053
8106 1 13 . 1 1 31 31 LEU HA H 461 4.064 4.064 4.070 -0.006 18053
8107 1 13 . 1 1 31 31 LEU C C 461 177.513 177.513 177.334 0.179 18053
8108 1 13 . 1 1 31 31 LEU CA C 461 57.124 57.124 56.844 0.280 18053
8109 1 13 . 1 1 31 31 LEU CB C 461 41.237 41.237 41.715 -0.478 18053
8110 1 13 . 1 1 31 31 LEU H H 461 9.012 9.012 8.422 0.590 18053
8111 1 13 . 1 1 32 32 GLU N N 462 115.101 115.101 116.583 -1.482 18053
8112 1 13 . 1 1 32 32 GLU HA H 462 4.283 4.283 4.922 -0.639 18053
8113 1 13 . 1 1 32 32 GLU C C 462 177.062 177.062 176.517 0.545 18053
8114 1 13 . 1 1 32 32 GLU CA C 462 55.759 55.759 55.142 0.617 18053
8115 1 13 . 1 1 32 32 GLU CB C 462 29.569 29.569 30.788 -1.220 18053
8116 1 13 . 1 1 32 32 GLU H H 462 7.588 7.588 8.235 -0.647 18053
8117 1 13 . 1 1 33 33 GLY N N 463 106.299 106.299 109.136 -2.837 18053
8118 1 13 . 1 1 33 33 GLY C C 463 174.824 174.824 175.056 -0.232 18053
8119 1 13 . 1 1 33 33 GLY CA C 463 46.806 46.806 45.603 1.203 18053
8120 1 13 . 1 1 33 33 GLY H H 463 7.372 7.372 7.973 -0.601 18053
8121 1 13 . 1 1 34 34 LYS N N 464 118.744 118.744 118.089 0.655 18053
8122 1 13 . 1 1 34 34 LYS HA H 464 4.562 4.562 4.211 0.351 18053
8123 1 13 . 1 1 34 34 LYS C C 464 177.076 177.076 174.963 2.113 18053
8124 1 13 . 1 1 34 34 LYS CA C 464 59.963 59.963 55.716 4.247 18053
8125 1 13 . 1 1 34 34 LYS CB C 464 33.111 33.111 32.611 0.500 18053
8126 1 13 . 1 1 34 34 LYS H H 464 9.547 9.547 7.958 1.589 18053
8127 1 13 . 1 1 35 35 PHE N N 465 109.125 109.125 112.380 -3.255 18053
8128 1 13 . 1 1 35 35 PHE HA H 465 5.514 5.514 4.875 0.639 18053
8129 1 13 . 1 1 35 35 PHE C C 465 174.183 174.183 172.574 1.609 18053
8130 1 13 . 1 1 35 35 PHE CA C 465 56.632 56.632 55.257 1.375 18053
8131 1 13 . 1 1 35 35 PHE CB C 465 40.599 40.599 40.990 -0.391 18053
8132 1 13 . 1 1 35 35 PHE H H 465 6.740 6.740 6.888 -0.148 18053
8133 1 13 . 1 1 36 36 VAL N N 466 119.579 119.579 120.636 -1.057 18053
8134 1 13 . 1 1 36 36 VAL HA H 466 3.709 3.709 4.102 -0.393 18053
8135 1 13 . 1 1 36 36 VAL C C 466 172.668 172.668 174.344 -1.676 18053
8136 1 13 . 1 1 36 36 VAL CA C 466 62.692 62.692 60.971 1.721 18053
8137 1 13 . 1 1 36 36 VAL CB C 466 36.215 36.215 34.255 1.960 18053
8138 1 13 . 1 1 36 36 VAL H H 466 7.628 7.628 8.218 -0.590 18053
8139 1 13 . 1 1 37 37 GLN N N 467 126.831 126.831 127.742 -0.911 18053
8140 1 13 . 1 1 37 37 GLN HA H 467 5.449 5.449 4.955 0.494 18053
8141 1 13 . 1 1 37 37 GLN C C 467 174.797 174.797 174.412 0.385 18053
8142 1 13 . 1 1 37 37 GLN CA C 467 54.121 54.121 53.862 0.259 18053
8143 1 13 . 1 1 37 37 GLN CB C 467 34.623 34.623 29.849 4.774 18053
8144 1 13 . 1 1 37 37 GLN H H 467 8.392 8.392 8.656 -0.264 18053
8145 1 13 . 1 1 38 38 LEU N N 468 123.018 123.018 126.573 -3.555 18053
8146 1 13 . 1 1 38 38 LEU HA H 468 5.422 5.422 5.388 0.034 18053
8147 1 13 . 1 1 38 38 LEU C C 468 175.588 175.588 175.894 -0.306 18053
8148 1 13 . 1 1 38 38 LEU CA C 468 52.702 52.702 53.337 -0.635 18053
8149 1 13 . 1 1 38 38 LEU CB C 468 45.046 45.046 45.128 -0.082 18053
8150 1 13 . 1 1 38 38 LEU H H 468 9.103 9.103 9.126 -0.023 18053
8151 1 13 . 1 1 39 39 LYS N N 469 118.983 118.983 119.920 -0.937 18053
8152 1 13 . 1 1 39 39 LYS HA H 469 4.852 4.852 4.832 0.020 18053
8153 1 13 . 1 1 39 39 LYS C C 469 173.309 173.309 174.275 -0.966 18053
8154 1 13 . 1 1 39 39 LYS CA C 469 54.994 54.994 54.734 0.260 18053
8155 1 13 . 1 1 39 39 LYS CB C 469 38.246 38.246 36.459 1.787 18053
8156 1 13 . 1 1 39 39 LYS H H 469 8.496 8.496 8.352 0.144 18053
8157 1 13 . 1 1 40 40 ASN N N 470 121.758 121.758 124.709 -2.951 18053
8158 1 13 . 1 1 40 40 ASN HA H 470 4.788 4.788 4.940 -0.152 18053
8159 1 13 . 1 1 40 40 ASN C C 470 174.496 174.496 175.319 -0.823 18053
8160 1 13 . 1 1 40 40 ASN CA C 470 51.119 51.119 52.399 -1.280 18053
8161 1 13 . 1 1 40 40 ASN CB C 470 37.559 37.559 39.732 -2.173 18053
8162 1 13 . 1 1 40 40 ASN H H 470 8.283 8.283 8.609 -0.326 18053
8163 1 13 . 1 1 41 41 ASN N N 471 122.422 122.422 124.020 -1.598 18053
8164 1 13 . 1 1 41 41 ASN HA H 471 4.588 4.588 4.829 -0.241 18053
8165 1 13 . 1 1 41 41 ASN C C 471 174.810 174.810 175.257 -0.447 18053
8166 1 13 . 1 1 41 41 ASN CA C 471 53.985 53.985 52.896 1.089 18053
8167 1 13 . 1 1 41 41 ASN CB C 471 39.600 39.600 40.134 -0.534 18053
8168 1 13 . 1 1 41 41 ASN H H 471 8.681 8.681 8.552 0.129 18053
8169 1 13 . 1 1 42 42 SER N N 472 116.446 116.446 116.474 -0.028 18053
8170 1 13 . 1 1 42 42 SER HA H 472 4.719 4.719 4.310 0.409 18053
8171 1 13 . 1 1 42 42 SER C C 472 172.804 172.804 174.671 -1.867 18053
8172 1 13 . 1 1 42 42 SER CA C 472 57.288 57.288 59.218 -1.930 18053
8173 1 13 . 1 1 42 42 SER CB C 472 66.241 66.241 64.361 1.880 18053
8174 1 13 . 1 1 42 42 SER H H 472 8.370 8.370 8.046 0.324 18053
8175 1 13 . 1 1 43 43 ASP N N 473 117.706 117.706 122.371 -4.665 18053
8176 1 13 . 1 1 43 43 ASP HA H 473 4.474 4.474 4.531 -0.057 18053
8177 1 13 . 1 1 43 43 ASP C C 473 175.343 175.343 175.594 -0.251 18053
8178 1 13 . 1 1 43 43 ASP CA C 473 53.521 53.521 55.589 -2.068 18053
8179 1 13 . 1 1 43 43 ASP CB C 473 40.322 40.322 40.900 -0.578 18053
8180 1 13 . 1 1 43 43 ASP H H 473 8.254 8.254 8.743 -0.489 18053
8181 1 13 . 1 1 44 44 LYS N N 474 120.209 120.209 117.159 3.050 18053
8182 1 13 . 1 1 44 44 LYS HA H 474 4.569 4.569 4.490 0.079 18053
8183 1 13 . 1 1 44 44 LYS C C 474 175.397 175.397 174.196 1.201 18053
8184 1 13 . 1 1 44 44 LYS CA C 474 54.012 54.012 54.309 -0.297 18053
8185 1 13 . 1 1 44 44 LYS CB C 474 35.383 35.383 34.409 0.974 18053
8186 1 13 . 1 1 44 44 LYS H H 474 8.305 8.305 7.499 0.806 18053
8187 1 13 . 1 1 45 45 ASP N N 475 124.993 124.993 120.344 4.649 18053
8188 1 13 . 1 1 45 45 ASP HA H 475 3.975 3.975 4.493 -0.518 18053
8189 1 13 . 1 1 45 45 ASP C C 475 174.810 174.810 176.136 -1.326 18053
8190 1 13 . 1 1 45 45 ASP CA C 475 54.995 54.995 55.541 -0.546 18053
8191 1 13 . 1 1 45 45 ASP CB C 475 40.364 40.364 40.593 -0.229 18053
8192 1 13 . 1 1 45 45 ASP H H 475 8.722 8.722 8.496 0.226 18053
8193 1 13 . 1 1 46 46 GLN N N 476 120.549 120.549 126.963 -6.414 18053
8194 1 13 . 1 1 46 46 GLN HA H 476 4.436 4.436 4.336 0.100 18053
8195 1 13 . 1 1 46 46 GLN C C 476 174.019 174.019 175.403 -1.384 18053
8196 1 13 . 1 1 46 46 GLN CA C 476 53.138 53.138 54.977 -1.839 18053
8197 1 13 . 1 1 46 46 GLN CB C 476 31.466 31.466 28.809 2.657 18053
8198 1 13 . 1 1 46 46 GLN H H 476 7.878 7.878 8.361 -0.483 18053
8199 1 13 . 1 1 47 47 SER N N 477 121.537 121.537 122.180 -0.643 18053
8200 1 13 . 1 1 47 47 SER HA H 477 4.229 4.229 4.279 -0.050 18053
8201 1 13 . 1 1 47 47 SER C C 477 174.565 174.565 173.984 0.581 18053
8202 1 13 . 1 1 47 47 SER CA C 477 58.706 58.706 58.446 0.260 18053
8203 1 13 . 1 1 47 47 SER CB C 477 62.965 62.965 62.630 0.335 18053
8204 1 13 . 1 1 47 47 SER H H 477 8.748 8.748 8.530 0.218 18053
8205 1 13 . 1 1 48 48 LEU N N 478 127.751 127.751 125.385 2.366 18053
8206 1 13 . 1 1 48 48 LEU HA H 478 2.631 2.631 4.371 -1.740 18053
8207 1 13 . 1 1 48 48 LEU C C 478 176.789 176.789 176.740 0.049 18053
8208 1 13 . 1 1 48 48 LEU CA C 478 52.102 52.102 54.236 -2.134 18053
8209 1 13 . 1 1 48 48 LEU CB C 478 42.343 42.343 43.312 -0.969 18053
8210 1 13 . 1 1 48 48 LEU H H 478 7.856 7.856 7.837 0.019 18053
8211 1 13 . 1 1 49 49 GLY N N 479 107.525 107.525 105.854 1.671 18053
8212 1 13 . 1 1 49 49 GLY C C 479 176.653 176.653 175.315 1.338 18053
8213 1 13 . 1 1 49 49 GLY CA C 479 48.062 48.062 45.611 2.451 18053
8214 1 13 . 1 1 49 49 GLY H H 479 7.728 7.728 8.723 -0.995 18053
8215 1 13 . 1 1 50 50 ASN N N 480 117.059 117.059 119.788 -2.729 18053
8216 1 13 . 1 1 50 50 ASN HA H 480 4.255 4.255 4.571 -0.316 18053
8217 1 13 . 1 1 50 50 ASN C C 480 174.961 174.961 174.993 -0.032 18053
8218 1 13 . 1 1 50 50 ASN CA C 480 56.360 56.360 53.647 2.713 18053
8219 1 13 . 1 1 50 50 ASN CB C 480 37.416 37.416 38.604 -1.188 18053
8220 1 13 . 1 1 50 50 ASN H H 480 7.552 7.552 8.764 -1.212 18053
8221 1 13 . 1 1 51 51 TRP N N 481 122.166 122.166 117.910 4.256 18053
8222 1 13 . 1 1 51 51 TRP HA H 481 4.477 4.477 4.812 -0.335 18053
8223 1 13 . 1 1 51 51 TRP C C 481 175.575 175.575 175.978 -0.403 18053
8224 1 13 . 1 1 51 51 TRP CA C 481 58.762 58.762 57.568 1.194 18053
8225 1 13 . 1 1 51 51 TRP CB C 481 28.041 28.041 29.758 -1.717 18053
8226 1 13 . 1 1 51 51 TRP H H 481 8.914 8.914 7.751 1.163 18053
8227 1 13 . 1 1 52 52 ARG N N 482 116.480 116.480 119.270 -2.790 18053
8228 1 13 . 1 1 52 52 ARG HA H 482 5.968 5.968 5.046 0.922 18053
8229 1 13 . 1 1 52 52 ARG C C 482 175.807 175.807 174.894 0.913 18053
8230 1 13 . 1 1 52 52 ARG CA C 482 54.121 54.121 54.858 -0.737 18053
8231 1 13 . 1 1 52 52 ARG CB C 482 35.124 35.124 33.829 1.295 18053
8232 1 13 . 1 1 52 52 ARG H H 482 9.147 9.147 9.156 -0.009 18053
8233 1 13 . 1 1 53 53 ILE N N 483 119.579 119.579 125.775 -6.196 18053
8234 1 13 . 1 1 53 53 ILE HA H 483 4.985 4.985 4.458 0.527 18053
8235 1 13 . 1 1 53 53 ILE C C 483 175.670 175.670 175.498 0.172 18053
8236 1 13 . 1 1 53 53 ILE CA C 483 60.400 60.400 61.383 -0.983 18053
8237 1 13 . 1 1 53 53 ILE CB C 483 40.227 40.227 38.062 2.165 18053
8238 1 13 . 1 1 53 53 ILE H H 483 9.000 9.000 8.764 0.236 18053
8239 1 13 . 1 1 54 54 LYS N N 484 124.737 124.737 127.968 -3.231 18053
8240 1 13 . 1 1 54 54 LYS HA H 484 5.463 5.463 5.018 0.445 18053
8241 1 13 . 1 1 54 54 LYS C C 484 175.575 175.575 176.065 -0.490 18053
8242 1 13 . 1 1 54 54 LYS CA C 484 54.613 54.613 55.860 -1.247 18053
8243 1 13 . 1 1 54 54 LYS CB C 484 35.041 35.041 34.109 0.932 18053
8244 1 13 . 1 1 54 54 LYS H H 484 9.678 9.678 8.826 0.852 18053
8245 1 13 . 1 1 55 55 ARG N N 485 124.090 124.090 123.315 0.775 18053
8246 1 13 . 1 1 55 55 ARG HA H 485 5.525 5.525 4.853 0.672 18053
8247 1 13 . 1 1 55 55 ARG C C 485 174.155 174.155 173.998 0.157 18053
8248 1 13 . 1 1 55 55 ARG CA C 485 53.903 53.903 55.798 -1.895 18053
8249 1 13 . 1 1 55 55 ARG H H 485 9.314 9.314 8.479 0.835 18053
8250 1 13 . 1 1 56 56 GLN N N 486 126.576 126.576 128.124 -1.548 18053
8251 1 13 . 1 1 56 56 GLN HA H 486 4.842 4.842 5.022 -0.180 18053
8252 1 13 . 1 1 56 56 GLN C C 486 174.991 174.991 174.635 0.356 18053
8253 1 13 . 1 1 56 56 GLN CA C 486 54.831 54.831 54.528 0.303 18053
8254 1 13 . 1 1 56 56 GLN CB C 486 31.465 31.465 30.561 0.904 18053
8255 1 13 . 1 1 56 56 GLN H H 486 8.831 8.831 8.572 0.259 18053
8256 1 13 . 1 1 57 57 VAL N N 487 126.712 126.712 126.450 0.262 18053
8257 1 13 . 1 1 57 57 VAL HA H 487 4.266 4.266 4.168 0.098 18053
8258 1 13 . 1 1 57 57 VAL C C 487 175.916 175.916 177.661 -1.745 18053
8259 1 13 . 1 1 57 57 VAL CA C 487 61.820 61.820 62.346 -0.526 18053
8260 1 13 . 1 1 57 57 VAL CB C 487 32.803 32.803 32.452 0.351 18053
8261 1 13 . 1 1 57 57 VAL H H 487 8.786 8.786 8.796 -0.010 18053
8262 1 13 . 1 1 58 58 LEU N N 488 127.274 127.274 125.103 2.171 18053
8263 1 13 . 1 1 58 58 LEU HA H 488 4.085 4.085 4.138 -0.053 18053
8264 1 13 . 1 1 58 58 LEU C C 488 177.158 177.158 178.350 -1.192 18053
8265 1 13 . 1 1 58 58 LEU CA C 488 56.906 56.906 58.321 -1.415 18053
8266 1 13 . 1 1 58 58 LEU CB C 488 41.374 41.374 41.620 -0.245 18053
8267 1 13 . 1 1 58 58 LEU H H 488 8.316 8.316 8.388 -0.072 18053
8268 1 13 . 1 1 59 59 GLU N N 489 119.647 119.647 119.564 0.083 18053
8269 1 13 . 1 1 59 59 GLU HA H 489 4.112 4.112 4.313 -0.201 18053
8270 1 13 . 1 1 59 59 GLU C C 489 176.230 176.230 177.444 -1.214 18053
8271 1 13 . 1 1 59 59 GLU CA C 489 57.015 57.015 56.068 0.947 18053
8272 1 13 . 1 1 59 59 GLU CB C 489 28.149 28.149 29.617 -1.468 18053
8273 1 13 . 1 1 59 59 GLU H H 489 8.636 8.636 7.983 0.653 18053
8274 1 13 . 1 1 60 60 GLY N N 490 108.819 108.819 107.136 1.683 18053
8275 1 13 . 1 1 60 60 GLY C C 490 173.568 173.568 174.016 -0.448 18053
8276 1 13 . 1 1 60 60 GLY CA C 490 44.773 44.773 45.133 -0.360 18053
8277 1 13 . 1 1 60 60 GLY H H 490 8.160 8.160 7.754 0.406 18053
8278 1 13 . 1 1 61 61 GLU N N 491 121.009 121.009 120.374 0.635 18053
8279 1 13 . 1 1 61 61 GLU HA H 491 4.323 4.323 4.442 -0.119 18053
8280 1 13 . 1 1 61 61 GLU C C 491 175.725 175.725 175.398 0.327 18053
8281 1 13 . 1 1 61 61 GLU CA C 491 56.196 56.196 56.173 0.023 18053
8282 1 13 . 1 1 61 61 GLU CB C 491 30.865 30.865 30.491 0.374 18053
8283 1 13 . 1 1 61 61 GLU H H 491 8.320 8.320 8.327 -0.007 18053
8284 1 13 . 1 1 62 62 GLU N N 492 123.426 123.426 119.469 3.957 18053
8285 1 13 . 1 1 62 62 GLU HA H 492 5.054 5.054 5.515 -0.461 18053
8286 1 13 . 1 1 62 62 GLU C C 492 175.930 175.930 175.799 0.131 18053
8287 1 13 . 1 1 62 62 GLU CA C 492 55.650 55.650 54.540 1.110 18053
8288 1 13 . 1 1 62 62 GLU CB C 492 32.312 32.312 33.351 -1.039 18053
8289 1 13 . 1 1 62 62 GLU H H 492 8.594 8.594 8.419 0.175 18053
8290 1 13 . 1 1 63 63 ILE N N 493 119.732 119.732 113.955 5.777 18053
8291 1 13 . 1 1 63 63 ILE HA H 493 4.788 4.788 4.685 0.103 18053
8292 1 13 . 1 1 63 63 ILE C C 493 174.647 174.647 174.403 0.244 18053
8293 1 13 . 1 1 63 63 ILE CA C 493 60.181 60.181 59.626 0.555 18053
8294 1 13 . 1 1 63 63 ILE CB C 493 41.183 41.183 41.326 -0.143 18053
8295 1 13 . 1 1 63 63 ILE H H 493 8.523 8.523 8.154 0.369 18053
8296 1 13 . 1 1 64 64 ALA N N 494 122.166 122.166 123.707 -1.541 18053
8297 1 13 . 1 1 64 64 ALA HA H 494 5.521 5.521 5.015 0.506 18053
8298 1 13 . 1 1 64 64 ALA C C 494 174.606 174.606 175.288 -0.682 18053
8299 1 13 . 1 1 64 64 ALA CA C 494 51.528 51.528 51.133 0.395 18053
8300 1 13 . 1 1 64 64 ALA CB C 494 22.239 22.239 20.506 1.733 18053
8301 1 13 . 1 1 64 64 ALA H H 494 8.741 8.741 8.285 0.456 18053
8302 1 13 . 1 1 65 65 TYR N N 495 126.729 126.729 125.360 1.369 18053
8303 1 13 . 1 1 65 65 TYR HA H 495 3.094 3.094 3.846 -0.752 18053
8304 1 13 . 1 1 65 65 TYR C C 495 173.036 173.036 173.720 -0.684 18053
8305 1 13 . 1 1 65 65 TYR CA C 495 56.905 56.905 58.050 -1.145 18053
8306 1 13 . 1 1 65 65 TYR CB C 495 40.269 40.269 40.122 0.147 18053
8307 1 13 . 1 1 65 65 TYR H H 495 8.462 8.462 8.391 0.071 18053
8308 1 13 . 1 1 66 66 LYS N N 496 128.108 128.108 123.124 4.984 18053
8309 1 13 . 1 1 66 66 LYS HA H 496 4.822 4.822 4.246 0.576 18053
8310 1 13 . 1 1 66 66 LYS C C 496 174.906 174.906 174.040 0.866 18053
8311 1 13 . 1 1 66 66 LYS CA C 496 53.739 53.739 53.774 -0.035 18053
8312 1 13 . 1 1 66 66 LYS CB C 496 34.782 34.782 34.701 0.081 18053
8313 1 13 . 1 1 66 66 LYS H H 496 7.010 7.010 6.924 0.086 18053
8314 1 13 . 1 1 67 67 PHE N N 497 125.299 125.299 122.432 2.867 18053
8315 1 13 . 1 1 67 67 PHE HA H 497 3.932 3.932 4.532 -0.600 18053
8316 1 13 . 1 1 67 67 PHE C C 497 177.990 177.990 175.747 2.243 18053
8317 1 13 . 1 1 67 67 PHE CA C 497 59.007 59.007 57.756 1.251 18053
8318 1 13 . 1 1 67 67 PHE CB C 497 40.981 40.981 40.698 0.283 18053
8319 1 13 . 1 1 67 67 PHE H H 497 8.509 8.509 8.190 0.319 18053
8320 1 13 . 1 1 68 68 THR N N 498 116.191 116.191 112.847 3.344 18053
8321 1 13 . 1 1 68 68 THR HA H 498 4.417 4.417 4.639 -0.222 18053
8322 1 13 . 1 1 68 68 THR CA C 498 60.855 60.855 59.317 1.538 18053
8323 1 13 . 1 1 68 68 THR CB C 498 68.019 68.019 69.458 -1.439 18053
8324 1 13 . 1 1 68 68 THR H H 498 8.688 8.688 8.404 0.284 18053
8325 1 13 . 1 1 69 69 PRO HA H 499 3.948 3.948 4.398 -0.450 18053
8326 1 13 . 1 1 69 69 PRO C C 499 177.444 177.444 176.922 0.522 18053
8327 1 13 . 1 1 69 69 PRO CA C 499 66.077 66.077 64.928 1.149 18053
8328 1 13 . 1 1 69 69 PRO CB C 499 32.776 32.776 31.858 0.918 18053
8329 1 13 . 1 1 70 70 LYS N N 500 113.552 113.552 115.717 -2.165 18053
8330 1 13 . 1 1 70 70 LYS HA H 500 4.385 4.385 4.225 0.160 18053
8331 1 13 . 1 1 70 70 LYS C C 500 176.325 176.325 176.661 -0.336 18053
8332 1 13 . 1 1 70 70 LYS CA C 500 54.995 54.995 56.349 -1.354 18053
8333 1 13 . 1 1 70 70 LYS CB C 500 31.793 31.793 31.846 -0.053 18053
8334 1 13 . 1 1 70 70 LYS H H 500 8.016 8.016 7.771 0.245 18053
8335 1 13 . 1 1 71 71 TYR N N 501 121.860 121.860 122.197 -0.337 18053
8336 1 13 . 1 1 71 71 TYR HA H 501 3.730 3.730 4.306 -0.576 18053
8337 1 13 . 1 1 71 71 TYR C C 501 174.838 174.838 174.358 0.480 18053
8338 1 13 . 1 1 71 71 TYR CA C 501 62.310 62.310 59.710 2.600 18053
8339 1 13 . 1 1 71 71 TYR CB C 501 38.781 38.781 39.289 -0.508 18053
8340 1 13 . 1 1 71 71 TYR H H 501 7.460 7.460 7.758 -0.298 18053
8341 1 13 . 1 1 72 72 ILE N N 502 129.487 129.487 127.044 2.443 18053
8342 1 13 . 1 1 72 72 ILE HA H 502 3.928 3.928 4.466 -0.538 18053
8343 1 13 . 1 1 72 72 ILE C C 502 172.968 172.968 174.240 -1.272 18053
8344 1 13 . 1 1 72 72 ILE CA C 502 59.308 59.308 59.506 -0.198 18053
8345 1 13 . 1 1 72 72 ILE CB C 502 40.910 40.910 40.824 0.086 18053
8346 1 13 . 1 1 72 72 ILE H H 502 7.168 7.168 7.481 -0.313 18053
8347 1 13 . 1 1 73 73 LEU N N 503 128.278 128.278 129.026 -0.748 18053
8348 1 13 . 1 1 73 73 LEU HA H 503 4.493 4.493 4.496 -0.003 18053
8349 1 13 . 1 1 73 73 LEU C C 503 175.834 175.834 175.373 0.461 18053
8350 1 13 . 1 1 73 73 LEU CA C 503 51.965 51.965 53.909 -1.944 18053
8351 1 13 . 1 1 73 73 LEU CB C 503 42.548 42.548 44.170 -1.622 18053
8352 1 13 . 1 1 73 73 LEU H H 503 8.483 8.483 8.621 -0.138 18053
8353 1 13 . 1 1 74 74 ARG N N 504 129.589 129.589 124.401 5.188 18053
8354 1 13 . 1 1 74 74 ARG HA H 504 3.743 3.743 4.429 -0.686 18053
8355 1 13 . 1 1 74 74 ARG C C 504 175.233 175.233 175.973 -0.740 18053
8356 1 13 . 1 1 74 74 ARG CA C 504 56.851 56.851 55.277 1.574 18053
8357 1 13 . 1 1 74 74 ARG CB C 504 30.292 30.292 30.934 -0.642 18053
8358 1 13 . 1 1 74 74 ARG H H 504 8.673 8.673 8.288 0.385 18053
8359 1 13 . 1 1 75 75 ALA N N 505 123.205 123.205 125.685 -2.480 18053
8360 1 13 . 1 1 75 75 ALA HA H 505 3.522 3.522 4.071 -0.549 18053
8361 1 13 . 1 1 75 75 ALA C C 505 178.441 178.441 177.982 0.459 18053
8362 1 13 . 1 1 75 75 ALA CA C 505 53.794 53.794 53.169 0.625 18053
8363 1 13 . 1 1 75 75 ALA CB C 505 18.910 18.910 17.954 0.956 18053
8364 1 13 . 1 1 75 75 ALA H H 505 8.564 8.564 8.460 0.104 18053
8365 1 13 . 1 1 76 76 GLY N N 506 112.241 112.241 111.634 0.607 18053
8366 1 13 . 1 1 76 76 GLY C C 506 174.278 174.278 174.885 -0.607 18053
8367 1 13 . 1 1 76 76 GLY CA C 506 46.725 46.725 45.159 1.566 18053
8368 1 13 . 1 1 76 76 GLY H H 506 7.381 7.381 8.387 -1.006 18053
8369 1 13 . 1 1 77 77 GLN N N 507 117.382 117.382 120.890 -3.508 18053
8370 1 13 . 1 1 77 77 GLN HA H 507 4.364 4.364 4.479 -0.115 18053
8371 1 13 . 1 1 77 77 GLN C C 507 173.937 173.937 175.257 -1.320 18053
8372 1 13 . 1 1 77 77 GLN CA C 507 54.558 54.558 55.459 -0.901 18053
8373 1 13 . 1 1 77 77 GLN CB C 507 30.073 30.073 29.863 0.210 18053
8374 1 13 . 1 1 77 77 GLN H H 507 7.996 7.996 7.613 0.383 18053
8375 1 13 . 1 1 78 78 MET N N 508 116.957 116.957 116.194 0.763 18053
8376 1 13 . 1 1 78 78 MET HA H 508 5.388 5.388 4.991 0.397 18053
8377 1 13 . 1 1 78 78 MET C C 508 175.807 175.807 175.221 0.586 18053
8378 1 13 . 1 1 78 78 MET CA C 508 54.067 54.067 54.258 -0.191 18053
8379 1 13 . 1 1 78 78 MET CB C 508 37.198 37.198 36.336 0.862 18053
8380 1 13 . 1 1 78 78 MET H H 508 8.092 8.092 8.176 -0.084 18053
8381 1 13 . 1 1 79 79 VAL N N 509 119.340 119.340 119.875 -0.535 18053
8382 1 13 . 1 1 79 79 VAL HA H 509 4.956 4.956 4.967 -0.011 18053
8383 1 13 . 1 1 79 79 VAL C C 509 172.217 172.217 173.718 -1.501 18053
8384 1 13 . 1 1 79 79 VAL CA C 509 59.471 59.471 60.920 -1.449 18053
8385 1 13 . 1 1 79 79 VAL CB C 509 33.676 33.676 35.361 -1.685 18053
8386 1 13 . 1 1 79 79 VAL H H 509 8.534 8.534 8.845 -0.311 18053
8387 1 13 . 1 1 80 80 THR N N 510 124.533 124.533 125.914 -1.381 18053
8388 1 13 . 1 1 80 80 THR HA H 510 4.586 4.586 5.151 -0.565 18053
8389 1 13 . 1 1 80 80 THR C C 510 172.215 172.215 173.580 -1.365 18053
8390 1 13 . 1 1 80 80 THR CA C 510 62.119 62.119 61.187 0.932 18053
8391 1 13 . 1 1 80 80 THR CB C 510 69.407 69.407 70.422 -1.015 18053
8392 1 13 . 1 1 80 80 THR H H 510 8.301 8.301 9.020 -0.719 18053
8393 1 13 . 1 1 81 81 VAL N N 511 127.002 127.002 126.984 0.018 18053
8394 1 13 . 1 1 81 81 VAL HA H 511 4.596 4.596 4.587 0.009 18053
8395 1 13 . 1 1 81 81 VAL C C 511 176.667 176.667 175.967 0.700 18053
8396 1 13 . 1 1 81 81 VAL CA C 511 61.382 61.382 61.250 0.132 18053
8397 1 13 . 1 1 81 81 VAL CB C 511 30.945 30.945 30.440 0.505 18053
8398 1 13 . 1 1 81 81 VAL H H 511 8.796 8.796 8.774 0.022 18053
8399 1 13 . 1 1 82 82 TRP N N 512 131.479 131.479 129.499 1.980 18053
8400 1 13 . 1 1 82 82 TRP HA H 512 5.338 5.338 5.081 0.257 18053
8401 1 13 . 1 1 82 82 TRP C C 512 176.885 176.885 175.703 1.182 18053
8402 1 13 . 1 1 82 82 TRP CA C 512 56.442 56.442 57.279 -0.837 18053
8403 1 13 . 1 1 82 82 TRP CB C 512 30.701 30.701 30.881 -0.180 18053
8404 1 13 . 1 1 82 82 TRP H H 512 9.924 9.924 9.452 0.472 18053
8405 1 13 . 1 1 83 83 ALA N N 513 123.954 123.954 120.556 3.398 18053
8406 1 13 . 1 1 83 83 ALA HA H 513 4.308 4.308 5.259 -0.951 18053
8407 1 13 . 1 1 83 83 ALA C C 513 178.140 178.140 178.173 -0.033 18053
8408 1 13 . 1 1 83 83 ALA CA C 513 52.211 52.211 50.421 1.790 18053
8409 1 13 . 1 1 83 83 ALA CB C 513 18.745 18.745 20.795 -2.050 18053
8410 1 13 . 1 1 83 83 ALA H H 513 9.048 9.048 8.584 0.464 18053
8411 1 13 . 1 1 84 84 ALA N N 514 125.146 125.146 124.491 0.655 18053
8412 1 13 . 1 1 84 84 ALA HA H 514 3.951 3.951 4.169 -0.218 18053
8413 1 13 . 1 1 84 84 ALA C C 514 179.519 179.519 178.987 0.532 18053
8414 1 13 . 1 1 84 84 ALA CA C 514 54.804 54.804 55.174 -0.370 18053
8415 1 13 . 1 1 84 84 ALA CB C 514 18.582 18.582 19.057 -0.475 18053
8416 1 13 . 1 1 84 84 ALA H H 514 8.341 8.341 8.284 0.057 18053
8417 1 13 . 1 1 85 85 GLY N N 515 103.388 103.388 103.699 -0.311 18053
8418 1 13 . 1 1 85 85 GLY C C 515 174.674 174.674 174.681 -0.007 18053
8419 1 13 . 1 1 85 85 GLY CA C 515 45.878 45.878 44.533 1.345 18053
8420 1 13 . 1 1 85 85 GLY H H 515 7.996 7.996 7.941 0.055 18053
8421 1 13 . 1 1 86 86 ALA N N 516 120.140 120.140 122.196 -2.056 18053
8422 1 13 . 1 1 86 86 ALA HA H 516 4.344 4.344 4.598 -0.254 18053
8423 1 13 . 1 1 86 86 ALA C C 516 177.690 177.690 178.256 -0.566 18053
8424 1 13 . 1 1 86 86 ALA CA C 516 53.139 53.139 52.270 0.869 18053
8425 1 13 . 1 1 86 86 ALA CB C 516 20.547 20.547 19.574 0.973 18053
8426 1 13 . 1 1 86 86 ALA H H 516 7.474 7.474 7.306 0.168 18053
8427 1 13 . 1 1 87 87 GLY N N 517 105.720 105.720 107.204 -1.484 18053
8428 1 13 . 1 1 87 87 GLY C C 517 173.650 173.650 174.700 -1.050 18053
8429 1 13 . 1 1 87 87 GLY CA C 517 46.014 46.014 45.391 0.623 18053
8430 1 13 . 1 1 87 87 GLY H H 517 7.779 7.779 7.777 0.002 18053
8431 1 13 . 1 1 88 88 VAL N N 518 121.537 121.537 119.984 1.553 18053
8432 1 13 . 1 1 88 88 VAL HA H 518 3.585 3.585 4.123 -0.538 18053
8433 1 13 . 1 1 88 88 VAL C C 518 174.851 174.851 175.290 -0.439 18053
8434 1 13 . 1 1 88 88 VAL CA C 518 61.274 61.274 61.318 -0.044 18053
8435 1 13 . 1 1 88 88 VAL CB C 518 33.376 33.376 32.774 0.602 18053
8436 1 13 . 1 1 88 88 VAL H H 518 7.499 7.499 7.882 -0.383 18053
8437 1 13 . 1 1 89 89 ALA N N 519 128.295 128.295 129.524 -1.229 18053
8438 1 13 . 1 1 89 89 ALA HA H 519 4.192 4.192 4.385 -0.193 18053
8439 1 13 . 1 1 89 89 ALA C C 519 176.680 176.680 176.617 0.063 18053
8440 1 13 . 1 1 89 89 ALA CA C 519 51.283 51.283 51.526 -0.243 18053
8441 1 13 . 1 1 89 89 ALA CB C 519 19.292 19.292 19.312 -0.020 18053
8442 1 13 . 1 1 89 89 ALA H H 519 7.960 7.960 8.077 -0.117 18053
8443 1 13 . 1 1 90 90 HIS N N 520 122.643 122.643 124.364 -1.721 18053
8444 1 13 . 1 1 90 90 HIS HA H 520 4.033 4.033 4.434 -0.401 18053
8445 1 13 . 1 1 90 90 HIS C C 520 175.793 175.793 174.595 1.198 18053
8446 1 13 . 1 1 90 90 HIS CA C 520 58.653 58.653 56.078 2.575 18053
8447 1 13 . 1 1 90 90 HIS CB C 520 32.285 32.285 29.832 2.453 18053
8448 1 13 . 1 1 90 90 HIS H H 520 8.394 8.394 8.885 -0.491 18053
8449 1 13 . 1 1 91 91 SER N N 521 121.247 121.247 123.547 -2.300 18053
8450 1 13 . 1 1 91 91 SER HA H 521 4.629 4.629 4.734 -0.105 18053
8451 1 13 . 1 1 91 91 SER CA C 521 55.843 55.843 55.918 -0.075 18053
8452 1 13 . 1 1 91 91 SER CB C 521 62.367 62.367 63.180 -0.813 18053
8453 1 13 . 1 1 91 91 SER H H 521 8.569 8.569 8.535 0.034 18053
8454 1 13 . 1 1 92 92 PRO HA H 522 4.002 4.002 4.826 -0.824 18053
8455 1 13 . 1 1 92 92 PRO CA C 522 62.244 62.244 62.323 -0.079 18053
8456 1 13 . 1 1 92 92 PRO CB C 522 30.931 30.931 31.484 -0.553 18053
8457 1 13 . 1 1 93 93 PRO HA H 523 4.672 4.672 4.808 -0.136 18053
8458 1 13 . 1 1 93 93 PRO C C 523 177.786 177.786 178.448 -0.662 18053
8459 1 13 . 1 1 93 93 PRO CA C 523 64.003 64.003 63.805 0.198 18053
8460 1 13 . 1 1 93 93 PRO CB C 523 34.905 34.905 32.807 2.098 18053
8461 1 13 . 1 1 94 94 SER N N 524 117.212 117.212 117.454 -0.242 18053
8462 1 13 . 1 1 94 94 SER HA H 524 4.678 4.678 4.390 0.288 18053
8463 1 13 . 1 1 94 94 SER C C 524 174.851 174.851 174.608 0.243 18053
8464 1 13 . 1 1 94 94 SER CA C 524 61.874 61.874 62.190 -0.316 18053
8465 1 13 . 1 1 94 94 SER CB C 524 64.057 64.057 63.717 0.340 18053
8466 1 13 . 1 1 94 94 SER H H 524 8.463 8.463 8.007 0.456 18053
8467 1 13 . 1 1 95 95 THR N N 525 121.588 121.588 119.273 2.315 18053
8468 1 13 . 1 1 95 95 THR HA H 525 4.859 4.859 5.009 -0.150 18053
8469 1 13 . 1 1 95 95 THR C C 525 172.094 172.094 173.406 -1.312 18053
8470 1 13 . 1 1 95 95 THR CA C 525 62.309 62.309 62.115 0.194 18053
8471 1 13 . 1 1 95 95 THR CB C 525 70.281 70.281 68.908 1.373 18053
8472 1 13 . 1 1 95 95 THR H H 525 7.631 7.631 7.977 -0.346 18053
8473 1 13 . 1 1 96 96 LEU N N 526 127.274 127.274 129.206 -1.932 18053
8474 1 13 . 1 1 96 96 LEU HA H 526 5.131 5.131 5.137 -0.006 18053
8475 1 13 . 1 1 96 96 LEU C C 526 175.916 175.916 176.010 -0.094 18053
8476 1 13 . 1 1 96 96 LEU CA C 526 52.075 52.075 54.536 -2.462 18053
8477 1 13 . 1 1 96 96 LEU CB C 526 43.790 43.790 43.448 0.342 18053
8478 1 13 . 1 1 96 96 LEU H H 526 8.977 8.977 8.330 0.647 18053
8479 1 13 . 1 1 97 97 VAL N N 527 124.056 124.056 120.078 3.978 18053
8480 1 13 . 1 1 97 97 VAL HA H 527 4.869 4.869 4.658 0.211 18053
8481 1 13 . 1 1 97 97 VAL C C 527 176.230 176.230 175.314 0.916 18053
8482 1 13 . 1 1 97 97 VAL CA C 527 61.519 61.519 61.384 0.135 18053
8483 1 13 . 1 1 97 97 VAL CB C 527 33.704 33.704 34.396 -0.692 18053
8484 1 13 . 1 1 97 97 VAL H H 527 10.724 10.724 7.944 2.780 18053
8485 1 13 . 1 1 98 98 TRP N N 528 132.586 132.586 130.769 1.817 18053
8486 1 13 . 1 1 98 98 TRP HA H 528 4.965 4.965 4.648 0.317 18053
8487 1 13 . 1 1 98 98 TRP C C 528 173.391 173.391 175.381 -1.990 18053
8488 1 13 . 1 1 98 98 TRP CA C 528 53.303 53.303 55.807 -2.504 18053
8489 1 13 . 1 1 98 98 TRP CB C 528 28.245 28.245 28.911 -0.666 18053
8490 1 13 . 1 1 98 98 TRP H H 528 9.400 9.400 8.919 0.481 18053
8491 1 13 . 1 1 99 99 LYS N N 529 126.644 126.644 127.924 -1.280 18053
8492 1 13 . 1 1 99 99 LYS HA H 529 3.839 3.839 4.155 -0.316 18053
8493 1 13 . 1 1 99 99 LYS C C 529 177.581 177.581 177.296 0.285 18053
8494 1 13 . 1 1 99 99 LYS CA C 529 58.543 58.543 57.329 1.214 18053
8495 1 13 . 1 1 99 99 LYS CB C 529 32.176 32.176 32.440 -0.264 18053
8496 1 13 . 1 1 99 99 LYS H H 529 8.153 8.153 8.148 0.005 18053
8497 1 13 . 1 1 100 100 GLY N N 530 110.385 110.385 113.942 -3.557 18053
8498 1 13 . 1 1 100 100 GLY C C 530 172.367 172.367 173.792 -1.425 18053
8499 1 13 . 1 1 100 100 GLY CA C 530 45.278 45.278 45.001 0.277 18053
8500 1 13 . 1 1 100 100 GLY H H 530 8.363 8.363 8.760 -0.397 18053
8501 1 13 . 1 1 101 101 GLN N N 531 121.162 121.162 122.668 -1.506 18053
8502 1 13 . 1 1 101 101 GLN HA H 531 3.972 3.972 4.337 -0.365 18053
8503 1 13 . 1 1 101 101 GLN CA C 531 52.620 52.620 54.010 -1.389 18053
8504 1 13 . 1 1 101 101 GLN CB C 531 27.595 27.595 27.878 -0.283 18053
8505 1 13 . 1 1 101 101 GLN H H 531 6.815 6.815 7.466 -0.651 18053
8506 1 13 . 1 1 102 102 SER N N 532 122.728 122.728 122.333 0.395 18053
8507 1 13 . 1 1 102 102 SER HA H 532 3.866 3.866 4.539 -0.673 18053
8508 1 13 . 1 1 102 102 SER C C 532 174.537 174.537 176.065 -1.528 18053
8509 1 13 . 1 1 102 102 SER CA C 532 61.983 61.983 60.553 1.430 18053
8510 1 13 . 1 1 102 102 SER CB C 532 62.802 62.802 63.427 -0.625 18053
8511 1 13 . 1 1 102 102 SER H H 532 8.662 8.662 8.803 -0.141 18053
8512 1 13 . 1 1 103 103 SER N N 533 110.811 110.811 117.668 -6.857 18053
8513 1 13 . 1 1 103 103 SER HA H 533 4.240 4.240 4.239 0.001 18053
8514 1 13 . 1 1 103 103 SER C C 533 174.087 174.087 175.471 -1.384 18053
8515 1 13 . 1 1 103 103 SER CA C 533 56.633 56.633 59.997 -3.364 18053
8516 1 13 . 1 1 103 103 SER CB C 533 64.658 64.658 63.481 1.177 18053
8517 1 13 . 1 1 103 103 SER H H 533 7.134 7.134 7.716 -0.582 18053
8518 1 13 . 1 1 104 104 TRP N N 534 126.133 126.133 123.026 3.107 18053
8519 1 13 . 1 1 104 104 TRP HA H 534 4.098 4.098 3.978 0.120 18053
8520 1 13 . 1 1 104 104 TRP C C 534 176.066 176.066 175.074 0.992 18053
8521 1 13 . 1 1 104 104 TRP CA C 534 60.127 60.127 58.249 1.878 18053
8522 1 13 . 1 1 104 104 TRP CB C 534 28.764 28.764 28.141 0.623 18053
8523 1 13 . 1 1 104 104 TRP H H 534 9.764 9.764 7.761 2.003 18053
8524 1 13 . 1 1 105 105 GLY N N 535 105.907 105.907 106.116 -0.209 18053
8525 1 13 . 1 1 105 105 GLY C C 535 172.217 172.217 174.058 -1.841 18053
8526 1 13 . 1 1 105 105 GLY CA C 535 44.240 44.240 44.974 -0.734 18053
8527 1 13 . 1 1 105 105 GLY H H 535 8.095 8.095 7.687 0.408 18053
8528 1 13 . 1 1 106 106 THR N N 536 111.253 111.253 115.896 -4.643 18053
8529 1 13 . 1 1 106 106 THR HA H 536 3.859 3.859 3.978 -0.119 18053
8530 1 13 . 1 1 106 106 THR C C 536 172.872 172.872 174.530 -1.658 18053
8531 1 13 . 1 1 106 106 THR CA C 536 59.635 59.635 63.762 -4.127 18053
8532 1 13 . 1 1 106 106 THR CB C 536 70.526 70.526 69.751 0.775 18053
8533 1 13 . 1 1 106 106 THR H H 536 7.913 7.913 7.695 0.218 18053
8534 1 13 . 1 1 107 107 GLY N N 537 107.712 107.712 113.845 -6.133 18053
8535 1 13 . 1 1 107 107 GLY C C 537 172.709 172.709 173.284 -0.575 18053
8536 1 13 . 1 1 107 107 GLY CA C 537 45.166 45.166 45.330 -0.164 18053
8537 1 13 . 1 1 107 107 GLY H H 537 7.533 7.533 7.974 -0.441 18053
8538 1 13 . 1 1 108 108 GLU N N 538 118.864 118.864 119.526 -0.662 18053
8539 1 13 . 1 1 108 108 GLU HA H 538 4.136 4.136 4.455 -0.319 18053
8540 1 13 . 1 1 108 108 GLU C C 538 176.353 176.353 175.330 1.023 18053
8541 1 13 . 1 1 108 108 GLU CA C 538 58.352 58.352 57.025 1.327 18053
8542 1 13 . 1 1 108 108 GLU CB C 538 30.156 30.156 30.651 -0.495 18053
8543 1 13 . 1 1 108 108 GLU H H 538 8.558 8.558 8.778 -0.220 18053
8544 1 13 . 1 1 109 109 SER N N 539 110.419 110.419 114.142 -3.723 18053
8545 1 13 . 1 1 109 109 SER HA H 539 4.963 4.963 5.553 -0.590 18053
8546 1 13 . 1 1 109 109 SER C C 539 173.787 173.787 172.963 0.824 18053
8547 1 13 . 1 1 109 109 SER CA C 539 57.125 57.125 57.147 -0.021 18053
8548 1 13 . 1 1 109 109 SER CB C 539 64.439 64.439 65.504 -1.065 18053
8549 1 13 . 1 1 109 109 SER H H 539 7.620 7.620 7.796 -0.176 18053
8550 1 13 . 1 1 110 110 PHE N N 540 118.778 118.778 118.411 0.367 18053
8551 1 13 . 1 1 110 110 PHE HA H 540 5.081 5.081 5.123 -0.042 18053
8552 1 13 . 1 1 110 110 PHE C C 540 176.052 176.052 172.931 3.121 18053
8553 1 13 . 1 1 110 110 PHE CA C 540 56.789 56.789 57.346 -0.557 18053
8554 1 13 . 1 1 110 110 PHE CB C 540 40.760 40.760 41.675 -0.915 18053
8555 1 13 . 1 1 110 110 PHE H H 540 8.318 8.318 8.805 -0.487 18053
8556 1 13 . 1 1 112 112 THR HA H 542 5.468 5.468 4.857 0.611 18053
8557 1 13 . 1 1 112 112 THR C C 542 172.381 172.381 173.625 -1.244 18053
8558 1 13 . 1 1 112 112 THR CA C 542 61.818 61.818 63.646 -1.828 18053
8559 1 13 . 1 1 112 112 THR CB C 542 70.990 70.990 69.615 1.375 18053
8560 1 13 . 1 1 113 113 VAL N N 543 124.771 124.771 128.301 -3.530 18053
8561 1 13 . 1 1 113 113 VAL HA H 543 4.864 4.864 4.494 0.370 18053
8562 1 13 . 1 1 113 113 VAL C C 543 173.132 173.132 174.240 -1.108 18053
8563 1 13 . 1 1 113 113 VAL CA C 543 60.099 60.099 61.390 -1.291 18053
8564 1 13 . 1 1 113 113 VAL CB C 543 36.433 36.433 33.459 2.974 18053
8565 1 13 . 1 1 113 113 VAL H H 543 9.380 9.380 8.668 0.712 18053
8566 1 13 . 1 1 114 114 LEU N N 544 128.789 128.789 129.875 -1.086 18053
8567 1 13 . 1 1 114 114 LEU HA H 544 5.320 5.320 4.849 0.471 18053
8568 1 13 . 1 1 114 114 LEU C C 544 174.237 174.237 175.235 -0.998 18053
8569 1 13 . 1 1 114 114 LEU CA C 544 53.193 53.193 54.273 -1.081 18053
8570 1 13 . 1 1 114 114 LEU CB C 544 45.879 45.879 44.065 1.814 18053
8571 1 13 . 1 1 114 114 LEU H H 544 8.948 8.948 8.215 0.733 18053
8572 1 13 . 1 1 115 115 VAL N N 545 127.002 127.002 125.919 1.083 18053
8573 1 13 . 1 1 115 115 VAL HA H 545 4.854 4.854 4.836 0.018 18053
8574 1 13 . 1 1 115 115 VAL C C 545 175.206 175.206 175.486 -0.280 18053
8575 1 13 . 1 1 115 115 VAL CA C 545 59.334 59.334 60.013 -0.679 18053
8576 1 13 . 1 1 115 115 VAL CB C 545 34.495 34.495 34.141 0.354 18053
8577 1 13 . 1 1 115 115 VAL H H 545 9.564 9.564 8.711 0.853 18053
8578 1 13 . 1 1 116 116 ASN N N 546 121.179 121.179 124.892 -3.713 18053
8579 1 13 . 1 1 116 116 ASN HA H 546 2.897 2.897 3.616 -0.719 18053
8580 1 13 . 1 1 116 116 ASN C C 546 176.885 176.885 175.696 1.189 18053
8581 1 13 . 1 1 116 116 ASN CA C 546 50.409 50.409 51.404 -0.995 18053
8582 1 13 . 1 1 116 116 ASN CB C 546 36.639 36.639 38.899 -2.260 18053
8583 1 13 . 1 1 116 116 ASN H H 546 8.016 8.016 8.120 -0.104 18053
8584 1 13 . 1 1 117 117 ALA N N 547 119.834 119.834 119.976 -0.142 18053
8585 1 13 . 1 1 117 117 ALA HA H 547 3.866 3.866 4.065 -0.199 18053
8586 1 13 . 1 1 117 117 ALA C C 547 177.772 177.772 178.234 -0.462 18053
8587 1 13 . 1 1 117 117 ALA CA C 547 54.504 54.504 54.416 0.088 18053
8588 1 13 . 1 1 117 117 ALA CB C 547 18.200 18.200 18.438 -0.238 18053
8589 1 13 . 1 1 117 117 ALA H H 547 6.444 6.444 7.931 -1.487 18053
8590 1 13 . 1 1 118 118 ASP N N 548 115.646 115.646 116.755 -1.109 18053
8591 1 13 . 1 1 118 118 ASP HA H 548 4.644 4.644 4.451 0.193 18053
8592 1 13 . 1 1 118 118 ASP C C 548 176.052 176.052 177.246 -1.194 18053
8593 1 13 . 1 1 118 118 ASP CA C 548 54.067 54.067 54.670 -0.603 18053
8594 1 13 . 1 1 118 118 ASP CB C 548 41.674 41.674 40.889 0.785 18053
8595 1 13 . 1 1 118 118 ASP H H 548 7.181 7.181 7.734 -0.553 18053
8596 1 13 . 1 1 119 119 GLY N N 549 107.167 107.167 107.904 -0.737 18053
8597 1 13 . 1 1 119 119 GLY C C 549 173.841 173.841 173.654 0.187 18053
8598 1 13 . 1 1 119 119 GLY CA C 549 45.455 45.455 45.308 0.147 18053
8599 1 13 . 1 1 119 119 GLY H H 549 7.738 7.738 7.590 0.148 18053
8600 1 13 . 1 1 120 120 GLU N N 550 121.196 121.196 118.631 2.565 18053
8601 1 13 . 1 1 120 120 GLU HA H 550 4.112 4.112 4.409 -0.297 18053
8602 1 13 . 1 1 120 120 GLU C C 550 175.588 175.588 175.273 0.315 18053
8603 1 13 . 1 1 120 120 GLU CA C 550 54.831 54.831 54.465 0.366 18053
8604 1 13 . 1 1 120 120 GLU CB C 550 29.937 29.937 30.956 -1.019 18053
8605 1 13 . 1 1 120 120 GLU H H 550 7.587 7.587 7.992 -0.405 18053
8606 1 13 . 1 1 121 121 GLU N N 551 123.886 123.886 123.425 0.461 18053
8607 1 13 . 1 1 121 121 GLU HA H 551 4.276 4.276 4.306 -0.030 18053
8608 1 13 . 1 1 121 121 GLU C C 551 176.817 176.817 175.882 0.935 18053
8609 1 13 . 1 1 121 121 GLU CA C 551 56.796 56.796 56.916 -0.120 18053
8610 1 13 . 1 1 121 121 GLU CB C 551 28.955 28.955 28.549 0.406 18053
8611 1 13 . 1 1 121 121 GLU H H 551 8.697 8.697 8.828 -0.131 18053
8612 1 13 . 1 1 122 122 VAL N N 552 120.055 120.055 123.286 -3.231 18053
8613 1 13 . 1 1 122 122 VAL HA H 552 4.364 4.364 3.886 0.478 18053
8614 1 13 . 1 1 122 122 VAL C C 552 175.998 175.998 174.914 1.084 18053
8615 1 13 . 1 1 122 122 VAL CA C 552 61.655 61.655 63.246 -1.591 18053
8616 1 13 . 1 1 122 122 VAL CB C 552 33.049 33.049 32.365 0.684 18053
8617 1 13 . 1 1 122 122 VAL H H 552 8.845 8.845 8.232 0.613 18053
8618 1 13 . 1 1 123 123 ALA N N 553 122.098 122.098 119.696 2.402 18053
8619 1 13 . 1 1 123 123 ALA HA H 553 4.890 4.890 4.718 0.172 18053
8620 1 13 . 1 1 123 123 ALA C C 553 175.261 175.261 174.839 0.422 18053
8621 1 13 . 1 1 123 123 ALA CA C 553 52.757 52.757 51.044 1.714 18053
8622 1 13 . 1 1 123 123 ALA CB C 553 22.267 22.267 22.274 -0.007 18053
8623 1 13 . 1 1 123 123 ALA H H 553 7.788 7.788 7.841 -0.053 18053
8624 1 13 . 1 1 124 124 MET N N 554 118.217 118.217 119.500 -1.283 18053
8625 1 13 . 1 1 124 124 MET HA H 554 5.286 5.286 5.212 0.074 18053
8626 1 13 . 1 1 124 124 MET C C 554 174.428 174.428 174.423 0.005 18053
8627 1 13 . 1 1 124 124 MET CA C 554 55.104 55.104 55.400 -0.296 18053
8628 1 13 . 1 1 124 124 MET CB C 554 35.342 35.342 36.929 -1.587 18053
8629 1 13 . 1 1 124 124 MET H H 554 8.693 8.693 8.333 0.360 18053
8630 1 13 . 1 1 125 125 ARG N N 555 122.132 122.132 125.254 -3.122 18053
8631 1 13 . 1 1 125 125 ARG HA H 555 4.900 4.900 4.679 0.221 18053
8632 1 13 . 1 1 125 125 ARG CA C 555 56.388 56.388 56.340 0.049 18053
8633 1 13 . 1 1 125 125 ARG CB C 555 34.378 34.378 33.927 0.451 18053
8634 1 13 . 1 1 125 125 ARG H H 555 8.919 8.919 9.039 -0.120 18053
8635 1 13 . 1 1 126 126 THR HA H 556 4.685 4.685 4.629 0.056 18053
8636 1 13 . 1 1 126 126 THR C C 556 172.436 172.436 173.869 -1.433 18053
8637 1 13 . 1 1 126 126 THR CA C 556 61.382 61.382 62.252 -0.870 18053
8638 1 13 . 1 1 126 126 THR CB C 556 70.444 70.444 69.350 1.094 18053
8639 1 13 . 1 1 127 127 VAL N N 557 124.976 124.976 128.686 -3.710 18053
8640 1 13 . 1 1 127 127 VAL HA H 557 4.146 4.146 4.008 0.138 18053
8641 1 13 . 1 1 127 127 VAL C C 557 173.937 173.937 174.221 -0.284 18053
8642 1 13 . 1 1 127 127 VAL CA C 557 61.109 61.109 61.315 -0.205 18053
8643 1 13 . 1 1 127 127 VAL CB C 557 33.759 33.759 32.733 1.026 18053
8644 1 13 . 1 1 127 127 VAL H H 557 8.127 8.127 8.549 -0.422 18053
8645 1 13 . 1 1 128 128 LYS N N 558 125.384 125.384 126.282 -0.898 18053
8646 1 13 . 1 1 128 128 LYS HA H 558 4.706 4.706 4.422 0.284 18053
8647 1 13 . 1 1 128 128 LYS C C 558 175.534 175.534 175.341 0.193 18053
8648 1 13 . 1 1 128 128 LYS CA C 558 54.886 54.886 54.016 0.870 18053
8649 1 13 . 1 1 128 128 LYS CB C 558 34.673 34.673 33.905 0.768 18053
8650 1 13 . 1 1 128 128 LYS H H 558 8.289 8.289 8.479 -0.190 18053
8651 1 13 . 1 1 129 129 LYS N N 559 124.005 124.005 127.106 -3.101 18053
8652 1 13 . 1 1 129 129 LYS HA H 559 4.310 4.310 4.118 0.192 18053
8653 1 13 . 1 1 129 129 LYS C C 559 176.571 176.571 176.242 0.329 18053
8654 1 13 . 1 1 129 129 LYS CA C 559 56.742 56.742 56.938 -0.196 18053
8655 1 13 . 1 1 129 129 LYS CB C 559 33.362 33.362 32.205 1.157 18053
8656 1 13 . 1 1 129 129 LYS H H 559 8.461 8.461 8.185 0.276 18053
8657 1 13 . 1 1 130 130 SER N N 560 117.195 117.195 123.057 -5.862 18053
8658 1 13 . 1 1 130 130 SER HA H 560 4.384 4.384 4.712 -0.328 18053
8659 1 13 . 1 1 130 130 SER C C 560 174.565 174.565 173.439 1.126 18053
8660 1 13 . 1 1 130 130 SER CA C 560 58.434 58.434 57.483 0.951 18053
8661 1 13 . 1 1 130 130 SER CB C 560 63.812 63.812 63.054 0.757 18053
8662 1 13 . 1 1 130 130 SER H H 560 8.465 8.465 8.208 0.257 18053
8663 1 13 . 1 1 131 131 SER N N 561 118.149 118.149 118.896 -0.747 18053
8664 1 13 . 1 1 131 131 SER HA H 561 4.412 4.412 4.641 -0.229 18053
8665 1 13 . 1 1 131 131 SER C C 561 174.456 174.456 174.795 -0.339 18053
8666 1 13 . 1 1 131 131 SER CA C 561 58.489 58.489 57.771 0.718 18053
8667 1 13 . 1 1 131 131 SER CB C 561 63.811 63.811 64.955 -1.144 18053
8668 1 13 . 1 1 131 131 SER H H 561 8.336 8.336 8.110 0.226 18053
8669 1 13 . 1 1 132 132 VAL N N 562 121.332 121.332 122.595 -1.263 18053
8670 1 13 . 1 1 132 132 VAL HA H 562 4.035 4.035 4.089 -0.054 18053
8671 1 13 . 1 1 132 132 VAL C C 562 176.066 176.066 176.433 -0.367 18053
8672 1 13 . 1 1 132 132 VAL CA C 562 62.446 62.446 62.505 -0.059 18053
8673 1 13 . 1 1 132 132 VAL CB C 562 32.394 32.394 32.000 0.394 18053
8674 1 13 . 1 1 132 132 VAL H H 562 7.982 7.982 8.482 -0.499 18053
8675 1 13 . 1 1 133 133 MET N N 563 124.022 124.022 120.381 3.641 18053
8676 1 13 . 1 1 133 133 MET HA H 563 4.385 4.385 4.324 0.061 18053
8677 1 13 . 1 1 133 133 MET C C 563 176.039 176.039 176.254 -0.215 18053
8678 1 13 . 1 1 133 133 MET CA C 563 55.350 55.350 56.090 -0.740 18053
8679 1 13 . 1 1 133 133 MET CB C 563 32.503 32.503 32.347 0.156 18053
8680 1 13 . 1 1 133 133 MET H H 563 8.295 8.295 7.647 0.648 18053
8681 1 13 . 1 1 134 134 ARG N N 564 122.677 122.677 123.652 -0.975 18053
8682 1 13 . 1 1 134 134 ARG HA H 564 4.262 4.262 4.236 0.026 18053
8683 1 13 . 1 1 134 134 ARG C C 564 176.298 176.298 176.490 -0.192 18053
8684 1 13 . 1 1 134 134 ARG CA C 564 56.087 56.087 56.036 0.051 18053
8685 1 13 . 1 1 134 134 ARG CB C 564 30.702 30.702 30.767 -0.065 18053
8686 1 13 . 1 1 134 134 ARG H H 564 8.295 8.295 8.489 -0.194 18053
8687 1 13 . 1 1 135 135 GLU N N 565 121.945 121.945 121.432 0.513 18053
8688 1 13 . 1 1 135 135 GLU HA H 565 4.160 4.160 4.137 0.023 18053
8689 1 13 . 1 1 135 135 GLU C C 565 176.080 176.080 176.111 -0.031 18053
8690 1 13 . 1 1 135 135 GLU CA C 565 56.906 56.906 57.346 -0.440 18053
8691 1 13 . 1 1 135 135 GLU CB C 565 29.774 29.774 28.902 0.872 18053
8692 1 13 . 1 1 135 135 GLU H H 565 8.470 8.470 8.665 -0.195 18053
8693 1 13 . 1 1 136 136 ASN N N 566 118.761 118.761 124.759 -5.998 18053
8694 1 13 . 1 1 136 136 ASN HA H 566 4.617 4.617 4.946 -0.329 18053
8695 1 13 . 1 1 136 136 ASN C C 566 175.315 175.315 175.279 0.036 18053
8696 1 13 . 1 1 136 136 ASN CA C 566 53.193 53.193 53.151 0.042 18053
8697 1 13 . 1 1 136 136 ASN CB C 566 38.836 38.836 38.983 -0.147 18053
8698 1 13 . 1 1 136 136 ASN H H 566 8.341 8.341 8.505 -0.164 18053
8699 1 13 . 1 1 137 137 GLU N N 567 121.349 121.349 123.015 -1.666 18053
8700 1 13 . 1 1 137 137 GLU HA H 567 4.152 4.152 4.011 0.141 18053
8701 1 13 . 1 1 137 137 GLU C C 567 176.243 176.243 176.309 -0.066 18053
8702 1 13 . 1 1 137 137 GLU CA C 567 56.906 56.906 58.528 -1.622 18053
8703 1 13 . 1 1 137 137 GLU CB C 567 29.992 29.992 29.758 0.235 18053
8704 1 13 . 1 1 137 137 GLU H H 567 8.349 8.349 8.598 -0.249 18053
8705 1 13 . 1 1 138 138 ASN N N 568 118.761 118.761 118.506 0.255 18053
8706 1 13 . 1 1 138 138 ASN HA H 568 4.712 4.712 4.620 0.092 18053
8707 1 13 . 1 1 138 138 ASN C C 568 174.551 174.551 174.170 0.381 18053
8708 1 13 . 1 1 138 138 ASN CA C 568 53.193 53.193 53.352 -0.159 18053
8709 1 13 . 1 1 138 138 ASN CB C 568 39.327 39.327 37.797 1.530 18053
8710 1 13 . 1 1 138 138 ASN H H 568 8.397 8.397 8.466 -0.069 18053
8711 1 14 . 1 1 20 20 ALA N N 450 125.180 125.180 125.530 -0.350 18053
8712 1 14 . 1 1 20 20 ALA HA H 450 4.706 4.706 4.533 0.173 18053
8713 1 14 . 1 1 20 20 ALA C C 450 177.226 177.226 177.378 -0.152 18053
8714 1 14 . 1 1 20 20 ALA CA C 450 52.757 52.757 52.475 0.282 18053
8715 1 14 . 1 1 20 20 ALA CB C 450 20.411 20.411 18.665 1.746 18053
8716 1 14 . 1 1 20 20 ALA H H 450 8.484 8.484 8.843 -0.359 18053
8717 1 14 . 1 1 21 21 SER N N 451 115.714 115.714 121.481 -5.767 18053
8718 1 14 . 1 1 21 21 SER HA H 451 4.513 4.513 4.329 0.184 18053
8719 1 14 . 1 1 21 21 SER C C 451 174.742 174.742 174.826 -0.084 18053
8720 1 14 . 1 1 21 21 SER CA C 451 58.516 58.516 58.600 -0.084 18053
8721 1 14 . 1 1 21 21 SER CB C 451 64.159 64.159 62.193 1.966 18053
8722 1 14 . 1 1 21 21 SER H H 451 8.487 8.487 8.355 0.132 18053
8723 1 14 . 1 1 22 22 GLY N N 452 111.509 111.509 113.436 -1.927 18053
8724 1 14 . 1 1 22 22 GLY C C 452 174.401 174.401 175.444 -1.043 18053
8725 1 14 . 1 1 22 22 GLY CA C 452 45.059 45.059 45.666 -0.607 18053
8726 1 14 . 1 1 22 22 GLY H H 452 8.198 8.198 8.145 0.053 18053
8727 1 14 . 1 1 23 23 SER N N 453 116.191 116.191 114.664 1.527 18053
8728 1 14 . 1 1 23 23 SER HA H 453 4.364 4.364 4.297 0.067 18053
8729 1 14 . 1 1 23 23 SER C C 453 173.432 173.432 174.659 -1.227 18053
8730 1 14 . 1 1 23 23 SER CA C 453 59.744 59.744 61.471 -1.727 18053
8731 1 14 . 1 1 23 23 SER CB C 453 64.335 64.335 63.979 0.356 18053
8732 1 14 . 1 1 23 23 SER H H 453 8.494 8.494 7.934 0.560 18053
8733 1 14 . 1 1 24 24 VAL N N 454 121.656 121.656 120.763 0.893 18053
8734 1 14 . 1 1 24 24 VAL HA H 454 5.035 5.035 4.640 0.395 18053
8735 1 14 . 1 1 24 24 VAL C C 454 174.606 174.606 176.076 -1.470 18053
8736 1 14 . 1 1 24 24 VAL CA C 454 61.055 61.055 61.102 -0.047 18053
8737 1 14 . 1 1 24 24 VAL CB C 454 32.503 32.503 30.754 1.749 18053
8738 1 14 . 1 1 24 24 VAL H H 454 7.830 7.830 7.980 -0.150 18053
8739 1 14 . 1 1 25 25 SER N N 455 119.323 119.323 122.230 -2.907 18053
8740 1 14 . 1 1 25 25 SER HA H 455 4.672 4.672 4.810 -0.138 18053
8741 1 14 . 1 1 25 25 SER C C 455 174.426 174.426 174.649 -0.223 18053
8742 1 14 . 1 1 25 25 SER CA C 455 55.268 55.268 56.581 -1.313 18053
8743 1 14 . 1 1 25 25 SER CB C 455 65.162 65.162 65.296 -0.134 18053
8744 1 14 . 1 1 25 25 SER H H 455 9.065 9.065 8.644 0.421 18053
8745 1 14 . 1 1 26 26 ILE N N 456 119.468 119.468 122.925 -3.457 18053
8746 1 14 . 1 1 26 26 ILE HA H 456 4.180 4.180 4.218 -0.038 18053
8747 1 14 . 1 1 26 26 ILE C C 456 175.506 175.506 176.317 -0.811 18053
8748 1 14 . 1 1 26 26 ILE CA C 456 61.328 61.328 61.561 -0.233 18053
8749 1 14 . 1 1 26 26 ILE CB C 456 37.962 37.962 36.751 1.212 18053
8750 1 14 . 1 1 26 26 ILE H H 456 8.295 8.295 8.676 -0.381 18053
8751 1 14 . 1 1 27 27 GLU N N 457 129.726 129.726 129.873 -0.147 18053
8752 1 14 . 1 1 27 27 GLU HA H 457 4.228 4.228 4.202 0.026 18053
8753 1 14 . 1 1 27 27 GLU C C 457 175.179 175.179 176.397 -1.218 18053
8754 1 14 . 1 1 27 27 GLU CA C 457 55.432 55.432 58.535 -3.103 18053
8755 1 14 . 1 1 27 27 GLU CB C 457 30.142 30.142 30.591 -0.449 18053
8756 1 14 . 1 1 27 27 GLU H H 457 8.393 8.393 8.586 -0.193 18053
8757 1 14 . 1 1 28 28 GLU N N 458 117.076 117.076 115.541 1.535 18053
8758 1 14 . 1 1 28 28 GLU HA H 458 4.168 4.168 4.701 -0.533 18053
8759 1 14 . 1 1 28 28 GLU C C 458 174.701 174.701 174.505 0.196 18053
8760 1 14 . 1 1 28 28 GLU CA C 458 56.906 56.906 55.487 1.419 18053
8761 1 14 . 1 1 28 28 GLU CB C 458 31.848 31.848 34.275 -2.427 18053
8762 1 14 . 1 1 28 28 GLU H H 458 7.489 7.489 8.083 -0.594 18053
8763 1 14 . 1 1 29 29 ILE N N 459 122.183 122.183 120.683 1.500 18053
8764 1 14 . 1 1 29 29 ILE HA H 459 3.764 3.764 4.055 -0.291 18053
8765 1 14 . 1 1 29 29 ILE C C 459 174.169 174.169 174.783 -0.614 18053
8766 1 14 . 1 1 29 29 ILE CA C 459 59.526 59.526 59.457 0.069 18053
8767 1 14 . 1 1 29 29 ILE CB C 459 40.309 40.309 40.889 -0.580 18053
8768 1 14 . 1 1 29 29 ILE H H 459 8.126 8.126 8.379 -0.253 18053
8769 1 14 . 1 1 30 30 ASP N N 460 123.205 123.205 124.753 -1.548 18053
8770 1 14 . 1 1 30 30 ASP HA H 460 4.183 4.183 4.324 -0.141 18053
8771 1 14 . 1 1 30 30 ASP C C 460 178.318 178.318 177.769 0.549 18053
8772 1 14 . 1 1 30 30 ASP CA C 460 53.930 53.930 53.850 0.080 18053
8773 1 14 . 1 1 30 30 ASP CB C 460 42.807 42.807 42.159 0.648 18053
8774 1 14 . 1 1 30 30 ASP H H 460 6.704 6.704 7.517 -0.813 18053
8775 1 14 . 1 1 31 31 LEU N N 461 128.551 128.551 121.678 6.873 18053
8776 1 14 . 1 1 31 31 LEU HA H 461 4.064 4.064 4.101 -0.037 18053
8777 1 14 . 1 1 31 31 LEU C C 461 177.513 177.513 177.698 -0.185 18053
8778 1 14 . 1 1 31 31 LEU CA C 461 57.124 57.124 57.693 -0.569 18053
8779 1 14 . 1 1 31 31 LEU CB C 461 41.237 41.237 42.214 -0.977 18053
8780 1 14 . 1 1 31 31 LEU H H 461 9.012 9.012 8.504 0.508 18053
8781 1 14 . 1 1 32 32 GLU N N 462 115.101 115.101 116.976 -1.875 18053
8782 1 14 . 1 1 32 32 GLU HA H 462 4.283 4.283 4.259 0.024 18053
8783 1 14 . 1 1 32 32 GLU C C 462 177.062 177.062 177.106 -0.044 18053
8784 1 14 . 1 1 32 32 GLU CA C 462 55.759 55.759 57.337 -1.578 18053
8785 1 14 . 1 1 32 32 GLU CB C 462 29.569 29.569 30.558 -0.989 18053
8786 1 14 . 1 1 32 32 GLU H H 462 7.588 7.588 7.818 -0.230 18053
8787 1 14 . 1 1 33 33 GLY N N 463 106.299 106.299 105.901 0.398 18053
8788 1 14 . 1 1 33 33 GLY C C 463 174.824 174.824 174.287 0.537 18053
8789 1 14 . 1 1 33 33 GLY CA C 463 46.806 46.806 44.797 2.009 18053
8790 1 14 . 1 1 33 33 GLY H H 463 7.372 7.372 8.124 -0.752 18053
8791 1 14 . 1 1 34 34 LYS N N 464 118.744 118.744 118.187 0.557 18053
8792 1 14 . 1 1 34 34 LYS HA H 464 4.562 4.562 4.392 0.170 18053
8793 1 14 . 1 1 34 34 LYS C C 464 177.076 177.076 174.942 2.134 18053
8794 1 14 . 1 1 34 34 LYS CA C 464 59.963 59.963 57.830 2.133 18053
8795 1 14 . 1 1 34 34 LYS CB C 464 33.111 33.111 33.691 -0.580 18053
8796 1 14 . 1 1 34 34 LYS H H 464 9.547 9.547 8.134 1.413 18053
8797 1 14 . 1 1 35 35 PHE N N 465 109.125 109.125 113.238 -4.113 18053
8798 1 14 . 1 1 35 35 PHE HA H 465 5.514 5.514 5.707 -0.193 18053
8799 1 14 . 1 1 35 35 PHE C C 465 174.183 174.183 172.843 1.340 18053
8800 1 14 . 1 1 35 35 PHE CA C 465 56.632 56.632 56.008 0.624 18053
8801 1 14 . 1 1 35 35 PHE CB C 465 40.599 40.599 40.883 -0.284 18053
8802 1 14 . 1 1 35 35 PHE H H 465 6.740 6.740 7.240 -0.500 18053
8803 1 14 . 1 1 36 36 VAL N N 466 119.579 119.579 119.904 -0.325 18053
8804 1 14 . 1 1 36 36 VAL HA H 466 3.709 3.709 4.274 -0.565 18053
8805 1 14 . 1 1 36 36 VAL C C 466 172.668 172.668 174.219 -1.551 18053
8806 1 14 . 1 1 36 36 VAL CA C 466 62.692 62.692 61.534 1.158 18053
8807 1 14 . 1 1 36 36 VAL CB C 466 36.215 36.215 35.472 0.743 18053
8808 1 14 . 1 1 36 36 VAL H H 466 7.628 7.628 9.040 -1.412 18053
8809 1 14 . 1 1 37 37 GLN N N 467 126.831 126.831 127.258 -0.427 18053
8810 1 14 . 1 1 37 37 GLN HA H 467 5.449 5.449 4.993 0.456 18053
8811 1 14 . 1 1 37 37 GLN C C 467 174.797 174.797 175.058 -0.261 18053
8812 1 14 . 1 1 37 37 GLN CA C 467 54.121 54.121 54.703 -0.582 18053
8813 1 14 . 1 1 37 37 GLN CB C 467 34.623 34.623 29.776 4.847 18053
8814 1 14 . 1 1 37 37 GLN H H 467 8.392 8.392 8.494 -0.102 18053
8815 1 14 . 1 1 38 38 LEU N N 468 123.018 123.018 128.270 -5.252 18053
8816 1 14 . 1 1 38 38 LEU HA H 468 5.422 5.422 5.314 0.108 18053
8817 1 14 . 1 1 38 38 LEU C C 468 175.588 175.588 175.700 -0.112 18053
8818 1 14 . 1 1 38 38 LEU CA C 468 52.702 52.702 53.738 -1.036 18053
8819 1 14 . 1 1 38 38 LEU CB C 468 45.046 45.046 44.968 0.078 18053
8820 1 14 . 1 1 38 38 LEU H H 468 9.103 9.103 9.178 -0.075 18053
8821 1 14 . 1 1 39 39 LYS N N 469 118.983 118.983 119.839 -0.856 18053
8822 1 14 . 1 1 39 39 LYS HA H 469 4.852 4.852 4.680 0.172 18053
8823 1 14 . 1 1 39 39 LYS C C 469 173.309 173.309 174.120 -0.811 18053
8824 1 14 . 1 1 39 39 LYS CA C 469 54.994 54.994 55.237 -0.243 18053
8825 1 14 . 1 1 39 39 LYS CB C 469 38.246 38.246 36.960 1.286 18053
8826 1 14 . 1 1 39 39 LYS H H 469 8.496 8.496 8.843 -0.347 18053
8827 1 14 . 1 1 40 40 ASN N N 470 121.758 121.758 122.318 -0.560 18053
8828 1 14 . 1 1 40 40 ASN HA H 470 4.788 4.788 5.212 -0.424 18053
8829 1 14 . 1 1 40 40 ASN C C 470 174.496 174.496 176.067 -1.571 18053
8830 1 14 . 1 1 40 40 ASN CA C 470 51.119 51.119 52.214 -1.095 18053
8831 1 14 . 1 1 40 40 ASN CB C 470 37.559 37.559 39.486 -1.927 18053
8832 1 14 . 1 1 40 40 ASN H H 470 8.283 8.283 8.204 0.079 18053
8833 1 14 . 1 1 41 41 ASN N N 471 122.422 122.422 124.900 -2.478 18053
8834 1 14 . 1 1 41 41 ASN HA H 471 4.588 4.588 4.785 -0.197 18053
8835 1 14 . 1 1 41 41 ASN C C 471 174.810 174.810 175.531 -0.721 18053
8836 1 14 . 1 1 41 41 ASN CA C 471 53.985 53.985 53.821 0.164 18053
8837 1 14 . 1 1 41 41 ASN CB C 471 39.600 39.600 39.656 -0.056 18053
8838 1 14 . 1 1 41 41 ASN H H 471 8.681 8.681 8.808 -0.127 18053
8839 1 14 . 1 1 42 42 SER N N 472 116.446 116.446 117.110 -0.664 18053
8840 1 14 . 1 1 42 42 SER HA H 472 4.719 4.719 4.589 0.130 18053
8841 1 14 . 1 1 42 42 SER C C 472 172.804 172.804 173.460 -0.656 18053
8842 1 14 . 1 1 42 42 SER CA C 472 57.288 57.288 58.459 -1.171 18053
8843 1 14 . 1 1 42 42 SER CB C 472 66.241 66.241 64.314 1.927 18053
8844 1 14 . 1 1 42 42 SER H H 472 8.370 8.370 7.898 0.472 18053
8845 1 14 . 1 1 43 43 ASP N N 473 117.706 117.706 121.644 -3.938 18053
8846 1 14 . 1 1 43 43 ASP HA H 473 4.474 4.474 4.418 0.056 18053
8847 1 14 . 1 1 43 43 ASP C C 473 175.343 175.343 176.049 -0.706 18053
8848 1 14 . 1 1 43 43 ASP CA C 473 53.521 53.521 56.174 -2.653 18053
8849 1 14 . 1 1 43 43 ASP CB C 473 40.322 40.322 40.948 -0.626 18053
8850 1 14 . 1 1 43 43 ASP H H 473 8.254 8.254 8.634 -0.380 18053
8851 1 14 . 1 1 44 44 LYS N N 474 120.209 120.209 119.716 0.493 18053
8852 1 14 . 1 1 44 44 LYS HA H 474 4.569 4.569 4.242 0.327 18053
8853 1 14 . 1 1 44 44 LYS C C 474 175.397 175.397 175.633 -0.236 18053
8854 1 14 . 1 1 44 44 LYS CA C 474 54.012 54.012 55.596 -1.584 18053
8855 1 14 . 1 1 44 44 LYS CB C 474 35.383 35.383 32.993 2.390 18053
8856 1 14 . 1 1 44 44 LYS H H 474 8.305 8.305 7.816 0.489 18053
8857 1 14 . 1 1 45 45 ASP N N 475 124.993 124.993 120.548 4.445 18053
8858 1 14 . 1 1 45 45 ASP HA H 475 3.975 3.975 4.371 -0.396 18053
8859 1 14 . 1 1 45 45 ASP C C 475 174.810 174.810 176.174 -1.364 18053
8860 1 14 . 1 1 45 45 ASP CA C 475 54.995 54.995 54.608 0.387 18053
8861 1 14 . 1 1 45 45 ASP CB C 475 40.364 40.364 41.340 -0.976 18053
8862 1 14 . 1 1 45 45 ASP H H 475 8.722 8.722 8.425 0.297 18053
8863 1 14 . 1 1 46 46 GLN N N 476 120.549 120.549 122.945 -2.396 18053
8864 1 14 . 1 1 46 46 GLN HA H 476 4.436 4.436 4.544 -0.108 18053
8865 1 14 . 1 1 46 46 GLN C C 476 174.019 174.019 174.603 -0.584 18053
8866 1 14 . 1 1 46 46 GLN CA C 476 53.138 53.138 53.681 -0.543 18053
8867 1 14 . 1 1 46 46 GLN CB C 476 31.466 31.466 30.347 1.119 18053
8868 1 14 . 1 1 46 46 GLN H H 476 7.878 7.878 8.266 -0.388 18053
8869 1 14 . 1 1 47 47 SER N N 477 121.537 121.537 122.139 -0.602 18053
8870 1 14 . 1 1 47 47 SER HA H 477 4.229 4.229 4.252 -0.023 18053
8871 1 14 . 1 1 47 47 SER C C 477 174.565 174.565 173.656 0.909 18053
8872 1 14 . 1 1 47 47 SER CA C 477 58.706 58.706 59.182 -0.476 18053
8873 1 14 . 1 1 47 47 SER CB C 477 62.965 62.965 63.117 -0.152 18053
8874 1 14 . 1 1 47 47 SER H H 477 8.748 8.748 8.650 0.098 18053
8875 1 14 . 1 1 48 48 LEU N N 478 127.751 127.751 123.702 4.049 18053
8876 1 14 . 1 1 48 48 LEU HA H 478 2.631 2.631 4.245 -1.614 18053
8877 1 14 . 1 1 48 48 LEU C C 478 176.789 176.789 177.437 -0.648 18053
8878 1 14 . 1 1 48 48 LEU CA C 478 52.102 52.102 53.571 -1.469 18053
8879 1 14 . 1 1 48 48 LEU CB C 478 42.343 42.343 42.872 -0.529 18053
8880 1 14 . 1 1 48 48 LEU H H 478 7.856 7.856 7.886 -0.030 18053
8881 1 14 . 1 1 49 49 GLY N N 479 107.525 107.525 106.919 0.606 18053
8882 1 14 . 1 1 49 49 GLY C C 479 176.653 176.653 174.772 1.881 18053
8883 1 14 . 1 1 49 49 GLY CA C 479 48.062 48.062 45.505 2.558 18053
8884 1 14 . 1 1 49 49 GLY H H 479 7.728 7.728 8.964 -1.236 18053
8885 1 14 . 1 1 50 50 ASN N N 480 117.059 117.059 119.144 -2.085 18053
8886 1 14 . 1 1 50 50 ASN HA H 480 4.255 4.255 4.700 -0.445 18053
8887 1 14 . 1 1 50 50 ASN C C 480 174.961 174.961 175.171 -0.210 18053
8888 1 14 . 1 1 50 50 ASN CA C 480 56.360 56.360 54.358 2.002 18053
8889 1 14 . 1 1 50 50 ASN CB C 480 37.416 37.416 39.162 -1.746 18053
8890 1 14 . 1 1 50 50 ASN H H 480 7.552 7.552 8.705 -1.153 18053
8891 1 14 . 1 1 51 51 TRP N N 481 122.166 122.166 119.301 2.865 18053
8892 1 14 . 1 1 51 51 TRP HA H 481 4.477 4.477 5.185 -0.708 18053
8893 1 14 . 1 1 51 51 TRP C C 481 175.575 175.575 175.659 -0.084 18053
8894 1 14 . 1 1 51 51 TRP CA C 481 58.762 58.762 56.982 1.780 18053
8895 1 14 . 1 1 51 51 TRP CB C 481 28.041 28.041 30.049 -2.008 18053
8896 1 14 . 1 1 51 51 TRP H H 481 8.914 8.914 7.843 1.071 18053
8897 1 14 . 1 1 52 52 ARG N N 482 116.480 116.480 119.009 -2.529 18053
8898 1 14 . 1 1 52 52 ARG HA H 482 5.968 5.968 5.393 0.575 18053
8899 1 14 . 1 1 52 52 ARG C C 482 175.807 175.807 174.957 0.850 18053
8900 1 14 . 1 1 52 52 ARG CA C 482 54.121 54.121 54.164 -0.043 18053
8901 1 14 . 1 1 52 52 ARG CB C 482 35.124 35.124 34.490 0.634 18053
8902 1 14 . 1 1 52 52 ARG H H 482 9.147 9.147 9.168 -0.021 18053
8903 1 14 . 1 1 53 53 ILE N N 483 119.579 119.579 123.976 -4.397 18053
8904 1 14 . 1 1 53 53 ILE HA H 483 4.985 4.985 4.730 0.255 18053
8905 1 14 . 1 1 53 53 ILE C C 483 175.670 175.670 175.781 -0.111 18053
8906 1 14 . 1 1 53 53 ILE CA C 483 60.400 60.400 60.605 -0.205 18053
8907 1 14 . 1 1 53 53 ILE CB C 483 40.227 40.227 38.074 2.153 18053
8908 1 14 . 1 1 53 53 ILE H H 483 9.000 9.000 8.809 0.191 18053
8909 1 14 . 1 1 54 54 LYS N N 484 124.737 124.737 128.495 -3.758 18053
8910 1 14 . 1 1 54 54 LYS HA H 484 5.463 5.463 4.882 0.581 18053
8911 1 14 . 1 1 54 54 LYS C C 484 175.575 175.575 175.894 -0.319 18053
8912 1 14 . 1 1 54 54 LYS CA C 484 54.613 54.613 56.589 -1.976 18053
8913 1 14 . 1 1 54 54 LYS CB C 484 35.041 35.041 33.337 1.704 18053
8914 1 14 . 1 1 54 54 LYS H H 484 9.678 9.678 8.871 0.807 18053
8915 1 14 . 1 1 55 55 ARG N N 485 124.090 124.090 124.383 -0.293 18053
8916 1 14 . 1 1 55 55 ARG HA H 485 5.525 5.525 5.084 0.441 18053
8917 1 14 . 1 1 55 55 ARG C C 485 174.155 174.155 175.064 -0.909 18053
8918 1 14 . 1 1 55 55 ARG CA C 485 53.903 53.903 54.853 -0.950 18053
8919 1 14 . 1 1 55 55 ARG H H 485 9.314 9.314 9.150 0.164 18053
8920 1 14 . 1 1 56 56 GLN N N 486 126.576 126.576 124.434 2.142 18053
8921 1 14 . 1 1 56 56 GLN HA H 486 4.842 4.842 4.941 -0.099 18053
8922 1 14 . 1 1 56 56 GLN C C 486 174.991 174.991 174.882 0.109 18053
8923 1 14 . 1 1 56 56 GLN CA C 486 54.831 54.831 54.022 0.809 18053
8924 1 14 . 1 1 56 56 GLN CB C 486 31.465 31.465 28.438 3.027 18053
8925 1 14 . 1 1 56 56 GLN H H 486 8.831 8.831 8.257 0.574 18053
8926 1 14 . 1 1 57 57 VAL N N 487 126.712 126.712 125.543 1.169 18053
8927 1 14 . 1 1 57 57 VAL HA H 487 4.266 4.266 4.233 0.033 18053
8928 1 14 . 1 1 57 57 VAL C C 487 175.916 175.916 177.873 -1.957 18053
8929 1 14 . 1 1 57 57 VAL CA C 487 61.820 61.820 62.545 -0.725 18053
8930 1 14 . 1 1 57 57 VAL CB C 487 32.803 32.803 32.408 0.395 18053
8931 1 14 . 1 1 57 57 VAL H H 487 8.786 8.786 8.631 0.155 18053
8932 1 14 . 1 1 58 58 LEU N N 488 127.274 127.274 124.388 2.886 18053
8933 1 14 . 1 1 58 58 LEU HA H 488 4.085 4.085 4.157 -0.072 18053
8934 1 14 . 1 1 58 58 LEU C C 488 177.158 177.158 177.729 -0.571 18053
8935 1 14 . 1 1 58 58 LEU CA C 488 56.906 56.906 57.666 -0.760 18053
8936 1 14 . 1 1 58 58 LEU CB C 488 41.374 41.374 41.761 -0.387 18053
8937 1 14 . 1 1 58 58 LEU H H 488 8.316 8.316 8.489 -0.173 18053
8938 1 14 . 1 1 59 59 GLU N N 489 119.647 119.647 118.151 1.496 18053
8939 1 14 . 1 1 59 59 GLU HA H 489 4.112 4.112 4.228 -0.116 18053
8940 1 14 . 1 1 59 59 GLU C C 489 176.230 176.230 177.131 -0.901 18053
8941 1 14 . 1 1 59 59 GLU CA C 489 57.015 57.015 56.782 0.233 18053
8942 1 14 . 1 1 59 59 GLU CB C 489 28.149 28.149 29.693 -1.544 18053
8943 1 14 . 1 1 59 59 GLU H H 489 8.636 8.636 8.041 0.595 18053
8944 1 14 . 1 1 60 60 GLY N N 490 108.819 108.819 107.948 0.871 18053
8945 1 14 . 1 1 60 60 GLY C C 490 173.568 173.568 173.703 -0.135 18053
8946 1 14 . 1 1 60 60 GLY CA C 490 44.773 44.773 44.867 -0.094 18053
8947 1 14 . 1 1 60 60 GLY H H 490 8.160 8.160 7.777 0.383 18053
8948 1 14 . 1 1 61 61 GLU N N 491 121.009 121.009 123.192 -2.183 18053
8949 1 14 . 1 1 61 61 GLU HA H 491 4.323 4.323 4.231 0.092 18053
8950 1 14 . 1 1 61 61 GLU C C 491 175.725 175.725 175.530 0.195 18053
8951 1 14 . 1 1 61 61 GLU CA C 491 56.196 56.196 56.644 -0.448 18053
8952 1 14 . 1 1 61 61 GLU CB C 491 30.865 30.865 29.171 1.694 18053
8953 1 14 . 1 1 61 61 GLU H H 491 8.320 8.320 8.578 -0.258 18053
8954 1 14 . 1 1 62 62 GLU N N 492 123.426 123.426 124.566 -1.140 18053
8955 1 14 . 1 1 62 62 GLU HA H 492 5.054 5.054 5.049 0.005 18053
8956 1 14 . 1 1 62 62 GLU C C 492 175.930 175.930 176.145 -0.215 18053
8957 1 14 . 1 1 62 62 GLU CA C 492 55.650 55.650 54.790 0.860 18053
8958 1 14 . 1 1 62 62 GLU CB C 492 32.312 32.312 30.858 1.454 18053
8959 1 14 . 1 1 62 62 GLU H H 492 8.594 8.594 8.437 0.157 18053
8960 1 14 . 1 1 63 63 ILE N N 493 119.732 119.732 118.197 1.535 18053
8961 1 14 . 1 1 63 63 ILE HA H 493 4.788 4.788 4.847 -0.059 18053
8962 1 14 . 1 1 63 63 ILE C C 493 174.647 174.647 174.168 0.479 18053
8963 1 14 . 1 1 63 63 ILE CA C 493 60.181 60.181 59.328 0.853 18053
8964 1 14 . 1 1 63 63 ILE CB C 493 41.183 41.183 41.890 -0.707 18053
8965 1 14 . 1 1 63 63 ILE H H 493 8.523 8.523 8.159 0.364 18053
8966 1 14 . 1 1 64 64 ALA N N 494 122.166 122.166 126.550 -4.384 18053
8967 1 14 . 1 1 64 64 ALA HA H 494 5.521 5.521 5.069 0.452 18053
8968 1 14 . 1 1 64 64 ALA C C 494 174.606 174.606 176.223 -1.617 18053
8969 1 14 . 1 1 64 64 ALA CA C 494 51.528 51.528 50.893 0.635 18053
8970 1 14 . 1 1 64 64 ALA CB C 494 22.239 22.239 20.522 1.717 18053
8971 1 14 . 1 1 64 64 ALA H H 494 8.741 8.741 8.690 0.051 18053
8972 1 14 . 1 1 65 65 TYR N N 495 126.729 126.729 126.738 -0.009 18053
8973 1 14 . 1 1 65 65 TYR HA H 495 3.094 3.094 3.604 -0.510 18053
8974 1 14 . 1 1 65 65 TYR C C 495 173.036 173.036 174.432 -1.396 18053
8975 1 14 . 1 1 65 65 TYR CA C 495 56.905 56.905 57.129 -0.224 18053
8976 1 14 . 1 1 65 65 TYR CB C 495 40.269 40.269 38.835 1.434 18053
8977 1 14 . 1 1 65 65 TYR H H 495 8.462 8.462 8.549 -0.087 18053
8978 1 14 . 1 1 66 66 LYS N N 496 128.108 128.108 127.846 0.262 18053
8979 1 14 . 1 1 66 66 LYS HA H 496 4.822 4.822 4.518 0.304 18053
8980 1 14 . 1 1 66 66 LYS C C 496 174.906 174.906 174.986 -0.080 18053
8981 1 14 . 1 1 66 66 LYS CA C 496 53.739 53.739 54.756 -1.017 18053
8982 1 14 . 1 1 66 66 LYS CB C 496 34.782 34.782 32.501 2.281 18053
8983 1 14 . 1 1 66 66 LYS H H 496 7.010 7.010 7.232 -0.222 18053
8984 1 14 . 1 1 67 67 PHE N N 497 125.299 125.299 123.455 1.844 18053
8985 1 14 . 1 1 67 67 PHE HA H 497 3.932 3.932 4.121 -0.189 18053
8986 1 14 . 1 1 67 67 PHE C C 497 177.990 177.990 175.747 2.243 18053
8987 1 14 . 1 1 67 67 PHE CA C 497 59.007 59.007 58.968 0.039 18053
8988 1 14 . 1 1 67 67 PHE CB C 497 40.981 40.981 39.833 1.148 18053
8989 1 14 . 1 1 67 67 PHE H H 497 8.509 8.509 8.288 0.221 18053
8990 1 14 . 1 1 68 68 THR N N 498 116.191 116.191 111.836 4.355 18053
8991 1 14 . 1 1 68 68 THR HA H 498 4.417 4.417 4.523 -0.106 18053
8992 1 14 . 1 1 68 68 THR CA C 498 60.855 60.855 59.788 1.067 18053
8993 1 14 . 1 1 68 68 THR CB C 498 68.019 68.019 69.347 -1.327 18053
8994 1 14 . 1 1 68 68 THR H H 498 8.688 8.688 8.340 0.348 18053
8995 1 14 . 1 1 69 69 PRO HA H 499 3.948 3.948 4.617 -0.669 18053
8996 1 14 . 1 1 69 69 PRO C C 499 177.444 177.444 176.794 0.650 18053
8997 1 14 . 1 1 69 69 PRO CA C 499 66.077 66.077 64.409 1.669 18053
8998 1 14 . 1 1 69 69 PRO CB C 499 32.776 32.776 31.895 0.881 18053
8999 1 14 . 1 1 70 70 LYS N N 500 113.552 113.552 115.534 -1.982 18053
9000 1 14 . 1 1 70 70 LYS HA H 500 4.385 4.385 4.252 0.133 18053
9001 1 14 . 1 1 70 70 LYS C C 500 176.325 176.325 175.724 0.601 18053
9002 1 14 . 1 1 70 70 LYS CA C 500 54.995 54.995 56.110 -1.115 18053
9003 1 14 . 1 1 70 70 LYS CB C 500 31.793 31.793 32.270 -0.477 18053
9004 1 14 . 1 1 70 70 LYS H H 500 8.016 8.016 8.120 -0.104 18053
9005 1 14 . 1 1 71 71 TYR N N 501 121.860 121.860 122.589 -0.729 18053
9006 1 14 . 1 1 71 71 TYR HA H 501 3.730 3.730 4.464 -0.734 18053
9007 1 14 . 1 1 71 71 TYR C C 501 174.838 174.838 173.580 1.258 18053
9008 1 14 . 1 1 71 71 TYR CA C 501 62.310 62.310 58.367 3.943 18053
9009 1 14 . 1 1 71 71 TYR CB C 501 38.781 38.781 39.071 -0.290 18053
9010 1 14 . 1 1 71 71 TYR H H 501 7.460 7.460 7.754 -0.294 18053
9011 1 14 . 1 1 72 72 ILE N N 502 129.487 129.487 127.315 2.172 18053
9012 1 14 . 1 1 72 72 ILE HA H 502 3.928 3.928 3.988 -0.060 18053
9013 1 14 . 1 1 72 72 ILE C C 502 172.968 172.968 173.972 -1.004 18053
9014 1 14 . 1 1 72 72 ILE CA C 502 59.308 59.308 59.639 -0.332 18053
9015 1 14 . 1 1 72 72 ILE CB C 502 40.910 40.910 39.769 1.141 18053
9016 1 14 . 1 1 72 72 ILE H H 502 7.168 7.168 8.166 -0.998 18053
9017 1 14 . 1 1 73 73 LEU N N 503 128.278 128.278 128.841 -0.563 18053
9018 1 14 . 1 1 73 73 LEU HA H 503 4.493 4.493 4.284 0.209 18053
9019 1 14 . 1 1 73 73 LEU C C 503 175.834 175.834 175.201 0.633 18053
9020 1 14 . 1 1 73 73 LEU CA C 503 51.965 51.965 53.315 -1.349 18053
9021 1 14 . 1 1 73 73 LEU CB C 503 42.548 42.548 42.688 -0.140 18053
9022 1 14 . 1 1 73 73 LEU H H 503 8.483 8.483 8.220 0.263 18053
9023 1 14 . 1 1 74 74 ARG N N 504 129.589 129.589 126.029 3.560 18053
9024 1 14 . 1 1 74 74 ARG HA H 504 3.743 3.743 4.266 -0.523 18053
9025 1 14 . 1 1 74 74 ARG C C 504 175.233 175.233 175.739 -0.506 18053
9026 1 14 . 1 1 74 74 ARG CA C 504 56.851 56.851 55.003 1.848 18053
9027 1 14 . 1 1 74 74 ARG CB C 504 30.292 30.292 31.202 -0.910 18053
9028 1 14 . 1 1 74 74 ARG H H 504 8.673 8.673 8.563 0.110 18053
9029 1 14 . 1 1 75 75 ALA N N 505 123.205 123.205 127.920 -4.715 18053
9030 1 14 . 1 1 75 75 ALA HA H 505 3.522 3.522 4.113 -0.591 18053
9031 1 14 . 1 1 75 75 ALA C C 505 178.441 178.441 177.419 1.022 18053
9032 1 14 . 1 1 75 75 ALA CA C 505 53.794 53.794 53.300 0.494 18053
9033 1 14 . 1 1 75 75 ALA CB C 505 18.910 18.910 18.255 0.655 18053
9034 1 14 . 1 1 75 75 ALA H H 505 8.564 8.564 8.353 0.211 18053
9035 1 14 . 1 1 76 76 GLY N N 506 112.241 112.241 111.605 0.636 18053
9036 1 14 . 1 1 76 76 GLY C C 506 174.278 174.278 174.785 -0.507 18053
9037 1 14 . 1 1 76 76 GLY CA C 506 46.725 46.725 45.028 1.697 18053
9038 1 14 . 1 1 76 76 GLY H H 506 7.381 7.381 8.553 -1.172 18053
9039 1 14 . 1 1 77 77 GLN N N 507 117.382 117.382 120.033 -2.651 18053
9040 1 14 . 1 1 77 77 GLN HA H 507 4.364 4.364 4.561 -0.197 18053
9041 1 14 . 1 1 77 77 GLN C C 507 173.937 173.937 174.457 -0.520 18053
9042 1 14 . 1 1 77 77 GLN CA C 507 54.558 54.558 54.833 -0.275 18053
9043 1 14 . 1 1 77 77 GLN CB C 507 30.073 30.073 30.334 -0.261 18053
9044 1 14 . 1 1 77 77 GLN H H 507 7.996 7.996 7.817 0.179 18053
9045 1 14 . 1 1 78 78 MET N N 508 116.957 116.957 114.662 2.295 18053
9046 1 14 . 1 1 78 78 MET HA H 508 5.388 5.388 4.793 0.595 18053
9047 1 14 . 1 1 78 78 MET C C 508 175.807 175.807 173.809 1.998 18053
9048 1 14 . 1 1 78 78 MET CA C 508 54.067 54.067 54.990 -0.923 18053
9049 1 14 . 1 1 78 78 MET CB C 508 37.198 37.198 36.677 0.521 18053
9050 1 14 . 1 1 78 78 MET H H 508 8.092 8.092 8.223 -0.131 18053
9051 1 14 . 1 1 79 79 VAL N N 509 119.340 119.340 122.075 -2.735 18053
9052 1 14 . 1 1 79 79 VAL HA H 509 4.956 4.956 4.797 0.159 18053
9053 1 14 . 1 1 79 79 VAL C C 509 172.217 172.217 174.646 -2.429 18053
9054 1 14 . 1 1 79 79 VAL CA C 509 59.471 59.471 60.279 -0.808 18053
9055 1 14 . 1 1 79 79 VAL CB C 509 33.676 33.676 35.134 -1.458 18053
9056 1 14 . 1 1 79 79 VAL H H 509 8.534 8.534 8.459 0.075 18053
9057 1 14 . 1 1 80 80 THR N N 510 124.533 124.533 126.383 -1.850 18053
9058 1 14 . 1 1 80 80 THR HA H 510 4.586 4.586 5.018 -0.432 18053
9059 1 14 . 1 1 80 80 THR C C 510 172.215 172.215 173.509 -1.294 18053
9060 1 14 . 1 1 80 80 THR CA C 510 62.119 62.119 61.403 0.716 18053
9061 1 14 . 1 1 80 80 THR CB C 510 69.407 69.407 69.204 0.203 18053
9062 1 14 . 1 1 80 80 THR H H 510 8.301 8.301 8.982 -0.681 18053
9063 1 14 . 1 1 81 81 VAL N N 511 127.002 127.002 127.339 -0.337 18053
9064 1 14 . 1 1 81 81 VAL HA H 511 4.596 4.596 4.533 0.063 18053
9065 1 14 . 1 1 81 81 VAL C C 511 176.667 176.667 175.171 1.496 18053
9066 1 14 . 1 1 81 81 VAL CA C 511 61.382 61.382 61.180 0.202 18053
9067 1 14 . 1 1 81 81 VAL CB C 511 30.945 30.945 30.666 0.279 18053
9068 1 14 . 1 1 81 81 VAL H H 511 8.796 8.796 8.662 0.134 18053
9069 1 14 . 1 1 82 82 TRP N N 512 131.479 131.479 128.845 2.634 18053
9070 1 14 . 1 1 82 82 TRP HA H 512 5.338 5.338 5.160 0.178 18053
9071 1 14 . 1 1 82 82 TRP C C 512 176.885 176.885 174.840 2.045 18053
9072 1 14 . 1 1 82 82 TRP CA C 512 56.442 56.442 56.134 0.308 18053
9073 1 14 . 1 1 82 82 TRP CB C 512 30.701 30.701 31.999 -1.298 18053
9074 1 14 . 1 1 82 82 TRP H H 512 9.924 9.924 9.001 0.923 18053
9075 1 14 . 1 1 83 83 ALA N N 513 123.954 123.954 120.838 3.116 18053
9076 1 14 . 1 1 83 83 ALA HA H 513 4.308 4.308 4.717 -0.409 18053
9077 1 14 . 1 1 83 83 ALA C C 513 178.140 178.140 178.533 -0.393 18053
9078 1 14 . 1 1 83 83 ALA CA C 513 52.211 52.211 50.928 1.283 18053
9079 1 14 . 1 1 83 83 ALA CB C 513 18.745 18.745 20.072 -1.327 18053
9080 1 14 . 1 1 83 83 ALA H H 513 9.048 9.048 8.511 0.537 18053
9081 1 14 . 1 1 84 84 ALA N N 514 125.146 125.146 125.906 -0.760 18053
9082 1 14 . 1 1 84 84 ALA HA H 514 3.951 3.951 4.068 -0.117 18053
9083 1 14 . 1 1 84 84 ALA C C 514 179.519 179.519 178.759 0.760 18053
9084 1 14 . 1 1 84 84 ALA CA C 514 54.804 54.804 54.868 -0.064 18053
9085 1 14 . 1 1 84 84 ALA CB C 514 18.582 18.582 18.982 -0.400 18053
9086 1 14 . 1 1 84 84 ALA H H 514 8.341 8.341 8.434 -0.093 18053
9087 1 14 . 1 1 85 85 GLY N N 515 103.388 103.388 104.972 -1.584 18053
9088 1 14 . 1 1 85 85 GLY C C 515 174.674 174.674 174.435 0.239 18053
9089 1 14 . 1 1 85 85 GLY CA C 515 45.878 45.878 45.046 0.832 18053
9090 1 14 . 1 1 85 85 GLY H H 515 7.996 7.996 7.897 0.099 18053
9091 1 14 . 1 1 86 86 ALA N N 516 120.140 120.140 123.458 -3.318 18053
9092 1 14 . 1 1 86 86 ALA HA H 516 4.344 4.344 4.646 -0.302 18053
9093 1 14 . 1 1 86 86 ALA C C 516 177.690 177.690 178.190 -0.500 18053
9094 1 14 . 1 1 86 86 ALA CA C 516 53.139 53.139 51.828 1.311 18053
9095 1 14 . 1 1 86 86 ALA CB C 516 20.547 20.547 19.242 1.305 18053
9096 1 14 . 1 1 86 86 ALA H H 516 7.474 7.474 7.291 0.183 18053
9097 1 14 . 1 1 87 87 GLY N N 517 105.720 105.720 107.544 -1.824 18053
9098 1 14 . 1 1 87 87 GLY C C 517 173.650 173.650 174.624 -0.974 18053
9099 1 14 . 1 1 87 87 GLY CA C 517 46.014 46.014 45.401 0.613 18053
9100 1 14 . 1 1 87 87 GLY H H 517 7.779 7.779 7.928 -0.149 18053
9101 1 14 . 1 1 88 88 VAL N N 518 121.537 121.537 119.494 2.043 18053
9102 1 14 . 1 1 88 88 VAL HA H 518 3.585 3.585 4.054 -0.469 18053
9103 1 14 . 1 1 88 88 VAL C C 518 174.851 174.851 175.076 -0.225 18053
9104 1 14 . 1 1 88 88 VAL CA C 518 61.274 61.274 60.953 0.320 18053
9105 1 14 . 1 1 88 88 VAL CB C 518 33.376 33.376 33.118 0.258 18053
9106 1 14 . 1 1 88 88 VAL H H 518 7.499 7.499 7.664 -0.165 18053
9107 1 14 . 1 1 89 89 ALA N N 519 128.295 128.295 129.579 -1.284 18053
9108 1 14 . 1 1 89 89 ALA HA H 519 4.192 4.192 4.363 -0.171 18053
9109 1 14 . 1 1 89 89 ALA C C 519 176.680 176.680 176.595 0.085 18053
9110 1 14 . 1 1 89 89 ALA CA C 519 51.283 51.283 51.350 -0.067 18053
9111 1 14 . 1 1 89 89 ALA CB C 519 19.292 19.292 19.120 0.172 18053
9112 1 14 . 1 1 89 89 ALA H H 519 7.960 7.960 8.064 -0.104 18053
9113 1 14 . 1 1 90 90 HIS N N 520 122.643 122.643 124.609 -1.966 18053
9114 1 14 . 1 1 90 90 HIS HA H 520 4.033 4.033 4.327 -0.294 18053
9115 1 14 . 1 1 90 90 HIS C C 520 175.793 175.793 174.344 1.449 18053
9116 1 14 . 1 1 90 90 HIS CA C 520 58.653 58.653 56.076 2.577 18053
9117 1 14 . 1 1 90 90 HIS CB C 520 32.285 32.285 29.662 2.623 18053
9118 1 14 . 1 1 90 90 HIS H H 520 8.394 8.394 8.894 -0.500 18053
9119 1 14 . 1 1 91 91 SER N N 521 121.247 121.247 124.066 -2.819 18053
9120 1 14 . 1 1 91 91 SER HA H 521 4.629 4.629 4.669 -0.040 18053
9121 1 14 . 1 1 91 91 SER CA C 521 55.843 55.843 55.971 -0.128 18053
9122 1 14 . 1 1 91 91 SER CB C 521 62.367 62.367 63.608 -1.241 18053
9123 1 14 . 1 1 91 91 SER H H 521 8.569 8.569 8.311 0.258 18053
9124 1 14 . 1 1 92 92 PRO HA H 522 4.002 4.002 4.627 -0.625 18053
9125 1 14 . 1 1 92 92 PRO CA C 522 62.244 62.244 62.499 -0.255 18053
9126 1 14 . 1 1 92 92 PRO CB C 522 30.931 30.931 31.337 -0.406 18053
9127 1 14 . 1 1 93 93 PRO HA H 523 4.672 4.672 4.856 -0.184 18053
9128 1 14 . 1 1 93 93 PRO C C 523 177.786 177.786 177.681 0.105 18053
9129 1 14 . 1 1 93 93 PRO CA C 523 64.003 64.003 63.745 0.258 18053
9130 1 14 . 1 1 93 93 PRO CB C 523 34.905 34.905 32.625 2.280 18053
9131 1 14 . 1 1 94 94 SER N N 524 117.212 117.212 117.465 -0.253 18053
9132 1 14 . 1 1 94 94 SER HA H 524 4.678 4.678 4.646 0.032 18053
9133 1 14 . 1 1 94 94 SER C C 524 174.851 174.851 174.763 0.088 18053
9134 1 14 . 1 1 94 94 SER CA C 524 61.874 61.874 61.175 0.699 18053
9135 1 14 . 1 1 94 94 SER CB C 524 64.057 64.057 64.030 0.027 18053
9136 1 14 . 1 1 94 94 SER H H 524 8.463 8.463 7.906 0.557 18053
9137 1 14 . 1 1 95 95 THR N N 525 121.588 121.588 119.913 1.675 18053
9138 1 14 . 1 1 95 95 THR HA H 525 4.859 4.859 4.820 0.039 18053
9139 1 14 . 1 1 95 95 THR C C 525 172.094 172.094 173.080 -0.986 18053
9140 1 14 . 1 1 95 95 THR CA C 525 62.309 62.309 62.327 -0.018 18053
9141 1 14 . 1 1 95 95 THR CB C 525 70.281 70.281 68.620 1.661 18053
9142 1 14 . 1 1 95 95 THR H H 525 7.631 7.631 8.043 -0.412 18053
9143 1 14 . 1 1 96 96 LEU N N 526 127.274 127.274 128.875 -1.601 18053
9144 1 14 . 1 1 96 96 LEU HA H 526 5.131 5.131 4.762 0.369 18053
9145 1 14 . 1 1 96 96 LEU C C 526 175.916 175.916 175.651 0.265 18053
9146 1 14 . 1 1 96 96 LEU CA C 526 52.075 52.075 54.671 -2.596 18053
9147 1 14 . 1 1 96 96 LEU CB C 526 43.790 43.790 43.501 0.289 18053
9148 1 14 . 1 1 96 96 LEU H H 526 8.977 8.977 8.116 0.861 18053
9149 1 14 . 1 1 97 97 VAL N N 527 124.056 124.056 120.845 3.211 18053
9150 1 14 . 1 1 97 97 VAL HA H 527 4.869 4.869 4.417 0.452 18053
9151 1 14 . 1 1 97 97 VAL C C 527 176.230 176.230 175.069 1.161 18053
9152 1 14 . 1 1 97 97 VAL CA C 527 61.519 61.519 60.936 0.583 18053
9153 1 14 . 1 1 97 97 VAL CB C 527 33.704 33.704 34.438 -0.735 18053
9154 1 14 . 1 1 97 97 VAL H H 527 10.724 10.724 7.813 2.911 18053
9155 1 14 . 1 1 98 98 TRP N N 528 132.586 132.586 130.473 2.113 18053
9156 1 14 . 1 1 98 98 TRP HA H 528 4.965 4.965 4.583 0.382 18053
9157 1 14 . 1 1 98 98 TRP C C 528 173.391 173.391 174.678 -1.287 18053
9158 1 14 . 1 1 98 98 TRP CA C 528 53.303 53.303 54.727 -1.424 18053
9159 1 14 . 1 1 98 98 TRP CB C 528 28.245 28.245 28.360 -0.115 18053
9160 1 14 . 1 1 98 98 TRP H H 528 9.400 9.400 8.337 1.063 18053
9161 1 14 . 1 1 99 99 LYS N N 529 126.644 126.644 129.214 -2.570 18053
9162 1 14 . 1 1 99 99 LYS HA H 529 3.839 3.839 4.065 -0.226 18053
9163 1 14 . 1 1 99 99 LYS C C 529 177.581 177.581 176.918 0.663 18053
9164 1 14 . 1 1 99 99 LYS CA C 529 58.543 58.543 57.363 1.180 18053
9165 1 14 . 1 1 99 99 LYS CB C 529 32.176 32.176 31.735 0.441 18053
9166 1 14 . 1 1 99 99 LYS H H 529 8.153 8.153 8.068 0.085 18053
9167 1 14 . 1 1 100 100 GLY N N 530 110.385 110.385 114.019 -3.634 18053
9168 1 14 . 1 1 100 100 GLY C C 530 172.367 172.367 173.627 -1.260 18053
9169 1 14 . 1 1 100 100 GLY CA C 530 45.278 45.278 44.819 0.459 18053
9170 1 14 . 1 1 100 100 GLY H H 530 8.363 8.363 8.501 -0.138 18053
9171 1 14 . 1 1 101 101 GLN N N 531 121.162 121.162 122.371 -1.209 18053
9172 1 14 . 1 1 101 101 GLN HA H 531 3.972 3.972 4.152 -0.180 18053
9173 1 14 . 1 1 101 101 GLN CA C 531 52.620 52.620 54.011 -1.391 18053
9174 1 14 . 1 1 101 101 GLN CB C 531 27.595 27.595 27.560 0.035 18053
9175 1 14 . 1 1 101 101 GLN H H 531 6.815 6.815 7.531 -0.716 18053
9176 1 14 . 1 1 102 102 SER N N 532 122.728 122.728 122.329 0.399 18053
9177 1 14 . 1 1 102 102 SER HA H 532 3.866 3.866 4.219 -0.353 18053
9178 1 14 . 1 1 102 102 SER C C 532 174.537 174.537 175.793 -1.256 18053
9179 1 14 . 1 1 102 102 SER CA C 532 61.983 61.983 62.008 -0.025 18053
9180 1 14 . 1 1 102 102 SER CB C 532 62.802 62.802 62.878 -0.076 18053
9181 1 14 . 1 1 102 102 SER H H 532 8.662 8.662 8.257 0.405 18053
9182 1 14 . 1 1 103 103 SER N N 533 110.811 110.811 116.267 -5.456 18053
9183 1 14 . 1 1 103 103 SER HA H 533 4.240 4.240 4.284 -0.044 18053
9184 1 14 . 1 1 103 103 SER C C 533 174.087 174.087 174.866 -0.779 18053
9185 1 14 . 1 1 103 103 SER CA C 533 56.633 56.633 58.271 -1.638 18053
9186 1 14 . 1 1 103 103 SER CB C 533 64.658 64.658 63.252 1.406 18053
9187 1 14 . 1 1 103 103 SER H H 533 7.134 7.134 8.164 -1.030 18053
9188 1 14 . 1 1 104 104 TRP N N 534 126.133 126.133 121.849 4.284 18053
9189 1 14 . 1 1 104 104 TRP HA H 534 4.098 4.098 4.142 -0.044 18053
9190 1 14 . 1 1 104 104 TRP C C 534 176.066 176.066 175.705 0.361 18053
9191 1 14 . 1 1 104 104 TRP CA C 534 60.127 60.127 56.800 3.327 18053
9192 1 14 . 1 1 104 104 TRP CB C 534 28.764 28.764 28.338 0.426 18053
9193 1 14 . 1 1 104 104 TRP H H 534 9.764 9.764 8.192 1.572 18053
9194 1 14 . 1 1 105 105 GLY N N 535 105.907 105.907 105.208 0.699 18053
9195 1 14 . 1 1 105 105 GLY C C 535 172.217 172.217 173.170 -0.953 18053
9196 1 14 . 1 1 105 105 GLY CA C 535 44.240 44.240 44.873 -0.632 18053
9197 1 14 . 1 1 105 105 GLY H H 535 8.095 8.095 7.532 0.563 18053
9198 1 14 . 1 1 106 106 THR N N 536 111.253 111.253 112.280 -1.027 18053
9199 1 14 . 1 1 106 106 THR HA H 536 3.859 3.859 4.641 -0.782 18053
9200 1 14 . 1 1 106 106 THR C C 536 172.872 172.872 174.041 -1.169 18053
9201 1 14 . 1 1 106 106 THR CA C 536 59.635 59.635 61.191 -1.556 18053
9202 1 14 . 1 1 106 106 THR CB C 536 70.526 70.526 69.448 1.078 18053
9203 1 14 . 1 1 106 106 THR H H 536 7.913 7.913 7.692 0.221 18053
9204 1 14 . 1 1 107 107 GLY N N 537 107.712 107.712 113.827 -6.115 18053
9205 1 14 . 1 1 107 107 GLY C C 537 172.709 172.709 172.890 -0.181 18053
9206 1 14 . 1 1 107 107 GLY CA C 537 45.166 45.166 44.741 0.425 18053
9207 1 14 . 1 1 107 107 GLY H H 537 7.533 7.533 7.963 -0.430 18053
9208 1 14 . 1 1 108 108 GLU N N 538 118.864 118.864 118.225 0.639 18053
9209 1 14 . 1 1 108 108 GLU HA H 538 4.136 4.136 4.219 -0.083 18053
9210 1 14 . 1 1 108 108 GLU C C 538 176.353 176.353 175.474 0.879 18053
9211 1 14 . 1 1 108 108 GLU CA C 538 58.352 58.352 58.097 0.255 18053
9212 1 14 . 1 1 108 108 GLU CB C 538 30.156 30.156 30.146 0.010 18053
9213 1 14 . 1 1 108 108 GLU H H 538 8.558 8.558 8.763 -0.205 18053
9214 1 14 . 1 1 109 109 SER N N 539 110.419 110.419 111.848 -1.429 18053
9215 1 14 . 1 1 109 109 SER HA H 539 4.963 4.963 4.881 0.082 18053
9216 1 14 . 1 1 109 109 SER C C 539 173.787 173.787 172.549 1.238 18053
9217 1 14 . 1 1 109 109 SER CA C 539 57.125 57.125 57.073 0.052 18053
9218 1 14 . 1 1 109 109 SER CB C 539 64.439 64.439 64.564 -0.125 18053
9219 1 14 . 1 1 109 109 SER H H 539 7.620 7.620 7.600 0.020 18053
9220 1 14 . 1 1 110 110 PHE N N 540 118.778 118.778 119.262 -0.484 18053
9221 1 14 . 1 1 110 110 PHE HA H 540 5.081 5.081 5.316 -0.235 18053
9222 1 14 . 1 1 110 110 PHE C C 540 176.052 176.052 173.218 2.834 18053
9223 1 14 . 1 1 110 110 PHE CA C 540 56.789 56.789 55.819 0.970 18053
9224 1 14 . 1 1 110 110 PHE CB C 540 40.760 40.760 42.438 -1.678 18053
9225 1 14 . 1 1 110 110 PHE H H 540 8.318 8.318 8.333 -0.015 18053
9226 1 14 . 1 1 112 112 THR HA H 542 5.468 5.468 5.240 0.228 18053
9227 1 14 . 1 1 112 112 THR C C 542 172.381 172.381 173.571 -1.190 18053
9228 1 14 . 1 1 112 112 THR CA C 542 61.818 61.818 62.440 -0.622 18053
9229 1 14 . 1 1 112 112 THR CB C 542 70.990 70.990 69.709 1.281 18053
9230 1 14 . 1 1 113 113 VAL N N 543 124.771 124.771 128.223 -3.452 18053
9231 1 14 . 1 1 113 113 VAL HA H 543 4.864 4.864 4.638 0.226 18053
9232 1 14 . 1 1 113 113 VAL C C 543 173.132 173.132 174.009 -0.877 18053
9233 1 14 . 1 1 113 113 VAL CA C 543 60.099 60.099 60.932 -0.833 18053
9234 1 14 . 1 1 113 113 VAL CB C 543 36.433 36.433 34.442 1.991 18053
9235 1 14 . 1 1 113 113 VAL H H 543 9.380 9.380 9.120 0.260 18053
9236 1 14 . 1 1 114 114 LEU N N 544 128.789 128.789 130.991 -2.202 18053
9237 1 14 . 1 1 114 114 LEU HA H 544 5.320 5.320 5.252 0.068 18053
9238 1 14 . 1 1 114 114 LEU C C 544 174.237 174.237 175.044 -0.807 18053
9239 1 14 . 1 1 114 114 LEU CA C 544 53.193 53.193 53.836 -0.643 18053
9240 1 14 . 1 1 114 114 LEU CB C 544 45.879 45.879 43.045 2.834 18053
9241 1 14 . 1 1 114 114 LEU H H 544 8.948 8.948 8.335 0.613 18053
9242 1 14 . 1 1 115 115 VAL N N 545 127.002 127.002 127.045 -0.043 18053
9243 1 14 . 1 1 115 115 VAL HA H 545 4.854 4.854 4.426 0.428 18053
9244 1 14 . 1 1 115 115 VAL C C 545 175.206 175.206 175.067 0.139 18053
9245 1 14 . 1 1 115 115 VAL CA C 545 59.334 59.334 60.164 -0.830 18053
9246 1 14 . 1 1 115 115 VAL CB C 545 34.495 34.495 33.534 0.961 18053
9247 1 14 . 1 1 115 115 VAL H H 545 9.564 9.564 8.586 0.978 18053
9248 1 14 . 1 1 116 116 ASN N N 546 121.179 121.179 122.622 -1.443 18053
9249 1 14 . 1 1 116 116 ASN HA H 546 2.897 2.897 3.844 -0.947 18053
9250 1 14 . 1 1 116 116 ASN C C 546 176.885 176.885 174.768 2.117 18053
9251 1 14 . 1 1 116 116 ASN CA C 546 50.409 50.409 51.178 -0.769 18053
9252 1 14 . 1 1 116 116 ASN CB C 546 36.639 36.639 39.950 -3.311 18053
9253 1 14 . 1 1 116 116 ASN H H 546 8.016 8.016 7.740 0.276 18053
9254 1 14 . 1 1 117 117 ALA N N 547 119.834 119.834 121.123 -1.289 18053
9255 1 14 . 1 1 117 117 ALA HA H 547 3.866 3.866 3.987 -0.121 18053
9256 1 14 . 1 1 117 117 ALA C C 547 177.772 177.772 178.176 -0.404 18053
9257 1 14 . 1 1 117 117 ALA CA C 547 54.504 54.504 54.391 0.114 18053
9258 1 14 . 1 1 117 117 ALA CB C 547 18.200 18.200 18.641 -0.441 18053
9259 1 14 . 1 1 117 117 ALA H H 547 6.444 6.444 8.145 -1.701 18053
9260 1 14 . 1 1 118 118 ASP N N 548 115.646 115.646 117.739 -2.093 18053
9261 1 14 . 1 1 118 118 ASP HA H 548 4.644 4.644 4.388 0.256 18053
9262 1 14 . 1 1 118 118 ASP C C 548 176.052 176.052 177.582 -1.530 18053
9263 1 14 . 1 1 118 118 ASP CA C 548 54.067 54.067 55.221 -1.154 18053
9264 1 14 . 1 1 118 118 ASP CB C 548 41.674 41.674 41.307 0.367 18053
9265 1 14 . 1 1 118 118 ASP H H 548 7.181 7.181 8.122 -0.941 18053
9266 1 14 . 1 1 119 119 GLY N N 549 107.167 107.167 107.402 -0.235 18053
9267 1 14 . 1 1 119 119 GLY C C 549 173.841 173.841 173.825 0.016 18053
9268 1 14 . 1 1 119 119 GLY CA C 549 45.455 45.455 44.684 0.771 18053
9269 1 14 . 1 1 119 119 GLY H H 549 7.738 7.738 7.615 0.123 18053
9270 1 14 . 1 1 120 120 GLU N N 550 121.196 121.196 121.324 -0.128 18053
9271 1 14 . 1 1 120 120 GLU HA H 550 4.112 4.112 4.237 -0.125 18053
9272 1 14 . 1 1 120 120 GLU C C 550 175.588 175.588 175.968 -0.380 18053
9273 1 14 . 1 1 120 120 GLU CA C 550 54.831 54.831 56.054 -1.223 18053
9274 1 14 . 1 1 120 120 GLU CB C 550 29.937 29.937 30.256 -0.319 18053
9275 1 14 . 1 1 120 120 GLU H H 550 7.587 7.587 7.758 -0.171 18053
9276 1 14 . 1 1 121 121 GLU N N 551 123.886 123.886 122.479 1.407 18053
9277 1 14 . 1 1 121 121 GLU HA H 551 4.276 4.276 4.197 0.079 18053
9278 1 14 . 1 1 121 121 GLU C C 551 176.817 176.817 176.690 0.127 18053
9279 1 14 . 1 1 121 121 GLU CA C 551 56.796 56.796 56.485 0.311 18053
9280 1 14 . 1 1 121 121 GLU CB C 551 28.955 28.955 28.851 0.104 18053
9281 1 14 . 1 1 121 121 GLU H H 551 8.697 8.697 8.592 0.105 18053
9282 1 14 . 1 1 122 122 VAL N N 552 120.055 120.055 119.033 1.022 18053
9283 1 14 . 1 1 122 122 VAL HA H 552 4.364 4.364 4.077 0.287 18053
9284 1 14 . 1 1 122 122 VAL C C 552 175.998 175.998 174.980 1.018 18053
9285 1 14 . 1 1 122 122 VAL CA C 552 61.655 61.655 62.507 -0.852 18053
9286 1 14 . 1 1 122 122 VAL CB C 552 33.049 33.049 32.274 0.775 18053
9287 1 14 . 1 1 122 122 VAL H H 552 8.845 8.845 7.804 1.041 18053
9288 1 14 . 1 1 123 123 ALA N N 553 122.098 122.098 120.075 2.023 18053
9289 1 14 . 1 1 123 123 ALA HA H 553 4.890 4.890 4.651 0.239 18053
9290 1 14 . 1 1 123 123 ALA C C 553 175.261 175.261 174.759 0.502 18053
9291 1 14 . 1 1 123 123 ALA CA C 553 52.757 52.757 51.461 1.296 18053
9292 1 14 . 1 1 123 123 ALA CB C 553 22.267 22.267 21.746 0.521 18053
9293 1 14 . 1 1 123 123 ALA H H 553 7.788 7.788 7.567 0.221 18053
9294 1 14 . 1 1 124 124 MET N N 554 118.217 118.217 121.727 -3.510 18053
9295 1 14 . 1 1 124 124 MET HA H 554 5.286 5.286 5.179 0.107 18053
9296 1 14 . 1 1 124 124 MET C C 554 174.428 174.428 174.351 0.077 18053
9297 1 14 . 1 1 124 124 MET CA C 554 55.104 55.104 55.310 -0.207 18053
9298 1 14 . 1 1 124 124 MET CB C 554 35.342 35.342 36.464 -1.122 18053
9299 1 14 . 1 1 124 124 MET H H 554 8.693 8.693 8.390 0.303 18053
9300 1 14 . 1 1 125 125 ARG N N 555 122.132 122.132 127.078 -4.946 18053
9301 1 14 . 1 1 125 125 ARG HA H 555 4.900 4.900 4.688 0.212 18053
9302 1 14 . 1 1 125 125 ARG CA C 555 56.388 56.388 55.989 0.399 18053
9303 1 14 . 1 1 125 125 ARG CB C 555 34.378 34.378 34.174 0.204 18053
9304 1 14 . 1 1 125 125 ARG H H 555 8.919 8.919 9.047 -0.128 18053
9305 1 14 . 1 1 126 126 THR HA H 556 4.685 4.685 4.692 -0.007 18053
9306 1 14 . 1 1 126 126 THR C C 556 172.436 172.436 173.723 -1.287 18053
9307 1 14 . 1 1 126 126 THR CA C 556 61.382 61.382 61.884 -0.502 18053
9308 1 14 . 1 1 126 126 THR CB C 556 70.444 70.444 69.437 1.007 18053
9309 1 14 . 1 1 127 127 VAL N N 557 124.976 124.976 128.879 -3.903 18053
9310 1 14 . 1 1 127 127 VAL HA H 557 4.146 4.146 4.053 0.093 18053
9311 1 14 . 1 1 127 127 VAL C C 557 173.937 173.937 174.214 -0.277 18053
9312 1 14 . 1 1 127 127 VAL CA C 557 61.109 61.109 60.971 0.138 18053
9313 1 14 . 1 1 127 127 VAL CB C 557 33.759 33.759 32.842 0.917 18053
9314 1 14 . 1 1 127 127 VAL H H 557 8.127 8.127 8.629 -0.502 18053
9315 1 14 . 1 1 128 128 LYS N N 558 125.384 125.384 127.336 -1.952 18053
9316 1 14 . 1 1 128 128 LYS HA H 558 4.706 4.706 4.505 0.201 18053
9317 1 14 . 1 1 128 128 LYS C C 558 175.534 175.534 175.772 -0.238 18053
9318 1 14 . 1 1 128 128 LYS CA C 558 54.886 54.886 53.977 0.909 18053
9319 1 14 . 1 1 128 128 LYS CB C 558 34.673 34.673 32.920 1.753 18053
9320 1 14 . 1 1 128 128 LYS H H 558 8.289 8.289 8.591 -0.302 18053
9321 1 14 . 1 1 129 129 LYS N N 559 124.005 124.005 127.775 -3.770 18053
9322 1 14 . 1 1 129 129 LYS HA H 559 4.310 4.310 4.014 0.296 18053
9323 1 14 . 1 1 129 129 LYS C C 559 176.571 176.571 175.861 0.710 18053
9324 1 14 . 1 1 129 129 LYS CA C 559 56.742 56.742 57.480 -0.738 18053
9325 1 14 . 1 1 129 129 LYS CB C 559 33.362 33.362 31.792 1.570 18053
9326 1 14 . 1 1 129 129 LYS H H 559 8.461 8.461 8.206 0.255 18053
9327 1 14 . 1 1 130 130 SER N N 560 117.195 117.195 121.855 -4.660 18053
9328 1 14 . 1 1 130 130 SER HA H 560 4.384 4.384 4.360 0.024 18053
9329 1 14 . 1 1 130 130 SER C C 560 174.565 174.565 174.142 0.423 18053
9330 1 14 . 1 1 130 130 SER CA C 560 58.434 58.434 59.807 -1.373 18053
9331 1 14 . 1 1 130 130 SER CB C 560 63.812 63.812 63.858 -0.046 18053
9332 1 14 . 1 1 130 130 SER H H 560 8.465 8.465 8.369 0.096 18053
9333 1 14 . 1 1 131 131 SER N N 561 118.149 118.149 114.183 3.966 18053
9334 1 14 . 1 1 131 131 SER HA H 561 4.412 4.412 4.611 -0.199 18053
9335 1 14 . 1 1 131 131 SER C C 561 174.456 174.456 173.682 0.774 18053
9336 1 14 . 1 1 131 131 SER CA C 561 58.489 58.489 57.767 0.722 18053
9337 1 14 . 1 1 131 131 SER CB C 561 63.811 63.811 64.948 -1.137 18053
9338 1 14 . 1 1 131 131 SER H H 561 8.336 8.336 7.947 0.389 18053
9339 1 14 . 1 1 132 132 VAL N N 562 121.332 121.332 116.848 4.484 18053
9340 1 14 . 1 1 132 132 VAL HA H 562 4.035 4.035 4.458 -0.423 18053
9341 1 14 . 1 1 132 132 VAL C C 562 176.066 176.066 175.880 0.186 18053
9342 1 14 . 1 1 132 132 VAL CA C 562 62.446 62.446 61.889 0.557 18053
9343 1 14 . 1 1 132 132 VAL CB C 562 32.394 32.394 31.442 0.952 18053
9344 1 14 . 1 1 132 132 VAL H H 562 7.982 7.982 8.506 -0.524 18053
9345 1 14 . 1 1 133 133 MET N N 563 124.022 124.022 119.099 4.923 18053
9346 1 14 . 1 1 133 133 MET HA H 563 4.385 4.385 4.287 0.098 18053
9347 1 14 . 1 1 133 133 MET C C 563 176.039 176.039 176.746 -0.707 18053
9348 1 14 . 1 1 133 133 MET CA C 563 55.350 55.350 57.158 -1.808 18053
9349 1 14 . 1 1 133 133 MET CB C 563 32.503 32.503 32.487 0.016 18053
9350 1 14 . 1 1 133 133 MET H H 563 8.295 8.295 7.767 0.528 18053
9351 1 14 . 1 1 134 134 ARG N N 564 122.677 122.677 119.374 3.303 18053
9352 1 14 . 1 1 134 134 ARG HA H 564 4.262 4.262 4.456 -0.194 18053
9353 1 14 . 1 1 134 134 ARG C C 564 176.298 176.298 175.032 1.266 18053
9354 1 14 . 1 1 134 134 ARG CA C 564 56.087 56.087 55.578 0.509 18053
9355 1 14 . 1 1 134 134 ARG CB C 564 30.702 30.702 32.148 -1.446 18053
9356 1 14 . 1 1 134 134 ARG H H 564 8.295 8.295 7.778 0.517 18053
9357 1 14 . 1 1 135 135 GLU N N 565 121.945 121.945 120.665 1.280 18053
9358 1 14 . 1 1 135 135 GLU HA H 565 4.160 4.160 4.156 0.004 18053
9359 1 14 . 1 1 135 135 GLU C C 565 176.080 176.080 174.985 1.095 18053
9360 1 14 . 1 1 135 135 GLU CA C 565 56.906 56.906 56.199 0.707 18053
9361 1 14 . 1 1 135 135 GLU CB C 565 29.774 29.774 29.462 0.312 18053
9362 1 14 . 1 1 135 135 GLU H H 565 8.470 8.470 8.666 -0.196 18053
9363 1 14 . 1 1 136 136 ASN N N 566 118.761 118.761 120.615 -1.854 18053
9364 1 14 . 1 1 136 136 ASN HA H 566 4.617 4.617 4.575 0.042 18053
9365 1 14 . 1 1 136 136 ASN C C 566 175.315 175.315 175.807 -0.492 18053
9366 1 14 . 1 1 136 136 ASN CA C 566 53.193 53.193 53.747 -0.554 18053
9367 1 14 . 1 1 136 136 ASN CB C 566 38.836 38.836 38.150 0.686 18053
9368 1 14 . 1 1 136 136 ASN H H 566 8.341 8.341 8.468 -0.127 18053
9369 1 14 . 1 1 137 137 GLU N N 567 121.349 121.349 125.596 -4.247 18053
9370 1 14 . 1 1 137 137 GLU HA H 567 4.152 4.152 4.432 -0.280 18053
9371 1 14 . 1 1 137 137 GLU C C 567 176.243 176.243 177.271 -1.028 18053
9372 1 14 . 1 1 137 137 GLU CA C 567 56.906 56.906 56.700 0.206 18053
9373 1 14 . 1 1 137 137 GLU CB C 567 29.992 29.992 29.663 0.330 18053
9374 1 14 . 1 1 137 137 GLU H H 567 8.349 8.349 8.664 -0.315 18053
9375 1 14 . 1 1 138 138 ASN N N 568 118.761 118.761 118.835 -0.074 18053
9376 1 14 . 1 1 138 138 ASN HA H 568 4.712 4.712 4.718 -0.006 18053
9377 1 14 . 1 1 138 138 ASN C C 568 174.551 174.551 176.781 -2.230 18053
9378 1 14 . 1 1 138 138 ASN CA C 568 53.193 53.193 53.512 -0.319 18053
9379 1 14 . 1 1 138 138 ASN CB C 568 39.327 39.327 38.881 0.446 18053
9380 1 14 . 1 1 138 138 ASN H H 568 8.397 8.397 8.408 -0.011 18053
9381 1 15 . 1 1 20 20 ALA N N 450 125.180 125.180 127.616 -2.436 18053
9382 1 15 . 1 1 20 20 ALA HA H 450 4.706 4.706 4.789 -0.083 18053
9383 1 15 . 1 1 20 20 ALA C C 450 177.226 177.226 176.499 0.727 18053
9384 1 15 . 1 1 20 20 ALA CA C 450 52.757 52.757 51.934 0.823 18053
9385 1 15 . 1 1 20 20 ALA CB C 450 20.411 20.411 20.235 0.176 18053
9386 1 15 . 1 1 20 20 ALA H H 450 8.484 8.484 8.600 -0.116 18053
9387 1 15 . 1 1 21 21 SER N N 451 115.714 115.714 116.968 -1.254 18053
9388 1 15 . 1 1 21 21 SER HA H 451 4.513 4.513 4.426 0.087 18053
9389 1 15 . 1 1 21 21 SER C C 451 174.742 174.742 175.605 -0.863 18053
9390 1 15 . 1 1 21 21 SER CA C 451 58.516 58.516 58.015 0.501 18053
9391 1 15 . 1 1 21 21 SER CB C 451 64.159 64.159 62.059 2.100 18053
9392 1 15 . 1 1 21 21 SER H H 451 8.487 8.487 8.411 0.076 18053
9393 1 15 . 1 1 22 22 GLY N N 452 111.509 111.509 116.294 -4.785 18053
9394 1 15 . 1 1 22 22 GLY C C 452 174.401 174.401 175.215 -0.814 18053
9395 1 15 . 1 1 22 22 GLY CA C 452 45.059 45.059 45.340 -0.281 18053
9396 1 15 . 1 1 22 22 GLY H H 452 8.198 8.198 8.448 -0.250 18053
9397 1 15 . 1 1 23 23 SER N N 453 116.191 116.191 114.572 1.619 18053
9398 1 15 . 1 1 23 23 SER HA H 453 4.364 4.364 4.378 -0.014 18053
9399 1 15 . 1 1 23 23 SER C C 453 173.432 173.432 174.186 -0.754 18053
9400 1 15 . 1 1 23 23 SER CA C 453 59.744 59.744 61.249 -1.505 18053
9401 1 15 . 1 1 23 23 SER CB C 453 64.335 64.335 64.358 -0.023 18053
9402 1 15 . 1 1 23 23 SER H H 453 8.494 8.494 8.265 0.229 18053
9403 1 15 . 1 1 24 24 VAL N N 454 121.656 121.656 117.746 3.910 18053
9404 1 15 . 1 1 24 24 VAL HA H 454 5.035 5.035 4.739 0.296 18053
9405 1 15 . 1 1 24 24 VAL C C 454 174.606 174.606 174.507 0.099 18053
9406 1 15 . 1 1 24 24 VAL CA C 454 61.055 61.055 60.786 0.269 18053
9407 1 15 . 1 1 24 24 VAL CB C 454 32.503 32.503 35.671 -3.168 18053
9408 1 15 . 1 1 24 24 VAL H H 454 7.830 7.830 7.896 -0.066 18053
9409 1 15 . 1 1 25 25 SER N N 455 119.323 119.323 118.428 0.895 18053
9410 1 15 . 1 1 25 25 SER HA H 455 4.672 4.672 4.906 -0.234 18053
9411 1 15 . 1 1 25 25 SER C C 455 174.426 174.426 173.187 1.239 18053
9412 1 15 . 1 1 25 25 SER CA C 455 55.268 55.268 55.371 -0.103 18053
9413 1 15 . 1 1 25 25 SER CB C 455 65.162 65.162 65.985 -0.823 18053
9414 1 15 . 1 1 25 25 SER H H 455 9.065 9.065 8.779 0.286 18053
9415 1 15 . 1 1 26 26 ILE N N 456 119.468 119.468 125.278 -5.810 18053
9416 1 15 . 1 1 26 26 ILE HA H 456 4.180 4.180 4.124 0.056 18053
9417 1 15 . 1 1 26 26 ILE C C 456 175.506 175.506 176.168 -0.662 18053
9418 1 15 . 1 1 26 26 ILE CA C 456 61.328 61.328 62.126 -0.798 18053
9419 1 15 . 1 1 26 26 ILE CB C 456 37.962 37.962 37.515 0.447 18053
9420 1 15 . 1 1 26 26 ILE H H 456 8.295 8.295 8.766 -0.471 18053
9421 1 15 . 1 1 27 27 GLU N N 457 129.726 129.726 127.803 1.923 18053
9422 1 15 . 1 1 27 27 GLU HA H 457 4.228 4.228 4.270 -0.042 18053
9423 1 15 . 1 1 27 27 GLU C C 457 175.179 175.179 176.574 -1.395 18053
9424 1 15 . 1 1 27 27 GLU CA C 457 55.432 55.432 58.763 -3.331 18053
9425 1 15 . 1 1 27 27 GLU CB C 457 30.142 30.142 30.760 -0.618 18053
9426 1 15 . 1 1 27 27 GLU H H 457 8.393 8.393 8.416 -0.023 18053
9427 1 15 . 1 1 28 28 GLU N N 458 117.076 117.076 116.890 0.186 18053
9428 1 15 . 1 1 28 28 GLU HA H 458 4.168 4.168 4.613 -0.445 18053
9429 1 15 . 1 1 28 28 GLU C C 458 174.701 174.701 174.648 0.053 18053
9430 1 15 . 1 1 28 28 GLU CA C 458 56.906 56.906 55.224 1.682 18053
9431 1 15 . 1 1 28 28 GLU CB C 458 31.848 31.848 32.683 -0.835 18053
9432 1 15 . 1 1 28 28 GLU H H 458 7.489 7.489 7.861 -0.372 18053
9433 1 15 . 1 1 29 29 ILE N N 459 122.183 122.183 120.783 1.400 18053
9434 1 15 . 1 1 29 29 ILE HA H 459 3.764 3.764 4.016 -0.252 18053
9435 1 15 . 1 1 29 29 ILE C C 459 174.169 174.169 174.412 -0.243 18053
9436 1 15 . 1 1 29 29 ILE CA C 459 59.526 59.526 59.272 0.254 18053
9437 1 15 . 1 1 29 29 ILE CB C 459 40.309 40.309 41.908 -1.599 18053
9438 1 15 . 1 1 29 29 ILE H H 459 8.126 8.126 8.283 -0.157 18053
9439 1 15 . 1 1 30 30 ASP N N 460 123.205 123.205 124.506 -1.301 18053
9440 1 15 . 1 1 30 30 ASP HA H 460 4.183 4.183 4.145 0.038 18053
9441 1 15 . 1 1 30 30 ASP C C 460 178.318 178.318 177.588 0.730 18053
9442 1 15 . 1 1 30 30 ASP CA C 460 53.930 53.930 53.979 -0.049 18053
9443 1 15 . 1 1 30 30 ASP CB C 460 42.807 42.807 42.263 0.544 18053
9444 1 15 . 1 1 30 30 ASP H H 460 6.704 6.704 7.041 -0.337 18053
9445 1 15 . 1 1 31 31 LEU N N 461 128.551 128.551 121.761 6.790 18053
9446 1 15 . 1 1 31 31 LEU HA H 461 4.064 4.064 4.079 -0.015 18053
9447 1 15 . 1 1 31 31 LEU C C 461 177.513 177.513 177.418 0.095 18053
9448 1 15 . 1 1 31 31 LEU CA C 461 57.124 57.124 57.097 0.027 18053
9449 1 15 . 1 1 31 31 LEU CB C 461 41.237 41.237 41.802 -0.565 18053
9450 1 15 . 1 1 31 31 LEU H H 461 9.012 9.012 8.210 0.802 18053
9451 1 15 . 1 1 32 32 GLU N N 462 115.101 115.101 117.412 -2.311 18053
9452 1 15 . 1 1 32 32 GLU HA H 462 4.283 4.283 4.223 0.060 18053
9453 1 15 . 1 1 32 32 GLU C C 462 177.062 177.062 177.093 -0.031 18053
9454 1 15 . 1 1 32 32 GLU CA C 462 55.759 55.759 57.279 -1.520 18053
9455 1 15 . 1 1 32 32 GLU CB C 462 29.569 29.569 30.518 -0.949 18053
9456 1 15 . 1 1 32 32 GLU H H 462 7.588 7.588 7.908 -0.320 18053
9457 1 15 . 1 1 33 33 GLY N N 463 106.299 106.299 105.674 0.625 18053
9458 1 15 . 1 1 33 33 GLY C C 463 174.824 174.824 174.843 -0.019 18053
9459 1 15 . 1 1 33 33 GLY CA C 463 46.806 46.806 44.921 1.885 18053
9460 1 15 . 1 1 33 33 GLY H H 463 7.372 7.372 7.853 -0.481 18053
9461 1 15 . 1 1 34 34 LYS N N 464 118.744 118.744 118.670 0.074 18053
9462 1 15 . 1 1 34 34 LYS HA H 464 4.562 4.562 4.470 0.092 18053
9463 1 15 . 1 1 34 34 LYS C C 464 177.076 177.076 174.964 2.112 18053
9464 1 15 . 1 1 34 34 LYS CA C 464 59.963 59.963 56.900 3.063 18053
9465 1 15 . 1 1 34 34 LYS CB C 464 33.111 33.111 33.885 -0.774 18053
9466 1 15 . 1 1 34 34 LYS H H 464 9.547 9.547 8.217 1.330 18053
9467 1 15 . 1 1 35 35 PHE N N 465 109.125 109.125 112.775 -3.650 18053
9468 1 15 . 1 1 35 35 PHE HA H 465 5.514 5.514 4.864 0.650 18053
9469 1 15 . 1 1 35 35 PHE C C 465 174.183 174.183 172.662 1.521 18053
9470 1 15 . 1 1 35 35 PHE CA C 465 56.632 56.632 55.112 1.520 18053
9471 1 15 . 1 1 35 35 PHE CB C 465 40.599 40.599 40.965 -0.366 18053
9472 1 15 . 1 1 35 35 PHE H H 465 6.740 6.740 6.988 -0.248 18053
9473 1 15 . 1 1 36 36 VAL N N 466 119.579 119.579 118.285 1.294 18053
9474 1 15 . 1 1 36 36 VAL HA H 466 3.709 3.709 4.112 -0.403 18053
9475 1 15 . 1 1 36 36 VAL C C 466 172.668 172.668 174.106 -1.438 18053
9476 1 15 . 1 1 36 36 VAL CA C 466 62.692 62.692 60.812 1.880 18053
9477 1 15 . 1 1 36 36 VAL CB C 466 36.215 36.215 35.466 0.749 18053
9478 1 15 . 1 1 36 36 VAL H H 466 7.628 7.628 8.138 -0.510 18053
9479 1 15 . 1 1 37 37 GLN N N 467 126.831 126.831 125.754 1.077 18053
9480 1 15 . 1 1 37 37 GLN HA H 467 5.449 5.449 4.970 0.479 18053
9481 1 15 . 1 1 37 37 GLN C C 467 174.797 174.797 174.285 0.512 18053
9482 1 15 . 1 1 37 37 GLN CA C 467 54.121 54.121 53.757 0.364 18053
9483 1 15 . 1 1 37 37 GLN CB C 467 34.623 34.623 30.233 4.391 18053
9484 1 15 . 1 1 37 37 GLN H H 467 8.392 8.392 8.681 -0.289 18053
9485 1 15 . 1 1 38 38 LEU N N 468 123.018 123.018 126.380 -3.362 18053
9486 1 15 . 1 1 38 38 LEU HA H 468 5.422 5.422 5.175 0.247 18053
9487 1 15 . 1 1 38 38 LEU C C 468 175.588 175.588 176.169 -0.581 18053
9488 1 15 . 1 1 38 38 LEU CA C 468 52.702 52.702 53.826 -1.124 18053
9489 1 15 . 1 1 38 38 LEU CB C 468 45.046 45.046 44.122 0.924 18053
9490 1 15 . 1 1 38 38 LEU H H 468 9.103 9.103 9.076 0.027 18053
9491 1 15 . 1 1 39 39 LYS N N 469 118.983 118.983 119.982 -0.999 18053
9492 1 15 . 1 1 39 39 LYS HA H 469 4.852 4.852 4.769 0.083 18053
9493 1 15 . 1 1 39 39 LYS C C 469 173.309 173.309 174.499 -1.190 18053
9494 1 15 . 1 1 39 39 LYS CA C 469 54.994 54.994 54.391 0.603 18053
9495 1 15 . 1 1 39 39 LYS CB C 469 38.246 38.246 36.381 1.865 18053
9496 1 15 . 1 1 39 39 LYS H H 469 8.496 8.496 8.637 -0.141 18053
9497 1 15 . 1 1 40 40 ASN N N 470 121.758 121.758 125.027 -3.269 18053
9498 1 15 . 1 1 40 40 ASN HA H 470 4.788 4.788 4.870 -0.082 18053
9499 1 15 . 1 1 40 40 ASN C C 470 174.496 174.496 175.330 -0.834 18053
9500 1 15 . 1 1 40 40 ASN CA C 470 51.119 51.119 52.506 -1.387 18053
9501 1 15 . 1 1 40 40 ASN CB C 470 37.559 37.559 38.594 -1.035 18053
9502 1 15 . 1 1 40 40 ASN H H 470 8.283 8.283 8.663 -0.380 18053
9503 1 15 . 1 1 41 41 ASN N N 471 122.422 122.422 124.621 -2.199 18053
9504 1 15 . 1 1 41 41 ASN HA H 471 4.588 4.588 4.638 -0.050 18053
9505 1 15 . 1 1 41 41 ASN C C 471 174.810 174.810 175.217 -0.407 18053
9506 1 15 . 1 1 41 41 ASN CA C 471 53.985 53.985 53.967 0.018 18053
9507 1 15 . 1 1 41 41 ASN CB C 471 39.600 39.600 39.028 0.572 18053
9508 1 15 . 1 1 41 41 ASN H H 471 8.681 8.681 8.355 0.326 18053
9509 1 15 . 1 1 42 42 SER N N 472 116.446 116.446 116.397 0.049 18053
9510 1 15 . 1 1 42 42 SER HA H 472 4.719 4.719 4.445 0.274 18053
9511 1 15 . 1 1 42 42 SER C C 472 172.804 172.804 174.252 -1.448 18053
9512 1 15 . 1 1 42 42 SER CA C 472 57.288 57.288 59.182 -1.894 18053
9513 1 15 . 1 1 42 42 SER CB C 472 66.241 66.241 64.069 2.172 18053
9514 1 15 . 1 1 42 42 SER H H 472 8.370 8.370 7.701 0.669 18053
9515 1 15 . 1 1 43 43 ASP N N 473 117.706 117.706 123.133 -5.427 18053
9516 1 15 . 1 1 43 43 ASP HA H 473 4.474 4.474 4.426 0.048 18053
9517 1 15 . 1 1 43 43 ASP C C 473 175.343 175.343 175.946 -0.603 18053
9518 1 15 . 1 1 43 43 ASP CA C 473 53.521 53.521 55.764 -2.243 18053
9519 1 15 . 1 1 43 43 ASP CB C 473 40.322 40.322 41.011 -0.689 18053
9520 1 15 . 1 1 43 43 ASP H H 473 8.254 8.254 8.791 -0.537 18053
9521 1 15 . 1 1 44 44 LYS N N 474 120.209 120.209 117.184 3.025 18053
9522 1 15 . 1 1 44 44 LYS HA H 474 4.569 4.569 4.448 0.121 18053
9523 1 15 . 1 1 44 44 LYS C C 474 175.397 175.397 175.466 -0.069 18053
9524 1 15 . 1 1 44 44 LYS CA C 474 54.012 54.012 54.364 -0.352 18053
9525 1 15 . 1 1 44 44 LYS CB C 474 35.383 35.383 34.033 1.350 18053
9526 1 15 . 1 1 44 44 LYS H H 474 8.305 8.305 7.572 0.733 18053
9527 1 15 . 1 1 45 45 ASP N N 475 124.993 124.993 119.885 5.108 18053
9528 1 15 . 1 1 45 45 ASP HA H 475 3.975 3.975 4.506 -0.531 18053
9529 1 15 . 1 1 45 45 ASP C C 475 174.810 174.810 175.978 -1.168 18053
9530 1 15 . 1 1 45 45 ASP CA C 475 54.995 54.995 55.028 -0.033 18053
9531 1 15 . 1 1 45 45 ASP CB C 475 40.364 40.364 41.212 -0.848 18053
9532 1 15 . 1 1 45 45 ASP H H 475 8.722 8.722 8.436 0.286 18053
9533 1 15 . 1 1 46 46 GLN N N 476 120.549 120.549 122.591 -2.042 18053
9534 1 15 . 1 1 46 46 GLN HA H 476 4.436 4.436 4.592 -0.156 18053
9535 1 15 . 1 1 46 46 GLN C C 476 174.019 174.019 174.558 -0.539 18053
9536 1 15 . 1 1 46 46 GLN CA C 476 53.138 53.138 53.967 -0.829 18053
9537 1 15 . 1 1 46 46 GLN CB C 476 31.466 31.466 30.681 0.785 18053
9538 1 15 . 1 1 46 46 GLN H H 476 7.878 7.878 8.374 -0.496 18053
9539 1 15 . 1 1 47 47 SER N N 477 121.537 121.537 121.402 0.135 18053
9540 1 15 . 1 1 47 47 SER HA H 477 4.229 4.229 4.328 -0.099 18053
9541 1 15 . 1 1 47 47 SER C C 477 174.565 174.565 174.037 0.528 18053
9542 1 15 . 1 1 47 47 SER CA C 477 58.706 58.706 58.797 -0.091 18053
9543 1 15 . 1 1 47 47 SER CB C 477 62.965 62.965 63.070 -0.105 18053
9544 1 15 . 1 1 47 47 SER H H 477 8.748 8.748 8.682 0.066 18053
9545 1 15 . 1 1 48 48 LEU N N 478 127.751 127.751 124.071 3.680 18053
9546 1 15 . 1 1 48 48 LEU HA H 478 2.631 2.631 4.401 -1.770 18053
9547 1 15 . 1 1 48 48 LEU C C 478 176.789 176.789 177.840 -1.051 18053
9548 1 15 . 1 1 48 48 LEU CA C 478 52.102 52.102 53.805 -1.703 18053
9549 1 15 . 1 1 48 48 LEU CB C 478 42.343 42.343 42.933 -0.590 18053
9550 1 15 . 1 1 48 48 LEU H H 478 7.856 7.856 7.789 0.067 18053
9551 1 15 . 1 1 49 49 GLY N N 479 107.525 107.525 106.423 1.102 18053
9552 1 15 . 1 1 49 49 GLY C C 479 176.653 176.653 175.288 1.365 18053
9553 1 15 . 1 1 49 49 GLY CA C 479 48.062 48.062 45.910 2.152 18053
9554 1 15 . 1 1 49 49 GLY H H 479 7.728 7.728 8.954 -1.226 18053
9555 1 15 . 1 1 50 50 ASN N N 480 117.059 117.059 119.553 -2.494 18053
9556 1 15 . 1 1 50 50 ASN HA H 480 4.255 4.255 4.633 -0.378 18053
9557 1 15 . 1 1 50 50 ASN C C 480 174.961 174.961 175.452 -0.491 18053
9558 1 15 . 1 1 50 50 ASN CA C 480 56.360 56.360 54.533 1.827 18053
9559 1 15 . 1 1 50 50 ASN CB C 480 37.416 37.416 38.655 -1.239 18053
9560 1 15 . 1 1 50 50 ASN H H 480 7.552 7.552 8.650 -1.098 18053
9561 1 15 . 1 1 51 51 TRP N N 481 122.166 122.166 118.819 3.347 18053
9562 1 15 . 1 1 51 51 TRP HA H 481 4.477 4.477 4.995 -0.518 18053
9563 1 15 . 1 1 51 51 TRP C C 481 175.575 175.575 175.664 -0.089 18053
9564 1 15 . 1 1 51 51 TRP CA C 481 58.762 58.762 58.114 0.648 18053
9565 1 15 . 1 1 51 51 TRP CB C 481 28.041 28.041 30.496 -2.455 18053
9566 1 15 . 1 1 51 51 TRP H H 481 8.914 8.914 7.865 1.049 18053
9567 1 15 . 1 1 52 52 ARG N N 482 116.480 116.480 117.529 -1.049 18053
9568 1 15 . 1 1 52 52 ARG HA H 482 5.968 5.968 5.321 0.647 18053
9569 1 15 . 1 1 52 52 ARG C C 482 175.807 175.807 174.580 1.227 18053
9570 1 15 . 1 1 52 52 ARG CA C 482 54.121 54.121 54.901 -0.780 18053
9571 1 15 . 1 1 52 52 ARG CB C 482 35.124 35.124 34.438 0.687 18053
9572 1 15 . 1 1 52 52 ARG H H 482 9.147 9.147 9.198 -0.051 18053
9573 1 15 . 1 1 53 53 ILE N N 483 119.579 119.579 123.518 -3.939 18053
9574 1 15 . 1 1 53 53 ILE HA H 483 4.985 4.985 4.926 0.059 18053
9575 1 15 . 1 1 53 53 ILE C C 483 175.670 175.670 175.724 -0.054 18053
9576 1 15 . 1 1 53 53 ILE CA C 483 60.400 60.400 60.439 -0.039 18053
9577 1 15 . 1 1 53 53 ILE CB C 483 40.227 40.227 38.564 1.663 18053
9578 1 15 . 1 1 53 53 ILE H H 483 9.000 9.000 8.819 0.181 18053
9579 1 15 . 1 1 54 54 LYS N N 484 124.737 124.737 127.782 -3.045 18053
9580 1 15 . 1 1 54 54 LYS HA H 484 5.463 5.463 4.780 0.683 18053
9581 1 15 . 1 1 54 54 LYS C C 484 175.575 175.575 176.280 -0.705 18053
9582 1 15 . 1 1 54 54 LYS CA C 484 54.613 54.613 56.480 -1.867 18053
9583 1 15 . 1 1 54 54 LYS CB C 484 35.041 35.041 33.884 1.157 18053
9584 1 15 . 1 1 54 54 LYS H H 484 9.678 9.678 8.592 1.086 18053
9585 1 15 . 1 1 55 55 ARG N N 485 124.090 124.090 122.184 1.906 18053
9586 1 15 . 1 1 55 55 ARG HA H 485 5.525 5.525 4.980 0.545 18053
9587 1 15 . 1 1 55 55 ARG C C 485 174.155 174.155 174.516 -0.361 18053
9588 1 15 . 1 1 55 55 ARG CA C 485 53.903 53.903 55.971 -2.068 18053
9589 1 15 . 1 1 55 55 ARG H H 485 9.314 9.314 8.729 0.585 18053
9590 1 15 . 1 1 56 56 GLN N N 486 126.576 126.576 127.541 -0.965 18053
9591 1 15 . 1 1 56 56 GLN HA H 486 4.842 4.842 4.555 0.287 18053
9592 1 15 . 1 1 56 56 GLN C C 486 174.991 174.991 174.984 0.007 18053
9593 1 15 . 1 1 56 56 GLN CA C 486 54.831 54.831 55.455 -0.624 18053
9594 1 15 . 1 1 56 56 GLN CB C 486 31.465 31.465 29.271 2.194 18053
9595 1 15 . 1 1 56 56 GLN H H 486 8.831 8.831 8.729 0.102 18053
9596 1 15 . 1 1 57 57 VAL N N 487 126.712 126.712 125.013 1.699 18053
9597 1 15 . 1 1 57 57 VAL HA H 487 4.266 4.266 4.264 0.002 18053
9598 1 15 . 1 1 57 57 VAL C C 487 175.916 175.916 177.029 -1.113 18053
9599 1 15 . 1 1 57 57 VAL CA C 487 61.820 61.820 61.567 0.253 18053
9600 1 15 . 1 1 57 57 VAL CB C 487 32.803 32.803 31.651 1.152 18053
9601 1 15 . 1 1 57 57 VAL H H 487 8.786 8.786 8.461 0.325 18053
9602 1 15 . 1 1 58 58 LEU N N 488 127.274 127.274 125.889 1.385 18053
9603 1 15 . 1 1 58 58 LEU HA H 488 4.085 4.085 4.210 -0.125 18053
9604 1 15 . 1 1 58 58 LEU C C 488 177.158 177.158 177.729 -0.571 18053
9605 1 15 . 1 1 58 58 LEU CA C 488 56.906 56.906 57.427 -0.521 18053
9606 1 15 . 1 1 58 58 LEU CB C 488 41.374 41.374 41.518 -0.144 18053
9607 1 15 . 1 1 58 58 LEU H H 488 8.316 8.316 8.761 -0.445 18053
9608 1 15 . 1 1 59 59 GLU N N 489 119.647 119.647 118.579 1.068 18053
9609 1 15 . 1 1 59 59 GLU HA H 489 4.112 4.112 4.275 -0.163 18053
9610 1 15 . 1 1 59 59 GLU C C 489 176.230 176.230 177.219 -0.989 18053
9611 1 15 . 1 1 59 59 GLU CA C 489 57.015 57.015 56.589 0.426 18053
9612 1 15 . 1 1 59 59 GLU CB C 489 28.149 28.149 29.554 -1.405 18053
9613 1 15 . 1 1 59 59 GLU H H 489 8.636 8.636 8.259 0.377 18053
9614 1 15 . 1 1 60 60 GLY N N 490 108.819 108.819 107.764 1.055 18053
9615 1 15 . 1 1 60 60 GLY C C 490 173.568 173.568 173.931 -0.363 18053
9616 1 15 . 1 1 60 60 GLY CA C 490 44.773 44.773 44.650 0.123 18053
9617 1 15 . 1 1 60 60 GLY H H 490 8.160 8.160 7.861 0.299 18053
9618 1 15 . 1 1 61 61 GLU N N 491 121.009 121.009 121.076 -0.067 18053
9619 1 15 . 1 1 61 61 GLU HA H 491 4.323 4.323 4.606 -0.283 18053
9620 1 15 . 1 1 61 61 GLU C C 491 175.725 175.725 174.920 0.805 18053
9621 1 15 . 1 1 61 61 GLU CA C 491 56.196 56.196 55.333 0.863 18053
9622 1 15 . 1 1 61 61 GLU CB C 491 30.865 30.865 31.233 -0.368 18053
9623 1 15 . 1 1 61 61 GLU H H 491 8.320 8.320 7.914 0.406 18053
9624 1 15 . 1 1 62 62 GLU N N 492 123.426 123.426 124.674 -1.248 18053
9625 1 15 . 1 1 62 62 GLU HA H 492 5.054 5.054 5.277 -0.223 18053
9626 1 15 . 1 1 62 62 GLU C C 492 175.930 175.930 175.936 -0.006 18053
9627 1 15 . 1 1 62 62 GLU CA C 492 55.650 55.650 55.195 0.455 18053
9628 1 15 . 1 1 62 62 GLU CB C 492 32.312 32.312 30.760 1.552 18053
9629 1 15 . 1 1 62 62 GLU H H 492 8.594 8.594 8.663 -0.069 18053
9630 1 15 . 1 1 63 63 ILE N N 493 119.732 119.732 118.733 0.999 18053
9631 1 15 . 1 1 63 63 ILE HA H 493 4.788 4.788 4.816 -0.028 18053
9632 1 15 . 1 1 63 63 ILE C C 493 174.647 174.647 174.221 0.426 18053
9633 1 15 . 1 1 63 63 ILE CA C 493 60.181 60.181 59.243 0.938 18053
9634 1 15 . 1 1 63 63 ILE CB C 493 41.183 41.183 41.501 -0.318 18053
9635 1 15 . 1 1 63 63 ILE H H 493 8.523 8.523 8.475 0.048 18053
9636 1 15 . 1 1 64 64 ALA N N 494 122.166 122.166 121.820 0.346 18053
9637 1 15 . 1 1 64 64 ALA HA H 494 5.521 5.521 4.843 0.678 18053
9638 1 15 . 1 1 64 64 ALA C C 494 174.606 174.606 175.614 -1.008 18053
9639 1 15 . 1 1 64 64 ALA CA C 494 51.528 51.528 51.905 -0.377 18053
9640 1 15 . 1 1 64 64 ALA CB C 494 22.239 22.239 21.049 1.190 18053
9641 1 15 . 1 1 64 64 ALA H H 494 8.741 8.741 8.293 0.448 18053
9642 1 15 . 1 1 65 65 TYR N N 495 126.729 126.729 126.021 0.708 18053
9643 1 15 . 1 1 65 65 TYR HA H 495 3.094 3.094 3.556 -0.462 18053
9644 1 15 . 1 1 65 65 TYR C C 495 173.036 173.036 173.973 -0.937 18053
9645 1 15 . 1 1 65 65 TYR CA C 495 56.905 56.905 57.093 -0.188 18053
9646 1 15 . 1 1 65 65 TYR CB C 495 40.269 40.269 38.668 1.601 18053
9647 1 15 . 1 1 65 65 TYR H H 495 8.462 8.462 8.439 0.023 18053
9648 1 15 . 1 1 66 66 LYS N N 496 128.108 128.108 127.411 0.697 18053
9649 1 15 . 1 1 66 66 LYS HA H 496 4.822 4.822 4.060 0.762 18053
9650 1 15 . 1 1 66 66 LYS C C 496 174.906 174.906 174.596 0.310 18053
9651 1 15 . 1 1 66 66 LYS CA C 496 53.739 53.739 55.237 -1.498 18053
9652 1 15 . 1 1 66 66 LYS CB C 496 34.782 34.782 33.204 1.578 18053
9653 1 15 . 1 1 66 66 LYS H H 496 7.010 7.010 7.517 -0.507 18053
9654 1 15 . 1 1 67 67 PHE N N 497 125.299 125.299 122.137 3.162 18053
9655 1 15 . 1 1 67 67 PHE HA H 497 3.932 3.932 4.221 -0.289 18053
9656 1 15 . 1 1 67 67 PHE C C 497 177.990 177.990 176.000 1.990 18053
9657 1 15 . 1 1 67 67 PHE CA C 497 59.007 59.007 57.637 1.370 18053
9658 1 15 . 1 1 67 67 PHE CB C 497 40.981 40.981 40.534 0.447 18053
9659 1 15 . 1 1 67 67 PHE H H 497 8.509 8.509 7.829 0.680 18053
9660 1 15 . 1 1 68 68 THR N N 498 116.191 116.191 112.104 4.087 18053
9661 1 15 . 1 1 68 68 THR HA H 498 4.417 4.417 4.736 -0.319 18053
9662 1 15 . 1 1 68 68 THR CA C 498 60.855 60.855 59.246 1.609 18053
9663 1 15 . 1 1 68 68 THR CB C 498 68.019 68.019 69.507 -1.488 18053
9664 1 15 . 1 1 68 68 THR H H 498 8.688 8.688 8.406 0.282 18053
9665 1 15 . 1 1 69 69 PRO HA H 499 3.948 3.948 4.551 -0.603 18053
9666 1 15 . 1 1 69 69 PRO C C 499 177.444 177.444 177.049 0.395 18053
9667 1 15 . 1 1 69 69 PRO CA C 499 66.077 66.077 64.663 1.414 18053
9668 1 15 . 1 1 69 69 PRO CB C 499 32.776 32.776 31.943 0.833 18053
9669 1 15 . 1 1 70 70 LYS N N 500 113.552 113.552 115.186 -1.634 18053
9670 1 15 . 1 1 70 70 LYS HA H 500 4.385 4.385 4.166 0.219 18053
9671 1 15 . 1 1 70 70 LYS C C 500 176.325 176.325 176.569 -0.244 18053
9672 1 15 . 1 1 70 70 LYS CA C 500 54.995 54.995 56.842 -1.847 18053
9673 1 15 . 1 1 70 70 LYS CB C 500 31.793 31.793 31.762 0.031 18053
9674 1 15 . 1 1 70 70 LYS H H 500 8.016 8.016 8.025 -0.009 18053
9675 1 15 . 1 1 71 71 TYR N N 501 121.860 121.860 121.811 0.049 18053
9676 1 15 . 1 1 71 71 TYR HA H 501 3.730 3.730 4.436 -0.706 18053
9677 1 15 . 1 1 71 71 TYR C C 501 174.838 174.838 173.698 1.140 18053
9678 1 15 . 1 1 71 71 TYR CA C 501 62.310 62.310 58.711 3.599 18053
9679 1 15 . 1 1 71 71 TYR CB C 501 38.781 38.781 39.117 -0.336 18053
9680 1 15 . 1 1 71 71 TYR H H 501 7.460 7.460 7.727 -0.267 18053
9681 1 15 . 1 1 72 72 ILE N N 502 129.487 129.487 127.035 2.452 18053
9682 1 15 . 1 1 72 72 ILE HA H 502 3.928 3.928 4.274 -0.346 18053
9683 1 15 . 1 1 72 72 ILE C C 502 172.968 172.968 174.081 -1.113 18053
9684 1 15 . 1 1 72 72 ILE CA C 502 59.308 59.308 59.499 -0.191 18053
9685 1 15 . 1 1 72 72 ILE CB C 502 40.910 40.910 40.362 0.548 18053
9686 1 15 . 1 1 72 72 ILE H H 502 7.168 7.168 8.042 -0.874 18053
9687 1 15 . 1 1 73 73 LEU N N 503 128.278 128.278 127.544 0.734 18053
9688 1 15 . 1 1 73 73 LEU HA H 503 4.493 4.493 4.420 0.073 18053
9689 1 15 . 1 1 73 73 LEU C C 503 175.834 175.834 175.561 0.273 18053
9690 1 15 . 1 1 73 73 LEU CA C 503 51.965 51.965 52.989 -1.024 18053
9691 1 15 . 1 1 73 73 LEU CB C 503 42.548 42.548 44.586 -2.038 18053
9692 1 15 . 1 1 73 73 LEU H H 503 8.483 8.483 8.459 0.024 18053
9693 1 15 . 1 1 74 74 ARG N N 504 129.589 129.589 123.415 6.174 18053
9694 1 15 . 1 1 74 74 ARG HA H 504 3.743 3.743 4.423 -0.680 18053
9695 1 15 . 1 1 74 74 ARG C C 504 175.233 175.233 176.249 -1.016 18053
9696 1 15 . 1 1 74 74 ARG CA C 504 56.851 56.851 55.454 1.397 18053
9697 1 15 . 1 1 74 74 ARG CB C 504 30.292 30.292 31.009 -0.717 18053
9698 1 15 . 1 1 74 74 ARG H H 504 8.673 8.673 8.477 0.196 18053
9699 1 15 . 1 1 75 75 ALA N N 505 123.205 123.205 124.643 -1.438 18053
9700 1 15 . 1 1 75 75 ALA HA H 505 3.522 3.522 4.157 -0.635 18053
9701 1 15 . 1 1 75 75 ALA C C 505 178.441 178.441 178.161 0.280 18053
9702 1 15 . 1 1 75 75 ALA CA C 505 53.794 53.794 53.128 0.666 18053
9703 1 15 . 1 1 75 75 ALA CB C 505 18.910 18.910 18.371 0.539 18053
9704 1 15 . 1 1 75 75 ALA H H 505 8.564 8.564 8.141 0.423 18053
9705 1 15 . 1 1 76 76 GLY N N 506 112.241 112.241 112.699 -0.458 18053
9706 1 15 . 1 1 76 76 GLY C C 506 174.278 174.278 174.037 0.241 18053
9707 1 15 . 1 1 76 76 GLY CA C 506 46.725 46.725 45.341 1.384 18053
9708 1 15 . 1 1 76 76 GLY H H 506 7.381 7.381 8.563 -1.182 18053
9709 1 15 . 1 1 77 77 GLN N N 507 117.382 117.382 118.612 -1.230 18053
9710 1 15 . 1 1 77 77 GLN HA H 507 4.364 4.364 4.592 -0.228 18053
9711 1 15 . 1 1 77 77 GLN C C 507 173.937 173.937 174.996 -1.059 18053
9712 1 15 . 1 1 77 77 GLN CA C 507 54.558 54.558 54.163 0.395 18053
9713 1 15 . 1 1 77 77 GLN CB C 507 30.073 30.073 30.475 -0.402 18053
9714 1 15 . 1 1 77 77 GLN H H 507 7.996 7.996 7.645 0.351 18053
9715 1 15 . 1 1 78 78 MET N N 508 116.957 116.957 115.158 1.799 18053
9716 1 15 . 1 1 78 78 MET HA H 508 5.388 5.388 4.808 0.580 18053
9717 1 15 . 1 1 78 78 MET C C 508 175.807 175.807 173.669 2.138 18053
9718 1 15 . 1 1 78 78 MET CA C 508 54.067 54.067 54.746 -0.679 18053
9719 1 15 . 1 1 78 78 MET CB C 508 37.198 37.198 36.539 0.659 18053
9720 1 15 . 1 1 78 78 MET H H 508 8.092 8.092 8.189 -0.097 18053
9721 1 15 . 1 1 79 79 VAL N N 509 119.340 119.340 119.819 -0.479 18053
9722 1 15 . 1 1 79 79 VAL HA H 509 4.956 4.956 4.829 0.127 18053
9723 1 15 . 1 1 79 79 VAL C C 509 172.217 172.217 174.036 -1.819 18053
9724 1 15 . 1 1 79 79 VAL CA C 509 59.471 59.471 60.549 -1.078 18053
9725 1 15 . 1 1 79 79 VAL CB C 509 33.676 33.676 35.091 -1.415 18053
9726 1 15 . 1 1 79 79 VAL H H 509 8.534 8.534 8.682 -0.148 18053
9727 1 15 . 1 1 80 80 THR N N 510 124.533 124.533 125.244 -0.711 18053
9728 1 15 . 1 1 80 80 THR HA H 510 4.586 4.586 5.194 -0.608 18053
9729 1 15 . 1 1 80 80 THR C C 510 172.215 172.215 173.843 -1.628 18053
9730 1 15 . 1 1 80 80 THR CA C 510 62.119 62.119 61.206 0.913 18053
9731 1 15 . 1 1 80 80 THR CB C 510 69.407 69.407 69.617 -0.210 18053
9732 1 15 . 1 1 80 80 THR H H 510 8.301 8.301 9.031 -0.730 18053
9733 1 15 . 1 1 81 81 VAL N N 511 127.002 127.002 127.342 -0.340 18053
9734 1 15 . 1 1 81 81 VAL HA H 511 4.596 4.596 4.541 0.055 18053
9735 1 15 . 1 1 81 81 VAL C C 511 176.667 176.667 175.752 0.915 18053
9736 1 15 . 1 1 81 81 VAL CA C 511 61.382 61.382 61.097 0.285 18053
9737 1 15 . 1 1 81 81 VAL CB C 511 30.945 30.945 30.511 0.434 18053
9738 1 15 . 1 1 81 81 VAL H H 511 8.796 8.796 8.737 0.059 18053
9739 1 15 . 1 1 82 82 TRP N N 512 131.479 131.479 129.391 2.088 18053
9740 1 15 . 1 1 82 82 TRP HA H 512 5.338 5.338 5.181 0.157 18053
9741 1 15 . 1 1 82 82 TRP C C 512 176.885 176.885 175.545 1.340 18053
9742 1 15 . 1 1 82 82 TRP CA C 512 56.442 56.442 56.998 -0.556 18053
9743 1 15 . 1 1 82 82 TRP CB C 512 30.701 30.701 31.075 -0.374 18053
9744 1 15 . 1 1 82 82 TRP H H 512 9.924 9.924 9.420 0.504 18053
9745 1 15 . 1 1 83 83 ALA N N 513 123.954 123.954 120.794 3.160 18053
9746 1 15 . 1 1 83 83 ALA HA H 513 4.308 4.308 5.145 -0.837 18053
9747 1 15 . 1 1 83 83 ALA C C 513 178.140 178.140 178.274 -0.134 18053
9748 1 15 . 1 1 83 83 ALA CA C 513 52.211 52.211 50.627 1.584 18053
9749 1 15 . 1 1 83 83 ALA CB C 513 18.745 18.745 20.702 -1.957 18053
9750 1 15 . 1 1 83 83 ALA H H 513 9.048 9.048 8.631 0.417 18053
9751 1 15 . 1 1 84 84 ALA N N 514 125.146 125.146 123.788 1.358 18053
9752 1 15 . 1 1 84 84 ALA HA H 514 3.951 3.951 4.243 -0.292 18053
9753 1 15 . 1 1 84 84 ALA C C 514 179.519 179.519 178.112 1.407 18053
9754 1 15 . 1 1 84 84 ALA CA C 514 54.804 54.804 54.573 0.231 18053
9755 1 15 . 1 1 84 84 ALA CB C 514 18.582 18.582 19.160 -0.577 18053
9756 1 15 . 1 1 84 84 ALA H H 514 8.341 8.341 8.194 0.147 18053
9757 1 15 . 1 1 85 85 GLY N N 515 103.388 103.388 103.489 -0.101 18053
9758 1 15 . 1 1 85 85 GLY C C 515 174.674 174.674 174.934 -0.260 18053
9759 1 15 . 1 1 85 85 GLY CA C 515 45.878 45.878 44.086 1.792 18053
9760 1 15 . 1 1 85 85 GLY H H 515 7.996 7.996 7.766 0.230 18053
9761 1 15 . 1 1 86 86 ALA N N 516 120.140 120.140 123.957 -3.817 18053
9762 1 15 . 1 1 86 86 ALA HA H 516 4.344 4.344 4.493 -0.149 18053
9763 1 15 . 1 1 86 86 ALA C C 516 177.690 177.690 177.779 -0.089 18053
9764 1 15 . 1 1 86 86 ALA CA C 516 53.139 53.139 52.421 0.718 18053
9765 1 15 . 1 1 86 86 ALA CB C 516 20.547 20.547 19.596 0.951 18053
9766 1 15 . 1 1 86 86 ALA H H 516 7.474 7.474 7.322 0.152 18053
9767 1 15 . 1 1 87 87 GLY N N 517 105.720 105.720 107.048 -1.328 18053
9768 1 15 . 1 1 87 87 GLY C C 517 173.650 173.650 174.112 -0.462 18053
9769 1 15 . 1 1 87 87 GLY CA C 517 46.014 46.014 45.208 0.806 18053
9770 1 15 . 1 1 87 87 GLY H H 517 7.779 7.779 8.407 -0.628 18053
9771 1 15 . 1 1 88 88 VAL N N 518 121.537 121.537 118.748 2.789 18053
9772 1 15 . 1 1 88 88 VAL HA H 518 3.585 3.585 4.235 -0.650 18053
9773 1 15 . 1 1 88 88 VAL C C 518 174.851 174.851 174.185 0.666 18053
9774 1 15 . 1 1 88 88 VAL CA C 518 61.274 61.274 60.918 0.356 18053
9775 1 15 . 1 1 88 88 VAL CB C 518 33.376 33.376 33.840 -0.464 18053
9776 1 15 . 1 1 88 88 VAL H H 518 7.499 7.499 7.675 -0.176 18053
9777 1 15 . 1 1 89 89 ALA N N 519 128.295 128.295 129.063 -0.768 18053
9778 1 15 . 1 1 89 89 ALA HA H 519 4.192 4.192 4.546 -0.354 18053
9779 1 15 . 1 1 89 89 ALA C C 519 176.680 176.680 176.251 0.429 18053
9780 1 15 . 1 1 89 89 ALA CA C 519 51.283 51.283 51.327 -0.044 18053
9781 1 15 . 1 1 89 89 ALA CB C 519 19.292 19.292 19.959 -0.667 18053
9782 1 15 . 1 1 89 89 ALA H H 519 7.960 7.960 7.996 -0.036 18053
9783 1 15 . 1 1 90 90 HIS N N 520 122.643 122.643 120.086 2.557 18053
9784 1 15 . 1 1 90 90 HIS HA H 520 4.033 4.033 4.444 -0.411 18053
9785 1 15 . 1 1 90 90 HIS C C 520 175.793 175.793 174.435 1.358 18053
9786 1 15 . 1 1 90 90 HIS CA C 520 58.653 58.653 56.223 2.430 18053
9787 1 15 . 1 1 90 90 HIS CB C 520 32.285 32.285 30.172 2.114 18053
9788 1 15 . 1 1 90 90 HIS H H 520 8.394 8.394 8.511 -0.117 18053
9789 1 15 . 1 1 91 91 SER N N 521 121.247 121.247 123.199 -1.952 18053
9790 1 15 . 1 1 91 91 SER HA H 521 4.629 4.629 4.730 -0.101 18053
9791 1 15 . 1 1 91 91 SER CA C 521 55.843 55.843 55.929 -0.086 18053
9792 1 15 . 1 1 91 91 SER CB C 521 62.367 62.367 63.356 -0.989 18053
9793 1 15 . 1 1 91 91 SER H H 521 8.569 8.569 8.555 0.014 18053
9794 1 15 . 1 1 92 92 PRO HA H 522 4.002 4.002 4.792 -0.790 18053
9795 1 15 . 1 1 92 92 PRO CA C 522 62.244 62.244 61.894 0.350 18053
9796 1 15 . 1 1 92 92 PRO CB C 522 30.931 30.931 31.738 -0.807 18053
9797 1 15 . 1 1 93 93 PRO HA H 523 4.672 4.672 4.743 -0.071 18053
9798 1 15 . 1 1 93 93 PRO C C 523 177.786 177.786 178.472 -0.686 18053
9799 1 15 . 1 1 93 93 PRO CA C 523 64.003 64.003 64.106 -0.103 18053
9800 1 15 . 1 1 93 93 PRO CB C 523 34.905 34.905 32.492 2.413 18053
9801 1 15 . 1 1 94 94 SER N N 524 117.212 117.212 117.517 -0.305 18053
9802 1 15 . 1 1 94 94 SER HA H 524 4.678 4.678 4.371 0.307 18053
9803 1 15 . 1 1 94 94 SER C C 524 174.851 174.851 174.806 0.045 18053
9804 1 15 . 1 1 94 94 SER CA C 524 61.874 61.874 61.666 0.208 18053
9805 1 15 . 1 1 94 94 SER CB C 524 64.057 64.057 63.397 0.660 18053
9806 1 15 . 1 1 94 94 SER H H 524 8.463 8.463 8.301 0.162 18053
9807 1 15 . 1 1 95 95 THR N N 525 121.588 121.588 119.426 2.162 18053
9808 1 15 . 1 1 95 95 THR HA H 525 4.859 4.859 5.061 -0.202 18053
9809 1 15 . 1 1 95 95 THR C C 525 172.094 172.094 173.638 -1.544 18053
9810 1 15 . 1 1 95 95 THR CA C 525 62.309 62.309 62.416 -0.107 18053
9811 1 15 . 1 1 95 95 THR CB C 525 70.281 70.281 68.435 1.846 18053
9812 1 15 . 1 1 95 95 THR H H 525 7.631 7.631 7.934 -0.303 18053
9813 1 15 . 1 1 96 96 LEU N N 526 127.274 127.274 128.338 -1.064 18053
9814 1 15 . 1 1 96 96 LEU HA H 526 5.131 5.131 4.901 0.230 18053
9815 1 15 . 1 1 96 96 LEU C C 526 175.916 175.916 175.804 0.112 18053
9816 1 15 . 1 1 96 96 LEU CA C 526 52.075 52.075 54.605 -2.530 18053
9817 1 15 . 1 1 96 96 LEU CB C 526 43.790 43.790 43.484 0.306 18053
9818 1 15 . 1 1 96 96 LEU H H 526 8.977 8.977 8.150 0.827 18053
9819 1 15 . 1 1 97 97 VAL N N 527 124.056 124.056 119.536 4.520 18053
9820 1 15 . 1 1 97 97 VAL HA H 527 4.869 4.869 4.673 0.196 18053
9821 1 15 . 1 1 97 97 VAL C C 527 176.230 176.230 175.545 0.685 18053
9822 1 15 . 1 1 97 97 VAL CA C 527 61.519 61.519 61.486 0.033 18053
9823 1 15 . 1 1 97 97 VAL CB C 527 33.704 33.704 34.519 -0.815 18053
9824 1 15 . 1 1 97 97 VAL H H 527 10.724 10.724 8.242 2.482 18053
9825 1 15 . 1 1 98 98 TRP N N 528 132.586 132.586 130.650 1.936 18053
9826 1 15 . 1 1 98 98 TRP HA H 528 4.965 4.965 4.542 0.423 18053
9827 1 15 . 1 1 98 98 TRP C C 528 173.391 173.391 174.924 -1.533 18053
9828 1 15 . 1 1 98 98 TRP CA C 528 53.303 53.303 55.635 -2.332 18053
9829 1 15 . 1 1 98 98 TRP CB C 528 28.245 28.245 28.453 -0.208 18053
9830 1 15 . 1 1 98 98 TRP H H 528 9.400 9.400 9.151 0.249 18053
9831 1 15 . 1 1 99 99 LYS N N 529 126.644 126.644 127.226 -0.582 18053
9832 1 15 . 1 1 99 99 LYS HA H 529 3.839 3.839 4.194 -0.355 18053
9833 1 15 . 1 1 99 99 LYS C C 529 177.581 177.581 177.236 0.345 18053
9834 1 15 . 1 1 99 99 LYS CA C 529 58.543 58.543 57.337 1.206 18053
9835 1 15 . 1 1 99 99 LYS CB C 529 32.176 32.176 32.748 -0.572 18053
9836 1 15 . 1 1 99 99 LYS H H 529 8.153 8.153 8.030 0.123 18053
9837 1 15 . 1 1 100 100 GLY N N 530 110.385 110.385 113.697 -3.312 18053
9838 1 15 . 1 1 100 100 GLY C C 530 172.367 172.367 173.765 -1.398 18053
9839 1 15 . 1 1 100 100 GLY CA C 530 45.278 45.278 44.815 0.464 18053
9840 1 15 . 1 1 100 100 GLY H H 530 8.363 8.363 8.657 -0.294 18053
9841 1 15 . 1 1 101 101 GLN N N 531 121.162 121.162 122.534 -1.372 18053
9842 1 15 . 1 1 101 101 GLN HA H 531 3.972 3.972 4.409 -0.437 18053
9843 1 15 . 1 1 101 101 GLN CA C 531 52.620 52.620 54.051 -1.431 18053
9844 1 15 . 1 1 101 101 GLN CB C 531 27.595 27.595 29.241 -1.646 18053
9845 1 15 . 1 1 101 101 GLN H H 531 6.815 6.815 7.412 -0.597 18053
9846 1 15 . 1 1 102 102 SER N N 532 122.728 122.728 120.898 1.830 18053
9847 1 15 . 1 1 102 102 SER HA H 532 3.866 3.866 4.499 -0.633 18053
9848 1 15 . 1 1 102 102 SER C C 532 174.537 174.537 175.630 -1.093 18053
9849 1 15 . 1 1 102 102 SER CA C 532 61.983 61.983 60.399 1.584 18053
9850 1 15 . 1 1 102 102 SER CB C 532 62.802 62.802 63.124 -0.322 18053
9851 1 15 . 1 1 102 102 SER H H 532 8.662 8.662 8.894 -0.232 18053
9852 1 15 . 1 1 103 103 SER N N 533 110.811 110.811 115.800 -4.989 18053
9853 1 15 . 1 1 103 103 SER HA H 533 4.240 4.240 4.434 -0.194 18053
9854 1 15 . 1 1 103 103 SER C C 533 174.087 174.087 174.298 -0.211 18053
9855 1 15 . 1 1 103 103 SER CA C 533 56.633 56.633 59.295 -2.662 18053
9856 1 15 . 1 1 103 103 SER CB C 533 64.658 64.658 63.202 1.456 18053
9857 1 15 . 1 1 103 103 SER H H 533 7.134 7.134 7.618 -0.484 18053
9858 1 15 . 1 1 104 104 TRP N N 534 126.133 126.133 118.633 7.500 18053
9859 1 15 . 1 1 104 104 TRP HA H 534 4.098 4.098 4.233 -0.135 18053
9860 1 15 . 1 1 104 104 TRP C C 534 176.066 176.066 175.741 0.325 18053
9861 1 15 . 1 1 104 104 TRP CA C 534 60.127 60.127 57.650 2.477 18053
9862 1 15 . 1 1 104 104 TRP CB C 534 28.764 28.764 29.181 -0.417 18053
9863 1 15 . 1 1 104 104 TRP H H 534 9.764 9.764 7.991 1.773 18053
9864 1 15 . 1 1 105 105 GLY N N 535 105.907 105.907 104.532 1.375 18053
9865 1 15 . 1 1 105 105 GLY C C 535 172.217 172.217 175.071 -2.854 18053
9866 1 15 . 1 1 105 105 GLY CA C 535 44.240 44.240 44.932 -0.692 18053
9867 1 15 . 1 1 105 105 GLY H H 535 8.095 8.095 7.939 0.156 18053
9868 1 15 . 1 1 106 106 THR N N 536 111.253 111.253 116.730 -5.477 18053
9869 1 15 . 1 1 106 106 THR HA H 536 3.859 3.859 4.252 -0.393 18053
9870 1 15 . 1 1 106 106 THR C C 536 172.872 172.872 174.483 -1.611 18053
9871 1 15 . 1 1 106 106 THR CA C 536 59.635 59.635 63.795 -4.160 18053
9872 1 15 . 1 1 106 106 THR CB C 536 70.526 70.526 69.891 0.634 18053
9873 1 15 . 1 1 106 106 THR H H 536 7.913 7.913 7.880 0.033 18053
9874 1 15 . 1 1 107 107 GLY N N 537 107.712 107.712 113.687 -5.975 18053
9875 1 15 . 1 1 107 107 GLY C C 537 172.709 172.709 173.070 -0.361 18053
9876 1 15 . 1 1 107 107 GLY CA C 537 45.166 45.166 45.427 -0.261 18053
9877 1 15 . 1 1 107 107 GLY H H 537 7.533 7.533 8.243 -0.710 18053
9878 1 15 . 1 1 108 108 GLU N N 538 118.864 118.864 119.787 -0.923 18053
9879 1 15 . 1 1 108 108 GLU HA H 538 4.136 4.136 4.301 -0.165 18053
9880 1 15 . 1 1 108 108 GLU C C 538 176.353 176.353 175.968 0.385 18053
9881 1 15 . 1 1 108 108 GLU CA C 538 58.352 58.352 57.840 0.513 18053
9882 1 15 . 1 1 108 108 GLU CB C 538 30.156 30.156 30.801 -0.645 18053
9883 1 15 . 1 1 108 108 GLU H H 538 8.558 8.558 8.777 -0.219 18053
9884 1 15 . 1 1 109 109 SER N N 539 110.419 110.419 111.691 -1.272 18053
9885 1 15 . 1 1 109 109 SER HA H 539 4.963 4.963 5.066 -0.103 18053
9886 1 15 . 1 1 109 109 SER C C 539 173.787 173.787 173.169 0.618 18053
9887 1 15 . 1 1 109 109 SER CA C 539 57.125 57.125 57.667 -0.542 18053
9888 1 15 . 1 1 109 109 SER CB C 539 64.439 64.439 65.839 -1.400 18053
9889 1 15 . 1 1 109 109 SER H H 539 7.620 7.620 7.574 0.046 18053
9890 1 15 . 1 1 110 110 PHE N N 540 118.778 118.778 117.582 1.196 18053
9891 1 15 . 1 1 110 110 PHE HA H 540 5.081 5.081 5.033 0.048 18053
9892 1 15 . 1 1 110 110 PHE C C 540 176.052 176.052 172.824 3.228 18053
9893 1 15 . 1 1 110 110 PHE CA C 540 56.789 56.789 57.121 -0.332 18053
9894 1 15 . 1 1 110 110 PHE CB C 540 40.760 40.760 41.606 -0.846 18053
9895 1 15 . 1 1 110 110 PHE H H 540 8.318 8.318 8.839 -0.521 18053
9896 1 15 . 1 1 112 112 THR HA H 542 5.468 5.468 4.925 0.543 18053
9897 1 15 . 1 1 112 112 THR C C 542 172.381 172.381 173.949 -1.568 18053
9898 1 15 . 1 1 112 112 THR CA C 542 61.818 61.818 62.454 -0.636 18053
9899 1 15 . 1 1 112 112 THR CB C 542 70.990 70.990 69.595 1.395 18053
9900 1 15 . 1 1 113 113 VAL N N 543 124.771 124.771 127.428 -2.657 18053
9901 1 15 . 1 1 113 113 VAL HA H 543 4.864 4.864 4.396 0.468 18053
9902 1 15 . 1 1 113 113 VAL C C 543 173.132 173.132 174.161 -1.029 18053
9903 1 15 . 1 1 113 113 VAL CA C 543 60.099 60.099 61.105 -1.006 18053
9904 1 15 . 1 1 113 113 VAL CB C 543 36.433 36.433 34.151 2.282 18053
9905 1 15 . 1 1 113 113 VAL H H 543 9.380 9.380 8.496 0.884 18053
9906 1 15 . 1 1 114 114 LEU N N 544 128.789 128.789 126.772 2.017 18053
9907 1 15 . 1 1 114 114 LEU HA H 544 5.320 5.320 4.976 0.344 18053
9908 1 15 . 1 1 114 114 LEU C C 544 174.237 174.237 175.011 -0.774 18053
9909 1 15 . 1 1 114 114 LEU CA C 544 53.193 53.193 53.631 -0.438 18053
9910 1 15 . 1 1 114 114 LEU CB C 544 45.879 45.879 45.114 0.765 18053
9911 1 15 . 1 1 114 114 LEU H H 544 8.948 8.948 8.405 0.543 18053
9912 1 15 . 1 1 115 115 VAL N N 545 127.002 127.002 124.579 2.423 18053
9913 1 15 . 1 1 115 115 VAL HA H 545 4.854 4.854 4.887 -0.033 18053
9914 1 15 . 1 1 115 115 VAL C C 545 175.206 175.206 174.370 0.836 18053
9915 1 15 . 1 1 115 115 VAL CA C 545 59.334 59.334 60.196 -0.862 18053
9916 1 15 . 1 1 115 115 VAL CB C 545 34.495 34.495 35.602 -1.107 18053
9917 1 15 . 1 1 115 115 VAL H H 545 9.564 9.564 9.049 0.515 18053
9918 1 15 . 1 1 116 116 ASN N N 546 121.179 121.179 121.672 -0.493 18053
9919 1 15 . 1 1 116 116 ASN HA H 546 2.897 2.897 3.806 -0.909 18053
9920 1 15 . 1 1 116 116 ASN C C 546 176.885 176.885 175.342 1.543 18053
9921 1 15 . 1 1 116 116 ASN CA C 546 50.409 50.409 51.150 -0.741 18053
9922 1 15 . 1 1 116 116 ASN CB C 546 36.639 36.639 38.906 -2.267 18053
9923 1 15 . 1 1 116 116 ASN H H 546 8.016 8.016 7.893 0.123 18053
9924 1 15 . 1 1 117 117 ALA N N 547 119.834 119.834 121.704 -1.870 18053
9925 1 15 . 1 1 117 117 ALA HA H 547 3.866 3.866 4.114 -0.248 18053
9926 1 15 . 1 1 117 117 ALA C C 547 177.772 177.772 178.087 -0.315 18053
9927 1 15 . 1 1 117 117 ALA CA C 547 54.504 54.504 54.155 0.349 18053
9928 1 15 . 1 1 117 117 ALA CB C 547 18.200 18.200 18.339 -0.139 18053
9929 1 15 . 1 1 117 117 ALA H H 547 6.444 6.444 8.083 -1.639 18053
9930 1 15 . 1 1 118 118 ASP N N 548 115.646 115.646 117.882 -2.236 18053
9931 1 15 . 1 1 118 118 ASP HA H 548 4.644 4.644 4.401 0.243 18053
9932 1 15 . 1 1 118 118 ASP C C 548 176.052 176.052 177.569 -1.517 18053
9933 1 15 . 1 1 118 118 ASP CA C 548 54.067 54.067 55.543 -1.476 18053
9934 1 15 . 1 1 118 118 ASP CB C 548 41.674 41.674 41.404 0.270 18053
9935 1 15 . 1 1 118 118 ASP H H 548 7.181 7.181 7.691 -0.510 18053
9936 1 15 . 1 1 119 119 GLY N N 549 107.167 107.167 106.873 0.294 18053
9937 1 15 . 1 1 119 119 GLY C C 549 173.841 173.841 173.475 0.366 18053
9938 1 15 . 1 1 119 119 GLY CA C 549 45.455 45.455 44.603 0.852 18053
9939 1 15 . 1 1 119 119 GLY H H 549 7.738 7.738 7.697 0.041 18053
9940 1 15 . 1 1 120 120 GLU N N 550 121.196 121.196 119.781 1.415 18053
9941 1 15 . 1 1 120 120 GLU HA H 550 4.112 4.112 4.353 -0.241 18053
9942 1 15 . 1 1 120 120 GLU C C 550 175.588 175.588 175.461 0.127 18053
9943 1 15 . 1 1 120 120 GLU CA C 550 54.831 54.831 55.233 -0.402 18053
9944 1 15 . 1 1 120 120 GLU CB C 550 29.937 29.937 30.613 -0.676 18053
9945 1 15 . 1 1 120 120 GLU H H 550 7.587 7.587 7.695 -0.108 18053
9946 1 15 . 1 1 121 121 GLU N N 551 123.886 123.886 123.213 0.673 18053
9947 1 15 . 1 1 121 121 GLU HA H 551 4.276 4.276 4.384 -0.108 18053
9948 1 15 . 1 1 121 121 GLU C C 551 176.817 176.817 175.940 0.877 18053
9949 1 15 . 1 1 121 121 GLU CA C 551 56.796 56.796 56.161 0.635 18053
9950 1 15 . 1 1 121 121 GLU CB C 551 28.955 28.955 28.648 0.307 18053
9951 1 15 . 1 1 121 121 GLU H H 551 8.697 8.697 8.723 -0.026 18053
9952 1 15 . 1 1 122 122 VAL N N 552 120.055 120.055 123.687 -3.632 18053
9953 1 15 . 1 1 122 122 VAL HA H 552 4.364 4.364 4.019 0.345 18053
9954 1 15 . 1 1 122 122 VAL C C 552 175.998 175.998 175.296 0.702 18053
9955 1 15 . 1 1 122 122 VAL CA C 552 61.655 61.655 62.461 -0.806 18053
9956 1 15 . 1 1 122 122 VAL CB C 552 33.049 33.049 32.328 0.721 18053
9957 1 15 . 1 1 122 122 VAL H H 552 8.845 8.845 8.529 0.316 18053
9958 1 15 . 1 1 123 123 ALA N N 553 122.098 122.098 119.545 2.553 18053
9959 1 15 . 1 1 123 123 ALA HA H 553 4.890 4.890 4.675 0.215 18053
9960 1 15 . 1 1 123 123 ALA C C 553 175.261 175.261 175.308 -0.047 18053
9961 1 15 . 1 1 123 123 ALA CA C 553 52.757 52.757 51.691 1.066 18053
9962 1 15 . 1 1 123 123 ALA CB C 553 22.267 22.267 21.521 0.746 18053
9963 1 15 . 1 1 123 123 ALA H H 553 7.788 7.788 7.596 0.192 18053
9964 1 15 . 1 1 124 124 MET N N 554 118.217 118.217 119.608 -1.391 18053
9965 1 15 . 1 1 124 124 MET HA H 554 5.286 5.286 5.096 0.190 18053
9966 1 15 . 1 1 124 124 MET C C 554 174.428 174.428 174.293 0.135 18053
9967 1 15 . 1 1 124 124 MET CA C 554 55.104 55.104 55.719 -0.615 18053
9968 1 15 . 1 1 124 124 MET CB C 554 35.342 35.342 37.006 -1.664 18053
9969 1 15 . 1 1 124 124 MET H H 554 8.693 8.693 8.475 0.218 18053
9970 1 15 . 1 1 125 125 ARG N N 555 122.132 122.132 125.303 -3.171 18053
9971 1 15 . 1 1 125 125 ARG HA H 555 4.900 4.900 4.763 0.137 18053
9972 1 15 . 1 1 125 125 ARG CA C 555 56.388 56.388 55.253 1.135 18053
9973 1 15 . 1 1 125 125 ARG CB C 555 34.378 34.378 32.519 1.859 18053
9974 1 15 . 1 1 125 125 ARG H H 555 8.919 8.919 8.942 -0.023 18053
9975 1 15 . 1 1 126 126 THR HA H 556 4.685 4.685 4.439 0.246 18053
9976 1 15 . 1 1 126 126 THR C C 556 172.436 172.436 173.817 -1.381 18053
9977 1 15 . 1 1 126 126 THR CA C 556 61.382 61.382 63.109 -1.727 18053
9978 1 15 . 1 1 126 126 THR CB C 556 70.444 70.444 68.902 1.542 18053
9979 1 15 . 1 1 127 127 VAL N N 557 124.976 124.976 127.861 -2.885 18053
9980 1 15 . 1 1 127 127 VAL HA H 557 4.146 4.146 4.094 0.052 18053
9981 1 15 . 1 1 127 127 VAL C C 557 173.937 173.937 173.939 -0.002 18053
9982 1 15 . 1 1 127 127 VAL CA C 557 61.109 61.109 60.942 0.167 18053
9983 1 15 . 1 1 127 127 VAL CB C 557 33.759 33.759 33.127 0.632 18053
9984 1 15 . 1 1 127 127 VAL H H 557 8.127 8.127 8.437 -0.309 18053
9985 1 15 . 1 1 128 128 LYS N N 558 125.384 125.384 125.892 -0.508 18053
9986 1 15 . 1 1 128 128 LYS HA H 558 4.706 4.706 4.604 0.102 18053
9987 1 15 . 1 1 128 128 LYS C C 558 175.534 175.534 175.370 0.164 18053
9988 1 15 . 1 1 128 128 LYS CA C 558 54.886 54.886 53.304 1.582 18053
9989 1 15 . 1 1 128 128 LYS CB C 558 34.673 34.673 33.245 1.428 18053
9990 1 15 . 1 1 128 128 LYS H H 558 8.289 8.289 8.284 0.005 18053
9991 1 15 . 1 1 129 129 LYS N N 559 124.005 124.005 127.923 -3.918 18053
9992 1 15 . 1 1 129 129 LYS HA H 559 4.310 4.310 4.130 0.180 18053
9993 1 15 . 1 1 129 129 LYS C C 559 176.571 176.571 175.436 1.135 18053
9994 1 15 . 1 1 129 129 LYS CA C 559 56.742 56.742 57.167 -0.425 18053
9995 1 15 . 1 1 129 129 LYS CB C 559 33.362 33.362 31.663 1.699 18053
9996 1 15 . 1 1 129 129 LYS H H 559 8.461 8.461 8.522 -0.061 18053
9997 1 15 . 1 1 130 130 SER N N 560 117.195 117.195 120.156 -2.961 18053
9998 1 15 . 1 1 130 130 SER HA H 560 4.384 4.384 4.560 -0.176 18053
9999 1 15 . 1 1 130 130 SER C C 560 174.565 174.565 174.342 0.223 18053
10000 1 15 . 1 1 130 130 SER CA C 560 58.434 58.434 58.030 0.404 18053
10001 1 15 . 1 1 130 130 SER CB C 560 63.812 63.812 64.328 -0.516 18053
10002 1 15 . 1 1 130 130 SER H H 560 8.465 8.465 8.189 0.276 18053
10003 1 15 . 1 1 131 131 SER N N 561 118.149 118.149 116.766 1.383 18053
10004 1 15 . 1 1 131 131 SER HA H 561 4.412 4.412 4.302 0.110 18053
10005 1 15 . 1 1 131 131 SER C C 561 174.456 174.456 174.492 -0.036 18053
10006 1 15 . 1 1 131 131 SER CA C 561 58.489 58.489 58.575 -0.086 18053
10007 1 15 . 1 1 131 131 SER CB C 561 63.811 63.811 63.881 -0.070 18053
10008 1 15 . 1 1 131 131 SER H H 561 8.336 8.336 8.355 -0.019 18053
10009 1 15 . 1 1 132 132 VAL N N 562 121.332 121.332 122.745 -1.413 18053
10010 1 15 . 1 1 132 132 VAL HA H 562 4.035 4.035 4.025 0.010 18053
10011 1 15 . 1 1 132 132 VAL C C 562 176.066 176.066 176.075 -0.009 18053
10012 1 15 . 1 1 132 132 VAL CA C 562 62.446 62.446 63.559 -1.113 18053
10013 1 15 . 1 1 132 132 VAL CB C 562 32.394 32.394 32.111 0.283 18053
10014 1 15 . 1 1 132 132 VAL H H 562 7.982 7.982 8.170 -0.188 18053
10015 1 15 . 1 1 133 133 MET N N 563 124.022 124.022 119.394 4.628 18053
10016 1 15 . 1 1 133 133 MET HA H 563 4.385 4.385 4.426 -0.041 18053
10017 1 15 . 1 1 133 133 MET C C 563 176.039 176.039 176.329 -0.290 18053
10018 1 15 . 1 1 133 133 MET CA C 563 55.350 55.350 55.761 -0.411 18053
10019 1 15 . 1 1 133 133 MET CB C 563 32.503 32.503 32.658 -0.155 18053
10020 1 15 . 1 1 133 133 MET H H 563 8.295 8.295 7.579 0.716 18053
10021 1 15 . 1 1 134 134 ARG N N 564 122.677 122.677 124.097 -1.420 18053
10022 1 15 . 1 1 134 134 ARG HA H 564 4.262 4.262 4.545 -0.283 18053
10023 1 15 . 1 1 134 134 ARG C C 564 176.298 176.298 175.991 0.307 18053
10024 1 15 . 1 1 134 134 ARG CA C 564 56.087 56.087 54.800 1.287 18053
10025 1 15 . 1 1 134 134 ARG CB C 564 30.702 30.702 31.514 -0.812 18053
10026 1 15 . 1 1 134 134 ARG H H 564 8.295 8.295 8.570 -0.275 18053
10027 1 15 . 1 1 135 135 GLU N N 565 121.945 121.945 122.399 -0.454 18053
10028 1 15 . 1 1 135 135 GLU HA H 565 4.160 4.160 4.260 -0.100 18053
10029 1 15 . 1 1 135 135 GLU C C 565 176.080 176.080 175.906 0.174 18053
10030 1 15 . 1 1 135 135 GLU CA C 565 56.906 56.906 56.981 -0.075 18053
10031 1 15 . 1 1 135 135 GLU CB C 565 29.774 29.774 29.018 0.756 18053
10032 1 15 . 1 1 135 135 GLU H H 565 8.470 8.470 8.561 -0.091 18053
10033 1 15 . 1 1 136 136 ASN N N 566 118.761 118.761 123.379 -4.618 18053
10034 1 15 . 1 1 136 136 ASN HA H 566 4.617 4.617 4.712 -0.095 18053
10035 1 15 . 1 1 136 136 ASN C C 566 175.315 175.315 175.623 -0.308 18053
10036 1 15 . 1 1 136 136 ASN CA C 566 53.193 53.193 53.149 0.044 18053
10037 1 15 . 1 1 136 136 ASN CB C 566 38.836 38.836 38.803 0.033 18053
10038 1 15 . 1 1 136 136 ASN H H 566 8.341 8.341 8.659 -0.318 18053
10039 1 15 . 1 1 137 137 GLU N N 567 121.349 121.349 121.888 -0.539 18053
10040 1 15 . 1 1 137 137 GLU HA H 567 4.152 4.152 4.323 -0.171 18053
10041 1 15 . 1 1 137 137 GLU C C 567 176.243 176.243 176.241 0.002 18053
10042 1 15 . 1 1 137 137 GLU CA C 567 56.906 56.906 57.519 -0.613 18053
10043 1 15 . 1 1 137 137 GLU CB C 567 29.992 29.992 29.576 0.416 18053
10044 1 15 . 1 1 137 137 GLU H H 567 8.349 8.349 8.413 -0.064 18053
10045 1 15 . 1 1 138 138 ASN N N 568 118.761 118.761 117.676 1.085 18053
10046 1 15 . 1 1 138 138 ASN HA H 568 4.712 4.712 4.587 0.125 18053
10047 1 15 . 1 1 138 138 ASN C C 568 174.551 174.551 174.109 0.442 18053
10048 1 15 . 1 1 138 138 ASN CA C 568 53.193 53.193 54.304 -1.111 18053
10049 1 15 . 1 1 138 138 ASN CB C 568 39.327 39.327 37.475 1.852 18053
10050 1 15 . 1 1 138 138 ASN H H 568 8.397 8.397 8.553 -0.156 18053
10051 1 16 . 1 1 20 20 ALA N N 450 125.180 125.180 128.002 -2.822 18053
10052 1 16 . 1 1 20 20 ALA HA H 450 4.706 4.706 4.582 0.124 18053
10053 1 16 . 1 1 20 20 ALA C C 450 177.226 177.226 175.610 1.616 18053
10054 1 16 . 1 1 20 20 ALA CA C 450 52.757 52.757 52.593 0.164 18053
10055 1 16 . 1 1 20 20 ALA CB C 450 20.411 20.411 21.037 -0.626 18053
10056 1 16 . 1 1 20 20 ALA H H 450 8.484 8.484 8.463 0.021 18053
10057 1 16 . 1 1 21 21 SER N N 451 115.714 115.714 119.007 -3.293 18053
10058 1 16 . 1 1 21 21 SER HA H 451 4.513 4.513 4.323 0.190 18053
10059 1 16 . 1 1 21 21 SER C C 451 174.742 174.742 176.235 -1.493 18053
10060 1 16 . 1 1 21 21 SER CA C 451 58.516 58.516 57.518 0.998 18053
10061 1 16 . 1 1 21 21 SER CB C 451 64.159 64.159 62.211 1.948 18053
10062 1 16 . 1 1 21 21 SER H H 451 8.487 8.487 8.509 -0.022 18053
10063 1 16 . 1 1 22 22 GLY N N 452 111.509 111.509 117.374 -5.865 18053
10064 1 16 . 1 1 22 22 GLY C C 452 174.401 174.401 175.810 -1.409 18053
10065 1 16 . 1 1 22 22 GLY CA C 452 45.059 45.059 45.690 -0.631 18053
10066 1 16 . 1 1 22 22 GLY H H 452 8.198 8.198 8.310 -0.112 18053
10067 1 16 . 1 1 23 23 SER N N 453 116.191 116.191 116.366 -0.175 18053
10068 1 16 . 1 1 23 23 SER HA H 453 4.364 4.364 4.256 0.108 18053
10069 1 16 . 1 1 23 23 SER C C 453 173.432 173.432 174.414 -0.982 18053
10070 1 16 . 1 1 23 23 SER CA C 453 59.744 59.744 61.797 -2.053 18053
10071 1 16 . 1 1 23 23 SER CB C 453 64.335 64.335 63.773 0.562 18053
10072 1 16 . 1 1 23 23 SER H H 453 8.494 8.494 7.955 0.539 18053
10073 1 16 . 1 1 24 24 VAL N N 454 121.656 121.656 120.807 0.849 18053
10074 1 16 . 1 1 24 24 VAL HA H 454 5.035 5.035 4.395 0.640 18053
10075 1 16 . 1 1 24 24 VAL C C 454 174.606 174.606 175.363 -0.757 18053
10076 1 16 . 1 1 24 24 VAL CA C 454 61.055 61.055 62.238 -1.183 18053
10077 1 16 . 1 1 24 24 VAL CB C 454 32.503 32.503 32.429 0.074 18053
10078 1 16 . 1 1 24 24 VAL H H 454 7.830 7.830 8.115 -0.285 18053
10079 1 16 . 1 1 25 25 SER N N 455 119.323 119.323 122.561 -3.238 18053
10080 1 16 . 1 1 25 25 SER HA H 455 4.672 4.672 4.859 -0.187 18053
10081 1 16 . 1 1 25 25 SER C C 455 174.426 174.426 173.885 0.541 18053
10082 1 16 . 1 1 25 25 SER CA C 455 55.268 55.268 56.194 -0.926 18053
10083 1 16 . 1 1 25 25 SER CB C 455 65.162 65.162 65.421 -0.259 18053
10084 1 16 . 1 1 25 25 SER H H 455 9.065 9.065 8.742 0.323 18053
10085 1 16 . 1 1 26 26 ILE N N 456 119.468 119.468 124.886 -5.418 18053
10086 1 16 . 1 1 26 26 ILE HA H 456 4.180 4.180 3.980 0.200 18053
10087 1 16 . 1 1 26 26 ILE C C 456 175.506 175.506 176.299 -0.793 18053
10088 1 16 . 1 1 26 26 ILE CA C 456 61.328 61.328 62.273 -0.945 18053
10089 1 16 . 1 1 26 26 ILE CB C 456 37.962 37.962 38.104 -0.142 18053
10090 1 16 . 1 1 26 26 ILE H H 456 8.295 8.295 8.801 -0.506 18053
10091 1 16 . 1 1 27 27 GLU N N 457 129.726 129.726 127.922 1.804 18053
10092 1 16 . 1 1 27 27 GLU HA H 457 4.228 4.228 4.292 -0.064 18053
10093 1 16 . 1 1 27 27 GLU C C 457 175.179 175.179 177.101 -1.922 18053
10094 1 16 . 1 1 27 27 GLU CA C 457 55.432 55.432 57.956 -2.524 18053
10095 1 16 . 1 1 27 27 GLU CB C 457 30.142 30.142 30.393 -0.251 18053
10096 1 16 . 1 1 27 27 GLU H H 457 8.393 8.393 8.597 -0.204 18053
10097 1 16 . 1 1 28 28 GLU N N 458 117.076 117.076 117.366 -0.290 18053
10098 1 16 . 1 1 28 28 GLU HA H 458 4.168 4.168 4.612 -0.444 18053
10099 1 16 . 1 1 28 28 GLU C C 458 174.701 174.701 174.738 -0.037 18053
10100 1 16 . 1 1 28 28 GLU CA C 458 56.906 56.906 55.158 1.748 18053
10101 1 16 . 1 1 28 28 GLU CB C 458 31.848 31.848 33.115 -1.267 18053
10102 1 16 . 1 1 28 28 GLU H H 458 7.489 7.489 8.023 -0.534 18053
10103 1 16 . 1 1 29 29 ILE N N 459 122.183 122.183 120.854 1.329 18053
10104 1 16 . 1 1 29 29 ILE HA H 459 3.764 3.764 4.133 -0.369 18053
10105 1 16 . 1 1 29 29 ILE C C 459 174.169 174.169 175.370 -1.201 18053
10106 1 16 . 1 1 29 29 ILE CA C 459 59.526 59.526 57.751 1.775 18053
10107 1 16 . 1 1 29 29 ILE CB C 459 40.309 40.309 40.812 -0.503 18053
10108 1 16 . 1 1 29 29 ILE H H 459 8.126 8.126 8.273 -0.147 18053
10109 1 16 . 1 1 30 30 ASP N N 460 123.205 123.205 125.558 -2.353 18053
10110 1 16 . 1 1 30 30 ASP HA H 460 4.183 4.183 4.217 -0.034 18053
10111 1 16 . 1 1 30 30 ASP C C 460 178.318 178.318 176.105 2.213 18053
10112 1 16 . 1 1 30 30 ASP CA C 460 53.930 53.930 53.756 0.174 18053
10113 1 16 . 1 1 30 30 ASP CB C 460 42.807 42.807 41.221 1.586 18053
10114 1 16 . 1 1 30 30 ASP H H 460 6.704 6.704 7.730 -1.026 18053
10115 1 16 . 1 1 31 31 LEU N N 461 128.551 128.551 114.558 13.993 18053
10116 1 16 . 1 1 31 31 LEU HA H 461 4.064 4.064 4.469 -0.405 18053
10117 1 16 . 1 1 31 31 LEU C C 461 177.513 177.513 176.527 0.986 18053
10118 1 16 . 1 1 31 31 LEU CA C 461 57.124 57.124 55.130 1.994 18053
10119 1 16 . 1 1 31 31 LEU CB C 461 41.237 41.237 42.184 -0.947 18053
10120 1 16 . 1 1 31 31 LEU H H 461 9.012 9.012 7.842 1.170 18053
10121 1 16 . 1 1 32 32 GLU N N 462 115.101 115.101 117.442 -2.341 18053
10122 1 16 . 1 1 32 32 GLU HA H 462 4.283 4.283 4.533 -0.250 18053
10123 1 16 . 1 1 32 32 GLU C C 462 177.062 177.062 176.198 0.864 18053
10124 1 16 . 1 1 32 32 GLU CA C 462 55.759 55.759 55.523 0.236 18053
10125 1 16 . 1 1 32 32 GLU CB C 462 29.569 29.569 30.598 -1.029 18053
10126 1 16 . 1 1 32 32 GLU H H 462 7.588 7.588 7.998 -0.410 18053
10127 1 16 . 1 1 33 33 GLY N N 463 106.299 106.299 108.436 -2.137 18053
10128 1 16 . 1 1 33 33 GLY C C 463 174.824 174.824 174.087 0.737 18053
10129 1 16 . 1 1 33 33 GLY CA C 463 46.806 46.806 45.713 1.093 18053
10130 1 16 . 1 1 33 33 GLY H H 463 7.372 7.372 8.283 -0.911 18053
10131 1 16 . 1 1 34 34 LYS N N 464 118.744 118.744 116.702 2.042 18053
10132 1 16 . 1 1 34 34 LYS HA H 464 4.562 4.562 4.647 -0.085 18053
10133 1 16 . 1 1 34 34 LYS C C 464 177.076 177.076 174.704 2.372 18053
10134 1 16 . 1 1 34 34 LYS CA C 464 59.963 59.963 56.959 3.004 18053
10135 1 16 . 1 1 34 34 LYS CB C 464 33.111 33.111 34.435 -1.324 18053
10136 1 16 . 1 1 34 34 LYS H H 464 9.547 9.547 8.210 1.337 18053
10137 1 16 . 1 1 35 35 PHE N N 465 109.125 109.125 112.481 -3.356 18053
10138 1 16 . 1 1 35 35 PHE HA H 465 5.514 5.514 4.904 0.610 18053
10139 1 16 . 1 1 35 35 PHE C C 465 174.183 174.183 172.470 1.713 18053
10140 1 16 . 1 1 35 35 PHE CA C 465 56.632 56.632 56.126 0.506 18053
10141 1 16 . 1 1 35 35 PHE CB C 465 40.599 40.599 40.188 0.411 18053
10142 1 16 . 1 1 35 35 PHE H H 465 6.740 6.740 7.348 -0.608 18053
10143 1 16 . 1 1 36 36 VAL N N 466 119.579 119.579 120.640 -1.061 18053
10144 1 16 . 1 1 36 36 VAL HA H 466 3.709 3.709 3.959 -0.250 18053
10145 1 16 . 1 1 36 36 VAL C C 466 172.668 172.668 174.532 -1.864 18053
10146 1 16 . 1 1 36 36 VAL CA C 466 62.692 62.692 61.224 1.468 18053
10147 1 16 . 1 1 36 36 VAL CB C 466 36.215 36.215 33.076 3.139 18053
10148 1 16 . 1 1 36 36 VAL H H 466 7.628 7.628 8.418 -0.790 18053
10149 1 16 . 1 1 37 37 GLN N N 467 126.831 126.831 128.191 -1.360 18053
10150 1 16 . 1 1 37 37 GLN HA H 467 5.449 5.449 4.644 0.805 18053
10151 1 16 . 1 1 37 37 GLN C C 467 174.797 174.797 174.803 -0.006 18053
10152 1 16 . 1 1 37 37 GLN CA C 467 54.121 54.121 54.837 -0.716 18053
10153 1 16 . 1 1 37 37 GLN CB C 467 34.623 34.623 28.660 5.963 18053
10154 1 16 . 1 1 37 37 GLN H H 467 8.392 8.392 8.294 0.098 18053
10155 1 16 . 1 1 38 38 LEU N N 468 123.018 123.018 127.489 -4.471 18053
10156 1 16 . 1 1 38 38 LEU HA H 468 5.422 5.422 4.629 0.793 18053
10157 1 16 . 1 1 38 38 LEU C C 468 175.588 175.588 176.179 -0.591 18053
10158 1 16 . 1 1 38 38 LEU CA C 468 52.702 52.702 54.183 -1.481 18053
10159 1 16 . 1 1 38 38 LEU CB C 468 45.046 45.046 43.914 1.132 18053
10160 1 16 . 1 1 38 38 LEU H H 468 9.103 9.103 8.891 0.212 18053
10161 1 16 . 1 1 39 39 LYS N N 469 118.983 118.983 119.096 -0.113 18053
10162 1 16 . 1 1 39 39 LYS HA H 469 4.852 4.852 4.549 0.303 18053
10163 1 16 . 1 1 39 39 LYS C C 469 173.309 173.309 174.067 -0.758 18053
10164 1 16 . 1 1 39 39 LYS CA C 469 54.994 54.994 55.563 -0.569 18053
10165 1 16 . 1 1 39 39 LYS CB C 469 38.246 38.246 36.714 1.532 18053
10166 1 16 . 1 1 39 39 LYS H H 469 8.496 8.496 8.635 -0.139 18053
10167 1 16 . 1 1 40 40 ASN N N 470 121.758 121.758 122.604 -0.846 18053
10168 1 16 . 1 1 40 40 ASN HA H 470 4.788 4.788 4.739 0.049 18053
10169 1 16 . 1 1 40 40 ASN C C 470 174.496 174.496 174.920 -0.424 18053
10170 1 16 . 1 1 40 40 ASN CA C 470 51.119 51.119 52.673 -1.554 18053
10171 1 16 . 1 1 40 40 ASN CB C 470 37.559 37.559 39.707 -2.148 18053
10172 1 16 . 1 1 40 40 ASN H H 470 8.283 8.283 8.655 -0.372 18053
10173 1 16 . 1 1 41 41 ASN N N 471 122.422 122.422 123.339 -0.917 18053
10174 1 16 . 1 1 41 41 ASN HA H 471 4.588 4.588 4.828 -0.240 18053
10175 1 16 . 1 1 41 41 ASN C C 471 174.810 174.810 174.378 0.432 18053
10176 1 16 . 1 1 41 41 ASN CA C 471 53.985 53.985 53.001 0.985 18053
10177 1 16 . 1 1 41 41 ASN CB C 471 39.600 39.600 40.464 -0.864 18053
10178 1 16 . 1 1 41 41 ASN H H 471 8.681 8.681 8.865 -0.184 18053
10179 1 16 . 1 1 42 42 SER N N 472 116.446 116.446 117.010 -0.564 18053
10180 1 16 . 1 1 42 42 SER HA H 472 4.719 4.719 4.487 0.232 18053
10181 1 16 . 1 1 42 42 SER C C 472 172.804 172.804 174.675 -1.871 18053
10182 1 16 . 1 1 42 42 SER CA C 472 57.288 57.288 58.246 -0.959 18053
10183 1 16 . 1 1 42 42 SER CB C 472 66.241 66.241 64.711 1.530 18053
10184 1 16 . 1 1 42 42 SER H H 472 8.370 8.370 8.025 0.345 18053
10185 1 16 . 1 1 43 43 ASP N N 473 117.706 117.706 123.851 -6.145 18053
10186 1 16 . 1 1 43 43 ASP HA H 473 4.474 4.474 4.534 -0.060 18053
10187 1 16 . 1 1 43 43 ASP C C 473 175.343 175.343 176.026 -0.683 18053
10188 1 16 . 1 1 43 43 ASP CA C 473 53.521 53.521 55.470 -1.949 18053
10189 1 16 . 1 1 43 43 ASP CB C 473 40.322 40.322 41.330 -1.008 18053
10190 1 16 . 1 1 43 43 ASP H H 473 8.254 8.254 8.720 -0.466 18053
10191 1 16 . 1 1 44 44 LYS N N 474 120.209 120.209 118.296 1.913 18053
10192 1 16 . 1 1 44 44 LYS HA H 474 4.569 4.569 4.490 0.079 18053
10193 1 16 . 1 1 44 44 LYS C C 474 175.397 175.397 175.391 0.006 18053
10194 1 16 . 1 1 44 44 LYS CA C 474 54.012 54.012 54.555 -0.543 18053
10195 1 16 . 1 1 44 44 LYS CB C 474 35.383 35.383 33.945 1.438 18053
10196 1 16 . 1 1 44 44 LYS H H 474 8.305 8.305 7.312 0.993 18053
10197 1 16 . 1 1 45 45 ASP N N 475 124.993 124.993 121.226 3.767 18053
10198 1 16 . 1 1 45 45 ASP HA H 475 3.975 3.975 4.530 -0.555 18053
10199 1 16 . 1 1 45 45 ASP C C 475 174.810 174.810 176.029 -1.219 18053
10200 1 16 . 1 1 45 45 ASP CA C 475 54.995 54.995 54.532 0.463 18053
10201 1 16 . 1 1 45 45 ASP CB C 475 40.364 40.364 40.540 -0.176 18053
10202 1 16 . 1 1 45 45 ASP H H 475 8.722 8.722 8.489 0.233 18053
10203 1 16 . 1 1 46 46 GLN N N 476 120.549 120.549 125.282 -4.733 18053
10204 1 16 . 1 1 46 46 GLN HA H 476 4.436 4.436 4.393 0.043 18053
10205 1 16 . 1 1 46 46 GLN C C 476 174.019 174.019 175.097 -1.078 18053
10206 1 16 . 1 1 46 46 GLN CA C 476 53.138 53.138 54.672 -1.534 18053
10207 1 16 . 1 1 46 46 GLN CB C 476 31.466 31.466 29.970 1.496 18053
10208 1 16 . 1 1 46 46 GLN H H 476 7.878 7.878 8.223 -0.345 18053
10209 1 16 . 1 1 47 47 SER N N 477 121.537 121.537 121.692 -0.155 18053
10210 1 16 . 1 1 47 47 SER HA H 477 4.229 4.229 4.231 -0.002 18053
10211 1 16 . 1 1 47 47 SER C C 477 174.565 174.565 173.992 0.573 18053
10212 1 16 . 1 1 47 47 SER CA C 477 58.706 58.706 58.517 0.189 18053
10213 1 16 . 1 1 47 47 SER CB C 477 62.965 62.965 62.763 0.202 18053
10214 1 16 . 1 1 47 47 SER H H 477 8.748 8.748 8.744 0.004 18053
10215 1 16 . 1 1 48 48 LEU N N 478 127.751 127.751 126.335 1.416 18053
10216 1 16 . 1 1 48 48 LEU HA H 478 2.631 2.631 4.259 -1.628 18053
10217 1 16 . 1 1 48 48 LEU C C 478 176.789 176.789 177.190 -0.401 18053
10218 1 16 . 1 1 48 48 LEU CA C 478 52.102 52.102 54.110 -2.008 18053
10219 1 16 . 1 1 48 48 LEU CB C 478 42.343 42.343 43.739 -1.396 18053
10220 1 16 . 1 1 48 48 LEU H H 478 7.856 7.856 7.603 0.253 18053
10221 1 16 . 1 1 49 49 GLY N N 479 107.525 107.525 110.569 -3.044 18053
10222 1 16 . 1 1 49 49 GLY C C 479 176.653 176.653 175.131 1.522 18053
10223 1 16 . 1 1 49 49 GLY CA C 479 48.062 48.062 45.774 2.288 18053
10224 1 16 . 1 1 49 49 GLY H H 479 7.728 7.728 8.388 -0.660 18053
10225 1 16 . 1 1 50 50 ASN N N 480 117.059 117.059 119.637 -2.578 18053
10226 1 16 . 1 1 50 50 ASN HA H 480 4.255 4.255 4.598 -0.343 18053
10227 1 16 . 1 1 50 50 ASN C C 480 174.961 174.961 175.570 -0.609 18053
10228 1 16 . 1 1 50 50 ASN CA C 480 56.360 56.360 54.617 1.743 18053
10229 1 16 . 1 1 50 50 ASN CB C 480 37.416 37.416 39.000 -1.584 18053
10230 1 16 . 1 1 50 50 ASN H H 480 7.552 7.552 8.735 -1.183 18053
10231 1 16 . 1 1 51 51 TRP N N 481 122.166 122.166 117.991 4.175 18053
10232 1 16 . 1 1 51 51 TRP HA H 481 4.477 4.477 4.647 -0.170 18053
10233 1 16 . 1 1 51 51 TRP C C 481 175.575 175.575 175.747 -0.172 18053
10234 1 16 . 1 1 51 51 TRP CA C 481 58.762 58.762 58.431 0.331 18053
10235 1 16 . 1 1 51 51 TRP CB C 481 28.041 28.041 30.209 -2.168 18053
10236 1 16 . 1 1 51 51 TRP H H 481 8.914 8.914 7.842 1.072 18053
10237 1 16 . 1 1 52 52 ARG N N 482 116.480 116.480 115.198 1.282 18053
10238 1 16 . 1 1 52 52 ARG HA H 482 5.968 5.968 5.373 0.595 18053
10239 1 16 . 1 1 52 52 ARG C C 482 175.807 175.807 174.526 1.281 18053
10240 1 16 . 1 1 52 52 ARG CA C 482 54.121 54.121 55.385 -1.264 18053
10241 1 16 . 1 1 52 52 ARG CB C 482 35.124 35.124 34.251 0.873 18053
10242 1 16 . 1 1 52 52 ARG H H 482 9.147 9.147 9.187 -0.040 18053
10243 1 16 . 1 1 53 53 ILE N N 483 119.579 119.579 124.017 -4.438 18053
10244 1 16 . 1 1 53 53 ILE HA H 483 4.985 4.985 4.991 -0.006 18053
10245 1 16 . 1 1 53 53 ILE C C 483 175.670 175.670 175.978 -0.308 18053
10246 1 16 . 1 1 53 53 ILE CA C 483 60.400 60.400 60.516 -0.116 18053
10247 1 16 . 1 1 53 53 ILE CB C 483 40.227 40.227 38.562 1.665 18053
10248 1 16 . 1 1 53 53 ILE H H 483 9.000 9.000 8.592 0.408 18053
10249 1 16 . 1 1 54 54 LYS N N 484 124.737 124.737 128.261 -3.524 18053
10250 1 16 . 1 1 54 54 LYS HA H 484 5.463 5.463 5.081 0.382 18053
10251 1 16 . 1 1 54 54 LYS C C 484 175.575 175.575 176.272 -0.697 18053
10252 1 16 . 1 1 54 54 LYS CA C 484 54.613 54.613 56.316 -1.702 18053
10253 1 16 . 1 1 54 54 LYS CB C 484 35.041 35.041 34.077 0.964 18053
10254 1 16 . 1 1 54 54 LYS H H 484 9.678 9.678 8.512 1.166 18053
10255 1 16 . 1 1 55 55 ARG N N 485 124.090 124.090 122.084 2.006 18053
10256 1 16 . 1 1 55 55 ARG HA H 485 5.525 5.525 5.056 0.469 18053
10257 1 16 . 1 1 55 55 ARG C C 485 174.155 174.155 174.055 0.100 18053
10258 1 16 . 1 1 55 55 ARG CA C 485 53.903 53.903 56.148 -2.245 18053
10259 1 16 . 1 1 55 55 ARG H H 485 9.314 9.314 8.693 0.621 18053
10260 1 16 . 1 1 56 56 GLN N N 486 126.576 126.576 128.394 -1.818 18053
10261 1 16 . 1 1 56 56 GLN HA H 486 4.842 4.842 4.948 -0.106 18053
10262 1 16 . 1 1 56 56 GLN C C 486 174.991 174.991 174.828 0.163 18053
10263 1 16 . 1 1 56 56 GLN CA C 486 54.831 54.831 54.537 0.294 18053
10264 1 16 . 1 1 56 56 GLN CB C 486 31.465 31.465 31.090 0.375 18053
10265 1 16 . 1 1 56 56 GLN H H 486 8.831 8.831 8.663 0.168 18053
10266 1 16 . 1 1 57 57 VAL N N 487 126.712 126.712 125.608 1.104 18053
10267 1 16 . 1 1 57 57 VAL HA H 487 4.266 4.266 4.193 0.073 18053
10268 1 16 . 1 1 57 57 VAL C C 487 175.916 175.916 178.201 -2.285 18053
10269 1 16 . 1 1 57 57 VAL CA C 487 61.820 61.820 63.467 -1.647 18053
10270 1 16 . 1 1 57 57 VAL CB C 487 32.803 32.803 32.052 0.751 18053
10271 1 16 . 1 1 57 57 VAL H H 487 8.786 8.786 8.632 0.154 18053
10272 1 16 . 1 1 58 58 LEU N N 488 127.274 127.274 123.525 3.749 18053
10273 1 16 . 1 1 58 58 LEU HA H 488 4.085 4.085 4.097 -0.012 18053
10274 1 16 . 1 1 58 58 LEU C C 488 177.158 177.158 177.958 -0.800 18053
10275 1 16 . 1 1 58 58 LEU CA C 488 56.906 56.906 57.989 -1.083 18053
10276 1 16 . 1 1 58 58 LEU CB C 488 41.374 41.374 41.678 -0.304 18053
10277 1 16 . 1 1 58 58 LEU H H 488 8.316 8.316 8.561 -0.245 18053
10278 1 16 . 1 1 59 59 GLU N N 489 119.647 119.647 118.366 1.281 18053
10279 1 16 . 1 1 59 59 GLU HA H 489 4.112 4.112 4.215 -0.103 18053
10280 1 16 . 1 1 59 59 GLU C C 489 176.230 176.230 177.214 -0.984 18053
10281 1 16 . 1 1 59 59 GLU CA C 489 57.015 57.015 57.378 -0.363 18053
10282 1 16 . 1 1 59 59 GLU CB C 489 28.149 28.149 29.907 -1.758 18053
10283 1 16 . 1 1 59 59 GLU H H 489 8.636 8.636 8.237 0.399 18053
10284 1 16 . 1 1 60 60 GLY N N 490 108.819 108.819 106.853 1.966 18053
10285 1 16 . 1 1 60 60 GLY C C 490 173.568 173.568 173.292 0.276 18053
10286 1 16 . 1 1 60 60 GLY CA C 490 44.773 44.773 44.735 0.038 18053
10287 1 16 . 1 1 60 60 GLY H H 490 8.160 8.160 7.694 0.466 18053
10288 1 16 . 1 1 61 61 GLU N N 491 121.009 121.009 123.145 -2.136 18053
10289 1 16 . 1 1 61 61 GLU HA H 491 4.323 4.323 4.258 0.065 18053
10290 1 16 . 1 1 61 61 GLU C C 491 175.725 175.725 175.653 0.072 18053
10291 1 16 . 1 1 61 61 GLU CA C 491 56.196 56.196 56.734 -0.538 18053
10292 1 16 . 1 1 61 61 GLU CB C 491 30.865 30.865 29.426 1.439 18053
10293 1 16 . 1 1 61 61 GLU H H 491 8.320 8.320 8.622 -0.302 18053
10294 1 16 . 1 1 62 62 GLU N N 492 123.426 123.426 124.544 -1.118 18053
10295 1 16 . 1 1 62 62 GLU HA H 492 5.054 5.054 5.164 -0.110 18053
10296 1 16 . 1 1 62 62 GLU C C 492 175.930 175.930 176.289 -0.359 18053
10297 1 16 . 1 1 62 62 GLU CA C 492 55.650 55.650 54.551 1.099 18053
10298 1 16 . 1 1 62 62 GLU CB C 492 32.312 32.312 30.712 1.600 18053
10299 1 16 . 1 1 62 62 GLU H H 492 8.594 8.594 8.538 0.056 18053
10300 1 16 . 1 1 63 63 ILE N N 493 119.732 119.732 119.830 -0.098 18053
10301 1 16 . 1 1 63 63 ILE HA H 493 4.788 4.788 4.702 0.086 18053
10302 1 16 . 1 1 63 63 ILE C C 493 174.647 174.647 174.507 0.140 18053
10303 1 16 . 1 1 63 63 ILE CA C 493 60.181 60.181 60.017 0.164 18053
10304 1 16 . 1 1 63 63 ILE CB C 493 41.183 41.183 40.375 0.808 18053
10305 1 16 . 1 1 63 63 ILE H H 493 8.523 8.523 8.281 0.242 18053
10306 1 16 . 1 1 64 64 ALA N N 494 122.166 122.166 126.628 -4.462 18053
10307 1 16 . 1 1 64 64 ALA HA H 494 5.521 5.521 4.909 0.612 18053
10308 1 16 . 1 1 64 64 ALA C C 494 174.606 174.606 176.073 -1.467 18053
10309 1 16 . 1 1 64 64 ALA CA C 494 51.528 51.528 50.383 1.145 18053
10310 1 16 . 1 1 64 64 ALA CB C 494 22.239 22.239 21.041 1.198 18053
10311 1 16 . 1 1 64 64 ALA H H 494 8.741 8.741 8.280 0.461 18053
10312 1 16 . 1 1 65 65 TYR N N 495 126.729 126.729 126.089 0.640 18053
10313 1 16 . 1 1 65 65 TYR HA H 495 3.094 3.094 3.376 -0.282 18053
10314 1 16 . 1 1 65 65 TYR C C 495 173.036 173.036 174.103 -1.067 18053
10315 1 16 . 1 1 65 65 TYR CA C 495 56.905 56.905 56.055 0.850 18053
10316 1 16 . 1 1 65 65 TYR CB C 495 40.269 40.269 38.119 2.150 18053
10317 1 16 . 1 1 65 65 TYR H H 495 8.462 8.462 8.511 -0.049 18053
10318 1 16 . 1 1 66 66 LYS N N 496 128.108 128.108 127.945 0.163 18053
10319 1 16 . 1 1 66 66 LYS HA H 496 4.822 4.822 4.088 0.734 18053
10320 1 16 . 1 1 66 66 LYS C C 496 174.906 174.906 175.775 -0.869 18053
10321 1 16 . 1 1 66 66 LYS CA C 496 53.739 53.739 54.799 -1.060 18053
10322 1 16 . 1 1 66 66 LYS CB C 496 34.782 34.782 31.542 3.240 18053
10323 1 16 . 1 1 66 66 LYS H H 496 7.010 7.010 7.605 -0.595 18053
10324 1 16 . 1 1 67 67 PHE N N 497 125.299 125.299 124.144 1.155 18053
10325 1 16 . 1 1 67 67 PHE HA H 497 3.932 3.932 3.954 -0.022 18053
10326 1 16 . 1 1 67 67 PHE C C 497 177.990 177.990 175.855 2.135 18053
10327 1 16 . 1 1 67 67 PHE CA C 497 59.007 59.007 58.354 0.653 18053
10328 1 16 . 1 1 67 67 PHE CB C 497 40.981 40.981 39.850 1.131 18053
10329 1 16 . 1 1 67 67 PHE H H 497 8.509 8.509 7.868 0.641 18053
10330 1 16 . 1 1 68 68 THR N N 498 116.191 116.191 112.048 4.143 18053
10331 1 16 . 1 1 68 68 THR HA H 498 4.417 4.417 4.734 -0.317 18053
10332 1 16 . 1 1 68 68 THR CA C 498 60.855 60.855 59.050 1.805 18053
10333 1 16 . 1 1 68 68 THR CB C 498 68.019 68.019 69.439 -1.420 18053
10334 1 16 . 1 1 68 68 THR H H 498 8.688 8.688 8.406 0.282 18053
10335 1 16 . 1 1 69 69 PRO HA H 499 3.948 3.948 4.520 -0.572 18053
10336 1 16 . 1 1 69 69 PRO C C 499 177.444 177.444 176.957 0.487 18053
10337 1 16 . 1 1 69 69 PRO CA C 499 66.077 66.077 64.522 1.555 18053
10338 1 16 . 1 1 69 69 PRO CB C 499 32.776 32.776 31.933 0.843 18053
10339 1 16 . 1 1 70 70 LYS N N 500 113.552 113.552 115.416 -1.864 18053
10340 1 16 . 1 1 70 70 LYS HA H 500 4.385 4.385 4.171 0.214 18053
10341 1 16 . 1 1 70 70 LYS C C 500 176.325 176.325 176.689 -0.364 18053
10342 1 16 . 1 1 70 70 LYS CA C 500 54.995 54.995 56.953 -1.958 18053
10343 1 16 . 1 1 70 70 LYS CB C 500 31.793 31.793 31.877 -0.084 18053
10344 1 16 . 1 1 70 70 LYS H H 500 8.016 8.016 7.934 0.082 18053
10345 1 16 . 1 1 71 71 TYR N N 501 121.860 121.860 121.111 0.749 18053
10346 1 16 . 1 1 71 71 TYR HA H 501 3.730 3.730 4.473 -0.743 18053
10347 1 16 . 1 1 71 71 TYR C C 501 174.838 174.838 174.014 0.824 18053
10348 1 16 . 1 1 71 71 TYR CA C 501 62.310 62.310 58.778 3.532 18053
10349 1 16 . 1 1 71 71 TYR CB C 501 38.781 38.781 40.007 -1.226 18053
10350 1 16 . 1 1 71 71 TYR H H 501 7.460 7.460 7.697 -0.237 18053
10351 1 16 . 1 1 72 72 ILE N N 502 129.487 129.487 125.395 4.092 18053
10352 1 16 . 1 1 72 72 ILE HA H 502 3.928 3.928 4.390 -0.462 18053
10353 1 16 . 1 1 72 72 ILE C C 502 172.968 172.968 173.905 -0.937 18053
10354 1 16 . 1 1 72 72 ILE CA C 502 59.308 59.308 59.417 -0.109 18053
10355 1 16 . 1 1 72 72 ILE CB C 502 40.910 40.910 41.218 -0.308 18053
10356 1 16 . 1 1 72 72 ILE H H 502 7.168 7.168 7.616 -0.448 18053
10357 1 16 . 1 1 73 73 LEU N N 503 128.278 128.278 127.249 1.029 18053
10358 1 16 . 1 1 73 73 LEU HA H 503 4.493 4.493 4.508 -0.015 18053
10359 1 16 . 1 1 73 73 LEU C C 503 175.834 175.834 175.530 0.304 18053
10360 1 16 . 1 1 73 73 LEU CA C 503 51.965 51.965 52.822 -0.857 18053
10361 1 16 . 1 1 73 73 LEU CB C 503 42.548 42.548 44.242 -1.694 18053
10362 1 16 . 1 1 73 73 LEU H H 503 8.483 8.483 8.601 -0.118 18053
10363 1 16 . 1 1 74 74 ARG N N 504 129.589 129.589 122.774 6.815 18053
10364 1 16 . 1 1 74 74 ARG HA H 504 3.743 3.743 4.530 -0.787 18053
10365 1 16 . 1 1 74 74 ARG C C 504 175.233 175.233 175.743 -0.510 18053
10366 1 16 . 1 1 74 74 ARG CA C 504 56.851 56.851 54.876 1.975 18053
10367 1 16 . 1 1 74 74 ARG CB C 504 30.292 30.292 30.756 -0.464 18053
10368 1 16 . 1 1 74 74 ARG H H 504 8.673 8.673 8.508 0.165 18053
10369 1 16 . 1 1 75 75 ALA N N 505 123.205 123.205 125.026 -1.821 18053
10370 1 16 . 1 1 75 75 ALA HA H 505 3.522 3.522 4.112 -0.590 18053
10371 1 16 . 1 1 75 75 ALA C C 505 178.441 178.441 177.997 0.444 18053
10372 1 16 . 1 1 75 75 ALA CA C 505 53.794 53.794 53.112 0.681 18053
10373 1 16 . 1 1 75 75 ALA CB C 505 18.910 18.910 18.565 0.345 18053
10374 1 16 . 1 1 75 75 ALA H H 505 8.564 8.564 8.210 0.354 18053
10375 1 16 . 1 1 76 76 GLY N N 506 112.241 112.241 111.909 0.332 18053
10376 1 16 . 1 1 76 76 GLY C C 506 174.278 174.278 174.605 -0.327 18053
10377 1 16 . 1 1 76 76 GLY CA C 506 46.725 46.725 45.276 1.449 18053
10378 1 16 . 1 1 76 76 GLY H H 506 7.381 7.381 8.727 -1.346 18053
10379 1 16 . 1 1 77 77 GLN N N 507 117.382 117.382 119.975 -2.593 18053
10380 1 16 . 1 1 77 77 GLN HA H 507 4.364 4.364 4.483 -0.119 18053
10381 1 16 . 1 1 77 77 GLN C C 507 173.937 173.937 175.378 -1.441 18053
10382 1 16 . 1 1 77 77 GLN CA C 507 54.558 54.558 54.919 -0.361 18053
10383 1 16 . 1 1 77 77 GLN CB C 507 30.073 30.073 29.691 0.382 18053
10384 1 16 . 1 1 77 77 GLN H H 507 7.996 7.996 7.530 0.466 18053
10385 1 16 . 1 1 78 78 MET N N 508 116.957 116.957 117.583 -0.626 18053
10386 1 16 . 1 1 78 78 MET HA H 508 5.388 5.388 4.691 0.697 18053
10387 1 16 . 1 1 78 78 MET C C 508 175.807 175.807 174.504 1.303 18053
10388 1 16 . 1 1 78 78 MET CA C 508 54.067 54.067 54.722 -0.655 18053
10389 1 16 . 1 1 78 78 MET CB C 508 37.198 37.198 35.523 1.675 18053
10390 1 16 . 1 1 78 78 MET H H 508 8.092 8.092 8.329 -0.237 18053
10391 1 16 . 1 1 79 79 VAL N N 509 119.340 119.340 118.454 0.886 18053
10392 1 16 . 1 1 79 79 VAL HA H 509 4.956 4.956 4.615 0.341 18053
10393 1 16 . 1 1 79 79 VAL C C 509 172.217 172.217 173.937 -1.720 18053
10394 1 16 . 1 1 79 79 VAL CA C 509 59.471 59.471 61.127 -1.656 18053
10395 1 16 . 1 1 79 79 VAL CB C 509 33.676 33.676 36.775 -3.099 18053
10396 1 16 . 1 1 79 79 VAL H H 509 8.534 8.534 8.146 0.388 18053
10397 1 16 . 1 1 80 80 THR N N 510 124.533 124.533 123.709 0.824 18053
10398 1 16 . 1 1 80 80 THR HA H 510 4.586 4.586 5.121 -0.535 18053
10399 1 16 . 1 1 80 80 THR C C 510 172.215 172.215 174.071 -1.856 18053
10400 1 16 . 1 1 80 80 THR CA C 510 62.119 62.119 61.592 0.527 18053
10401 1 16 . 1 1 80 80 THR CB C 510 69.407 69.407 69.955 -0.548 18053
10402 1 16 . 1 1 80 80 THR H H 510 8.301 8.301 8.889 -0.588 18053
10403 1 16 . 1 1 81 81 VAL N N 511 127.002 127.002 127.687 -0.685 18053
10404 1 16 . 1 1 81 81 VAL HA H 511 4.596 4.596 4.794 -0.198 18053
10405 1 16 . 1 1 81 81 VAL C C 511 176.667 176.667 176.164 0.503 18053
10406 1 16 . 1 1 81 81 VAL CA C 511 61.382 61.382 62.041 -0.659 18053
10407 1 16 . 1 1 81 81 VAL CB C 511 30.945 30.945 31.753 -0.808 18053
10408 1 16 . 1 1 81 81 VAL H H 511 8.796 8.796 8.682 0.114 18053
10409 1 16 . 1 1 82 82 TRP N N 512 131.479 131.479 129.756 1.723 18053
10410 1 16 . 1 1 82 82 TRP HA H 512 5.338 5.338 5.279 0.059 18053
10411 1 16 . 1 1 82 82 TRP C C 512 176.885 176.885 175.802 1.083 18053
10412 1 16 . 1 1 82 82 TRP CA C 512 56.442 56.442 57.823 -1.381 18053
10413 1 16 . 1 1 82 82 TRP CB C 512 30.701 30.701 31.314 -0.613 18053
10414 1 16 . 1 1 82 82 TRP H H 512 9.924 9.924 8.842 1.082 18053
10415 1 16 . 1 1 83 83 ALA N N 513 123.954 123.954 120.570 3.384 18053
10416 1 16 . 1 1 83 83 ALA HA H 513 4.308 4.308 4.830 -0.522 18053
10417 1 16 . 1 1 83 83 ALA C C 513 178.140 178.140 178.025 0.115 18053
10418 1 16 . 1 1 83 83 ALA CA C 513 52.211 52.211 50.399 1.812 18053
10419 1 16 . 1 1 83 83 ALA CB C 513 18.745 18.745 20.631 -1.887 18053
10420 1 16 . 1 1 83 83 ALA H H 513 9.048 9.048 8.832 0.216 18053
10421 1 16 . 1 1 84 84 ALA N N 514 125.146 125.146 124.121 1.025 18053
10422 1 16 . 1 1 84 84 ALA HA H 514 3.951 3.951 4.197 -0.246 18053
10423 1 16 . 1 1 84 84 ALA C C 514 179.519 179.519 177.778 1.741 18053
10424 1 16 . 1 1 84 84 ALA CA C 514 54.804 54.804 54.142 0.662 18053
10425 1 16 . 1 1 84 84 ALA CB C 514 18.582 18.582 19.148 -0.565 18053
10426 1 16 . 1 1 84 84 ALA H H 514 8.341 8.341 8.327 0.014 18053
10427 1 16 . 1 1 85 85 GLY N N 515 103.388 103.388 103.547 -0.159 18053
10428 1 16 . 1 1 85 85 GLY C C 515 174.674 174.674 174.557 0.117 18053
10429 1 16 . 1 1 85 85 GLY CA C 515 45.878 45.878 44.146 1.732 18053
10430 1 16 . 1 1 85 85 GLY H H 515 7.996 7.996 7.608 0.388 18053
10431 1 16 . 1 1 86 86 ALA N N 516 120.140 120.140 122.656 -2.516 18053
10432 1 16 . 1 1 86 86 ALA HA H 516 4.344 4.344 4.723 -0.379 18053
10433 1 16 . 1 1 86 86 ALA C C 516 177.690 177.690 177.867 -0.177 18053
10434 1 16 . 1 1 86 86 ALA CA C 516 53.139 53.139 51.960 1.179 18053
10435 1 16 . 1 1 86 86 ALA CB C 516 20.547 20.547 19.525 1.022 18053
10436 1 16 . 1 1 86 86 ALA H H 516 7.474 7.474 7.313 0.161 18053
10437 1 16 . 1 1 87 87 GLY N N 517 105.720 105.720 107.579 -1.859 18053
10438 1 16 . 1 1 87 87 GLY C C 517 173.650 173.650 174.438 -0.788 18053
10439 1 16 . 1 1 87 87 GLY CA C 517 46.014 46.014 45.345 0.669 18053
10440 1 16 . 1 1 87 87 GLY H H 517 7.779 7.779 8.234 -0.455 18053
10441 1 16 . 1 1 88 88 VAL N N 518 121.537 121.537 118.019 3.518 18053
10442 1 16 . 1 1 88 88 VAL HA H 518 3.585 3.585 4.207 -0.622 18053
10443 1 16 . 1 1 88 88 VAL C C 518 174.851 174.851 174.343 0.508 18053
10444 1 16 . 1 1 88 88 VAL CA C 518 61.274 61.274 60.751 0.523 18053
10445 1 16 . 1 1 88 88 VAL CB C 518 33.376 33.376 33.581 -0.205 18053
10446 1 16 . 1 1 88 88 VAL H H 518 7.499 7.499 7.731 -0.232 18053
10447 1 16 . 1 1 89 89 ALA N N 519 128.295 128.295 128.530 -0.235 18053
10448 1 16 . 1 1 89 89 ALA HA H 519 4.192 4.192 4.445 -0.253 18053
10449 1 16 . 1 1 89 89 ALA C C 519 176.680 176.680 176.739 -0.059 18053
10450 1 16 . 1 1 89 89 ALA CA C 519 51.283 51.283 51.277 0.006 18053
10451 1 16 . 1 1 89 89 ALA CB C 519 19.292 19.292 19.601 -0.309 18053
10452 1 16 . 1 1 89 89 ALA H H 519 7.960 7.960 8.130 -0.170 18053
10453 1 16 . 1 1 90 90 HIS N N 520 122.643 122.643 123.355 -0.712 18053
10454 1 16 . 1 1 90 90 HIS HA H 520 4.033 4.033 4.552 -0.519 18053
10455 1 16 . 1 1 90 90 HIS C C 520 175.793 175.793 174.471 1.322 18053
10456 1 16 . 1 1 90 90 HIS CA C 520 58.653 58.653 56.530 2.123 18053
10457 1 16 . 1 1 90 90 HIS CB C 520 32.285 32.285 29.285 3.000 18053
10458 1 16 . 1 1 90 90 HIS H H 520 8.394 8.394 8.813 -0.419 18053
10459 1 16 . 1 1 91 91 SER N N 521 121.247 121.247 123.635 -2.388 18053
10460 1 16 . 1 1 91 91 SER HA H 521 4.629 4.629 4.681 -0.052 18053
10461 1 16 . 1 1 91 91 SER CA C 521 55.843 55.843 55.964 -0.121 18053
10462 1 16 . 1 1 91 91 SER CB C 521 62.367 62.367 63.600 -1.233 18053
10463 1 16 . 1 1 91 91 SER H H 521 8.569 8.569 8.461 0.108 18053
10464 1 16 . 1 1 92 92 PRO HA H 522 4.002 4.002 4.850 -0.848 18053
10465 1 16 . 1 1 92 92 PRO CA C 522 62.244 62.244 62.237 0.007 18053
10466 1 16 . 1 1 92 92 PRO CB C 522 30.931 30.931 31.453 -0.522 18053
10467 1 16 . 1 1 93 93 PRO HA H 523 4.672 4.672 4.954 -0.282 18053
10468 1 16 . 1 1 93 93 PRO C C 523 177.786 177.786 176.671 1.115 18053
10469 1 16 . 1 1 93 93 PRO CA C 523 64.003 64.003 63.474 0.529 18053
10470 1 16 . 1 1 93 93 PRO CB C 523 34.905 34.905 32.448 2.457 18053
10471 1 16 . 1 1 94 94 SER N N 524 117.212 117.212 117.038 0.174 18053
10472 1 16 . 1 1 94 94 SER HA H 524 4.678 4.678 4.690 -0.012 18053
10473 1 16 . 1 1 94 94 SER C C 524 174.851 174.851 174.592 0.259 18053
10474 1 16 . 1 1 94 94 SER CA C 524 61.874 61.874 60.052 1.822 18053
10475 1 16 . 1 1 94 94 SER CB C 524 64.057 64.057 64.138 -0.081 18053
10476 1 16 . 1 1 94 94 SER H H 524 8.463 8.463 7.680 0.783 18053
10477 1 16 . 1 1 95 95 THR N N 525 121.588 121.588 121.188 0.400 18053
10478 1 16 . 1 1 95 95 THR HA H 525 4.859 4.859 4.808 0.051 18053
10479 1 16 . 1 1 95 95 THR C C 525 172.094 172.094 173.196 -1.102 18053
10480 1 16 . 1 1 95 95 THR CA C 525 62.309 62.309 62.743 -0.434 18053
10481 1 16 . 1 1 95 95 THR CB C 525 70.281 70.281 67.776 2.505 18053
10482 1 16 . 1 1 95 95 THR H H 525 7.631 7.631 8.058 -0.427 18053
10483 1 16 . 1 1 96 96 LEU N N 526 127.274 127.274 130.509 -3.235 18053
10484 1 16 . 1 1 96 96 LEU HA H 526 5.131 5.131 4.867 0.264 18053
10485 1 16 . 1 1 96 96 LEU C C 526 175.916 175.916 175.987 -0.071 18053
10486 1 16 . 1 1 96 96 LEU CA C 526 52.075 52.075 54.213 -2.138 18053
10487 1 16 . 1 1 96 96 LEU CB C 526 43.790 43.790 42.695 1.095 18053
10488 1 16 . 1 1 96 96 LEU H H 526 8.977 8.977 8.194 0.783 18053
10489 1 16 . 1 1 97 97 VAL N N 527 124.056 124.056 124.769 -0.713 18053
10490 1 16 . 1 1 97 97 VAL HA H 527 4.869 4.869 4.434 0.435 18053
10491 1 16 . 1 1 97 97 VAL C C 527 176.230 176.230 175.569 0.661 18053
10492 1 16 . 1 1 97 97 VAL CA C 527 61.519 61.519 61.888 -0.368 18053
10493 1 16 . 1 1 97 97 VAL CB C 527 33.704 33.704 32.045 1.659 18053
10494 1 16 . 1 1 97 97 VAL H H 527 10.724 10.724 8.639 2.085 18053
10495 1 16 . 1 1 98 98 TRP N N 528 132.586 132.586 132.039 0.547 18053
10496 1 16 . 1 1 98 98 TRP HA H 528 4.965 4.965 4.244 0.721 18053
10497 1 16 . 1 1 98 98 TRP C C 528 173.391 173.391 174.505 -1.114 18053
10498 1 16 . 1 1 98 98 TRP CA C 528 53.303 53.303 55.083 -1.780 18053
10499 1 16 . 1 1 98 98 TRP CB C 528 28.245 28.245 28.135 0.110 18053
10500 1 16 . 1 1 98 98 TRP H H 528 9.400 9.400 9.009 0.391 18053
10501 1 16 . 1 1 99 99 LYS N N 529 126.644 126.644 128.522 -1.878 18053
10502 1 16 . 1 1 99 99 LYS HA H 529 3.839 3.839 4.182 -0.343 18053
10503 1 16 . 1 1 99 99 LYS C C 529 177.581 177.581 177.226 0.355 18053
10504 1 16 . 1 1 99 99 LYS CA C 529 58.543 58.543 57.190 1.353 18053
10505 1 16 . 1 1 99 99 LYS CB C 529 32.176 32.176 32.794 -0.618 18053
10506 1 16 . 1 1 99 99 LYS H H 529 8.153 8.153 7.962 0.191 18053
10507 1 16 . 1 1 100 100 GLY N N 530 110.385 110.385 112.810 -2.425 18053
10508 1 16 . 1 1 100 100 GLY C C 530 172.367 172.367 173.396 -1.029 18053
10509 1 16 . 1 1 100 100 GLY CA C 530 45.278 45.278 44.692 0.586 18053
10510 1 16 . 1 1 100 100 GLY H H 530 8.363 8.363 8.533 -0.170 18053
10511 1 16 . 1 1 101 101 GLN N N 531 121.162 121.162 121.022 0.140 18053
10512 1 16 . 1 1 101 101 GLN HA H 531 3.972 3.972 4.218 -0.246 18053
10513 1 16 . 1 1 101 101 GLN CA C 531 52.620 52.620 52.756 -0.136 18053
10514 1 16 . 1 1 101 101 GLN CB C 531 27.595 27.595 28.742 -1.147 18053
10515 1 16 . 1 1 101 101 GLN H H 531 6.815 6.815 7.134 -0.319 18053
10516 1 16 . 1 1 102 102 SER N N 532 122.728 122.728 122.638 0.090 18053
10517 1 16 . 1 1 102 102 SER HA H 532 3.866 3.866 4.356 -0.490 18053
10518 1 16 . 1 1 102 102 SER C C 532 174.537 174.537 175.613 -1.076 18053
10519 1 16 . 1 1 102 102 SER CA C 532 61.983 61.983 61.261 0.723 18053
10520 1 16 . 1 1 102 102 SER CB C 532 62.802 62.802 63.127 -0.325 18053
10521 1 16 . 1 1 102 102 SER H H 532 8.662 8.662 8.836 -0.174 18053
10522 1 16 . 1 1 103 103 SER N N 533 110.811 110.811 115.931 -5.120 18053
10523 1 16 . 1 1 103 103 SER HA H 533 4.240 4.240 4.847 -0.607 18053
10524 1 16 . 1 1 103 103 SER C C 533 174.087 174.087 173.544 0.543 18053
10525 1 16 . 1 1 103 103 SER CA C 533 56.633 56.633 57.358 -0.725 18053
10526 1 16 . 1 1 103 103 SER CB C 533 64.658 64.658 63.821 0.837 18053
10527 1 16 . 1 1 103 103 SER H H 533 7.134 7.134 7.656 -0.522 18053
10528 1 16 . 1 1 104 104 TRP N N 534 126.133 126.133 121.557 4.576 18053
10529 1 16 . 1 1 104 104 TRP HA H 534 4.098 4.098 4.091 0.007 18053
10530 1 16 . 1 1 104 104 TRP C C 534 176.066 176.066 175.640 0.426 18053
10531 1 16 . 1 1 104 104 TRP CA C 534 60.127 60.127 58.163 1.964 18053
10532 1 16 . 1 1 104 104 TRP CB C 534 28.764 28.764 28.580 0.184 18053
10533 1 16 . 1 1 104 104 TRP H H 534 9.764 9.764 7.746 2.018 18053
10534 1 16 . 1 1 105 105 GLY N N 535 105.907 105.907 106.223 -0.316 18053
10535 1 16 . 1 1 105 105 GLY C C 535 172.217 172.217 173.911 -1.694 18053
10536 1 16 . 1 1 105 105 GLY CA C 535 44.240 44.240 44.905 -0.665 18053
10537 1 16 . 1 1 105 105 GLY H H 535 8.095 8.095 7.624 0.471 18053
10538 1 16 . 1 1 106 106 THR N N 536 111.253 111.253 112.980 -1.727 18053
10539 1 16 . 1 1 106 106 THR HA H 536 3.859 3.859 4.166 -0.307 18053
10540 1 16 . 1 1 106 106 THR C C 536 172.872 172.872 174.383 -1.511 18053
10541 1 16 . 1 1 106 106 THR CA C 536 59.635 59.635 62.450 -2.814 18053
10542 1 16 . 1 1 106 106 THR CB C 536 70.526 70.526 69.110 1.416 18053
10543 1 16 . 1 1 106 106 THR H H 536 7.913 7.913 7.905 0.008 18053
10544 1 16 . 1 1 107 107 GLY N N 537 107.712 107.712 111.294 -3.582 18053
10545 1 16 . 1 1 107 107 GLY C C 537 172.709 172.709 173.406 -0.697 18053
10546 1 16 . 1 1 107 107 GLY CA C 537 45.166 45.166 44.923 0.242 18053
10547 1 16 . 1 1 107 107 GLY H H 537 7.533 7.533 7.874 -0.341 18053
10548 1 16 . 1 1 108 108 GLU N N 538 118.864 118.864 118.575 0.289 18053
10549 1 16 . 1 1 108 108 GLU HA H 538 4.136 4.136 4.187 -0.051 18053
10550 1 16 . 1 1 108 108 GLU C C 538 176.353 176.353 175.302 1.051 18053
10551 1 16 . 1 1 108 108 GLU CA C 538 58.352 58.352 58.132 0.220 18053
10552 1 16 . 1 1 108 108 GLU CB C 538 30.156 30.156 30.013 0.143 18053
10553 1 16 . 1 1 108 108 GLU H H 538 8.558 8.558 8.535 0.023 18053
10554 1 16 . 1 1 109 109 SER N N 539 110.419 110.419 109.797 0.622 18053
10555 1 16 . 1 1 109 109 SER HA H 539 4.963 4.963 4.772 0.191 18053
10556 1 16 . 1 1 109 109 SER C C 539 173.787 173.787 172.529 1.258 18053
10557 1 16 . 1 1 109 109 SER CA C 539 57.125 57.125 57.104 0.021 18053
10558 1 16 . 1 1 109 109 SER CB C 539 64.439 64.439 65.757 -1.318 18053
10559 1 16 . 1 1 109 109 SER H H 539 7.620 7.620 7.557 0.063 18053
10560 1 16 . 1 1 110 110 PHE N N 540 118.778 118.778 115.647 3.131 18053
10561 1 16 . 1 1 110 110 PHE HA H 540 5.081 5.081 5.292 -0.211 18053
10562 1 16 . 1 1 110 110 PHE C C 540 176.052 176.052 173.594 2.458 18053
10563 1 16 . 1 1 110 110 PHE CA C 540 56.789 56.789 56.913 -0.124 18053
10564 1 16 . 1 1 110 110 PHE CB C 540 40.760 40.760 42.250 -1.490 18053
10565 1 16 . 1 1 110 110 PHE H H 540 8.318 8.318 8.551 -0.233 18053
10566 1 16 . 1 1 112 112 THR HA H 542 5.468 5.468 4.827 0.641 18053
10567 1 16 . 1 1 112 112 THR C C 542 172.381 172.381 173.693 -1.312 18053
10568 1 16 . 1 1 112 112 THR CA C 542 61.818 61.818 62.633 -0.815 18053
10569 1 16 . 1 1 112 112 THR CB C 542 70.990 70.990 68.895 2.095 18053
10570 1 16 . 1 1 113 113 VAL N N 543 124.771 124.771 127.727 -2.956 18053
10571 1 16 . 1 1 113 113 VAL HA H 543 4.864 4.864 4.560 0.304 18053
10572 1 16 . 1 1 113 113 VAL C C 543 173.132 173.132 174.341 -1.209 18053
10573 1 16 . 1 1 113 113 VAL CA C 543 60.099 60.099 60.884 -0.785 18053
10574 1 16 . 1 1 113 113 VAL CB C 543 36.433 36.433 33.849 2.583 18053
10575 1 16 . 1 1 113 113 VAL H H 543 9.380 9.380 8.601 0.779 18053
10576 1 16 . 1 1 114 114 LEU N N 544 128.789 128.789 127.750 1.039 18053
10577 1 16 . 1 1 114 114 LEU HA H 544 5.320 5.320 5.110 0.210 18053
10578 1 16 . 1 1 114 114 LEU C C 544 174.237 174.237 174.942 -0.705 18053
10579 1 16 . 1 1 114 114 LEU CA C 544 53.193 53.193 53.685 -0.492 18053
10580 1 16 . 1 1 114 114 LEU CB C 544 45.879 45.879 44.604 1.275 18053
10581 1 16 . 1 1 114 114 LEU H H 544 8.948 8.948 8.507 0.441 18053
10582 1 16 . 1 1 115 115 VAL N N 545 127.002 127.002 125.288 1.714 18053
10583 1 16 . 1 1 115 115 VAL HA H 545 4.854 4.854 4.846 0.008 18053
10584 1 16 . 1 1 115 115 VAL C C 545 175.206 175.206 174.332 0.874 18053
10585 1 16 . 1 1 115 115 VAL CA C 545 59.334 59.334 59.824 -0.490 18053
10586 1 16 . 1 1 115 115 VAL CB C 545 34.495 34.495 35.336 -0.841 18053
10587 1 16 . 1 1 115 115 VAL H H 545 9.564 9.564 9.100 0.464 18053
10588 1 16 . 1 1 116 116 ASN N N 546 121.179 121.179 119.632 1.547 18053
10589 1 16 . 1 1 116 116 ASN HA H 546 2.897 2.897 4.376 -1.479 18053
10590 1 16 . 1 1 116 116 ASN C C 546 176.885 176.885 175.441 1.444 18053
10591 1 16 . 1 1 116 116 ASN CA C 546 50.409 50.409 51.389 -0.980 18053
10592 1 16 . 1 1 116 116 ASN CB C 546 36.639 36.639 39.675 -3.036 18053
10593 1 16 . 1 1 116 116 ASN H H 546 8.016 8.016 7.857 0.159 18053
10594 1 16 . 1 1 117 117 ALA N N 547 119.834 119.834 122.101 -2.267 18053
10595 1 16 . 1 1 117 117 ALA HA H 547 3.866 3.866 4.040 -0.174 18053
10596 1 16 . 1 1 117 117 ALA C C 547 177.772 177.772 177.952 -0.180 18053
10597 1 16 . 1 1 117 117 ALA CA C 547 54.504 54.504 54.496 0.008 18053
10598 1 16 . 1 1 117 117 ALA CB C 547 18.200 18.200 18.415 -0.215 18053
10599 1 16 . 1 1 117 117 ALA H H 547 6.444 6.444 8.304 -1.860 18053
10600 1 16 . 1 1 118 118 ASP N N 548 115.646 115.646 117.036 -1.390 18053
10601 1 16 . 1 1 118 118 ASP HA H 548 4.644 4.644 4.349 0.295 18053
10602 1 16 . 1 1 118 118 ASP C C 548 176.052 176.052 177.605 -1.553 18053
10603 1 16 . 1 1 118 118 ASP CA C 548 54.067 54.067 55.693 -1.626 18053
10604 1 16 . 1 1 118 118 ASP CB C 548 41.674 41.674 41.455 0.220 18053
10605 1 16 . 1 1 118 118 ASP H H 548 7.181 7.181 7.918 -0.737 18053
10606 1 16 . 1 1 119 119 GLY N N 549 107.167 107.167 106.487 0.680 18053
10607 1 16 . 1 1 119 119 GLY C C 549 173.841 173.841 173.547 0.294 18053
10608 1 16 . 1 1 119 119 GLY CA C 549 45.455 45.455 44.855 0.600 18053
10609 1 16 . 1 1 119 119 GLY H H 549 7.738 7.738 7.708 0.030 18053
10610 1 16 . 1 1 120 120 GLU N N 550 121.196 121.196 120.198 0.998 18053
10611 1 16 . 1 1 120 120 GLU HA H 550 4.112 4.112 4.209 -0.097 18053
10612 1 16 . 1 1 120 120 GLU C C 550 175.588 175.588 175.709 -0.121 18053
10613 1 16 . 1 1 120 120 GLU CA C 550 54.831 54.831 56.022 -1.191 18053
10614 1 16 . 1 1 120 120 GLU CB C 550 29.937 29.937 30.065 -0.128 18053
10615 1 16 . 1 1 120 120 GLU H H 550 7.587 7.587 7.682 -0.095 18053
10616 1 16 . 1 1 121 121 GLU N N 551 123.886 123.886 124.005 -0.119 18053
10617 1 16 . 1 1 121 121 GLU HA H 551 4.276 4.276 4.421 -0.145 18053
10618 1 16 . 1 1 121 121 GLU C C 551 176.817 176.817 176.550 0.267 18053
10619 1 16 . 1 1 121 121 GLU CA C 551 56.796 56.796 55.657 1.139 18053
10620 1 16 . 1 1 121 121 GLU CB C 551 28.955 28.955 29.062 -0.107 18053
10621 1 16 . 1 1 121 121 GLU H H 551 8.697 8.697 8.630 0.067 18053
10622 1 16 . 1 1 122 122 VAL N N 552 120.055 120.055 119.347 0.708 18053
10623 1 16 . 1 1 122 122 VAL HA H 552 4.364 4.364 3.920 0.444 18053
10624 1 16 . 1 1 122 122 VAL C C 552 175.998 175.998 175.224 0.774 18053
10625 1 16 . 1 1 122 122 VAL CA C 552 61.655 61.655 62.793 -1.138 18053
10626 1 16 . 1 1 122 122 VAL CB C 552 33.049 33.049 31.714 1.335 18053
10627 1 16 . 1 1 122 122 VAL H H 552 8.845 8.845 8.150 0.695 18053
10628 1 16 . 1 1 123 123 ALA N N 553 122.098 122.098 119.950 2.148 18053
10629 1 16 . 1 1 123 123 ALA HA H 553 4.890 4.890 4.581 0.309 18053
10630 1 16 . 1 1 123 123 ALA C C 553 175.261 175.261 174.590 0.671 18053
10631 1 16 . 1 1 123 123 ALA CA C 553 52.757 52.757 51.960 0.797 18053
10632 1 16 . 1 1 123 123 ALA CB C 553 22.267 22.267 21.780 0.487 18053
10633 1 16 . 1 1 123 123 ALA H H 553 7.788 7.788 7.511 0.277 18053
10634 1 16 . 1 1 124 124 MET N N 554 118.217 118.217 120.837 -2.620 18053
10635 1 16 . 1 1 124 124 MET HA H 554 5.286 5.286 4.979 0.307 18053
10636 1 16 . 1 1 124 124 MET C C 554 174.428 174.428 174.746 -0.318 18053
10637 1 16 . 1 1 124 124 MET CA C 554 55.104 55.104 55.790 -0.686 18053
10638 1 16 . 1 1 124 124 MET CB C 554 35.342 35.342 35.648 -0.306 18053
10639 1 16 . 1 1 124 124 MET H H 554 8.693 8.693 8.473 0.220 18053
10640 1 16 . 1 1 125 125 ARG N N 555 122.132 122.132 127.637 -5.505 18053
10641 1 16 . 1 1 125 125 ARG HA H 555 4.900 4.900 4.760 0.140 18053
10642 1 16 . 1 1 125 125 ARG CA C 555 56.388 56.388 54.201 2.187 18053
10643 1 16 . 1 1 125 125 ARG CB C 555 34.378 34.378 30.363 4.015 18053
10644 1 16 . 1 1 125 125 ARG H H 555 8.919 8.919 8.831 0.088 18053
10645 1 16 . 1 1 126 126 THR HA H 556 4.685 4.685 4.457 0.228 18053
10646 1 16 . 1 1 126 126 THR C C 556 172.436 172.436 174.189 -1.753 18053
10647 1 16 . 1 1 126 126 THR CA C 556 61.382 61.382 62.753 -1.371 18053
10648 1 16 . 1 1 126 126 THR CB C 556 70.444 70.444 68.488 1.956 18053
10649 1 16 . 1 1 127 127 VAL N N 557 124.976 124.976 123.674 1.302 18053
10650 1 16 . 1 1 127 127 VAL HA H 557 4.146 4.146 4.385 -0.239 18053
10651 1 16 . 1 1 127 127 VAL C C 557 173.937 173.937 174.462 -0.525 18053
10652 1 16 . 1 1 127 127 VAL CA C 557 61.109 61.109 60.111 0.998 18053
10653 1 16 . 1 1 127 127 VAL CB C 557 33.759 33.759 33.169 0.590 18053
10654 1 16 . 1 1 127 127 VAL H H 557 8.127 8.127 8.004 0.123 18053
10655 1 16 . 1 1 128 128 LYS N N 558 125.384 125.384 122.460 2.924 18053
10656 1 16 . 1 1 128 128 LYS HA H 558 4.706 4.706 4.598 0.107 18053
10657 1 16 . 1 1 128 128 LYS C C 558 175.534 175.534 176.159 -0.625 18053
10658 1 16 . 1 1 128 128 LYS CA C 558 54.886 54.886 53.635 1.251 18053
10659 1 16 . 1 1 128 128 LYS CB C 558 34.673 34.673 35.128 -0.455 18053
10660 1 16 . 1 1 128 128 LYS H H 558 8.289 8.289 8.278 0.011 18053
10661 1 16 . 1 1 129 129 LYS N N 559 124.005 124.005 122.775 1.230 18053
10662 1 16 . 1 1 129 129 LYS HA H 559 4.310 4.310 4.218 0.092 18053
10663 1 16 . 1 1 129 129 LYS C C 559 176.571 176.571 176.172 0.399 18053
10664 1 16 . 1 1 129 129 LYS CA C 559 56.742 56.742 57.259 -0.517 18053
10665 1 16 . 1 1 129 129 LYS CB C 559 33.362 33.362 31.401 1.961 18053
10666 1 16 . 1 1 129 129 LYS H H 559 8.461 8.461 8.421 0.040 18053
10667 1 16 . 1 1 130 130 SER N N 560 117.195 117.195 120.667 -3.472 18053
10668 1 16 . 1 1 130 130 SER HA H 560 4.384 4.384 4.422 -0.038 18053
10669 1 16 . 1 1 130 130 SER C C 560 174.565 174.565 173.752 0.813 18053
10670 1 16 . 1 1 130 130 SER CA C 560 58.434 58.434 58.157 0.277 18053
10671 1 16 . 1 1 130 130 SER CB C 560 63.812 63.812 63.335 0.477 18053
10672 1 16 . 1 1 130 130 SER H H 560 8.465 8.465 8.140 0.325 18053
10673 1 16 . 1 1 131 131 SER N N 561 118.149 118.149 116.172 1.977 18053
10674 1 16 . 1 1 131 131 SER HA H 561 4.412 4.412 4.298 0.114 18053
10675 1 16 . 1 1 131 131 SER C C 561 174.456 174.456 173.640 0.816 18053
10676 1 16 . 1 1 131 131 SER CA C 561 58.489 58.489 58.547 -0.058 18053
10677 1 16 . 1 1 131 131 SER CB C 561 63.811 63.811 63.504 0.307 18053
10678 1 16 . 1 1 131 131 SER H H 561 8.336 8.336 8.217 0.119 18053
10679 1 16 . 1 1 132 132 VAL N N 562 121.332 121.332 124.582 -3.250 18053
10680 1 16 . 1 1 132 132 VAL HA H 562 4.035 4.035 3.996 0.039 18053
10681 1 16 . 1 1 132 132 VAL C C 562 176.066 176.066 174.960 1.106 18053
10682 1 16 . 1 1 132 132 VAL CA C 562 62.446 62.446 61.853 0.593 18053
10683 1 16 . 1 1 132 132 VAL CB C 562 32.394 32.394 31.060 1.334 18053
10684 1 16 . 1 1 132 132 VAL H H 562 7.982 7.982 8.406 -0.424 18053
10685 1 16 . 1 1 133 133 MET N N 563 124.022 124.022 124.792 -0.770 18053
10686 1 16 . 1 1 133 133 MET HA H 563 4.385 4.385 4.497 -0.112 18053
10687 1 16 . 1 1 133 133 MET C C 563 176.039 176.039 176.262 -0.223 18053
10688 1 16 . 1 1 133 133 MET CA C 563 55.350 55.350 55.510 -0.160 18053
10689 1 16 . 1 1 133 133 MET CB C 563 32.503 32.503 31.123 1.380 18053
10690 1 16 . 1 1 133 133 MET H H 563 8.295 8.295 7.915 0.380 18053
10691 1 16 . 1 1 134 134 ARG N N 564 122.677 122.677 123.191 -0.514 18053
10692 1 16 . 1 1 134 134 ARG HA H 564 4.262 4.262 3.915 0.347 18053
10693 1 16 . 1 1 134 134 ARG C C 564 176.298 176.298 176.984 -0.686 18053
10694 1 16 . 1 1 134 134 ARG CA C 564 56.087 56.087 56.974 -0.887 18053
10695 1 16 . 1 1 134 134 ARG CB C 564 30.702 30.702 29.421 1.281 18053
10696 1 16 . 1 1 134 134 ARG H H 564 8.295 8.295 8.693 -0.398 18053
10697 1 16 . 1 1 135 135 GLU N N 565 121.945 121.945 116.570 5.375 18053
10698 1 16 . 1 1 135 135 GLU HA H 565 4.160 4.160 3.827 0.333 18053
10699 1 16 . 1 1 135 135 GLU C C 565 176.080 176.080 175.782 0.298 18053
10700 1 16 . 1 1 135 135 GLU CA C 565 56.906 56.906 58.200 -1.294 18053
10701 1 16 . 1 1 135 135 GLU CB C 565 29.774 29.774 28.946 0.828 18053
10702 1 16 . 1 1 135 135 GLU H H 565 8.470 8.470 8.792 -0.322 18053
10703 1 16 . 1 1 136 136 ASN N N 566 118.761 118.761 121.114 -2.353 18053
10704 1 16 . 1 1 136 136 ASN HA H 566 4.617 4.617 4.594 0.023 18053
10705 1 16 . 1 1 136 136 ASN C C 566 175.315 175.315 176.104 -0.789 18053
10706 1 16 . 1 1 136 136 ASN CA C 566 53.193 53.193 53.643 -0.450 18053
10707 1 16 . 1 1 136 136 ASN CB C 566 38.836 38.836 38.638 0.198 18053
10708 1 16 . 1 1 136 136 ASN H H 566 8.341 8.341 8.144 0.197 18053
10709 1 16 . 1 1 137 137 GLU N N 567 121.349 121.349 126.924 -5.575 18053
10710 1 16 . 1 1 137 137 GLU HA H 567 4.152 4.152 4.207 -0.055 18053
10711 1 16 . 1 1 137 137 GLU C C 567 176.243 176.243 176.180 0.063 18053
10712 1 16 . 1 1 137 137 GLU CA C 567 56.906 56.906 57.214 -0.308 18053
10713 1 16 . 1 1 137 137 GLU CB C 567 29.992 29.992 30.317 -0.325 18053
10714 1 16 . 1 1 137 137 GLU H H 567 8.349 8.349 8.430 -0.081 18053
10715 1 16 . 1 1 138 138 ASN N N 568 118.761 118.761 117.146 1.615 18053
10716 1 16 . 1 1 138 138 ASN HA H 568 4.712 4.712 4.512 0.200 18053
10717 1 16 . 1 1 138 138 ASN C C 568 174.551 174.551 174.271 0.280 18053
10718 1 16 . 1 1 138 138 ASN CA C 568 53.193 53.193 53.690 -0.497 18053
10719 1 16 . 1 1 138 138 ASN CB C 568 39.327 39.327 38.693 0.634 18053
10720 1 16 . 1 1 138 138 ASN H H 568 8.397 8.397 8.269 0.128 18053
10721 1 17 . 1 1 20 20 ALA N N 450 125.180 125.180 128.071 -2.891 18053
10722 1 17 . 1 1 20 20 ALA HA H 450 4.706 4.706 4.338 0.368 18053
10723 1 17 . 1 1 20 20 ALA C C 450 177.226 177.226 177.865 -0.639 18053
10724 1 17 . 1 1 20 20 ALA CA C 450 52.757 52.757 51.891 0.866 18053
10725 1 17 . 1 1 20 20 ALA CB C 450 20.411 20.411 19.140 1.271 18053
10726 1 17 . 1 1 20 20 ALA H H 450 8.484 8.484 8.562 -0.078 18053
10727 1 17 . 1 1 21 21 SER N N 451 115.714 115.714 121.632 -5.918 18053
10728 1 17 . 1 1 21 21 SER HA H 451 4.513 4.513 4.476 0.036 18053
10729 1 17 . 1 1 21 21 SER C C 451 174.742 174.742 175.504 -0.762 18053
10730 1 17 . 1 1 21 21 SER CA C 451 58.516 58.516 58.199 0.317 18053
10731 1 17 . 1 1 21 21 SER CB C 451 64.159 64.159 61.515 2.644 18053
10732 1 17 . 1 1 21 21 SER H H 451 8.487 8.487 8.306 0.181 18053
10733 1 17 . 1 1 22 22 GLY N N 452 111.509 111.509 114.180 -2.671 18053
10734 1 17 . 1 1 22 22 GLY C C 452 174.401 174.401 174.271 0.130 18053
10735 1 17 . 1 1 22 22 GLY CA C 452 45.059 45.059 46.777 -1.718 18053
10736 1 17 . 1 1 22 22 GLY H H 452 8.198 8.198 8.445 -0.247 18053
10737 1 17 . 1 1 23 23 SER N N 453 116.191 116.191 113.724 2.467 18053
10738 1 17 . 1 1 23 23 SER HA H 453 4.364 4.364 4.530 -0.166 18053
10739 1 17 . 1 1 23 23 SER C C 453 173.432 173.432 173.250 0.182 18053
10740 1 17 . 1 1 23 23 SER CA C 453 59.744 59.744 58.567 1.177 18053
10741 1 17 . 1 1 23 23 SER CB C 453 64.335 64.335 64.804 -0.469 18053
10742 1 17 . 1 1 23 23 SER H H 453 8.494 8.494 8.141 0.353 18053
10743 1 17 . 1 1 24 24 VAL N N 454 121.656 121.656 123.415 -1.759 18053
10744 1 17 . 1 1 24 24 VAL HA H 454 5.035 5.035 4.410 0.625 18053
10745 1 17 . 1 1 24 24 VAL C C 454 174.606 174.606 175.067 -0.461 18053
10746 1 17 . 1 1 24 24 VAL CA C 454 61.055 61.055 61.697 -0.642 18053
10747 1 17 . 1 1 24 24 VAL CB C 454 32.503 32.503 33.329 -0.826 18053
10748 1 17 . 1 1 24 24 VAL H H 454 7.830 7.830 7.764 0.066 18053
10749 1 17 . 1 1 25 25 SER N N 455 119.323 119.323 114.945 4.378 18053
10750 1 17 . 1 1 25 25 SER HA H 455 4.672 4.672 4.871 -0.199 18053
10751 1 17 . 1 1 25 25 SER C C 455 174.426 174.426 172.967 1.459 18053
10752 1 17 . 1 1 25 25 SER CA C 455 55.268 55.268 56.543 -1.275 18053
10753 1 17 . 1 1 25 25 SER CB C 455 65.162 65.162 64.956 0.206 18053
10754 1 17 . 1 1 25 25 SER H H 455 9.065 9.065 8.543 0.522 18053
10755 1 17 . 1 1 26 26 ILE N N 456 119.468 119.468 126.125 -6.657 18053
10756 1 17 . 1 1 26 26 ILE HA H 456 4.180 4.180 4.164 0.016 18053
10757 1 17 . 1 1 26 26 ILE C C 456 175.506 175.506 175.752 -0.246 18053
10758 1 17 . 1 1 26 26 ILE CA C 456 61.328 61.328 62.307 -0.979 18053
10759 1 17 . 1 1 26 26 ILE CB C 456 37.962 37.962 36.820 1.142 18053
10760 1 17 . 1 1 26 26 ILE H H 456 8.295 8.295 8.790 -0.495 18053
10761 1 17 . 1 1 27 27 GLU N N 457 129.726 129.726 129.313 0.413 18053
10762 1 17 . 1 1 27 27 GLU HA H 457 4.228 4.228 4.198 0.030 18053
10763 1 17 . 1 1 27 27 GLU C C 457 175.179 175.179 176.484 -1.305 18053
10764 1 17 . 1 1 27 27 GLU CA C 457 55.432 55.432 57.999 -2.567 18053
10765 1 17 . 1 1 27 27 GLU CB C 457 30.142 30.142 30.658 -0.516 18053
10766 1 17 . 1 1 27 27 GLU H H 457 8.393 8.393 8.290 0.103 18053
10767 1 17 . 1 1 28 28 GLU N N 458 117.076 117.076 116.877 0.199 18053
10768 1 17 . 1 1 28 28 GLU HA H 458 4.168 4.168 4.556 -0.388 18053
10769 1 17 . 1 1 28 28 GLU C C 458 174.701 174.701 174.505 0.196 18053
10770 1 17 . 1 1 28 28 GLU CA C 458 56.906 56.906 55.116 1.790 18053
10771 1 17 . 1 1 28 28 GLU CB C 458 31.848 31.848 33.353 -1.505 18053
10772 1 17 . 1 1 28 28 GLU H H 458 7.489 7.489 8.007 -0.518 18053
10773 1 17 . 1 1 29 29 ILE N N 459 122.183 122.183 119.931 2.252 18053
10774 1 17 . 1 1 29 29 ILE HA H 459 3.764 3.764 3.789 -0.025 18053
10775 1 17 . 1 1 29 29 ILE C C 459 174.169 174.169 174.413 -0.244 18053
10776 1 17 . 1 1 29 29 ILE CA C 459 59.526 59.526 59.495 0.031 18053
10777 1 17 . 1 1 29 29 ILE CB C 459 40.309 40.309 41.501 -1.192 18053
10778 1 17 . 1 1 29 29 ILE H H 459 8.126 8.126 8.300 -0.174 18053
10779 1 17 . 1 1 30 30 ASP N N 460 123.205 123.205 124.255 -1.050 18053
10780 1 17 . 1 1 30 30 ASP HA H 460 4.183 4.183 4.538 -0.355 18053
10781 1 17 . 1 1 30 30 ASP C C 460 178.318 178.318 176.556 1.762 18053
10782 1 17 . 1 1 30 30 ASP CA C 460 53.930 53.930 53.230 0.700 18053
10783 1 17 . 1 1 30 30 ASP CB C 460 42.807 42.807 42.562 0.245 18053
10784 1 17 . 1 1 30 30 ASP H H 460 6.704 6.704 7.472 -0.768 18053
10785 1 17 . 1 1 31 31 LEU N N 461 128.551 128.551 115.926 12.625 18053
10786 1 17 . 1 1 31 31 LEU HA H 461 4.064 4.064 4.135 -0.071 18053
10787 1 17 . 1 1 31 31 LEU C C 461 177.513 177.513 177.791 -0.278 18053
10788 1 17 . 1 1 31 31 LEU CA C 461 57.124 57.124 56.803 0.321 18053
10789 1 17 . 1 1 31 31 LEU CB C 461 41.237 41.237 41.632 -0.395 18053
10790 1 17 . 1 1 31 31 LEU H H 461 9.012 9.012 8.412 0.600 18053
10791 1 17 . 1 1 32 32 GLU N N 462 115.101 115.101 117.305 -2.204 18053
10792 1 17 . 1 1 32 32 GLU HA H 462 4.283 4.283 4.315 -0.032 18053
10793 1 17 . 1 1 32 32 GLU C C 462 177.062 177.062 176.803 0.259 18053
10794 1 17 . 1 1 32 32 GLU CA C 462 55.759 55.759 57.406 -1.647 18053
10795 1 17 . 1 1 32 32 GLU CB C 462 29.569 29.569 30.459 -0.890 18053
10796 1 17 . 1 1 32 32 GLU H H 462 7.588 7.588 7.858 -0.270 18053
10797 1 17 . 1 1 33 33 GLY N N 463 106.299 106.299 106.301 -0.002 18053
10798 1 17 . 1 1 33 33 GLY C C 463 174.824 174.824 175.063 -0.239 18053
10799 1 17 . 1 1 33 33 GLY CA C 463 46.806 46.806 45.139 1.667 18053
10800 1 17 . 1 1 33 33 GLY H H 463 7.372 7.372 7.831 -0.459 18053
10801 1 17 . 1 1 34 34 LYS N N 464 118.744 118.744 119.873 -1.129 18053
10802 1 17 . 1 1 34 34 LYS HA H 464 4.562 4.562 4.569 -0.007 18053
10803 1 17 . 1 1 34 34 LYS C C 464 177.076 177.076 175.238 1.838 18053
10804 1 17 . 1 1 34 34 LYS CA C 464 59.963 59.963 57.326 2.637 18053
10805 1 17 . 1 1 34 34 LYS CB C 464 33.111 33.111 34.152 -1.041 18053
10806 1 17 . 1 1 34 34 LYS H H 464 9.547 9.547 8.406 1.141 18053
10807 1 17 . 1 1 35 35 PHE N N 465 109.125 109.125 114.619 -5.494 18053
10808 1 17 . 1 1 35 35 PHE HA H 465 5.514 5.514 5.321 0.193 18053
10809 1 17 . 1 1 35 35 PHE C C 465 174.183 174.183 173.031 1.152 18053
10810 1 17 . 1 1 35 35 PHE CA C 465 56.632 56.632 55.747 0.885 18053
10811 1 17 . 1 1 35 35 PHE CB C 465 40.599 40.599 41.262 -0.663 18053
10812 1 17 . 1 1 35 35 PHE H H 465 6.740 6.740 8.110 -1.370 18053
10813 1 17 . 1 1 36 36 VAL N N 466 119.579 119.579 119.925 -0.346 18053
10814 1 17 . 1 1 36 36 VAL HA H 466 3.709 3.709 3.958 -0.249 18053
10815 1 17 . 1 1 36 36 VAL C C 466 172.668 172.668 174.098 -1.430 18053
10816 1 17 . 1 1 36 36 VAL CA C 466 62.692 62.692 61.148 1.544 18053
10817 1 17 . 1 1 36 36 VAL CB C 466 36.215 36.215 34.448 1.767 18053
10818 1 17 . 1 1 36 36 VAL H H 466 7.628 7.628 8.565 -0.937 18053
10819 1 17 . 1 1 37 37 GLN N N 467 126.831 126.831 128.413 -1.582 18053
10820 1 17 . 1 1 37 37 GLN HA H 467 5.449 5.449 4.780 0.669 18053
10821 1 17 . 1 1 37 37 GLN C C 467 174.797 174.797 174.124 0.673 18053
10822 1 17 . 1 1 37 37 GLN CA C 467 54.121 54.121 54.784 -0.663 18053
10823 1 17 . 1 1 37 37 GLN CB C 467 34.623 34.623 29.440 5.183 18053
10824 1 17 . 1 1 37 37 GLN H H 467 8.392 8.392 8.546 -0.154 18053
10825 1 17 . 1 1 38 38 LEU N N 468 123.018 123.018 129.261 -6.243 18053
10826 1 17 . 1 1 38 38 LEU HA H 468 5.422 5.422 4.799 0.623 18053
10827 1 17 . 1 1 38 38 LEU C C 468 175.588 175.588 174.313 1.275 18053
10828 1 17 . 1 1 38 38 LEU CA C 468 52.702 52.702 54.441 -1.739 18053
10829 1 17 . 1 1 38 38 LEU CB C 468 45.046 45.046 45.723 -0.677 18053
10830 1 17 . 1 1 38 38 LEU H H 468 9.103 9.103 8.913 0.190 18053
10831 1 17 . 1 1 39 39 LYS N N 469 118.983 118.983 126.794 -7.811 18053
10832 1 17 . 1 1 39 39 LYS HA H 469 4.852 4.852 4.887 -0.035 18053
10833 1 17 . 1 1 39 39 LYS C C 469 173.309 173.309 174.764 -1.455 18053
10834 1 17 . 1 1 39 39 LYS CA C 469 54.994 54.994 53.879 1.115 18053
10835 1 17 . 1 1 39 39 LYS CB C 469 38.246 38.246 35.411 2.835 18053
10836 1 17 . 1 1 39 39 LYS H H 469 8.496 8.496 8.715 -0.219 18053
10837 1 17 . 1 1 40 40 ASN N N 470 121.758 121.758 124.784 -3.026 18053
10838 1 17 . 1 1 40 40 ASN HA H 470 4.788 4.788 4.629 0.159 18053
10839 1 17 . 1 1 40 40 ASN C C 470 174.496 174.496 175.084 -0.588 18053
10840 1 17 . 1 1 40 40 ASN CA C 470 51.119 51.119 52.612 -1.493 18053
10841 1 17 . 1 1 40 40 ASN CB C 470 37.559 37.559 38.934 -1.375 18053
10842 1 17 . 1 1 40 40 ASN H H 470 8.283 8.283 8.751 -0.468 18053
10843 1 17 . 1 1 41 41 ASN N N 471 122.422 122.422 124.262 -1.840 18053
10844 1 17 . 1 1 41 41 ASN HA H 471 4.588 4.588 4.725 -0.137 18053
10845 1 17 . 1 1 41 41 ASN C C 471 174.810 174.810 175.278 -0.468 18053
10846 1 17 . 1 1 41 41 ASN CA C 471 53.985 53.985 54.222 -0.237 18053
10847 1 17 . 1 1 41 41 ASN CB C 471 39.600 39.600 39.132 0.468 18053
10848 1 17 . 1 1 41 41 ASN H H 471 8.681 8.681 8.420 0.261 18053
10849 1 17 . 1 1 42 42 SER N N 472 116.446 116.446 116.745 -0.299 18053
10850 1 17 . 1 1 42 42 SER HA H 472 4.719 4.719 4.464 0.255 18053
10851 1 17 . 1 1 42 42 SER C C 472 172.804 172.804 174.156 -1.352 18053
10852 1 17 . 1 1 42 42 SER CA C 472 57.288 57.288 58.976 -1.688 18053
10853 1 17 . 1 1 42 42 SER CB C 472 66.241 66.241 63.992 2.248 18053
10854 1 17 . 1 1 42 42 SER H H 472 8.370 8.370 7.709 0.661 18053
10855 1 17 . 1 1 43 43 ASP N N 473 117.706 117.706 120.720 -3.014 18053
10856 1 17 . 1 1 43 43 ASP HA H 473 4.474 4.474 4.566 -0.092 18053
10857 1 17 . 1 1 43 43 ASP C C 473 175.343 175.343 175.177 0.166 18053
10858 1 17 . 1 1 43 43 ASP CA C 473 53.521 53.521 55.410 -1.889 18053
10859 1 17 . 1 1 43 43 ASP CB C 473 40.322 40.322 40.822 -0.500 18053
10860 1 17 . 1 1 43 43 ASP H H 473 8.254 8.254 8.686 -0.432 18053
10861 1 17 . 1 1 44 44 LYS N N 474 120.209 120.209 117.878 2.331 18053
10862 1 17 . 1 1 44 44 LYS HA H 474 4.569 4.569 4.532 0.037 18053
10863 1 17 . 1 1 44 44 LYS C C 474 175.397 175.397 174.545 0.852 18053
10864 1 17 . 1 1 44 44 LYS CA C 474 54.012 54.012 54.305 -0.293 18053
10865 1 17 . 1 1 44 44 LYS CB C 474 35.383 35.383 34.613 0.770 18053
10866 1 17 . 1 1 44 44 LYS H H 474 8.305 8.305 7.288 1.017 18053
10867 1 17 . 1 1 45 45 ASP N N 475 124.993 124.993 120.598 4.395 18053
10868 1 17 . 1 1 45 45 ASP HA H 475 3.975 3.975 4.623 -0.648 18053
10869 1 17 . 1 1 45 45 ASP C C 475 174.810 174.810 176.102 -1.292 18053
10870 1 17 . 1 1 45 45 ASP CA C 475 54.995 54.995 54.401 0.593 18053
10871 1 17 . 1 1 45 45 ASP CB C 475 40.364 40.364 40.565 -0.201 18053
10872 1 17 . 1 1 45 45 ASP H H 475 8.722 8.722 8.422 0.300 18053
10873 1 17 . 1 1 46 46 GLN N N 476 120.549 120.549 125.374 -4.825 18053
10874 1 17 . 1 1 46 46 GLN HA H 476 4.436 4.436 4.393 0.043 18053
10875 1 17 . 1 1 46 46 GLN C C 476 174.019 174.019 174.980 -0.961 18053
10876 1 17 . 1 1 46 46 GLN CA C 476 53.138 53.138 54.580 -1.442 18053
10877 1 17 . 1 1 46 46 GLN CB C 476 31.466 31.466 29.721 1.745 18053
10878 1 17 . 1 1 46 46 GLN H H 476 7.878 7.878 8.234 -0.356 18053
10879 1 17 . 1 1 47 47 SER N N 477 121.537 121.537 121.134 0.403 18053
10880 1 17 . 1 1 47 47 SER HA H 477 4.229 4.229 4.257 -0.028 18053
10881 1 17 . 1 1 47 47 SER C C 477 174.565 174.565 173.921 0.644 18053
10882 1 17 . 1 1 47 47 SER CA C 477 58.706 58.706 58.670 0.036 18053
10883 1 17 . 1 1 47 47 SER CB C 477 62.965 62.965 62.829 0.136 18053
10884 1 17 . 1 1 47 47 SER H H 477 8.748 8.748 8.651 0.097 18053
10885 1 17 . 1 1 48 48 LEU N N 478 127.751 127.751 125.651 2.100 18053
10886 1 17 . 1 1 48 48 LEU HA H 478 2.631 2.631 4.177 -1.546 18053
10887 1 17 . 1 1 48 48 LEU C C 478 176.789 176.789 178.263 -1.474 18053
10888 1 17 . 1 1 48 48 LEU CA C 478 52.102 52.102 54.067 -1.965 18053
10889 1 17 . 1 1 48 48 LEU CB C 478 42.343 42.343 43.765 -1.422 18053
10890 1 17 . 1 1 48 48 LEU H H 478 7.856 7.856 7.635 0.221 18053
10891 1 17 . 1 1 49 49 GLY N N 479 107.525 107.525 105.598 1.927 18053
10892 1 17 . 1 1 49 49 GLY C C 479 176.653 176.653 175.268 1.385 18053
10893 1 17 . 1 1 49 49 GLY CA C 479 48.062 48.062 45.870 2.192 18053
10894 1 17 . 1 1 49 49 GLY H H 479 7.728 7.728 8.652 -0.924 18053
10895 1 17 . 1 1 50 50 ASN N N 480 117.059 117.059 119.753 -2.694 18053
10896 1 17 . 1 1 50 50 ASN HA H 480 4.255 4.255 4.594 -0.339 18053
10897 1 17 . 1 1 50 50 ASN C C 480 174.961 174.961 175.632 -0.671 18053
10898 1 17 . 1 1 50 50 ASN CA C 480 56.360 56.360 53.822 2.538 18053
10899 1 17 . 1 1 50 50 ASN CB C 480 37.416 37.416 38.787 -1.371 18053
10900 1 17 . 1 1 50 50 ASN H H 480 7.552 7.552 8.500 -0.948 18053
10901 1 17 . 1 1 51 51 TRP N N 481 122.166 122.166 119.405 2.761 18053
10902 1 17 . 1 1 51 51 TRP HA H 481 4.477 4.477 4.797 -0.320 18053
10903 1 17 . 1 1 51 51 TRP C C 481 175.575 175.575 175.619 -0.044 18053
10904 1 17 . 1 1 51 51 TRP CA C 481 58.762 58.762 58.407 0.355 18053
10905 1 17 . 1 1 51 51 TRP CB C 481 28.041 28.041 29.779 -1.738 18053
10906 1 17 . 1 1 51 51 TRP H H 481 8.914 8.914 7.893 1.021 18053
10907 1 17 . 1 1 52 52 ARG N N 482 116.480 116.480 118.229 -1.749 18053
10908 1 17 . 1 1 52 52 ARG HA H 482 5.968 5.968 5.418 0.550 18053
10909 1 17 . 1 1 52 52 ARG C C 482 175.807 175.807 174.927 0.880 18053
10910 1 17 . 1 1 52 52 ARG CA C 482 54.121 54.121 54.861 -0.740 18053
10911 1 17 . 1 1 52 52 ARG CB C 482 35.124 35.124 34.058 1.066 18053
10912 1 17 . 1 1 52 52 ARG H H 482 9.147 9.147 9.071 0.076 18053
10913 1 17 . 1 1 53 53 ILE N N 483 119.579 119.579 125.055 -5.476 18053
10914 1 17 . 1 1 53 53 ILE HA H 483 4.985 4.985 4.889 0.096 18053
10915 1 17 . 1 1 53 53 ILE C C 483 175.670 175.670 175.787 -0.117 18053
10916 1 17 . 1 1 53 53 ILE CA C 483 60.400 60.400 60.869 -0.469 18053
10917 1 17 . 1 1 53 53 ILE CB C 483 40.227 40.227 38.486 1.742 18053
10918 1 17 . 1 1 53 53 ILE H H 483 9.000 9.000 8.769 0.231 18053
10919 1 17 . 1 1 54 54 LYS N N 484 124.737 124.737 128.375 -3.638 18053
10920 1 17 . 1 1 54 54 LYS HA H 484 5.463 5.463 5.145 0.318 18053
10921 1 17 . 1 1 54 54 LYS C C 484 175.575 175.575 176.249 -0.674 18053
10922 1 17 . 1 1 54 54 LYS CA C 484 54.613 54.613 56.422 -1.810 18053
10923 1 17 . 1 1 54 54 LYS CB C 484 35.041 35.041 33.873 1.168 18053
10924 1 17 . 1 1 54 54 LYS H H 484 9.678 9.678 8.831 0.847 18053
10925 1 17 . 1 1 55 55 ARG N N 485 124.090 124.090 121.492 2.598 18053
10926 1 17 . 1 1 55 55 ARG HA H 485 5.525 5.525 5.100 0.425 18053
10927 1 17 . 1 1 55 55 ARG C C 485 174.155 174.155 174.342 -0.187 18053
10928 1 17 . 1 1 55 55 ARG CA C 485 53.903 53.903 55.303 -1.400 18053
10929 1 17 . 1 1 55 55 ARG H H 485 9.314 9.314 8.920 0.394 18053
10930 1 17 . 1 1 56 56 GLN N N 486 126.576 126.576 125.853 0.723 18053
10931 1 17 . 1 1 56 56 GLN HA H 486 4.842 4.842 5.542 -0.700 18053
10932 1 17 . 1 1 56 56 GLN C C 486 174.991 174.991 174.606 0.385 18053
10933 1 17 . 1 1 56 56 GLN CA C 486 54.831 54.831 54.382 0.449 18053
10934 1 17 . 1 1 56 56 GLN CB C 486 31.465 31.465 31.617 -0.152 18053
10935 1 17 . 1 1 56 56 GLN H H 486 8.831 8.831 8.572 0.259 18053
10936 1 17 . 1 1 57 57 VAL N N 487 126.712 126.712 124.702 2.010 18053
10937 1 17 . 1 1 57 57 VAL HA H 487 4.266 4.266 4.438 -0.172 18053
10938 1 17 . 1 1 57 57 VAL C C 487 175.916 175.916 178.084 -2.168 18053
10939 1 17 . 1 1 57 57 VAL CA C 487 61.820 61.820 61.464 0.356 18053
10940 1 17 . 1 1 57 57 VAL CB C 487 32.803 32.803 32.446 0.357 18053
10941 1 17 . 1 1 57 57 VAL H H 487 8.786 8.786 8.860 -0.074 18053
10942 1 17 . 1 1 58 58 LEU N N 488 127.274 127.274 124.502 2.772 18053
10943 1 17 . 1 1 58 58 LEU HA H 488 4.085 4.085 4.151 -0.066 18053
10944 1 17 . 1 1 58 58 LEU C C 488 177.158 177.158 178.159 -1.001 18053
10945 1 17 . 1 1 58 58 LEU CA C 488 56.906 56.906 58.024 -1.118 18053
10946 1 17 . 1 1 58 58 LEU CB C 488 41.374 41.374 41.425 -0.051 18053
10947 1 17 . 1 1 58 58 LEU H H 488 8.316 8.316 8.491 -0.175 18053
10948 1 17 . 1 1 59 59 GLU N N 489 119.647 119.647 119.431 0.216 18053
10949 1 17 . 1 1 59 59 GLU HA H 489 4.112 4.112 4.184 -0.072 18053
10950 1 17 . 1 1 59 59 GLU C C 489 176.230 176.230 177.514 -1.284 18053
10951 1 17 . 1 1 59 59 GLU CA C 489 57.015 57.015 56.823 0.192 18053
10952 1 17 . 1 1 59 59 GLU CB C 489 28.149 28.149 29.343 -1.194 18053
10953 1 17 . 1 1 59 59 GLU H H 489 8.636 8.636 8.245 0.391 18053
10954 1 17 . 1 1 60 60 GLY N N 490 108.819 108.819 107.103 1.716 18053
10955 1 17 . 1 1 60 60 GLY C C 490 173.568 173.568 173.660 -0.092 18053
10956 1 17 . 1 1 60 60 GLY CA C 490 44.773 44.773 45.009 -0.236 18053
10957 1 17 . 1 1 60 60 GLY H H 490 8.160 8.160 7.905 0.255 18053
10958 1 17 . 1 1 61 61 GLU N N 491 121.009 121.009 121.432 -0.423 18053
10959 1 17 . 1 1 61 61 GLU HA H 491 4.323 4.323 4.315 0.008 18053
10960 1 17 . 1 1 61 61 GLU C C 491 175.725 175.725 175.330 0.395 18053
10961 1 17 . 1 1 61 61 GLU CA C 491 56.196 56.196 56.082 0.114 18053
10962 1 17 . 1 1 61 61 GLU CB C 491 30.865 30.865 29.765 1.101 18053
10963 1 17 . 1 1 61 61 GLU H H 491 8.320 8.320 8.198 0.122 18053
10964 1 17 . 1 1 62 62 GLU N N 492 123.426 123.426 124.063 -0.637 18053
10965 1 17 . 1 1 62 62 GLU HA H 492 5.054 5.054 5.277 -0.223 18053
10966 1 17 . 1 1 62 62 GLU C C 492 175.930 175.930 175.903 0.027 18053
10967 1 17 . 1 1 62 62 GLU CA C 492 55.650 55.650 55.115 0.535 18053
10968 1 17 . 1 1 62 62 GLU CB C 492 32.312 32.312 30.797 1.515 18053
10969 1 17 . 1 1 62 62 GLU H H 492 8.594 8.594 8.675 -0.081 18053
10970 1 17 . 1 1 63 63 ILE N N 493 119.732 119.732 118.344 1.388 18053
10971 1 17 . 1 1 63 63 ILE HA H 493 4.788 4.788 4.847 -0.059 18053
10972 1 17 . 1 1 63 63 ILE C C 493 174.647 174.647 173.777 0.870 18053
10973 1 17 . 1 1 63 63 ILE CA C 493 60.181 60.181 59.263 0.918 18053
10974 1 17 . 1 1 63 63 ILE CB C 493 41.183 41.183 42.376 -1.193 18053
10975 1 17 . 1 1 63 63 ILE H H 493 8.523 8.523 8.401 0.122 18053
10976 1 17 . 1 1 64 64 ALA N N 494 122.166 122.166 122.610 -0.444 18053
10977 1 17 . 1 1 64 64 ALA HA H 494 5.521 5.521 5.033 0.488 18053
10978 1 17 . 1 1 64 64 ALA C C 494 174.606 174.606 175.601 -0.995 18053
10979 1 17 . 1 1 64 64 ALA CA C 494 51.528 51.528 51.380 0.148 18053
10980 1 17 . 1 1 64 64 ALA CB C 494 22.239 22.239 21.897 0.342 18053
10981 1 17 . 1 1 64 64 ALA H H 494 8.741 8.741 8.192 0.549 18053
10982 1 17 . 1 1 65 65 TYR N N 495 126.729 126.729 125.213 1.516 18053
10983 1 17 . 1 1 65 65 TYR HA H 495 3.094 3.094 2.983 0.111 18053
10984 1 17 . 1 1 65 65 TYR C C 495 173.036 173.036 173.765 -0.729 18053
10985 1 17 . 1 1 65 65 TYR CA C 495 56.905 56.905 56.146 0.759 18053
10986 1 17 . 1 1 65 65 TYR CB C 495 40.269 40.269 38.283 1.986 18053
10987 1 17 . 1 1 65 65 TYR H H 495 8.462 8.462 8.256 0.206 18053
10988 1 17 . 1 1 66 66 LYS N N 496 128.108 128.108 127.418 0.690 18053
10989 1 17 . 1 1 66 66 LYS HA H 496 4.822 4.822 4.250 0.572 18053
10990 1 17 . 1 1 66 66 LYS C C 496 174.906 174.906 174.923 -0.017 18053
10991 1 17 . 1 1 66 66 LYS CA C 496 53.739 53.739 54.989 -1.250 18053
10992 1 17 . 1 1 66 66 LYS CB C 496 34.782 34.782 32.591 2.191 18053
10993 1 17 . 1 1 66 66 LYS H H 496 7.010 7.010 7.259 -0.249 18053
10994 1 17 . 1 1 67 67 PHE N N 497 125.299 125.299 124.015 1.284 18053
10995 1 17 . 1 1 67 67 PHE HA H 497 3.932 3.932 3.935 -0.003 18053
10996 1 17 . 1 1 67 67 PHE C C 497 177.990 177.990 175.969 2.021 18053
10997 1 17 . 1 1 67 67 PHE CA C 497 59.007 59.007 59.039 -0.032 18053
10998 1 17 . 1 1 67 67 PHE CB C 497 40.981 40.981 39.821 1.160 18053
10999 1 17 . 1 1 67 67 PHE H H 497 8.509 8.509 8.216 0.293 18053
11000 1 17 . 1 1 68 68 THR N N 498 116.191 116.191 112.886 3.305 18053
11001 1 17 . 1 1 68 68 THR HA H 498 4.417 4.417 4.688 -0.271 18053
11002 1 17 . 1 1 68 68 THR CA C 498 60.855 60.855 59.560 1.295 18053
11003 1 17 . 1 1 68 68 THR CB C 498 68.019 68.019 69.158 -1.139 18053
11004 1 17 . 1 1 68 68 THR H H 498 8.688 8.688 8.616 0.072 18053
11005 1 17 . 1 1 69 69 PRO HA H 499 3.948 3.948 4.472 -0.524 18053
11006 1 17 . 1 1 69 69 PRO C C 499 177.444 177.444 176.924 0.520 18053
11007 1 17 . 1 1 69 69 PRO CA C 499 66.077 66.077 64.855 1.222 18053
11008 1 17 . 1 1 69 69 PRO CB C 499 32.776 32.776 32.110 0.666 18053
11009 1 17 . 1 1 70 70 LYS N N 500 113.552 113.552 116.234 -2.682 18053
11010 1 17 . 1 1 70 70 LYS HA H 500 4.385 4.385 4.167 0.218 18053
11011 1 17 . 1 1 70 70 LYS C C 500 176.325 176.325 176.743 -0.418 18053
11012 1 17 . 1 1 70 70 LYS CA C 500 54.995 54.995 56.832 -1.837 18053
11013 1 17 . 1 1 70 70 LYS CB C 500 31.793 31.793 31.721 0.072 18053
11014 1 17 . 1 1 70 70 LYS H H 500 8.016 8.016 7.913 0.103 18053
11015 1 17 . 1 1 71 71 TYR N N 501 121.860 121.860 121.855 0.005 18053
11016 1 17 . 1 1 71 71 TYR HA H 501 3.730 3.730 4.390 -0.660 18053
11017 1 17 . 1 1 71 71 TYR C C 501 174.838 174.838 173.962 0.876 18053
11018 1 17 . 1 1 71 71 TYR CA C 501 62.310 62.310 59.278 3.032 18053
11019 1 17 . 1 1 71 71 TYR CB C 501 38.781 38.781 39.106 -0.325 18053
11020 1 17 . 1 1 71 71 TYR H H 501 7.460 7.460 7.777 -0.317 18053
11021 1 17 . 1 1 72 72 ILE N N 502 129.487 129.487 127.657 1.830 18053
11022 1 17 . 1 1 72 72 ILE HA H 502 3.928 3.928 4.294 -0.366 18053
11023 1 17 . 1 1 72 72 ILE C C 502 172.968 172.968 174.211 -1.243 18053
11024 1 17 . 1 1 72 72 ILE CA C 502 59.308 59.308 59.468 -0.160 18053
11025 1 17 . 1 1 72 72 ILE CB C 502 40.910 40.910 39.714 1.196 18053
11026 1 17 . 1 1 72 72 ILE H H 502 7.168 7.168 7.922 -0.754 18053
11027 1 17 . 1 1 73 73 LEU N N 503 128.278 128.278 129.398 -1.120 18053
11028 1 17 . 1 1 73 73 LEU HA H 503 4.493 4.493 4.243 0.250 18053
11029 1 17 . 1 1 73 73 LEU C C 503 175.834 175.834 175.646 0.188 18053
11030 1 17 . 1 1 73 73 LEU CA C 503 51.965 51.965 54.274 -2.309 18053
11031 1 17 . 1 1 73 73 LEU CB C 503 42.548 42.548 43.230 -0.682 18053
11032 1 17 . 1 1 73 73 LEU H H 503 8.483 8.483 8.287 0.196 18053
11033 1 17 . 1 1 74 74 ARG N N 504 129.589 129.589 123.767 5.822 18053
11034 1 17 . 1 1 74 74 ARG HA H 504 3.743 3.743 4.428 -0.685 18053
11035 1 17 . 1 1 74 74 ARG C C 504 175.233 175.233 175.903 -0.670 18053
11036 1 17 . 1 1 74 74 ARG CA C 504 56.851 56.851 55.511 1.340 18053
11037 1 17 . 1 1 74 74 ARG CB C 504 30.292 30.292 30.674 -0.382 18053
11038 1 17 . 1 1 74 74 ARG H H 504 8.673 8.673 8.418 0.255 18053
11039 1 17 . 1 1 75 75 ALA N N 505 123.205 123.205 124.752 -1.547 18053
11040 1 17 . 1 1 75 75 ALA HA H 505 3.522 3.522 4.207 -0.685 18053
11041 1 17 . 1 1 75 75 ALA C C 505 178.441 178.441 178.075 0.366 18053
11042 1 17 . 1 1 75 75 ALA CA C 505 53.794 53.794 53.013 0.781 18053
11043 1 17 . 1 1 75 75 ALA CB C 505 18.910 18.910 18.252 0.658 18053
11044 1 17 . 1 1 75 75 ALA H H 505 8.564 8.564 8.139 0.425 18053
11045 1 17 . 1 1 76 76 GLY N N 506 112.241 112.241 113.163 -0.922 18053
11046 1 17 . 1 1 76 76 GLY C C 506 174.278 174.278 174.268 0.010 18053
11047 1 17 . 1 1 76 76 GLY CA C 506 46.725 46.725 45.209 1.516 18053
11048 1 17 . 1 1 76 76 GLY H H 506 7.381 7.381 8.583 -1.202 18053
11049 1 17 . 1 1 77 77 GLN N N 507 117.382 117.382 118.665 -1.283 18053
11050 1 17 . 1 1 77 77 GLN HA H 507 4.364 4.364 4.713 -0.349 18053
11051 1 17 . 1 1 77 77 GLN C C 507 173.937 173.937 174.477 -0.540 18053
11052 1 17 . 1 1 77 77 GLN CA C 507 54.558 54.558 53.866 0.692 18053
11053 1 17 . 1 1 77 77 GLN CB C 507 30.073 30.073 30.616 -0.543 18053
11054 1 17 . 1 1 77 77 GLN H H 507 7.996 7.996 7.748 0.248 18053
11055 1 17 . 1 1 78 78 MET N N 508 116.957 116.957 115.142 1.815 18053
11056 1 17 . 1 1 78 78 MET HA H 508 5.388 5.388 5.233 0.155 18053
11057 1 17 . 1 1 78 78 MET C C 508 175.807 175.807 174.537 1.270 18053
11058 1 17 . 1 1 78 78 MET CA C 508 54.067 54.067 53.790 0.277 18053
11059 1 17 . 1 1 78 78 MET CB C 508 37.198 37.198 36.210 0.988 18053
11060 1 17 . 1 1 78 78 MET H H 508 8.092 8.092 8.303 -0.211 18053
11061 1 17 . 1 1 79 79 VAL N N 509 119.340 119.340 120.710 -1.370 18053
11062 1 17 . 1 1 79 79 VAL HA H 509 4.956 4.956 4.746 0.210 18053
11063 1 17 . 1 1 79 79 VAL C C 509 172.217 172.217 174.598 -2.381 18053
11064 1 17 . 1 1 79 79 VAL CA C 509 59.471 59.471 60.117 -0.646 18053
11065 1 17 . 1 1 79 79 VAL CB C 509 33.676 33.676 34.445 -0.769 18053
11066 1 17 . 1 1 79 79 VAL H H 509 8.534 8.534 8.964 -0.430 18053
11067 1 17 . 1 1 80 80 THR N N 510 124.533 124.533 126.144 -1.611 18053
11068 1 17 . 1 1 80 80 THR HA H 510 4.586 4.586 4.834 -0.248 18053
11069 1 17 . 1 1 80 80 THR C C 510 172.215 172.215 174.197 -1.982 18053
11070 1 17 . 1 1 80 80 THR CA C 510 62.119 62.119 62.143 -0.024 18053
11071 1 17 . 1 1 80 80 THR CB C 510 69.407 69.407 68.722 0.684 18053
11072 1 17 . 1 1 80 80 THR H H 510 8.301 8.301 8.979 -0.678 18053
11073 1 17 . 1 1 81 81 VAL N N 511 127.002 127.002 127.943 -0.941 18053
11074 1 17 . 1 1 81 81 VAL HA H 511 4.596 4.596 4.324 0.272 18053
11075 1 17 . 1 1 81 81 VAL C C 511 176.667 176.667 175.922 0.745 18053
11076 1 17 . 1 1 81 81 VAL CA C 511 61.382 61.382 62.245 -0.862 18053
11077 1 17 . 1 1 81 81 VAL CB C 511 30.945 30.945 31.246 -0.301 18053
11078 1 17 . 1 1 81 81 VAL H H 511 8.796 8.796 8.678 0.118 18053
11079 1 17 . 1 1 82 82 TRP N N 512 131.479 131.479 129.258 2.221 18053
11080 1 17 . 1 1 82 82 TRP HA H 512 5.338 5.338 5.354 -0.016 18053
11081 1 17 . 1 1 82 82 TRP C C 512 176.885 176.885 175.906 0.979 18053
11082 1 17 . 1 1 82 82 TRP CA C 512 56.442 56.442 57.504 -1.062 18053
11083 1 17 . 1 1 82 82 TRP CB C 512 30.701 30.701 30.768 -0.067 18053
11084 1 17 . 1 1 82 82 TRP H H 512 9.924 9.924 9.358 0.566 18053
11085 1 17 . 1 1 83 83 ALA N N 513 123.954 123.954 121.036 2.918 18053
11086 1 17 . 1 1 83 83 ALA HA H 513 4.308 4.308 4.778 -0.470 18053
11087 1 17 . 1 1 83 83 ALA C C 513 178.140 178.140 178.437 -0.297 18053
11088 1 17 . 1 1 83 83 ALA CA C 513 52.211 52.211 50.635 1.576 18053
11089 1 17 . 1 1 83 83 ALA CB C 513 18.745 18.745 20.385 -1.640 18053
11090 1 17 . 1 1 83 83 ALA H H 513 9.048 9.048 8.857 0.191 18053
11091 1 17 . 1 1 84 84 ALA N N 514 125.146 125.146 122.860 2.286 18053
11092 1 17 . 1 1 84 84 ALA HA H 514 3.951 3.951 4.085 -0.134 18053
11093 1 17 . 1 1 84 84 ALA C C 514 179.519 179.519 178.972 0.547 18053
11094 1 17 . 1 1 84 84 ALA CA C 514 54.804 54.804 55.011 -0.207 18053
11095 1 17 . 1 1 84 84 ALA CB C 514 18.582 18.582 18.949 -0.367 18053
11096 1 17 . 1 1 84 84 ALA H H 514 8.341 8.341 8.248 0.093 18053
11097 1 17 . 1 1 85 85 GLY N N 515 103.388 103.388 103.963 -0.575 18053
11098 1 17 . 1 1 85 85 GLY C C 515 174.674 174.674 174.498 0.176 18053
11099 1 17 . 1 1 85 85 GLY CA C 515 45.878 45.878 44.648 1.230 18053
11100 1 17 . 1 1 85 85 GLY H H 515 7.996 7.996 7.926 0.070 18053
11101 1 17 . 1 1 86 86 ALA N N 516 120.140 120.140 123.169 -3.029 18053
11102 1 17 . 1 1 86 86 ALA HA H 516 4.344 4.344 4.561 -0.217 18053
11103 1 17 . 1 1 86 86 ALA C C 516 177.690 177.690 177.973 -0.283 18053
11104 1 17 . 1 1 86 86 ALA CA C 516 53.139 53.139 52.437 0.702 18053
11105 1 17 . 1 1 86 86 ALA CB C 516 20.547 20.547 19.350 1.197 18053
11106 1 17 . 1 1 86 86 ALA H H 516 7.474 7.474 7.402 0.072 18053
11107 1 17 . 1 1 87 87 GLY N N 517 105.720 105.720 107.899 -2.179 18053
11108 1 17 . 1 1 87 87 GLY C C 517 173.650 173.650 174.127 -0.477 18053
11109 1 17 . 1 1 87 87 GLY CA C 517 46.014 46.014 45.328 0.686 18053
11110 1 17 . 1 1 87 87 GLY H H 517 7.779 7.779 8.040 -0.261 18053
11111 1 17 . 1 1 88 88 VAL N N 518 121.537 121.537 118.046 3.491 18053
11112 1 17 . 1 1 88 88 VAL HA H 518 3.585 3.585 4.156 -0.571 18053
11113 1 17 . 1 1 88 88 VAL C C 518 174.851 174.851 174.769 0.082 18053
11114 1 17 . 1 1 88 88 VAL CA C 518 61.274 61.274 60.602 0.672 18053
11115 1 17 . 1 1 88 88 VAL CB C 518 33.376 33.376 33.157 0.219 18053
11116 1 17 . 1 1 88 88 VAL H H 518 7.499 7.499 7.707 -0.208 18053
11117 1 17 . 1 1 89 89 ALA N N 519 128.295 128.295 129.512 -1.217 18053
11118 1 17 . 1 1 89 89 ALA HA H 519 4.192 4.192 4.332 -0.140 18053
11119 1 17 . 1 1 89 89 ALA C C 519 176.680 176.680 176.790 -0.110 18053
11120 1 17 . 1 1 89 89 ALA CA C 519 51.283 51.283 51.768 -0.485 18053
11121 1 17 . 1 1 89 89 ALA CB C 519 19.292 19.292 19.230 0.062 18053
11122 1 17 . 1 1 89 89 ALA H H 519 7.960 7.960 8.277 -0.317 18053
11123 1 17 . 1 1 90 90 HIS N N 520 122.643 122.643 124.487 -1.844 18053
11124 1 17 . 1 1 90 90 HIS HA H 520 4.033 4.033 4.380 -0.347 18053
11125 1 17 . 1 1 90 90 HIS C C 520 175.793 175.793 174.345 1.448 18053
11126 1 17 . 1 1 90 90 HIS CA C 520 58.653 58.653 56.321 2.333 18053
11127 1 17 . 1 1 90 90 HIS CB C 520 32.285 32.285 29.745 2.540 18053
11128 1 17 . 1 1 90 90 HIS H H 520 8.394 8.394 8.884 -0.490 18053
11129 1 17 . 1 1 91 91 SER N N 521 121.247 121.247 123.511 -2.264 18053
11130 1 17 . 1 1 91 91 SER HA H 521 4.629 4.629 4.702 -0.073 18053
11131 1 17 . 1 1 91 91 SER CA C 521 55.843 55.843 55.961 -0.118 18053
11132 1 17 . 1 1 91 91 SER CB C 521 62.367 62.367 63.573 -1.206 18053
11133 1 17 . 1 1 91 91 SER H H 521 8.569 8.569 8.326 0.243 18053
11134 1 17 . 1 1 92 92 PRO HA H 522 4.002 4.002 4.849 -0.847 18053
11135 1 17 . 1 1 92 92 PRO CA C 522 62.244 62.244 62.390 -0.146 18053
11136 1 17 . 1 1 92 92 PRO CB C 522 30.931 30.931 31.330 -0.399 18053
11137 1 17 . 1 1 93 93 PRO HA H 523 4.672 4.672 4.732 -0.060 18053
11138 1 17 . 1 1 93 93 PRO C C 523 177.786 177.786 178.143 -0.357 18053
11139 1 17 . 1 1 93 93 PRO CA C 523 64.003 64.003 63.910 0.093 18053
11140 1 17 . 1 1 93 93 PRO CB C 523 34.905 34.905 32.283 2.622 18053
11141 1 17 . 1 1 94 94 SER N N 524 117.212 117.212 116.797 0.415 18053
11142 1 17 . 1 1 94 94 SER HA H 524 4.678 4.678 4.416 0.262 18053
11143 1 17 . 1 1 94 94 SER C C 524 174.851 174.851 174.374 0.477 18053
11144 1 17 . 1 1 94 94 SER CA C 524 61.874 61.874 60.718 1.156 18053
11145 1 17 . 1 1 94 94 SER CB C 524 64.057 64.057 63.662 0.395 18053
11146 1 17 . 1 1 94 94 SER H H 524 8.463 8.463 8.006 0.457 18053
11147 1 17 . 1 1 95 95 THR N N 525 121.588 121.588 119.310 2.278 18053
11148 1 17 . 1 1 95 95 THR HA H 525 4.859 4.859 4.980 -0.121 18053
11149 1 17 . 1 1 95 95 THR C C 525 172.094 172.094 173.368 -1.274 18053
11150 1 17 . 1 1 95 95 THR CA C 525 62.309 62.309 62.374 -0.065 18053
11151 1 17 . 1 1 95 95 THR CB C 525 70.281 70.281 69.087 1.194 18053
11152 1 17 . 1 1 95 95 THR H H 525 7.631 7.631 7.943 -0.312 18053
11153 1 17 . 1 1 96 96 LEU N N 526 127.274 127.274 129.888 -2.614 18053
11154 1 17 . 1 1 96 96 LEU HA H 526 5.131 5.131 5.043 0.088 18053
11155 1 17 . 1 1 96 96 LEU C C 526 175.916 175.916 175.414 0.502 18053
11156 1 17 . 1 1 96 96 LEU CA C 526 52.075 52.075 54.137 -2.062 18053
11157 1 17 . 1 1 96 96 LEU CB C 526 43.790 43.790 44.275 -0.485 18053
11158 1 17 . 1 1 96 96 LEU H H 526 8.977 8.977 8.603 0.374 18053
11159 1 17 . 1 1 97 97 VAL N N 527 124.056 124.056 120.377 3.679 18053
11160 1 17 . 1 1 97 97 VAL HA H 527 4.869 4.869 4.660 0.209 18053
11161 1 17 . 1 1 97 97 VAL C C 527 176.230 176.230 175.165 1.065 18053
11162 1 17 . 1 1 97 97 VAL CA C 527 61.519 61.519 60.994 0.525 18053
11163 1 17 . 1 1 97 97 VAL CB C 527 33.704 33.704 33.593 0.111 18053
11164 1 17 . 1 1 97 97 VAL H H 527 10.724 10.724 8.174 2.550 18053
11165 1 17 . 1 1 98 98 TRP N N 528 132.586 132.586 131.305 1.281 18053
11166 1 17 . 1 1 98 98 TRP HA H 528 4.965 4.965 4.337 0.628 18053
11167 1 17 . 1 1 98 98 TRP C C 528 173.391 173.391 174.414 -1.023 18053
11168 1 17 . 1 1 98 98 TRP CA C 528 53.303 53.303 54.698 -1.395 18053
11169 1 17 . 1 1 98 98 TRP CB C 528 28.245 28.245 28.239 0.006 18053
11170 1 17 . 1 1 98 98 TRP H H 528 9.400 9.400 8.965 0.435 18053
11171 1 17 . 1 1 99 99 LYS N N 529 126.644 126.644 128.845 -2.201 18053
11172 1 17 . 1 1 99 99 LYS HA H 529 3.839 3.839 4.151 -0.312 18053
11173 1 17 . 1 1 99 99 LYS C C 529 177.581 177.581 176.956 0.625 18053
11174 1 17 . 1 1 99 99 LYS CA C 529 58.543 58.543 56.940 1.603 18053
11175 1 17 . 1 1 99 99 LYS CB C 529 32.176 32.176 32.321 -0.145 18053
11176 1 17 . 1 1 99 99 LYS H H 529 8.153 8.153 7.968 0.185 18053
11177 1 17 . 1 1 100 100 GLY N N 530 110.385 110.385 113.886 -3.501 18053
11178 1 17 . 1 1 100 100 GLY C C 530 172.367 172.367 173.373 -1.006 18053
11179 1 17 . 1 1 100 100 GLY CA C 530 45.278 45.278 44.640 0.638 18053
11180 1 17 . 1 1 100 100 GLY H H 530 8.363 8.363 8.541 -0.178 18053
11181 1 17 . 1 1 101 101 GLN N N 531 121.162 121.162 121.379 -0.217 18053
11182 1 17 . 1 1 101 101 GLN HA H 531 3.972 3.972 4.342 -0.370 18053
11183 1 17 . 1 1 101 101 GLN CA C 531 52.620 52.620 53.460 -0.840 18053
11184 1 17 . 1 1 101 101 GLN CB C 531 27.595 27.595 28.989 -1.395 18053
11185 1 17 . 1 1 101 101 GLN H H 531 6.815 6.815 7.062 -0.247 18053
11186 1 17 . 1 1 102 102 SER N N 532 122.728 122.728 122.081 0.647 18053
11187 1 17 . 1 1 102 102 SER HA H 532 3.866 3.866 4.322 -0.456 18053
11188 1 17 . 1 1 102 102 SER C C 532 174.537 174.537 176.021 -1.484 18053
11189 1 17 . 1 1 102 102 SER CA C 532 61.983 61.983 60.940 1.043 18053
11190 1 17 . 1 1 102 102 SER CB C 532 62.802 62.802 63.111 -0.309 18053
11191 1 17 . 1 1 102 102 SER H H 532 8.662 8.662 8.751 -0.089 18053
11192 1 17 . 1 1 103 103 SER N N 533 110.811 110.811 116.842 -6.031 18053
11193 1 17 . 1 1 103 103 SER HA H 533 4.240 4.240 4.440 -0.200 18053
11194 1 17 . 1 1 103 103 SER C C 533 174.087 174.087 174.158 -0.071 18053
11195 1 17 . 1 1 103 103 SER CA C 533 56.633 56.633 59.717 -3.084 18053
11196 1 17 . 1 1 103 103 SER CB C 533 64.658 64.658 63.154 1.504 18053
11197 1 17 . 1 1 103 103 SER H H 533 7.134 7.134 7.799 -0.665 18053
11198 1 17 . 1 1 104 104 TRP N N 534 126.133 126.133 119.099 7.034 18053
11199 1 17 . 1 1 104 104 TRP HA H 534 4.098 4.098 4.287 -0.189 18053
11200 1 17 . 1 1 104 104 TRP C C 534 176.066 176.066 175.914 0.152 18053
11201 1 17 . 1 1 104 104 TRP CA C 534 60.127 60.127 57.330 2.797 18053
11202 1 17 . 1 1 104 104 TRP CB C 534 28.764 28.764 29.149 -0.385 18053
11203 1 17 . 1 1 104 104 TRP H H 534 9.764 9.764 8.039 1.725 18053
11204 1 17 . 1 1 105 105 GLY N N 535 105.907 105.907 104.849 1.058 18053
11205 1 17 . 1 1 105 105 GLY C C 535 172.217 172.217 173.745 -1.528 18053
11206 1 17 . 1 1 105 105 GLY CA C 535 44.240 44.240 44.897 -0.657 18053
11207 1 17 . 1 1 105 105 GLY H H 535 8.095 8.095 8.317 -0.222 18053
11208 1 17 . 1 1 106 106 THR N N 536 111.253 111.253 112.265 -1.012 18053
11209 1 17 . 1 1 106 106 THR HA H 536 3.859 3.859 4.008 -0.149 18053
11210 1 17 . 1 1 106 106 THR C C 536 172.872 172.872 173.813 -0.941 18053
11211 1 17 . 1 1 106 106 THR CA C 536 59.635 59.635 61.120 -1.485 18053
11212 1 17 . 1 1 106 106 THR CB C 536 70.526 70.526 69.790 0.736 18053
11213 1 17 . 1 1 106 106 THR H H 536 7.913 7.913 7.566 0.347 18053
11214 1 17 . 1 1 107 107 GLY N N 537 107.712 107.712 109.174 -1.462 18053
11215 1 17 . 1 1 107 107 GLY C C 537 172.709 172.709 173.053 -0.344 18053
11216 1 17 . 1 1 107 107 GLY CA C 537 45.166 45.166 45.323 -0.157 18053
11217 1 17 . 1 1 107 107 GLY H H 537 7.533 7.533 7.514 0.019 18053
11218 1 17 . 1 1 108 108 GLU N N 538 118.864 118.864 118.834 0.030 18053
11219 1 17 . 1 1 108 108 GLU HA H 538 4.136 4.136 4.337 -0.201 18053
11220 1 17 . 1 1 108 108 GLU C C 538 176.353 176.353 175.524 0.829 18053
11221 1 17 . 1 1 108 108 GLU CA C 538 58.352 58.352 57.718 0.635 18053
11222 1 17 . 1 1 108 108 GLU CB C 538 30.156 30.156 30.397 -0.241 18053
11223 1 17 . 1 1 108 108 GLU H H 538 8.558 8.558 8.620 -0.062 18053
11224 1 17 . 1 1 109 109 SER N N 539 110.419 110.419 112.880 -2.461 18053
11225 1 17 . 1 1 109 109 SER HA H 539 4.963 4.963 4.714 0.249 18053
11226 1 17 . 1 1 109 109 SER C C 539 173.787 173.787 172.561 1.226 18053
11227 1 17 . 1 1 109 109 SER CA C 539 57.125 57.125 57.873 -0.748 18053
11228 1 17 . 1 1 109 109 SER CB C 539 64.439 64.439 64.944 -0.505 18053
11229 1 17 . 1 1 109 109 SER H H 539 7.620 7.620 7.788 -0.169 18053
11230 1 17 . 1 1 110 110 PHE N N 540 118.778 118.778 119.794 -1.016 18053
11231 1 17 . 1 1 110 110 PHE HA H 540 5.081 5.081 5.319 -0.238 18053
11232 1 17 . 1 1 110 110 PHE C C 540 176.052 176.052 173.711 2.341 18053
11233 1 17 . 1 1 110 110 PHE CA C 540 56.789 56.789 56.346 0.443 18053
11234 1 17 . 1 1 110 110 PHE CB C 540 40.760 40.760 42.092 -1.332 18053
11235 1 17 . 1 1 110 110 PHE H H 540 8.318 8.318 8.825 -0.507 18053
11236 1 17 . 1 1 112 112 THR HA H 542 5.468 5.468 4.996 0.472 18053
11237 1 17 . 1 1 112 112 THR C C 542 172.381 172.381 173.657 -1.276 18053
11238 1 17 . 1 1 112 112 THR CA C 542 61.818 61.818 63.142 -1.325 18053
11239 1 17 . 1 1 112 112 THR CB C 542 70.990 70.990 70.115 0.875 18053
11240 1 17 . 1 1 113 113 VAL N N 543 124.771 124.771 125.585 -0.814 18053
11241 1 17 . 1 1 113 113 VAL HA H 543 4.864 4.864 4.533 0.331 18053
11242 1 17 . 1 1 113 113 VAL C C 543 173.132 173.132 173.845 -0.713 18053
11243 1 17 . 1 1 113 113 VAL CA C 543 60.099 60.099 61.373 -1.274 18053
11244 1 17 . 1 1 113 113 VAL CB C 543 36.433 36.433 35.391 1.042 18053
11245 1 17 . 1 1 113 113 VAL H H 543 9.380 9.380 8.958 0.422 18053
11246 1 17 . 1 1 114 114 LEU N N 544 128.789 128.789 128.583 0.206 18053
11247 1 17 . 1 1 114 114 LEU HA H 544 5.320 5.320 4.853 0.467 18053
11248 1 17 . 1 1 114 114 LEU C C 544 174.237 174.237 175.218 -0.981 18053
11249 1 17 . 1 1 114 114 LEU CA C 544 53.193 53.193 54.187 -0.994 18053
11250 1 17 . 1 1 114 114 LEU CB C 544 45.879 45.879 44.112 1.767 18053
11251 1 17 . 1 1 114 114 LEU H H 544 8.948 8.948 8.312 0.636 18053
11252 1 17 . 1 1 115 115 VAL N N 545 127.002 127.002 126.064 0.938 18053
11253 1 17 . 1 1 115 115 VAL HA H 545 4.854 4.854 4.656 0.198 18053
11254 1 17 . 1 1 115 115 VAL C C 545 175.206 175.206 175.085 0.121 18053
11255 1 17 . 1 1 115 115 VAL CA C 545 59.334 59.334 59.769 -0.435 18053
11256 1 17 . 1 1 115 115 VAL CB C 545 34.495 34.495 34.280 0.215 18053
11257 1 17 . 1 1 115 115 VAL H H 545 9.564 9.564 8.755 0.809 18053
11258 1 17 . 1 1 116 116 ASN N N 546 121.179 121.179 124.257 -3.078 18053
11259 1 17 . 1 1 116 116 ASN HA H 546 2.897 2.897 3.455 -0.558 18053
11260 1 17 . 1 1 116 116 ASN C C 546 176.885 176.885 175.789 1.096 18053
11261 1 17 . 1 1 116 116 ASN CA C 546 50.409 50.409 50.420 -0.011 18053
11262 1 17 . 1 1 116 116 ASN CB C 546 36.639 36.639 39.309 -2.670 18053
11263 1 17 . 1 1 116 116 ASN H H 546 8.016 8.016 7.862 0.154 18053
11264 1 17 . 1 1 117 117 ALA N N 547 119.834 119.834 121.131 -1.297 18053
11265 1 17 . 1 1 117 117 ALA HA H 547 3.866 3.866 4.118 -0.252 18053
11266 1 17 . 1 1 117 117 ALA C C 547 177.772 177.772 178.030 -0.258 18053
11267 1 17 . 1 1 117 117 ALA CA C 547 54.504 54.504 54.078 0.426 18053
11268 1 17 . 1 1 117 117 ALA CB C 547 18.200 18.200 18.419 -0.219 18053
11269 1 17 . 1 1 117 117 ALA H H 547 6.444 6.444 8.009 -1.565 18053
11270 1 17 . 1 1 118 118 ASP N N 548 115.646 115.646 117.561 -1.915 18053
11271 1 17 . 1 1 118 118 ASP HA H 548 4.644 4.644 4.379 0.265 18053
11272 1 17 . 1 1 118 118 ASP C C 548 176.052 176.052 177.431 -1.379 18053
11273 1 17 . 1 1 118 118 ASP CA C 548 54.067 54.067 55.557 -1.490 18053
11274 1 17 . 1 1 118 118 ASP CB C 548 41.674 41.674 41.356 0.318 18053
11275 1 17 . 1 1 118 118 ASP H H 548 7.181 7.181 8.052 -0.871 18053
11276 1 17 . 1 1 119 119 GLY N N 549 107.167 107.167 106.690 0.477 18053
11277 1 17 . 1 1 119 119 GLY C C 549 173.841 173.841 173.884 -0.043 18053
11278 1 17 . 1 1 119 119 GLY CA C 549 45.455 45.455 44.578 0.877 18053
11279 1 17 . 1 1 119 119 GLY H H 549 7.738 7.738 7.614 0.124 18053
11280 1 17 . 1 1 120 120 GLU N N 550 121.196 121.196 120.662 0.534 18053
11281 1 17 . 1 1 120 120 GLU HA H 550 4.112 4.112 4.311 -0.199 18053
11282 1 17 . 1 1 120 120 GLU C C 550 175.588 175.588 175.329 0.259 18053
11283 1 17 . 1 1 120 120 GLU CA C 550 54.831 54.831 55.485 -0.654 18053
11284 1 17 . 1 1 120 120 GLU CB C 550 29.937 29.937 30.533 -0.596 18053
11285 1 17 . 1 1 120 120 GLU H H 550 7.587 7.587 7.616 -0.029 18053
11286 1 17 . 1 1 121 121 GLU N N 551 123.886 123.886 122.751 1.135 18053
11287 1 17 . 1 1 121 121 GLU HA H 551 4.276 4.276 4.390 -0.114 18053
11288 1 17 . 1 1 121 121 GLU C C 551 176.817 176.817 176.614 0.203 18053
11289 1 17 . 1 1 121 121 GLU CA C 551 56.796 56.796 56.616 0.180 18053
11290 1 17 . 1 1 121 121 GLU CB C 551 28.955 28.955 29.245 -0.290 18053
11291 1 17 . 1 1 121 121 GLU H H 551 8.697 8.697 8.654 0.043 18053
11292 1 17 . 1 1 122 122 VAL N N 552 120.055 120.055 119.289 0.766 18053
11293 1 17 . 1 1 122 122 VAL HA H 552 4.364 4.364 4.163 0.201 18053
11294 1 17 . 1 1 122 122 VAL C C 552 175.998 175.998 175.249 0.749 18053
11295 1 17 . 1 1 122 122 VAL CA C 552 61.655 61.655 62.291 -0.636 18053
11296 1 17 . 1 1 122 122 VAL CB C 552 33.049 33.049 32.479 0.570 18053
11297 1 17 . 1 1 122 122 VAL H H 552 8.845 8.845 8.342 0.503 18053
11298 1 17 . 1 1 123 123 ALA N N 553 122.098 122.098 120.982 1.116 18053
11299 1 17 . 1 1 123 123 ALA HA H 553 4.890 4.890 4.686 0.204 18053
11300 1 17 . 1 1 123 123 ALA C C 553 175.261 175.261 175.250 0.011 18053
11301 1 17 . 1 1 123 123 ALA CA C 553 52.757 52.757 50.989 1.768 18053
11302 1 17 . 1 1 123 123 ALA CB C 553 22.267 22.267 22.121 0.146 18053
11303 1 17 . 1 1 123 123 ALA H H 553 7.788 7.788 7.651 0.137 18053
11304 1 17 . 1 1 124 124 MET N N 554 118.217 118.217 120.352 -2.135 18053
11305 1 17 . 1 1 124 124 MET HA H 554 5.286 5.286 4.997 0.289 18053
11306 1 17 . 1 1 124 124 MET C C 554 174.428 174.428 174.175 0.253 18053
11307 1 17 . 1 1 124 124 MET CA C 554 55.104 55.104 55.743 -0.639 18053
11308 1 17 . 1 1 124 124 MET CB C 554 35.342 35.342 35.694 -0.352 18053
11309 1 17 . 1 1 124 124 MET H H 554 8.693 8.693 8.578 0.115 18053
11310 1 17 . 1 1 125 125 ARG N N 555 122.132 122.132 127.542 -5.410 18053
11311 1 17 . 1 1 125 125 ARG HA H 555 4.900 4.900 4.763 0.137 18053
11312 1 17 . 1 1 125 125 ARG CA C 555 56.388 56.388 54.980 1.407 18053
11313 1 17 . 1 1 125 125 ARG CB C 555 34.378 34.378 33.374 1.004 18053
11314 1 17 . 1 1 125 125 ARG H H 555 8.919 8.919 8.775 0.144 18053
11315 1 17 . 1 1 126 126 THR HA H 556 4.685 4.685 4.155 0.530 18053
11316 1 17 . 1 1 126 126 THR C C 556 172.436 172.436 173.624 -1.188 18053
11317 1 17 . 1 1 126 126 THR CA C 556 61.382 61.382 63.819 -2.437 18053
11318 1 17 . 1 1 126 126 THR CB C 556 70.444 70.444 69.281 1.163 18053
11319 1 17 . 1 1 127 127 VAL N N 557 124.976 124.976 126.227 -1.251 18053
11320 1 17 . 1 1 127 127 VAL HA H 557 4.146 4.146 4.322 -0.176 18053
11321 1 17 . 1 1 127 127 VAL C C 557 173.937 173.937 172.895 1.042 18053
11322 1 17 . 1 1 127 127 VAL CA C 557 61.109 61.109 59.700 1.409 18053
11323 1 17 . 1 1 127 127 VAL CB C 557 33.759 33.759 34.097 -0.338 18053
11324 1 17 . 1 1 127 127 VAL H H 557 8.127 8.127 8.029 0.098 18053
11325 1 17 . 1 1 128 128 LYS N N 558 125.384 125.384 123.898 1.486 18053
11326 1 17 . 1 1 128 128 LYS HA H 558 4.706 4.706 4.356 0.350 18053
11327 1 17 . 1 1 128 128 LYS C C 558 175.534 175.534 174.269 1.265 18053
11328 1 17 . 1 1 128 128 LYS CA C 558 54.886 54.886 54.279 0.607 18053
11329 1 17 . 1 1 128 128 LYS CB C 558 34.673 34.673 35.099 -0.425 18053
11330 1 17 . 1 1 128 128 LYS H H 558 8.289 8.289 7.844 0.445 18053
11331 1 17 . 1 1 129 129 LYS N N 559 124.005 124.005 124.437 -0.432 18053
11332 1 17 . 1 1 129 129 LYS HA H 559 4.310 4.310 4.056 0.254 18053
11333 1 17 . 1 1 129 129 LYS C C 559 176.571 176.571 175.540 1.031 18053
11334 1 17 . 1 1 129 129 LYS CA C 559 56.742 56.742 57.829 -1.087 18053
11335 1 17 . 1 1 129 129 LYS CB C 559 33.362 33.362 32.409 0.953 18053
11336 1 17 . 1 1 129 129 LYS H H 559 8.461 8.461 8.163 0.298 18053
11337 1 17 . 1 1 130 130 SER N N 560 117.195 117.195 122.371 -5.176 18053
11338 1 17 . 1 1 130 130 SER HA H 560 4.384 4.384 4.665 -0.281 18053
11339 1 17 . 1 1 130 130 SER C C 560 174.565 174.565 173.271 1.294 18053
11340 1 17 . 1 1 130 130 SER CA C 560 58.434 58.434 57.866 0.568 18053
11341 1 17 . 1 1 130 130 SER CB C 560 63.812 63.812 63.191 0.621 18053
11342 1 17 . 1 1 130 130 SER H H 560 8.465 8.465 8.574 -0.109 18053
11343 1 17 . 1 1 131 131 SER N N 561 118.149 118.149 116.274 1.875 18053
11344 1 17 . 1 1 131 131 SER HA H 561 4.412 4.412 4.160 0.252 18053
11345 1 17 . 1 1 131 131 SER C C 561 174.456 174.456 173.435 1.021 18053
11346 1 17 . 1 1 131 131 SER CA C 561 58.489 58.489 59.085 -0.596 18053
11347 1 17 . 1 1 131 131 SER CB C 561 63.811 63.811 63.252 0.559 18053
11348 1 17 . 1 1 131 131 SER H H 561 8.336 8.336 8.007 0.329 18053
11349 1 17 . 1 1 132 132 VAL N N 562 121.332 121.332 117.171 4.161 18053
11350 1 17 . 1 1 132 132 VAL HA H 562 4.035 4.035 3.773 0.262 18053
11351 1 17 . 1 1 132 132 VAL C C 562 176.066 176.066 174.993 1.073 18053
11352 1 17 . 1 1 132 132 VAL CA C 562 62.446 62.446 63.363 -0.917 18053
11353 1 17 . 1 1 132 132 VAL CB C 562 32.394 32.394 31.218 1.176 18053
11354 1 17 . 1 1 132 132 VAL H H 562 7.982 7.982 8.185 -0.203 18053
11355 1 17 . 1 1 133 133 MET N N 563 124.022 124.022 120.188 3.834 18053
11356 1 17 . 1 1 133 133 MET HA H 563 4.385 4.385 4.438 -0.053 18053
11357 1 17 . 1 1 133 133 MET C C 563 176.039 176.039 176.343 -0.304 18053
11358 1 17 . 1 1 133 133 MET CA C 563 55.350 55.350 53.761 1.589 18053
11359 1 17 . 1 1 133 133 MET CB C 563 32.503 32.503 32.351 0.152 18053
11360 1 17 . 1 1 133 133 MET H H 563 8.295 8.295 7.822 0.473 18053
11361 1 17 . 1 1 134 134 ARG N N 564 122.677 122.677 123.586 -0.909 18053
11362 1 17 . 1 1 134 134 ARG HA H 564 4.262 4.262 4.427 -0.165 18053
11363 1 17 . 1 1 134 134 ARG C C 564 176.298 176.298 176.538 -0.240 18053
11364 1 17 . 1 1 134 134 ARG CA C 564 56.087 56.087 54.438 1.649 18053
11365 1 17 . 1 1 134 134 ARG CB C 564 30.702 30.702 30.017 0.685 18053
11366 1 17 . 1 1 134 134 ARG H H 564 8.295 8.295 8.626 -0.331 18053
11367 1 17 . 1 1 135 135 GLU N N 565 121.945 121.945 126.367 -4.422 18053
11368 1 17 . 1 1 135 135 GLU HA H 565 4.160 4.160 4.340 -0.180 18053
11369 1 17 . 1 1 135 135 GLU C C 565 176.080 176.080 176.433 -0.353 18053
11370 1 17 . 1 1 135 135 GLU CA C 565 56.906 56.906 56.633 0.272 18053
11371 1 17 . 1 1 135 135 GLU CB C 565 29.774 29.774 28.150 1.624 18053
11372 1 17 . 1 1 135 135 GLU H H 565 8.470 8.470 8.959 -0.489 18053
11373 1 17 . 1 1 136 136 ASN N N 566 118.761 118.761 120.608 -1.847 18053
11374 1 17 . 1 1 136 136 ASN HA H 566 4.617 4.617 4.587 0.030 18053
11375 1 17 . 1 1 136 136 ASN C C 566 175.315 175.315 175.960 -0.645 18053
11376 1 17 . 1 1 136 136 ASN CA C 566 53.193 53.193 54.441 -1.248 18053
11377 1 17 . 1 1 136 136 ASN CB C 566 38.836 38.836 38.836 -0.000 18053
11378 1 17 . 1 1 136 136 ASN H H 566 8.341 8.341 8.168 0.173 18053
11379 1 17 . 1 1 137 137 GLU N N 567 121.349 121.349 118.272 3.077 18053
11380 1 17 . 1 1 137 137 GLU HA H 567 4.152 4.152 4.158 -0.006 18053
11381 1 17 . 1 1 137 137 GLU C C 567 176.243 176.243 176.443 -0.200 18053
11382 1 17 . 1 1 137 137 GLU CA C 567 56.906 56.906 57.775 -0.869 18053
11383 1 17 . 1 1 137 137 GLU CB C 567 29.992 29.992 29.627 0.365 18053
11384 1 17 . 1 1 137 137 GLU H H 567 8.349 8.349 8.571 -0.222 18053
11385 1 17 . 1 1 138 138 ASN N N 568 118.761 118.761 116.942 1.819 18053
11386 1 17 . 1 1 138 138 ASN HA H 568 4.712 4.712 4.893 -0.181 18053
11387 1 17 . 1 1 138 138 ASN C C 568 174.551 174.551 173.736 0.815 18053
11388 1 17 . 1 1 138 138 ASN CA C 568 53.193 53.193 52.656 0.537 18053
11389 1 17 . 1 1 138 138 ASN CB C 568 39.327 39.327 41.866 -2.539 18053
11390 1 17 . 1 1 138 138 ASN H H 568 8.397 8.397 7.672 0.725 18053
11391 1 18 . 1 1 20 20 ALA N N 450 125.180 125.180 124.662 0.518 18053
11392 1 18 . 1 1 20 20 ALA HA H 450 4.706 4.706 4.528 0.178 18053
11393 1 18 . 1 1 20 20 ALA C C 450 177.226 177.226 176.647 0.579 18053
11394 1 18 . 1 1 20 20 ALA CA C 450 52.757 52.757 52.707 0.050 18053
11395 1 18 . 1 1 20 20 ALA CB C 450 20.411 20.411 19.452 0.959 18053
11396 1 18 . 1 1 20 20 ALA H H 450 8.484 8.484 8.572 -0.088 18053
11397 1 18 . 1 1 21 21 SER N N 451 115.714 115.714 119.858 -4.144 18053
11398 1 18 . 1 1 21 21 SER HA H 451 4.513 4.513 4.451 0.062 18053
11399 1 18 . 1 1 21 21 SER C C 451 174.742 174.742 174.950 -0.208 18053
11400 1 18 . 1 1 21 21 SER CA C 451 58.516 58.516 58.313 0.203 18053
11401 1 18 . 1 1 21 21 SER CB C 451 64.159 64.159 64.256 -0.097 18053
11402 1 18 . 1 1 21 21 SER H H 451 8.487 8.487 8.638 -0.151 18053
11403 1 18 . 1 1 22 22 GLY N N 452 111.509 111.509 114.434 -2.925 18053
11404 1 18 . 1 1 22 22 GLY C C 452 174.401 174.401 174.770 -0.369 18053
11405 1 18 . 1 1 22 22 GLY CA C 452 45.059 45.059 45.620 -0.561 18053
11406 1 18 . 1 1 22 22 GLY H H 452 8.198 8.198 8.860 -0.662 18053
11407 1 18 . 1 1 23 23 SER N N 453 116.191 116.191 116.389 -0.198 18053
11408 1 18 . 1 1 23 23 SER HA H 453 4.364 4.364 4.452 -0.088 18053
11409 1 18 . 1 1 23 23 SER C C 453 173.432 173.432 174.813 -1.381 18053
11410 1 18 . 1 1 23 23 SER CA C 453 59.744 59.744 60.008 -0.265 18053
11411 1 18 . 1 1 23 23 SER CB C 453 64.335 64.335 63.284 1.051 18053
11412 1 18 . 1 1 23 23 SER H H 453 8.494 8.494 8.508 -0.014 18053
11413 1 18 . 1 1 24 24 VAL N N 454 121.656 121.656 120.446 1.210 18053
11414 1 18 . 1 1 24 24 VAL HA H 454 5.035 5.035 4.130 0.904 18053
11415 1 18 . 1 1 24 24 VAL C C 454 174.606 174.606 175.589 -0.983 18053
11416 1 18 . 1 1 24 24 VAL CA C 454 61.055 61.055 61.716 -0.661 18053
11417 1 18 . 1 1 24 24 VAL CB C 454 32.503 32.503 31.581 0.922 18053
11418 1 18 . 1 1 24 24 VAL H H 454 7.830 7.830 7.662 0.168 18053
11419 1 18 . 1 1 25 25 SER N N 455 119.323 119.323 121.090 -1.767 18053
11420 1 18 . 1 1 25 25 SER HA H 455 4.672 4.672 4.855 -0.183 18053
11421 1 18 . 1 1 25 25 SER C C 455 174.426 174.426 173.438 0.988 18053
11422 1 18 . 1 1 25 25 SER CA C 455 55.268 55.268 55.513 -0.245 18053
11423 1 18 . 1 1 25 25 SER CB C 455 65.162 65.162 65.570 -0.408 18053
11424 1 18 . 1 1 25 25 SER H H 455 9.065 9.065 8.754 0.311 18053
11425 1 18 . 1 1 26 26 ILE N N 456 119.468 119.468 128.021 -8.553 18053
11426 1 18 . 1 1 26 26 ILE HA H 456 4.180 4.180 4.167 0.013 18053
11427 1 18 . 1 1 26 26 ILE C C 456 175.506 175.506 175.943 -0.437 18053
11428 1 18 . 1 1 26 26 ILE CA C 456 61.328 61.328 61.868 -0.540 18053
11429 1 18 . 1 1 26 26 ILE CB C 456 37.962 37.962 36.953 1.009 18053
11430 1 18 . 1 1 26 26 ILE H H 456 8.295 8.295 8.839 -0.544 18053
11431 1 18 . 1 1 27 27 GLU N N 457 129.726 129.726 129.170 0.556 18053
11432 1 18 . 1 1 27 27 GLU HA H 457 4.228 4.228 4.222 0.006 18053
11433 1 18 . 1 1 27 27 GLU C C 457 175.179 175.179 176.148 -0.969 18053
11434 1 18 . 1 1 27 27 GLU CA C 457 55.432 55.432 58.561 -3.129 18053
11435 1 18 . 1 1 27 27 GLU CB C 457 30.142 30.142 30.979 -0.837 18053
11436 1 18 . 1 1 27 27 GLU H H 457 8.393 8.393 8.192 0.201 18053
11437 1 18 . 1 1 28 28 GLU N N 458 117.076 117.076 116.446 0.630 18053
11438 1 18 . 1 1 28 28 GLU HA H 458 4.168 4.168 4.617 -0.449 18053
11439 1 18 . 1 1 28 28 GLU C C 458 174.701 174.701 175.188 -0.487 18053
11440 1 18 . 1 1 28 28 GLU CA C 458 56.906 56.906 54.930 1.976 18053
11441 1 18 . 1 1 28 28 GLU CB C 458 31.848 31.848 32.622 -0.774 18053
11442 1 18 . 1 1 28 28 GLU H H 458 7.489 7.489 8.052 -0.563 18053
11443 1 18 . 1 1 29 29 ILE N N 459 122.183 122.183 120.879 1.304 18053
11444 1 18 . 1 1 29 29 ILE HA H 459 3.764 3.764 3.983 -0.219 18053
11445 1 18 . 1 1 29 29 ILE C C 459 174.169 174.169 174.580 -0.411 18053
11446 1 18 . 1 1 29 29 ILE CA C 459 59.526 59.526 59.501 0.025 18053
11447 1 18 . 1 1 29 29 ILE CB C 459 40.309 40.309 41.965 -1.656 18053
11448 1 18 . 1 1 29 29 ILE H H 459 8.126 8.126 8.315 -0.189 18053
11449 1 18 . 1 1 30 30 ASP N N 460 123.205 123.205 124.115 -0.910 18053
11450 1 18 . 1 1 30 30 ASP HA H 460 4.183 4.183 4.158 0.025 18053
11451 1 18 . 1 1 30 30 ASP C C 460 178.318 178.318 177.663 0.655 18053
11452 1 18 . 1 1 30 30 ASP CA C 460 53.930 53.930 53.298 0.632 18053
11453 1 18 . 1 1 30 30 ASP CB C 460 42.807 42.807 42.287 0.520 18053
11454 1 18 . 1 1 30 30 ASP H H 460 6.704 6.704 7.486 -0.782 18053
11455 1 18 . 1 1 31 31 LEU N N 461 128.551 128.551 119.787 8.764 18053
11456 1 18 . 1 1 31 31 LEU HA H 461 4.064 4.064 4.039 0.025 18053
11457 1 18 . 1 1 31 31 LEU C C 461 177.513 177.513 177.630 -0.117 18053
11458 1 18 . 1 1 31 31 LEU CA C 461 57.124 57.124 57.406 -0.282 18053
11459 1 18 . 1 1 31 31 LEU CB C 461 41.237 41.237 42.141 -0.904 18053
11460 1 18 . 1 1 31 31 LEU H H 461 9.012 9.012 8.069 0.943 18053
11461 1 18 . 1 1 32 32 GLU N N 462 115.101 115.101 116.818 -1.717 18053
11462 1 18 . 1 1 32 32 GLU HA H 462 4.283 4.283 4.734 -0.451 18053
11463 1 18 . 1 1 32 32 GLU C C 462 177.062 177.062 176.993 0.069 18053
11464 1 18 . 1 1 32 32 GLU CA C 462 55.759 55.759 56.330 -0.571 18053
11465 1 18 . 1 1 32 32 GLU CB C 462 29.569 29.569 30.781 -1.212 18053
11466 1 18 . 1 1 32 32 GLU H H 462 7.588 7.588 7.914 -0.326 18053
11467 1 18 . 1 1 33 33 GLY N N 463 106.299 106.299 107.775 -1.476 18053
11468 1 18 . 1 1 33 33 GLY C C 463 174.824 174.824 174.705 0.119 18053
11469 1 18 . 1 1 33 33 GLY CA C 463 46.806 46.806 44.960 1.846 18053
11470 1 18 . 1 1 33 33 GLY H H 463 7.372 7.372 8.167 -0.795 18053
11471 1 18 . 1 1 34 34 LYS N N 464 118.744 118.744 119.101 -0.357 18053
11472 1 18 . 1 1 34 34 LYS HA H 464 4.562 4.562 4.381 0.181 18053
11473 1 18 . 1 1 34 34 LYS C C 464 177.076 177.076 174.771 2.305 18053
11474 1 18 . 1 1 34 34 LYS CA C 464 59.963 59.963 57.500 2.463 18053
11475 1 18 . 1 1 34 34 LYS CB C 464 33.111 33.111 33.689 -0.578 18053
11476 1 18 . 1 1 34 34 LYS H H 464 9.547 9.547 8.226 1.321 18053
11477 1 18 . 1 1 35 35 PHE N N 465 109.125 109.125 112.769 -3.644 18053
11478 1 18 . 1 1 35 35 PHE HA H 465 5.514 5.514 4.778 0.736 18053
11479 1 18 . 1 1 35 35 PHE C C 465 174.183 174.183 172.454 1.729 18053
11480 1 18 . 1 1 35 35 PHE CA C 465 56.632 56.632 55.398 1.234 18053
11481 1 18 . 1 1 35 35 PHE CB C 465 40.599 40.599 40.944 -0.345 18053
11482 1 18 . 1 1 35 35 PHE H H 465 6.740 6.740 6.968 -0.228 18053
11483 1 18 . 1 1 36 36 VAL N N 466 119.579 119.579 118.867 0.712 18053
11484 1 18 . 1 1 36 36 VAL HA H 466 3.709 3.709 4.126 -0.417 18053
11485 1 18 . 1 1 36 36 VAL C C 466 172.668 172.668 173.913 -1.245 18053
11486 1 18 . 1 1 36 36 VAL CA C 466 62.692 62.692 60.978 1.714 18053
11487 1 18 . 1 1 36 36 VAL CB C 466 36.215 36.215 35.452 0.763 18053
11488 1 18 . 1 1 36 36 VAL H H 466 7.628 7.628 7.852 -0.224 18053
11489 1 18 . 1 1 37 37 GLN N N 467 126.831 126.831 127.875 -1.044 18053
11490 1 18 . 1 1 37 37 GLN HA H 467 5.449 5.449 4.869 0.580 18053
11491 1 18 . 1 1 37 37 GLN C C 467 174.797 174.797 175.070 -0.273 18053
11492 1 18 . 1 1 37 37 GLN CA C 467 54.121 54.121 54.988 -0.867 18053
11493 1 18 . 1 1 37 37 GLN CB C 467 34.623 34.623 29.782 4.841 18053
11494 1 18 . 1 1 37 37 GLN H H 467 8.392 8.392 8.315 0.077 18053
11495 1 18 . 1 1 38 38 LEU N N 468 123.018 123.018 128.445 -5.427 18053
11496 1 18 . 1 1 38 38 LEU HA H 468 5.422 5.422 5.223 0.199 18053
11497 1 18 . 1 1 38 38 LEU C C 468 175.588 175.588 176.353 -0.765 18053
11498 1 18 . 1 1 38 38 LEU CA C 468 52.702 52.702 54.086 -1.384 18053
11499 1 18 . 1 1 38 38 LEU CB C 468 45.046 45.046 43.725 1.321 18053
11500 1 18 . 1 1 38 38 LEU H H 468 9.103 9.103 8.714 0.389 18053
11501 1 18 . 1 1 39 39 LYS N N 469 118.983 118.983 120.015 -1.032 18053
11502 1 18 . 1 1 39 39 LYS HA H 469 4.852 4.852 4.744 0.108 18053
11503 1 18 . 1 1 39 39 LYS C C 469 173.309 173.309 174.264 -0.955 18053
11504 1 18 . 1 1 39 39 LYS CA C 469 54.994 54.994 55.106 -0.112 18053
11505 1 18 . 1 1 39 39 LYS CB C 469 38.246 38.246 36.319 1.927 18053
11506 1 18 . 1 1 39 39 LYS H H 469 8.496 8.496 8.796 -0.300 18053
11507 1 18 . 1 1 40 40 ASN N N 470 121.758 121.758 125.827 -4.069 18053
11508 1 18 . 1 1 40 40 ASN HA H 470 4.788 4.788 5.233 -0.445 18053
11509 1 18 . 1 1 40 40 ASN C C 470 174.496 174.496 175.131 -0.635 18053
11510 1 18 . 1 1 40 40 ASN CA C 470 51.119 51.119 51.459 -0.341 18053
11511 1 18 . 1 1 40 40 ASN CB C 470 37.559 37.559 39.192 -1.633 18053
11512 1 18 . 1 1 40 40 ASN H H 470 8.283 8.283 8.585 -0.302 18053
11513 1 18 . 1 1 41 41 ASN N N 471 122.422 122.422 122.678 -0.256 18053
11514 1 18 . 1 1 41 41 ASN HA H 471 4.588 4.588 4.545 0.043 18053
11515 1 18 . 1 1 41 41 ASN C C 471 174.810 174.810 175.505 -0.695 18053
11516 1 18 . 1 1 41 41 ASN CA C 471 53.985 53.985 54.035 -0.050 18053
11517 1 18 . 1 1 41 41 ASN CB C 471 39.600 39.600 38.680 0.920 18053
11518 1 18 . 1 1 41 41 ASN H H 471 8.681 8.681 8.544 0.137 18053
11519 1 18 . 1 1 42 42 SER N N 472 116.446 116.446 115.739 0.707 18053
11520 1 18 . 1 1 42 42 SER HA H 472 4.719 4.719 4.420 0.299 18053
11521 1 18 . 1 1 42 42 SER C C 472 172.804 172.804 174.658 -1.854 18053
11522 1 18 . 1 1 42 42 SER CA C 472 57.288 57.288 57.619 -0.331 18053
11523 1 18 . 1 1 42 42 SER CB C 472 66.241 66.241 64.682 1.559 18053
11524 1 18 . 1 1 42 42 SER H H 472 8.370 8.370 7.624 0.746 18053
11525 1 18 . 1 1 43 43 ASP N N 473 117.706 117.706 122.536 -4.830 18053
11526 1 18 . 1 1 43 43 ASP HA H 473 4.474 4.474 4.473 0.001 18053
11527 1 18 . 1 1 43 43 ASP C C 473 175.343 175.343 176.024 -0.681 18053
11528 1 18 . 1 1 43 43 ASP CA C 473 53.521 53.521 55.112 -1.591 18053
11529 1 18 . 1 1 43 43 ASP CB C 473 40.322 40.322 41.060 -0.738 18053
11530 1 18 . 1 1 43 43 ASP H H 473 8.254 8.254 8.753 -0.499 18053
11531 1 18 . 1 1 44 44 LYS N N 474 120.209 120.209 119.691 0.518 18053
11532 1 18 . 1 1 44 44 LYS HA H 474 4.569 4.569 4.442 0.127 18053
11533 1 18 . 1 1 44 44 LYS C C 474 175.397 175.397 175.981 -0.584 18053
11534 1 18 . 1 1 44 44 LYS CA C 474 54.012 54.012 54.256 -0.244 18053
11535 1 18 . 1 1 44 44 LYS CB C 474 35.383 35.383 33.318 2.065 18053
11536 1 18 . 1 1 44 44 LYS H H 474 8.305 8.305 7.537 0.768 18053
11537 1 18 . 1 1 45 45 ASP N N 475 124.993 124.993 122.907 2.086 18053
11538 1 18 . 1 1 45 45 ASP HA H 475 3.975 3.975 4.529 -0.554 18053
11539 1 18 . 1 1 45 45 ASP C C 475 174.810 174.810 175.949 -1.139 18053
11540 1 18 . 1 1 45 45 ASP CA C 475 54.995 54.995 55.035 -0.040 18053
11541 1 18 . 1 1 45 45 ASP CB C 475 40.364 40.364 40.486 -0.122 18053
11542 1 18 . 1 1 45 45 ASP H H 475 8.722 8.722 8.540 0.182 18053
11543 1 18 . 1 1 46 46 GLN N N 476 120.549 120.549 126.709 -6.160 18053
11544 1 18 . 1 1 46 46 GLN HA H 476 4.436 4.436 4.193 0.243 18053
11545 1 18 . 1 1 46 46 GLN C C 476 174.019 174.019 175.494 -1.475 18053
11546 1 18 . 1 1 46 46 GLN CA C 476 53.138 53.138 55.047 -1.909 18053
11547 1 18 . 1 1 46 46 GLN CB C 476 31.466 31.466 28.886 2.580 18053
11548 1 18 . 1 1 46 46 GLN H H 476 7.878 7.878 8.251 -0.373 18053
11549 1 18 . 1 1 47 47 SER N N 477 121.537 121.537 123.381 -1.844 18053
11550 1 18 . 1 1 47 47 SER HA H 477 4.229 4.229 4.159 0.070 18053
11551 1 18 . 1 1 47 47 SER C C 477 174.565 174.565 173.172 1.393 18053
11552 1 18 . 1 1 47 47 SER CA C 477 58.706 58.706 59.374 -0.668 18053
11553 1 18 . 1 1 47 47 SER CB C 477 62.965 62.965 62.870 0.095 18053
11554 1 18 . 1 1 47 47 SER H H 477 8.748 8.748 8.671 0.077 18053
11555 1 18 . 1 1 48 48 LEU N N 478 127.751 127.751 126.010 1.741 18053
11556 1 18 . 1 1 48 48 LEU HA H 478 2.631 2.631 4.208 -1.577 18053
11557 1 18 . 1 1 48 48 LEU C C 478 176.789 176.789 176.503 0.286 18053
11558 1 18 . 1 1 48 48 LEU CA C 478 52.102 52.102 53.928 -1.826 18053
11559 1 18 . 1 1 48 48 LEU CB C 478 42.343 42.343 44.145 -1.802 18053
11560 1 18 . 1 1 48 48 LEU H H 478 7.856 7.856 7.536 0.320 18053
11561 1 18 . 1 1 49 49 GLY N N 479 107.525 107.525 109.531 -2.006 18053
11562 1 18 . 1 1 49 49 GLY C C 479 176.653 176.653 175.115 1.538 18053
11563 1 18 . 1 1 49 49 GLY CA C 479 48.062 48.062 45.907 2.155 18053
11564 1 18 . 1 1 49 49 GLY H H 479 7.728 7.728 8.640 -0.912 18053
11565 1 18 . 1 1 50 50 ASN N N 480 117.059 117.059 119.823 -2.764 18053
11566 1 18 . 1 1 50 50 ASN HA H 480 4.255 4.255 4.578 -0.323 18053
11567 1 18 . 1 1 50 50 ASN C C 480 174.961 174.961 175.375 -0.414 18053
11568 1 18 . 1 1 50 50 ASN CA C 480 56.360 56.360 54.404 1.956 18053
11569 1 18 . 1 1 50 50 ASN CB C 480 37.416 37.416 38.869 -1.453 18053
11570 1 18 . 1 1 50 50 ASN H H 480 7.552 7.552 8.705 -1.153 18053
11571 1 18 . 1 1 51 51 TRP N N 481 122.166 122.166 119.097 3.069 18053
11572 1 18 . 1 1 51 51 TRP HA H 481 4.477 4.477 5.023 -0.546 18053
11573 1 18 . 1 1 51 51 TRP C C 481 175.575 175.575 175.899 -0.324 18053
11574 1 18 . 1 1 51 51 TRP CA C 481 58.762 58.762 57.698 1.064 18053
11575 1 18 . 1 1 51 51 TRP CB C 481 28.041 28.041 29.393 -1.352 18053
11576 1 18 . 1 1 51 51 TRP H H 481 8.914 8.914 7.896 1.018 18053
11577 1 18 . 1 1 52 52 ARG N N 482 116.480 116.480 120.355 -3.875 18053
11578 1 18 . 1 1 52 52 ARG HA H 482 5.968 5.968 5.316 0.652 18053
11579 1 18 . 1 1 52 52 ARG C C 482 175.807 175.807 175.167 0.640 18053
11580 1 18 . 1 1 52 52 ARG CA C 482 54.121 54.121 54.317 -0.196 18053
11581 1 18 . 1 1 52 52 ARG CB C 482 35.124 35.124 34.595 0.529 18053
11582 1 18 . 1 1 52 52 ARG H H 482 9.147 9.147 9.141 0.006 18053
11583 1 18 . 1 1 53 53 ILE N N 483 119.579 119.579 124.230 -4.651 18053
11584 1 18 . 1 1 53 53 ILE HA H 483 4.985 4.985 4.947 0.038 18053
11585 1 18 . 1 1 53 53 ILE C C 483 175.670 175.670 175.980 -0.310 18053
11586 1 18 . 1 1 53 53 ILE CA C 483 60.400 60.400 60.273 0.127 18053
11587 1 18 . 1 1 53 53 ILE CB C 483 40.227 40.227 38.822 1.405 18053
11588 1 18 . 1 1 53 53 ILE H H 483 9.000 9.000 8.660 0.340 18053
11589 1 18 . 1 1 54 54 LYS N N 484 124.737 124.737 129.388 -4.651 18053
11590 1 18 . 1 1 54 54 LYS HA H 484 5.463 5.463 4.644 0.819 18053
11591 1 18 . 1 1 54 54 LYS C C 484 175.575 175.575 176.089 -0.514 18053
11592 1 18 . 1 1 54 54 LYS CA C 484 54.613 54.613 56.160 -1.546 18053
11593 1 18 . 1 1 54 54 LYS CB C 484 35.041 35.041 32.137 2.904 18053
11594 1 18 . 1 1 54 54 LYS H H 484 9.678 9.678 8.434 1.244 18053
11595 1 18 . 1 1 55 55 ARG N N 485 124.090 124.090 127.810 -3.720 18053
11596 1 18 . 1 1 55 55 ARG HA H 485 5.525 5.525 4.685 0.840 18053
11597 1 18 . 1 1 55 55 ARG C C 485 174.155 174.155 175.019 -0.864 18053
11598 1 18 . 1 1 55 55 ARG CA C 485 53.903 53.903 54.787 -0.884 18053
11599 1 18 . 1 1 55 55 ARG H H 485 9.314 9.314 8.740 0.574 18053
11600 1 18 . 1 1 56 56 GLN N N 486 126.576 126.576 126.941 -0.365 18053
11601 1 18 . 1 1 56 56 GLN HA H 486 4.842 4.842 4.889 -0.047 18053
11602 1 18 . 1 1 56 56 GLN C C 486 174.991 174.991 175.046 -0.055 18053
11603 1 18 . 1 1 56 56 GLN CA C 486 54.831 54.831 54.743 0.088 18053
11604 1 18 . 1 1 56 56 GLN CB C 486 31.465 31.465 29.387 2.078 18053
11605 1 18 . 1 1 56 56 GLN H H 486 8.831 8.831 8.500 0.331 18053
11606 1 18 . 1 1 57 57 VAL N N 487 126.712 126.712 124.485 2.227 18053
11607 1 18 . 1 1 57 57 VAL HA H 487 4.266 4.266 4.270 -0.004 18053
11608 1 18 . 1 1 57 57 VAL C C 487 175.916 175.916 177.072 -1.156 18053
11609 1 18 . 1 1 57 57 VAL CA C 487 61.820 61.820 61.781 0.039 18053
11610 1 18 . 1 1 57 57 VAL CB C 487 32.803 32.803 32.504 0.299 18053
11611 1 18 . 1 1 57 57 VAL H H 487 8.786 8.786 8.798 -0.012 18053
11612 1 18 . 1 1 58 58 LEU N N 488 127.274 127.274 125.657 1.617 18053
11613 1 18 . 1 1 58 58 LEU HA H 488 4.085 4.085 4.175 -0.090 18053
11614 1 18 . 1 1 58 58 LEU C C 488 177.158 177.158 177.747 -0.589 18053
11615 1 18 . 1 1 58 58 LEU CA C 488 56.906 56.906 57.461 -0.555 18053
11616 1 18 . 1 1 58 58 LEU CB C 488 41.374 41.374 41.564 -0.190 18053
11617 1 18 . 1 1 58 58 LEU H H 488 8.316 8.316 8.544 -0.228 18053
11618 1 18 . 1 1 59 59 GLU N N 489 119.647 119.647 119.032 0.615 18053
11619 1 18 . 1 1 59 59 GLU HA H 489 4.112 4.112 4.209 -0.097 18053
11620 1 18 . 1 1 59 59 GLU C C 489 176.230 176.230 177.241 -1.011 18053
11621 1 18 . 1 1 59 59 GLU CA C 489 57.015 57.015 56.566 0.450 18053
11622 1 18 . 1 1 59 59 GLU CB C 489 28.149 28.149 29.826 -1.677 18053
11623 1 18 . 1 1 59 59 GLU H H 489 8.636 8.636 8.092 0.544 18053
11624 1 18 . 1 1 60 60 GLY N N 490 108.819 108.819 107.608 1.211 18053
11625 1 18 . 1 1 60 60 GLY C C 490 173.568 173.568 173.907 -0.339 18053
11626 1 18 . 1 1 60 60 GLY CA C 490 44.773 44.773 44.591 0.182 18053
11627 1 18 . 1 1 60 60 GLY H H 490 8.160 8.160 7.829 0.331 18053
11628 1 18 . 1 1 61 61 GLU N N 491 121.009 121.009 121.590 -0.581 18053
11629 1 18 . 1 1 61 61 GLU HA H 491 4.323 4.323 4.570 -0.247 18053
11630 1 18 . 1 1 61 61 GLU C C 491 175.725 175.725 175.048 0.677 18053
11631 1 18 . 1 1 61 61 GLU CA C 491 56.196 56.196 55.163 1.032 18053
11632 1 18 . 1 1 61 61 GLU CB C 491 30.865 30.865 30.961 -0.096 18053
11633 1 18 . 1 1 61 61 GLU H H 491 8.320 8.320 7.870 0.450 18053
11634 1 18 . 1 1 62 62 GLU N N 492 123.426 123.426 124.266 -0.840 18053
11635 1 18 . 1 1 62 62 GLU HA H 492 5.054 5.054 4.949 0.105 18053
11636 1 18 . 1 1 62 62 GLU C C 492 175.930 175.930 176.197 -0.267 18053
11637 1 18 . 1 1 62 62 GLU CA C 492 55.650 55.650 55.125 0.525 18053
11638 1 18 . 1 1 62 62 GLU CB C 492 32.312 32.312 29.023 3.289 18053
11639 1 18 . 1 1 62 62 GLU H H 492 8.594 8.594 8.789 -0.195 18053
11640 1 18 . 1 1 63 63 ILE N N 493 119.732 119.732 119.194 0.538 18053
11641 1 18 . 1 1 63 63 ILE HA H 493 4.788 4.788 4.574 0.214 18053
11642 1 18 . 1 1 63 63 ILE C C 493 174.647 174.647 174.492 0.155 18053
11643 1 18 . 1 1 63 63 ILE CA C 493 60.181 60.181 60.245 -0.064 18053
11644 1 18 . 1 1 63 63 ILE CB C 493 41.183 41.183 39.690 1.493 18053
11645 1 18 . 1 1 63 63 ILE H H 493 8.523 8.523 7.942 0.581 18053
11646 1 18 . 1 1 64 64 ALA N N 494 122.166 122.166 128.387 -6.221 18053
11647 1 18 . 1 1 64 64 ALA HA H 494 5.521 5.521 4.652 0.869 18053
11648 1 18 . 1 1 64 64 ALA C C 494 174.606 174.606 176.095 -1.489 18053
11649 1 18 . 1 1 64 64 ALA CA C 494 51.528 51.528 50.188 1.340 18053
11650 1 18 . 1 1 64 64 ALA CB C 494 22.239 22.239 19.889 2.350 18053
11651 1 18 . 1 1 64 64 ALA H H 494 8.741 8.741 8.372 0.369 18053
11652 1 18 . 1 1 65 65 TYR N N 495 126.729 126.729 126.698 0.031 18053
11653 1 18 . 1 1 65 65 TYR HA H 495 3.094 3.094 3.465 -0.371 18053
11654 1 18 . 1 1 65 65 TYR C C 495 173.036 173.036 174.193 -1.157 18053
11655 1 18 . 1 1 65 65 TYR CA C 495 56.905 56.905 56.650 0.255 18053
11656 1 18 . 1 1 65 65 TYR CB C 495 40.269 40.269 38.190 2.079 18053
11657 1 18 . 1 1 65 65 TYR H H 495 8.462 8.462 8.305 0.157 18053
11658 1 18 . 1 1 66 66 LYS N N 496 128.108 128.108 127.729 0.379 18053
11659 1 18 . 1 1 66 66 LYS HA H 496 4.822 4.822 4.410 0.412 18053
11660 1 18 . 1 1 66 66 LYS C C 496 174.906 174.906 174.877 0.029 18053
11661 1 18 . 1 1 66 66 LYS CA C 496 53.739 53.739 54.553 -0.814 18053
11662 1 18 . 1 1 66 66 LYS CB C 496 34.782 34.782 32.389 2.393 18053
11663 1 18 . 1 1 66 66 LYS H H 496 7.010 7.010 7.292 -0.282 18053
11664 1 18 . 1 1 67 67 PHE N N 497 125.299 125.299 123.144 2.155 18053
11665 1 18 . 1 1 67 67 PHE HA H 497 3.932 3.932 4.124 -0.192 18053
11666 1 18 . 1 1 67 67 PHE C C 497 177.990 177.990 175.841 2.149 18053
11667 1 18 . 1 1 67 67 PHE CA C 497 59.007 59.007 58.292 0.715 18053
11668 1 18 . 1 1 67 67 PHE CB C 497 40.981 40.981 40.037 0.944 18053
11669 1 18 . 1 1 67 67 PHE H H 497 8.509 8.509 7.996 0.513 18053
11670 1 18 . 1 1 68 68 THR N N 498 116.191 116.191 111.764 4.427 18053
11671 1 18 . 1 1 68 68 THR HA H 498 4.417 4.417 4.674 -0.257 18053
11672 1 18 . 1 1 68 68 THR CA C 498 60.855 60.855 59.027 1.828 18053
11673 1 18 . 1 1 68 68 THR CB C 498 68.019 68.019 69.520 -1.501 18053
11674 1 18 . 1 1 68 68 THR H H 498 8.688 8.688 8.312 0.376 18053
11675 1 18 . 1 1 69 69 PRO HA H 499 3.948 3.948 4.574 -0.626 18053
11676 1 18 . 1 1 69 69 PRO C C 499 177.444 177.444 176.859 0.585 18053
11677 1 18 . 1 1 69 69 PRO CA C 499 66.077 66.077 64.456 1.621 18053
11678 1 18 . 1 1 69 69 PRO CB C 499 32.776 32.776 31.849 0.927 18053
11679 1 18 . 1 1 70 70 LYS N N 500 113.552 113.552 115.707 -2.155 18053
11680 1 18 . 1 1 70 70 LYS HA H 500 4.385 4.385 4.158 0.227 18053
11681 1 18 . 1 1 70 70 LYS C C 500 176.325 176.325 176.697 -0.372 18053
11682 1 18 . 1 1 70 70 LYS CA C 500 54.995 54.995 56.734 -1.739 18053
11683 1 18 . 1 1 70 70 LYS CB C 500 31.793 31.793 31.852 -0.059 18053
11684 1 18 . 1 1 70 70 LYS H H 500 8.016 8.016 7.828 0.188 18053
11685 1 18 . 1 1 71 71 TYR N N 501 121.860 121.860 121.716 0.144 18053
11686 1 18 . 1 1 71 71 TYR HA H 501 3.730 3.730 4.406 -0.676 18053
11687 1 18 . 1 1 71 71 TYR C C 501 174.838 174.838 173.842 0.996 18053
11688 1 18 . 1 1 71 71 TYR CA C 501 62.310 62.310 59.083 3.227 18053
11689 1 18 . 1 1 71 71 TYR CB C 501 38.781 38.781 39.315 -0.534 18053
11690 1 18 . 1 1 71 71 TYR H H 501 7.460 7.460 7.770 -0.310 18053
11691 1 18 . 1 1 72 72 ILE N N 502 129.487 129.487 127.195 2.292 18053
11692 1 18 . 1 1 72 72 ILE HA H 502 3.928 3.928 4.428 -0.500 18053
11693 1 18 . 1 1 72 72 ILE C C 502 172.968 172.968 174.032 -1.064 18053
11694 1 18 . 1 1 72 72 ILE CA C 502 59.308 59.308 59.356 -0.048 18053
11695 1 18 . 1 1 72 72 ILE CB C 502 40.910 40.910 40.544 0.366 18053
11696 1 18 . 1 1 72 72 ILE H H 502 7.168 7.168 7.906 -0.738 18053
11697 1 18 . 1 1 73 73 LEU N N 503 128.278 128.278 129.120 -0.842 18053
11698 1 18 . 1 1 73 73 LEU HA H 503 4.493 4.493 4.449 0.044 18053
11699 1 18 . 1 1 73 73 LEU C C 503 175.834 175.834 175.360 0.474 18053
11700 1 18 . 1 1 73 73 LEU CA C 503 51.965 51.965 53.088 -1.123 18053
11701 1 18 . 1 1 73 73 LEU CB C 503 42.548 42.548 43.246 -0.698 18053
11702 1 18 . 1 1 73 73 LEU H H 503 8.483 8.483 8.360 0.123 18053
11703 1 18 . 1 1 74 74 ARG N N 504 129.589 129.589 125.519 4.070 18053
11704 1 18 . 1 1 74 74 ARG HA H 504 3.743 3.743 4.347 -0.604 18053
11705 1 18 . 1 1 74 74 ARG C C 504 175.233 175.233 175.883 -0.650 18053
11706 1 18 . 1 1 74 74 ARG CA C 504 56.851 56.851 55.245 1.606 18053
11707 1 18 . 1 1 74 74 ARG CB C 504 30.292 30.292 30.962 -0.670 18053
11708 1 18 . 1 1 74 74 ARG H H 504 8.673 8.673 8.370 0.303 18053
11709 1 18 . 1 1 75 75 ALA N N 505 123.205 123.205 123.589 -0.384 18053
11710 1 18 . 1 1 75 75 ALA HA H 505 3.522 3.522 4.413 -0.891 18053
11711 1 18 . 1 1 75 75 ALA C C 505 178.441 178.441 178.199 0.242 18053
11712 1 18 . 1 1 75 75 ALA CA C 505 53.794 53.794 52.585 1.209 18053
11713 1 18 . 1 1 75 75 ALA CB C 505 18.910 18.910 18.469 0.441 18053
11714 1 18 . 1 1 75 75 ALA H H 505 8.564 8.564 8.360 0.204 18053
11715 1 18 . 1 1 76 76 GLY N N 506 112.241 112.241 112.685 -0.444 18053
11716 1 18 . 1 1 76 76 GLY C C 506 174.278 174.278 173.982 0.296 18053
11717 1 18 . 1 1 76 76 GLY CA C 506 46.725 46.725 45.135 1.591 18053
11718 1 18 . 1 1 76 76 GLY H H 506 7.381 7.381 8.552 -1.171 18053
11719 1 18 . 1 1 77 77 GLN N N 507 117.382 117.382 118.534 -1.152 18053
11720 1 18 . 1 1 77 77 GLN HA H 507 4.364 4.364 4.716 -0.352 18053
11721 1 18 . 1 1 77 77 GLN C C 507 173.937 173.937 174.578 -0.641 18053
11722 1 18 . 1 1 77 77 GLN CA C 507 54.558 54.558 53.717 0.841 18053
11723 1 18 . 1 1 77 77 GLN CB C 507 30.073 30.073 30.767 -0.694 18053
11724 1 18 . 1 1 77 77 GLN H H 507 7.996 7.996 7.626 0.370 18053
11725 1 18 . 1 1 78 78 MET N N 508 116.957 116.957 115.673 1.284 18053
11726 1 18 . 1 1 78 78 MET HA H 508 5.388 5.388 4.689 0.699 18053
11727 1 18 . 1 1 78 78 MET C C 508 175.807 175.807 174.065 1.742 18053
11728 1 18 . 1 1 78 78 MET CA C 508 54.067 54.067 54.201 -0.134 18053
11729 1 18 . 1 1 78 78 MET CB C 508 37.198 37.198 34.796 2.402 18053
11730 1 18 . 1 1 78 78 MET H H 508 8.092 8.092 8.239 -0.147 18053
11731 1 18 . 1 1 79 79 VAL N N 509 119.340 119.340 119.395 -0.055 18053
11732 1 18 . 1 1 79 79 VAL HA H 509 4.956 4.956 4.725 0.231 18053
11733 1 18 . 1 1 79 79 VAL C C 509 172.217 172.217 174.054 -1.837 18053
11734 1 18 . 1 1 79 79 VAL CA C 509 59.471 59.471 60.722 -1.251 18053
11735 1 18 . 1 1 79 79 VAL CB C 509 33.676 33.676 36.210 -2.534 18053
11736 1 18 . 1 1 79 79 VAL H H 509 8.534 8.534 8.606 -0.072 18053
11737 1 18 . 1 1 80 80 THR N N 510 124.533 124.533 124.509 0.024 18053
11738 1 18 . 1 1 80 80 THR HA H 510 4.586 4.586 4.947 -0.361 18053
11739 1 18 . 1 1 80 80 THR C C 510 172.215 172.215 173.986 -1.771 18053
11740 1 18 . 1 1 80 80 THR CA C 510 62.119 62.119 61.545 0.574 18053
11741 1 18 . 1 1 80 80 THR CB C 510 69.407 69.407 69.576 -0.169 18053
11742 1 18 . 1 1 80 80 THR H H 510 8.301 8.301 8.532 -0.231 18053
11743 1 18 . 1 1 81 81 VAL N N 511 127.002 127.002 121.706 5.296 18053
11744 1 18 . 1 1 81 81 VAL HA H 511 4.596 4.596 4.944 -0.348 18053
11745 1 18 . 1 1 81 81 VAL C C 511 176.667 176.667 175.125 1.542 18053
11746 1 18 . 1 1 81 81 VAL CA C 511 61.382 61.382 59.962 1.420 18053
11747 1 18 . 1 1 81 81 VAL CB C 511 30.945 30.945 31.614 -0.669 18053
11748 1 18 . 1 1 81 81 VAL H H 511 8.796 8.796 8.646 0.150 18053
11749 1 18 . 1 1 82 82 TRP N N 512 131.479 131.479 129.163 2.316 18053
11750 1 18 . 1 1 82 82 TRP HA H 512 5.338 5.338 5.097 0.241 18053
11751 1 18 . 1 1 82 82 TRP C C 512 176.885 176.885 175.689 1.196 18053
11752 1 18 . 1 1 82 82 TRP CA C 512 56.442 56.442 56.597 -0.155 18053
11753 1 18 . 1 1 82 82 TRP CB C 512 30.701 30.701 31.405 -0.704 18053
11754 1 18 . 1 1 82 82 TRP H H 512 9.924 9.924 9.163 0.761 18053
11755 1 18 . 1 1 83 83 ALA N N 513 123.954 123.954 120.807 3.147 18053
11756 1 18 . 1 1 83 83 ALA HA H 513 4.308 4.308 5.195 -0.887 18053
11757 1 18 . 1 1 83 83 ALA C C 513 178.140 178.140 178.223 -0.083 18053
11758 1 18 . 1 1 83 83 ALA CA C 513 52.211 52.211 50.680 1.531 18053
11759 1 18 . 1 1 83 83 ALA CB C 513 18.745 18.745 20.603 -1.858 18053
11760 1 18 . 1 1 83 83 ALA H H 513 9.048 9.048 8.596 0.452 18053
11761 1 18 . 1 1 84 84 ALA N N 514 125.146 125.146 124.247 0.899 18053
11762 1 18 . 1 1 84 84 ALA HA H 514 3.951 3.951 4.169 -0.218 18053
11763 1 18 . 1 1 84 84 ALA C C 514 179.519 179.519 178.157 1.362 18053
11764 1 18 . 1 1 84 84 ALA CA C 514 54.804 54.804 54.722 0.082 18053
11765 1 18 . 1 1 84 84 ALA CB C 514 18.582 18.582 19.012 -0.430 18053
11766 1 18 . 1 1 84 84 ALA H H 514 8.341 8.341 8.280 0.061 18053
11767 1 18 . 1 1 85 85 GLY N N 515 103.388 103.388 103.492 -0.104 18053
11768 1 18 . 1 1 85 85 GLY C C 515 174.674 174.674 174.870 -0.196 18053
11769 1 18 . 1 1 85 85 GLY CA C 515 45.878 45.878 44.144 1.734 18053
11770 1 18 . 1 1 85 85 GLY H H 515 7.996 7.996 7.593 0.403 18053
11771 1 18 . 1 1 86 86 ALA N N 516 120.140 120.140 123.934 -3.794 18053
11772 1 18 . 1 1 86 86 ALA HA H 516 4.344 4.344 4.575 -0.231 18053
11773 1 18 . 1 1 86 86 ALA C C 516 177.690 177.690 177.412 0.278 18053
11774 1 18 . 1 1 86 86 ALA CA C 516 53.139 53.139 51.910 1.229 18053
11775 1 18 . 1 1 86 86 ALA CB C 516 20.547 20.547 19.426 1.121 18053
11776 1 18 . 1 1 86 86 ALA H H 516 7.474 7.474 7.310 0.164 18053
11777 1 18 . 1 1 87 87 GLY N N 517 105.720 105.720 106.381 -0.661 18053
11778 1 18 . 1 1 87 87 GLY C C 517 173.650 173.650 174.303 -0.653 18053
11779 1 18 . 1 1 87 87 GLY CA C 517 46.014 46.014 45.077 0.937 18053
11780 1 18 . 1 1 87 87 GLY H H 517 7.779 7.779 8.392 -0.613 18053
11781 1 18 . 1 1 88 88 VAL N N 518 121.537 121.537 117.560 3.977 18053
11782 1 18 . 1 1 88 88 VAL HA H 518 3.585 3.585 4.103 -0.518 18053
11783 1 18 . 1 1 88 88 VAL C C 518 174.851 174.851 174.545 0.306 18053
11784 1 18 . 1 1 88 88 VAL CA C 518 61.274 61.274 60.511 0.763 18053
11785 1 18 . 1 1 88 88 VAL CB C 518 33.376 33.376 33.375 0.001 18053
11786 1 18 . 1 1 88 88 VAL H H 518 7.499 7.499 7.510 -0.011 18053
11787 1 18 . 1 1 89 89 ALA N N 519 128.295 128.295 128.668 -0.373 18053
11788 1 18 . 1 1 89 89 ALA HA H 519 4.192 4.192 4.568 -0.376 18053
11789 1 18 . 1 1 89 89 ALA C C 519 176.680 176.680 176.486 0.194 18053
11790 1 18 . 1 1 89 89 ALA CA C 519 51.283 51.283 50.808 0.475 18053
11791 1 18 . 1 1 89 89 ALA CB C 519 19.292 19.292 19.698 -0.406 18053
11792 1 18 . 1 1 89 89 ALA H H 519 7.960 7.960 8.143 -0.183 18053
11793 1 18 . 1 1 90 90 HIS N N 520 122.643 122.643 124.371 -1.728 18053
11794 1 18 . 1 1 90 90 HIS HA H 520 4.033 4.033 4.412 -0.379 18053
11795 1 18 . 1 1 90 90 HIS C C 520 175.793 175.793 174.410 1.383 18053
11796 1 18 . 1 1 90 90 HIS CA C 520 58.653 58.653 56.366 2.287 18053
11797 1 18 . 1 1 90 90 HIS CB C 520 32.285 32.285 29.623 2.662 18053
11798 1 18 . 1 1 90 90 HIS H H 520 8.394 8.394 8.895 -0.501 18053
11799 1 18 . 1 1 91 91 SER N N 521 121.247 121.247 123.475 -2.228 18053
11800 1 18 . 1 1 91 91 SER HA H 521 4.629 4.629 4.702 -0.073 18053
11801 1 18 . 1 1 91 91 SER CA C 521 55.843 55.843 55.948 -0.105 18053
11802 1 18 . 1 1 91 91 SER CB C 521 62.367 62.367 63.360 -0.993 18053
11803 1 18 . 1 1 91 91 SER H H 521 8.569 8.569 8.339 0.230 18053
11804 1 18 . 1 1 92 92 PRO HA H 522 4.002 4.002 4.780 -0.778 18053
11805 1 18 . 1 1 92 92 PRO CA C 522 62.244 62.244 62.406 -0.162 18053
11806 1 18 . 1 1 92 92 PRO CB C 522 30.931 30.931 31.430 -0.499 18053
11807 1 18 . 1 1 93 93 PRO HA H 523 4.672 4.672 4.766 -0.094 18053
11808 1 18 . 1 1 93 93 PRO C C 523 177.786 177.786 177.727 0.059 18053
11809 1 18 . 1 1 93 93 PRO CA C 523 64.003 64.003 64.202 -0.199 18053
11810 1 18 . 1 1 93 93 PRO CB C 523 34.905 34.905 32.547 2.358 18053
11811 1 18 . 1 1 94 94 SER N N 524 117.212 117.212 115.210 2.002 18053
11812 1 18 . 1 1 94 94 SER HA H 524 4.678 4.678 4.367 0.311 18053
11813 1 18 . 1 1 94 94 SER C C 524 174.851 174.851 174.513 0.338 18053
11814 1 18 . 1 1 94 94 SER CA C 524 61.874 61.874 61.137 0.737 18053
11815 1 18 . 1 1 94 94 SER CB C 524 64.057 64.057 63.522 0.535 18053
11816 1 18 . 1 1 94 94 SER H H 524 8.463 8.463 8.324 0.139 18053
11817 1 18 . 1 1 95 95 THR N N 525 121.588 121.588 118.617 2.971 18053
11818 1 18 . 1 1 95 95 THR HA H 525 4.859 4.859 5.106 -0.247 18053
11819 1 18 . 1 1 95 95 THR C C 525 172.094 172.094 173.178 -1.084 18053
11820 1 18 . 1 1 95 95 THR CA C 525 62.309 62.309 61.578 0.731 18053
11821 1 18 . 1 1 95 95 THR CB C 525 70.281 70.281 69.564 0.717 18053
11822 1 18 . 1 1 95 95 THR H H 525 7.631 7.631 7.824 -0.193 18053
11823 1 18 . 1 1 96 96 LEU N N 526 127.274 127.274 128.059 -0.785 18053
11824 1 18 . 1 1 96 96 LEU HA H 526 5.131 5.131 5.091 0.040 18053
11825 1 18 . 1 1 96 96 LEU C C 526 175.916 175.916 175.736 0.180 18053
11826 1 18 . 1 1 96 96 LEU CA C 526 52.075 52.075 54.309 -2.233 18053
11827 1 18 . 1 1 96 96 LEU CB C 526 43.790 43.790 43.751 0.039 18053
11828 1 18 . 1 1 96 96 LEU H H 526 8.977 8.977 8.348 0.629 18053
11829 1 18 . 1 1 97 97 VAL N N 527 124.056 124.056 119.053 5.003 18053
11830 1 18 . 1 1 97 97 VAL HA H 527 4.869 4.869 4.797 0.072 18053
11831 1 18 . 1 1 97 97 VAL C C 527 176.230 176.230 175.525 0.705 18053
11832 1 18 . 1 1 97 97 VAL CA C 527 61.519 61.519 60.892 0.627 18053
11833 1 18 . 1 1 97 97 VAL CB C 527 33.704 33.704 34.971 -1.267 18053
11834 1 18 . 1 1 97 97 VAL H H 527 10.724 10.724 8.171 2.553 18053
11835 1 18 . 1 1 98 98 TRP N N 528 132.586 132.586 130.507 2.079 18053
11836 1 18 . 1 1 98 98 TRP HA H 528 4.965 4.965 4.658 0.307 18053
11837 1 18 . 1 1 98 98 TRP C C 528 173.391 173.391 174.832 -1.441 18053
11838 1 18 . 1 1 98 98 TRP CA C 528 53.303 53.303 55.461 -2.158 18053
11839 1 18 . 1 1 98 98 TRP CB C 528 28.245 28.245 28.420 -0.175 18053
11840 1 18 . 1 1 98 98 TRP H H 528 9.400 9.400 9.267 0.133 18053
11841 1 18 . 1 1 99 99 LYS N N 529 126.644 126.644 127.632 -0.988 18053
11842 1 18 . 1 1 99 99 LYS HA H 529 3.839 3.839 4.181 -0.342 18053
11843 1 18 . 1 1 99 99 LYS C C 529 177.581 177.581 177.324 0.257 18053
11844 1 18 . 1 1 99 99 LYS CA C 529 58.543 58.543 57.368 1.175 18053
11845 1 18 . 1 1 99 99 LYS CB C 529 32.176 32.176 32.629 -0.453 18053
11846 1 18 . 1 1 99 99 LYS H H 529 8.153 8.153 8.062 0.091 18053
11847 1 18 . 1 1 100 100 GLY N N 530 110.385 110.385 113.525 -3.140 18053
11848 1 18 . 1 1 100 100 GLY C C 530 172.367 172.367 173.712 -1.345 18053
11849 1 18 . 1 1 100 100 GLY CA C 530 45.278 45.278 44.906 0.372 18053
11850 1 18 . 1 1 100 100 GLY H H 530 8.363 8.363 8.661 -0.298 18053
11851 1 18 . 1 1 101 101 GLN N N 531 121.162 121.162 121.505 -0.343 18053
11852 1 18 . 1 1 101 101 GLN HA H 531 3.972 3.972 4.411 -0.439 18053
11853 1 18 . 1 1 101 101 GLN CA C 531 52.620 52.620 54.414 -1.794 18053
11854 1 18 . 1 1 101 101 GLN CB C 531 27.595 27.595 28.614 -1.019 18053
11855 1 18 . 1 1 101 101 GLN H H 531 6.815 6.815 7.487 -0.672 18053
11856 1 18 . 1 1 102 102 SER N N 532 122.728 122.728 122.234 0.494 18053
11857 1 18 . 1 1 102 102 SER HA H 532 3.866 3.866 4.644 -0.778 18053
11858 1 18 . 1 1 102 102 SER C C 532 174.537 174.537 175.638 -1.101 18053
11859 1 18 . 1 1 102 102 SER CA C 532 61.983 61.983 59.994 1.989 18053
11860 1 18 . 1 1 102 102 SER CB C 532 62.802 62.802 63.294 -0.492 18053
11861 1 18 . 1 1 102 102 SER H H 532 8.662 8.662 8.994 -0.332 18053
11862 1 18 . 1 1 103 103 SER N N 533 110.811 110.811 116.569 -5.758 18053
11863 1 18 . 1 1 103 103 SER HA H 533 4.240 4.240 4.579 -0.339 18053
11864 1 18 . 1 1 103 103 SER C C 533 174.087 174.087 174.334 -0.247 18053
11865 1 18 . 1 1 103 103 SER CA C 533 56.633 56.633 58.992 -2.359 18053
11866 1 18 . 1 1 103 103 SER CB C 533 64.658 64.658 64.300 0.358 18053
11867 1 18 . 1 1 103 103 SER H H 533 7.134 7.134 7.792 -0.658 18053
11868 1 18 . 1 1 104 104 TRP N N 534 126.133 126.133 120.942 5.191 18053
11869 1 18 . 1 1 104 104 TRP HA H 534 4.098 4.098 4.128 -0.030 18053
11870 1 18 . 1 1 104 104 TRP C C 534 176.066 176.066 175.184 0.882 18053
11871 1 18 . 1 1 104 104 TRP CA C 534 60.127 60.127 58.382 1.745 18053
11872 1 18 . 1 1 104 104 TRP CB C 534 28.764 28.764 28.650 0.114 18053
11873 1 18 . 1 1 104 104 TRP H H 534 9.764 9.764 7.554 2.210 18053
11874 1 18 . 1 1 105 105 GLY N N 535 105.907 105.907 105.906 0.001 18053
11875 1 18 . 1 1 105 105 GLY C C 535 172.217 172.217 174.279 -2.062 18053
11876 1 18 . 1 1 105 105 GLY CA C 535 44.240 44.240 44.871 -0.631 18053
11877 1 18 . 1 1 105 105 GLY H H 535 8.095 8.095 7.505 0.590 18053
11878 1 18 . 1 1 106 106 THR N N 536 111.253 111.253 113.620 -2.367 18053
11879 1 18 . 1 1 106 106 THR HA H 536 3.859 3.859 4.699 -0.840 18053
11880 1 18 . 1 1 106 106 THR C C 536 172.872 172.872 174.270 -1.398 18053
11881 1 18 . 1 1 106 106 THR CA C 536 59.635 59.635 61.736 -2.101 18053
11882 1 18 . 1 1 106 106 THR CB C 536 70.526 70.526 69.612 0.914 18053
11883 1 18 . 1 1 106 106 THR H H 536 7.913 7.913 7.920 -0.007 18053
11884 1 18 . 1 1 107 107 GLY N N 537 107.712 107.712 109.024 -1.312 18053
11885 1 18 . 1 1 107 107 GLY C C 537 172.709 172.709 172.893 -0.184 18053
11886 1 18 . 1 1 107 107 GLY CA C 537 45.166 45.166 45.163 0.004 18053
11887 1 18 . 1 1 107 107 GLY H H 537 7.533 7.533 8.286 -0.753 18053
11888 1 18 . 1 1 108 108 GLU N N 538 118.864 118.864 119.598 -0.734 18053
11889 1 18 . 1 1 108 108 GLU HA H 538 4.136 4.136 4.272 -0.136 18053
11890 1 18 . 1 1 108 108 GLU C C 538 176.353 176.353 175.276 1.077 18053
11891 1 18 . 1 1 108 108 GLU CA C 538 58.352 58.352 57.657 0.695 18053
11892 1 18 . 1 1 108 108 GLU CB C 538 30.156 30.156 30.192 -0.036 18053
11893 1 18 . 1 1 108 108 GLU H H 538 8.558 8.558 8.835 -0.277 18053
11894 1 18 . 1 1 109 109 SER N N 539 110.419 110.419 112.490 -2.071 18053
11895 1 18 . 1 1 109 109 SER HA H 539 4.963 4.963 4.547 0.416 18053
11896 1 18 . 1 1 109 109 SER C C 539 173.787 173.787 172.899 0.888 18053
11897 1 18 . 1 1 109 109 SER CA C 539 57.125 57.125 57.651 -0.526 18053
11898 1 18 . 1 1 109 109 SER CB C 539 64.439 64.439 64.642 -0.203 18053
11899 1 18 . 1 1 109 109 SER H H 539 7.620 7.620 7.688 -0.068 18053
11900 1 18 . 1 1 110 110 PHE N N 540 118.778 118.778 119.216 -0.438 18053
11901 1 18 . 1 1 110 110 PHE HA H 540 5.081 5.081 5.070 0.011 18053
11902 1 18 . 1 1 110 110 PHE C C 540 176.052 176.052 172.910 3.142 18053
11903 1 18 . 1 1 110 110 PHE CA C 540 56.789 56.789 56.976 -0.187 18053
11904 1 18 . 1 1 110 110 PHE CB C 540 40.760 40.760 41.373 -0.613 18053
11905 1 18 . 1 1 110 110 PHE H H 540 8.318 8.318 8.156 0.162 18053
11906 1 18 . 1 1 112 112 THR HA H 542 5.468 5.468 5.161 0.307 18053
11907 1 18 . 1 1 112 112 THR C C 542 172.381 172.381 173.469 -1.088 18053
11908 1 18 . 1 1 112 112 THR CA C 542 61.818 61.818 62.151 -0.334 18053
11909 1 18 . 1 1 112 112 THR CB C 542 70.990 70.990 70.689 0.301 18053
11910 1 18 . 1 1 113 113 VAL N N 543 124.771 124.771 126.813 -2.042 18053
11911 1 18 . 1 1 113 113 VAL HA H 543 4.864 4.864 4.521 0.343 18053
11912 1 18 . 1 1 113 113 VAL C C 543 173.132 173.132 173.877 -0.745 18053
11913 1 18 . 1 1 113 113 VAL CA C 543 60.099 60.099 60.658 -0.559 18053
11914 1 18 . 1 1 113 113 VAL CB C 543 36.433 36.433 34.742 1.691 18053
11915 1 18 . 1 1 113 113 VAL H H 543 9.380 9.380 8.999 0.381 18053
11916 1 18 . 1 1 114 114 LEU N N 544 128.789 128.789 127.116 1.673 18053
11917 1 18 . 1 1 114 114 LEU HA H 544 5.320 5.320 5.248 0.072 18053
11918 1 18 . 1 1 114 114 LEU C C 544 174.237 174.237 174.662 -0.425 18053
11919 1 18 . 1 1 114 114 LEU CA C 544 53.193 53.193 53.696 -0.503 18053
11920 1 18 . 1 1 114 114 LEU CB C 544 45.879 45.879 44.769 1.110 18053
11921 1 18 . 1 1 114 114 LEU H H 544 8.948 8.948 8.680 0.268 18053
11922 1 18 . 1 1 115 115 VAL N N 545 127.002 127.002 127.221 -0.219 18053
11923 1 18 . 1 1 115 115 VAL HA H 545 4.854 4.854 4.598 0.256 18053
11924 1 18 . 1 1 115 115 VAL C C 545 175.206 175.206 173.696 1.510 18053
11925 1 18 . 1 1 115 115 VAL CA C 545 59.334 59.334 59.708 -0.374 18053
11926 1 18 . 1 1 115 115 VAL CB C 545 34.495 34.495 34.405 0.090 18053
11927 1 18 . 1 1 115 115 VAL H H 545 9.564 9.564 8.843 0.721 18053
11928 1 18 . 1 1 116 116 ASN N N 546 121.179 121.179 124.724 -3.545 18053
11929 1 18 . 1 1 116 116 ASN HA H 546 2.897 2.897 4.148 -1.251 18053
11930 1 18 . 1 1 116 116 ASN C C 546 176.885 176.885 175.136 1.749 18053
11931 1 18 . 1 1 116 116 ASN CA C 546 50.409 50.409 51.253 -0.844 18053
11932 1 18 . 1 1 116 116 ASN CB C 546 36.639 36.639 39.323 -2.684 18053
11933 1 18 . 1 1 116 116 ASN H H 546 8.016 8.016 8.180 -0.164 18053
11934 1 18 . 1 1 117 117 ALA N N 547 119.834 119.834 121.081 -1.247 18053
11935 1 18 . 1 1 117 117 ALA HA H 547 3.866 3.866 4.104 -0.238 18053
11936 1 18 . 1 1 117 117 ALA C C 547 177.772 177.772 177.922 -0.150 18053
11937 1 18 . 1 1 117 117 ALA CA C 547 54.504 54.504 54.062 0.442 18053
11938 1 18 . 1 1 117 117 ALA CB C 547 18.200 18.200 18.427 -0.227 18053
11939 1 18 . 1 1 117 117 ALA H H 547 6.444 6.444 8.453 -2.009 18053
11940 1 18 . 1 1 118 118 ASP N N 548 115.646 115.646 117.920 -2.274 18053
11941 1 18 . 1 1 118 118 ASP HA H 548 4.644 4.644 4.500 0.144 18053
11942 1 18 . 1 1 118 118 ASP C C 548 176.052 176.052 177.558 -1.506 18053
11943 1 18 . 1 1 118 118 ASP CA C 548 54.067 54.067 54.837 -0.770 18053
11944 1 18 . 1 1 118 118 ASP CB C 548 41.674 41.674 41.060 0.614 18053
11945 1 18 . 1 1 118 118 ASP H H 548 7.181 7.181 8.033 -0.852 18053
11946 1 18 . 1 1 119 119 GLY N N 549 107.167 107.167 107.747 -0.580 18053
11947 1 18 . 1 1 119 119 GLY C C 549 173.841 173.841 173.380 0.461 18053
11948 1 18 . 1 1 119 119 GLY CA C 549 45.455 45.455 45.241 0.214 18053
11949 1 18 . 1 1 119 119 GLY H H 549 7.738 7.738 7.749 -0.011 18053
11950 1 18 . 1 1 120 120 GLU N N 550 121.196 121.196 119.191 2.005 18053
11951 1 18 . 1 1 120 120 GLU HA H 550 4.112 4.112 4.369 -0.257 18053
11952 1 18 . 1 1 120 120 GLU C C 550 175.588 175.588 175.479 0.109 18053
11953 1 18 . 1 1 120 120 GLU CA C 550 54.831 54.831 54.637 0.194 18053
11954 1 18 . 1 1 120 120 GLU CB C 550 29.937 29.937 30.300 -0.363 18053
11955 1 18 . 1 1 120 120 GLU H H 550 7.587 7.587 7.999 -0.412 18053
11956 1 18 . 1 1 121 121 GLU N N 551 123.886 123.886 124.620 -0.734 18053
11957 1 18 . 1 1 121 121 GLU HA H 551 4.276 4.276 4.181 0.095 18053
11958 1 18 . 1 1 121 121 GLU C C 551 176.817 176.817 176.351 0.466 18053
11959 1 18 . 1 1 121 121 GLU CA C 551 56.796 56.796 56.890 -0.094 18053
11960 1 18 . 1 1 121 121 GLU CB C 551 28.955 28.955 29.653 -0.698 18053
11961 1 18 . 1 1 121 121 GLU H H 551 8.697 8.697 8.785 -0.088 18053
11962 1 18 . 1 1 122 122 VAL N N 552 120.055 120.055 120.490 -0.435 18053
11963 1 18 . 1 1 122 122 VAL HA H 552 4.364 4.364 4.127 0.237 18053
11964 1 18 . 1 1 122 122 VAL C C 552 175.998 175.998 174.976 1.022 18053
11965 1 18 . 1 1 122 122 VAL CA C 552 61.655 61.655 62.137 -0.482 18053
11966 1 18 . 1 1 122 122 VAL CB C 552 33.049 33.049 32.504 0.545 18053
11967 1 18 . 1 1 122 122 VAL H H 552 8.845 8.845 8.213 0.631 18053
11968 1 18 . 1 1 123 123 ALA N N 553 122.098 122.098 121.512 0.586 18053
11969 1 18 . 1 1 123 123 ALA HA H 553 4.890 4.890 4.793 0.097 18053
11970 1 18 . 1 1 123 123 ALA C C 553 175.261 175.261 175.177 0.084 18053
11971 1 18 . 1 1 123 123 ALA CA C 553 52.757 52.757 51.440 1.317 18053
11972 1 18 . 1 1 123 123 ALA CB C 553 22.267 22.267 21.865 0.402 18053
11973 1 18 . 1 1 123 123 ALA H H 553 7.788 7.788 7.682 0.106 18053
11974 1 18 . 1 1 124 124 MET N N 554 118.217 118.217 120.656 -2.439 18053
11975 1 18 . 1 1 124 124 MET HA H 554 5.286 5.286 5.129 0.157 18053
11976 1 18 . 1 1 124 124 MET C C 554 174.428 174.428 173.965 0.463 18053
11977 1 18 . 1 1 124 124 MET CA C 554 55.104 55.104 55.666 -0.562 18053
11978 1 18 . 1 1 124 124 MET CB C 554 35.342 35.342 36.974 -1.632 18053
11979 1 18 . 1 1 124 124 MET H H 554 8.693 8.693 8.380 0.313 18053
11980 1 18 . 1 1 125 125 ARG N N 555 122.132 122.132 125.912 -3.780 18053
11981 1 18 . 1 1 125 125 ARG HA H 555 4.900 4.900 4.771 0.129 18053
11982 1 18 . 1 1 125 125 ARG CA C 555 56.388 56.388 55.642 0.745 18053
11983 1 18 . 1 1 125 125 ARG CB C 555 34.378 34.378 34.357 0.021 18053
11984 1 18 . 1 1 125 125 ARG H H 555 8.919 8.919 9.114 -0.195 18053
11985 1 18 . 1 1 126 126 THR HA H 556 4.685 4.685 4.431 0.254 18053
11986 1 18 . 1 1 126 126 THR C C 556 172.436 172.436 173.849 -1.413 18053
11987 1 18 . 1 1 126 126 THR CA C 556 61.382 61.382 62.914 -1.532 18053
11988 1 18 . 1 1 126 126 THR CB C 556 70.444 70.444 69.038 1.406 18053
11989 1 18 . 1 1 127 127 VAL N N 557 124.976 124.976 127.184 -2.208 18053
11990 1 18 . 1 1 127 127 VAL HA H 557 4.146 4.146 4.204 -0.058 18053
11991 1 18 . 1 1 127 127 VAL C C 557 173.937 173.937 173.207 0.730 18053
11992 1 18 . 1 1 127 127 VAL CA C 557 61.109 61.109 60.597 0.512 18053
11993 1 18 . 1 1 127 127 VAL CB C 557 33.759 33.759 34.991 -1.232 18053
11994 1 18 . 1 1 127 127 VAL H H 557 8.127 8.127 8.235 -0.108 18053
11995 1 18 . 1 1 128 128 LYS N N 558 125.384 125.384 123.416 1.968 18053
11996 1 18 . 1 1 128 128 LYS HA H 558 4.706 4.706 4.200 0.505 18053
11997 1 18 . 1 1 128 128 LYS C C 558 175.534 175.534 174.986 0.548 18053
11998 1 18 . 1 1 128 128 LYS CA C 558 54.886 54.886 53.388 1.498 18053
11999 1 18 . 1 1 128 128 LYS CB C 558 34.673 34.673 34.854 -0.181 18053
12000 1 18 . 1 1 128 128 LYS H H 558 8.289 8.289 8.096 0.193 18053
12001 1 18 . 1 1 129 129 LYS N N 559 124.005 124.005 125.352 -1.347 18053
12002 1 18 . 1 1 129 129 LYS HA H 559 4.310 4.310 4.181 0.129 18053
12003 1 18 . 1 1 129 129 LYS C C 559 176.571 176.571 175.537 1.034 18053
12004 1 18 . 1 1 129 129 LYS CA C 559 56.742 56.742 57.023 -0.281 18053
12005 1 18 . 1 1 129 129 LYS CB C 559 33.362 33.362 30.906 2.456 18053
12006 1 18 . 1 1 129 129 LYS H H 559 8.461 8.461 8.254 0.207 18053
12007 1 18 . 1 1 130 130 SER N N 560 117.195 117.195 119.532 -2.337 18053
12008 1 18 . 1 1 130 130 SER HA H 560 4.384 4.384 4.397 -0.013 18053
12009 1 18 . 1 1 130 130 SER C C 560 174.565 174.565 175.022 -0.457 18053
12010 1 18 . 1 1 130 130 SER CA C 560 58.434 58.434 59.250 -0.816 18053
12011 1 18 . 1 1 130 130 SER CB C 560 63.812 63.812 64.072 -0.260 18053
12012 1 18 . 1 1 130 130 SER H H 560 8.465 8.465 8.111 0.354 18053
12013 1 18 . 1 1 131 131 SER N N 561 118.149 118.149 119.307 -1.158 18053
12014 1 18 . 1 1 131 131 SER HA H 561 4.412 4.412 4.422 -0.010 18053
12015 1 18 . 1 1 131 131 SER C C 561 174.456 174.456 174.259 0.197 18053
12016 1 18 . 1 1 131 131 SER CA C 561 58.489 58.489 58.336 0.153 18053
12017 1 18 . 1 1 131 131 SER CB C 561 63.811 63.811 63.866 -0.055 18053
12018 1 18 . 1 1 131 131 SER H H 561 8.336 8.336 8.278 0.058 18053
12019 1 18 . 1 1 132 132 VAL N N 562 121.332 121.332 125.170 -3.838 18053
12020 1 18 . 1 1 132 132 VAL HA H 562 4.035 4.035 3.812 0.223 18053
12021 1 18 . 1 1 132 132 VAL C C 562 176.066 176.066 175.662 0.404 18053
12022 1 18 . 1 1 132 132 VAL CA C 562 62.446 62.446 63.690 -1.244 18053
12023 1 18 . 1 1 132 132 VAL CB C 562 32.394 32.394 32.454 -0.060 18053
12024 1 18 . 1 1 132 132 VAL H H 562 7.982 7.982 8.596 -0.614 18053
12025 1 18 . 1 1 133 133 MET N N 563 124.022 124.022 118.556 5.466 18053
12026 1 18 . 1 1 133 133 MET HA H 563 4.385 4.385 4.552 -0.167 18053
12027 1 18 . 1 1 133 133 MET C C 563 176.039 176.039 175.412 0.627 18053
12028 1 18 . 1 1 133 133 MET CA C 563 55.350 55.350 54.733 0.617 18053
12029 1 18 . 1 1 133 133 MET CB C 563 32.503 32.503 33.506 -1.003 18053
12030 1 18 . 1 1 133 133 MET H H 563 8.295 8.295 7.568 0.727 18053
12031 1 18 . 1 1 134 134 ARG N N 564 122.677 122.677 121.758 0.919 18053
12032 1 18 . 1 1 134 134 ARG HA H 564 4.262 4.262 4.272 -0.010 18053
12033 1 18 . 1 1 134 134 ARG C C 564 176.298 176.298 176.180 0.118 18053
12034 1 18 . 1 1 134 134 ARG CA C 564 56.087 56.087 56.307 -0.220 18053
12035 1 18 . 1 1 134 134 ARG CB C 564 30.702 30.702 30.111 0.591 18053
12036 1 18 . 1 1 134 134 ARG H H 564 8.295 8.295 8.371 -0.076 18053
12037 1 18 . 1 1 135 135 GLU N N 565 121.945 121.945 125.574 -3.629 18053
12038 1 18 . 1 1 135 135 GLU HA H 565 4.160 4.160 4.173 -0.013 18053
12039 1 18 . 1 1 135 135 GLU C C 565 176.080 176.080 176.070 0.010 18053
12040 1 18 . 1 1 135 135 GLU CA C 565 56.906 56.906 56.614 0.292 18053
12041 1 18 . 1 1 135 135 GLU CB C 565 29.774 29.774 30.201 -0.427 18053
12042 1 18 . 1 1 135 135 GLU H H 565 8.470 8.470 8.645 -0.175 18053
12043 1 18 . 1 1 136 136 ASN N N 566 118.761 118.761 124.521 -5.760 18053
12044 1 18 . 1 1 136 136 ASN HA H 566 4.617 4.617 4.672 -0.055 18053
12045 1 18 . 1 1 136 136 ASN C C 566 175.315 175.315 174.626 0.689 18053
12046 1 18 . 1 1 136 136 ASN CA C 566 53.193 53.193 53.603 -0.410 18053
12047 1 18 . 1 1 136 136 ASN CB C 566 38.836 38.836 38.801 0.035 18053
12048 1 18 . 1 1 136 136 ASN H H 566 8.341 8.341 8.579 -0.238 18053
12049 1 18 . 1 1 137 137 GLU N N 567 121.349 121.349 126.982 -5.633 18053
12050 1 18 . 1 1 137 137 GLU HA H 567 4.152 4.152 4.414 -0.262 18053
12051 1 18 . 1 1 137 137 GLU C C 567 176.243 176.243 175.705 0.538 18053
12052 1 18 . 1 1 137 137 GLU CA C 567 56.906 56.906 56.194 0.711 18053
12053 1 18 . 1 1 137 137 GLU CB C 567 29.992 29.992 31.052 -1.060 18053
12054 1 18 . 1 1 137 137 GLU H H 567 8.349 8.349 8.539 -0.190 18053
12055 1 18 . 1 1 138 138 ASN N N 568 118.761 118.761 120.674 -1.913 18053
12056 1 18 . 1 1 138 138 ASN HA H 568 4.712 4.712 4.581 0.131 18053
12057 1 18 . 1 1 138 138 ASN C C 568 174.551 174.551 174.598 -0.047 18053
12058 1 18 . 1 1 138 138 ASN CA C 568 53.193 53.193 53.950 -0.757 18053
12059 1 18 . 1 1 138 138 ASN CB C 568 39.327 39.327 37.865 1.462 18053
12060 1 18 . 1 1 138 138 ASN H H 568 8.397 8.397 8.531 -0.134 18053
12061 1 19 . 1 1 20 20 ALA N N 450 125.180 125.180 125.171 0.009 18053
12062 1 19 . 1 1 20 20 ALA HA H 450 4.706 4.706 4.236 0.470 18053
12063 1 19 . 1 1 20 20 ALA C C 450 177.226 177.226 177.069 0.157 18053
12064 1 19 . 1 1 20 20 ALA CA C 450 52.757 52.757 52.725 0.032 18053
12065 1 19 . 1 1 20 20 ALA CB C 450 20.411 20.411 18.284 2.127 18053
12066 1 19 . 1 1 20 20 ALA H H 450 8.484 8.484 8.503 -0.019 18053
12067 1 19 . 1 1 21 21 SER N N 451 115.714 115.714 121.102 -5.388 18053
12068 1 19 . 1 1 21 21 SER HA H 451 4.513 4.513 4.636 -0.123 18053
12069 1 19 . 1 1 21 21 SER C C 451 174.742 174.742 175.064 -0.322 18053
12070 1 19 . 1 1 21 21 SER CA C 451 58.516 58.516 57.335 1.181 18053
12071 1 19 . 1 1 21 21 SER CB C 451 64.159 64.159 62.879 1.280 18053
12072 1 19 . 1 1 21 21 SER H H 451 8.487 8.487 8.042 0.445 18053
12073 1 19 . 1 1 22 22 GLY N N 452 111.509 111.509 115.035 -3.526 18053
12074 1 19 . 1 1 22 22 GLY C C 452 174.401 174.401 174.825 -0.424 18053
12075 1 19 . 1 1 22 22 GLY CA C 452 45.059 45.059 47.033 -1.974 18053
12076 1 19 . 1 1 22 22 GLY H H 452 8.198 8.198 8.708 -0.510 18053
12077 1 19 . 1 1 23 23 SER N N 453 116.191 116.191 114.680 1.511 18053
12078 1 19 . 1 1 23 23 SER HA H 453 4.364 4.364 4.509 -0.145 18053
12079 1 19 . 1 1 23 23 SER C C 453 173.432 173.432 172.581 0.851 18053
12080 1 19 . 1 1 23 23 SER CA C 453 59.744 59.744 59.685 0.059 18053
12081 1 19 . 1 1 23 23 SER CB C 453 64.335 64.335 64.372 -0.037 18053
12082 1 19 . 1 1 23 23 SER H H 453 8.494 8.494 8.144 0.350 18053
12083 1 19 . 1 1 24 24 VAL N N 454 121.656 121.656 121.507 0.149 18053
12084 1 19 . 1 1 24 24 VAL HA H 454 5.035 5.035 4.602 0.433 18053
12085 1 19 . 1 1 24 24 VAL C C 454 174.606 174.606 175.186 -0.580 18053
12086 1 19 . 1 1 24 24 VAL CA C 454 61.055 61.055 60.849 0.206 18053
12087 1 19 . 1 1 24 24 VAL CB C 454 32.503 32.503 34.426 -1.923 18053
12088 1 19 . 1 1 24 24 VAL H H 454 7.830 7.830 7.807 0.023 18053
12089 1 19 . 1 1 25 25 SER N N 455 119.323 119.323 119.318 0.005 18053
12090 1 19 . 1 1 25 25 SER HA H 455 4.672 4.672 4.878 -0.206 18053
12091 1 19 . 1 1 25 25 SER C C 455 174.426 174.426 173.805 0.621 18053
12092 1 19 . 1 1 25 25 SER CA C 455 55.268 55.268 56.173 -0.905 18053
12093 1 19 . 1 1 25 25 SER CB C 455 65.162 65.162 66.267 -1.105 18053
12094 1 19 . 1 1 25 25 SER H H 455 9.065 9.065 8.600 0.465 18053
12095 1 19 . 1 1 26 26 ILE N N 456 119.468 119.468 121.616 -2.148 18053
12096 1 19 . 1 1 26 26 ILE HA H 456 4.180 4.180 4.249 -0.069 18053
12097 1 19 . 1 1 26 26 ILE C C 456 175.506 175.506 176.482 -0.976 18053
12098 1 19 . 1 1 26 26 ILE CA C 456 61.328 61.328 61.638 -0.310 18053
12099 1 19 . 1 1 26 26 ILE CB C 456 37.962 37.962 36.926 1.036 18053
12100 1 19 . 1 1 26 26 ILE H H 456 8.295 8.295 8.623 -0.328 18053
12101 1 19 . 1 1 27 27 GLU N N 457 129.726 129.726 129.827 -0.101 18053
12102 1 19 . 1 1 27 27 GLU HA H 457 4.228 4.228 4.189 0.039 18053
12103 1 19 . 1 1 27 27 GLU C C 457 175.179 175.179 176.263 -1.084 18053
12104 1 19 . 1 1 27 27 GLU CA C 457 55.432 55.432 58.678 -3.245 18053
12105 1 19 . 1 1 27 27 GLU CB C 457 30.142 30.142 30.602 -0.459 18053
12106 1 19 . 1 1 27 27 GLU H H 457 8.393 8.393 8.584 -0.191 18053
12107 1 19 . 1 1 28 28 GLU N N 458 117.076 117.076 115.296 1.780 18053
12108 1 19 . 1 1 28 28 GLU HA H 458 4.168 4.168 4.668 -0.500 18053
12109 1 19 . 1 1 28 28 GLU C C 458 174.701 174.701 174.501 0.200 18053
12110 1 19 . 1 1 28 28 GLU CA C 458 56.906 56.906 55.428 1.478 18053
12111 1 19 . 1 1 28 28 GLU CB C 458 31.848 31.848 34.081 -2.232 18053
12112 1 19 . 1 1 28 28 GLU H H 458 7.489 7.489 7.902 -0.413 18053
12113 1 19 . 1 1 29 29 ILE N N 459 122.183 122.183 119.786 2.397 18053
12114 1 19 . 1 1 29 29 ILE HA H 459 3.764 3.764 3.971 -0.207 18053
12115 1 19 . 1 1 29 29 ILE C C 459 174.169 174.169 174.702 -0.533 18053
12116 1 19 . 1 1 29 29 ILE CA C 459 59.526 59.526 59.362 0.164 18053
12117 1 19 . 1 1 29 29 ILE CB C 459 40.309 40.309 41.265 -0.956 18053
12118 1 19 . 1 1 29 29 ILE H H 459 8.126 8.126 8.271 -0.145 18053
12119 1 19 . 1 1 30 30 ASP N N 460 123.205 123.205 124.157 -0.952 18053
12120 1 19 . 1 1 30 30 ASP HA H 460 4.183 4.183 4.199 -0.016 18053
12121 1 19 . 1 1 30 30 ASP C C 460 178.318 178.318 177.793 0.525 18053
12122 1 19 . 1 1 30 30 ASP CA C 460 53.930 53.930 54.050 -0.119 18053
12123 1 19 . 1 1 30 30 ASP CB C 460 42.807 42.807 42.238 0.569 18053
12124 1 19 . 1 1 30 30 ASP H H 460 6.704 6.704 7.349 -0.645 18053
12125 1 19 . 1 1 31 31 LEU N N 461 128.551 128.551 122.863 5.688 18053
12126 1 19 . 1 1 31 31 LEU HA H 461 4.064 4.064 4.181 -0.117 18053
12127 1 19 . 1 1 31 31 LEU C C 461 177.513 177.513 178.521 -1.008 18053
12128 1 19 . 1 1 31 31 LEU CA C 461 57.124 57.124 56.959 0.165 18053
12129 1 19 . 1 1 31 31 LEU CB C 461 41.237 41.237 41.501 -0.264 18053
12130 1 19 . 1 1 31 31 LEU H H 461 9.012 9.012 8.435 0.577 18053
12131 1 19 . 1 1 32 32 GLU N N 462 115.101 115.101 119.208 -4.107 18053
12132 1 19 . 1 1 32 32 GLU HA H 462 4.283 4.283 4.494 -0.211 18053
12133 1 19 . 1 1 32 32 GLU C C 462 177.062 177.062 177.133 -0.071 18053
12134 1 19 . 1 1 32 32 GLU CA C 462 55.759 55.759 57.086 -1.327 18053
12135 1 19 . 1 1 32 32 GLU CB C 462 29.569 29.569 30.604 -1.035 18053
12136 1 19 . 1 1 32 32 GLU H H 462 7.588 7.588 8.252 -0.664 18053
12137 1 19 . 1 1 33 33 GLY N N 463 106.299 106.299 105.793 0.506 18053
12138 1 19 . 1 1 33 33 GLY C C 463 174.824 174.824 175.140 -0.316 18053
12139 1 19 . 1 1 33 33 GLY CA C 463 46.806 46.806 44.676 2.130 18053
12140 1 19 . 1 1 33 33 GLY H H 463 7.372 7.372 8.026 -0.654 18053
12141 1 19 . 1 1 34 34 LYS N N 464 118.744 118.744 119.180 -0.436 18053
12142 1 19 . 1 1 34 34 LYS HA H 464 4.562 4.562 4.266 0.296 18053
12143 1 19 . 1 1 34 34 LYS C C 464 177.076 177.076 175.521 1.555 18053
12144 1 19 . 1 1 34 34 LYS CA C 464 59.963 59.963 58.275 1.688 18053
12145 1 19 . 1 1 34 34 LYS CB C 464 33.111 33.111 33.294 -0.183 18053
12146 1 19 . 1 1 34 34 LYS H H 464 9.547 9.547 8.208 1.339 18053
12147 1 19 . 1 1 35 35 PHE N N 465 109.125 109.125 112.052 -2.927 18053
12148 1 19 . 1 1 35 35 PHE HA H 465 5.514 5.514 5.353 0.161 18053
12149 1 19 . 1 1 35 35 PHE C C 465 174.183 174.183 172.865 1.318 18053
12150 1 19 . 1 1 35 35 PHE CA C 465 56.632 56.632 55.271 1.361 18053
12151 1 19 . 1 1 35 35 PHE CB C 465 40.599 40.599 41.137 -0.538 18053
12152 1 19 . 1 1 35 35 PHE H H 465 6.740 6.740 7.038 -0.298 18053
12153 1 19 . 1 1 36 36 VAL N N 466 119.579 119.579 119.854 -0.275 18053
12154 1 19 . 1 1 36 36 VAL HA H 466 3.709 3.709 4.188 -0.479 18053
12155 1 19 . 1 1 36 36 VAL C C 466 172.668 172.668 174.470 -1.802 18053
12156 1 19 . 1 1 36 36 VAL CA C 466 62.692 62.692 61.356 1.336 18053
12157 1 19 . 1 1 36 36 VAL CB C 466 36.215 36.215 33.950 2.265 18053
12158 1 19 . 1 1 36 36 VAL H H 466 7.628 7.628 8.943 -1.315 18053
12159 1 19 . 1 1 37 37 GLN N N 467 126.831 126.831 127.780 -0.949 18053
12160 1 19 . 1 1 37 37 GLN HA H 467 5.449 5.449 4.826 0.623 18053
12161 1 19 . 1 1 37 37 GLN C C 467 174.797 174.797 174.923 -0.126 18053
12162 1 19 . 1 1 37 37 GLN CA C 467 54.121 54.121 54.873 -0.752 18053
12163 1 19 . 1 1 37 37 GLN CB C 467 34.623 34.623 29.545 5.078 18053
12164 1 19 . 1 1 37 37 GLN H H 467 8.392 8.392 8.499 -0.107 18053
12165 1 19 . 1 1 38 38 LEU N N 468 123.018 123.018 129.067 -6.049 18053
12166 1 19 . 1 1 38 38 LEU HA H 468 5.422 5.422 5.222 0.200 18053
12167 1 19 . 1 1 38 38 LEU C C 468 175.588 175.588 175.286 0.302 18053
12168 1 19 . 1 1 38 38 LEU CA C 468 52.702 52.702 53.747 -1.045 18053
12169 1 19 . 1 1 38 38 LEU CB C 468 45.046 45.046 44.748 0.298 18053
12170 1 19 . 1 1 38 38 LEU H H 468 9.103 9.103 8.950 0.153 18053
12171 1 19 . 1 1 39 39 LYS N N 469 118.983 118.983 122.726 -3.743 18053
12172 1 19 . 1 1 39 39 LYS HA H 469 4.852 4.852 4.890 -0.038 18053
12173 1 19 . 1 1 39 39 LYS C C 469 173.309 173.309 174.930 -1.621 18053
12174 1 19 . 1 1 39 39 LYS CA C 469 54.994 54.994 53.823 1.171 18053
12175 1 19 . 1 1 39 39 LYS CB C 469 38.246 38.246 35.889 2.357 18053
12176 1 19 . 1 1 39 39 LYS H H 469 8.496 8.496 8.625 -0.129 18053
12177 1 19 . 1 1 40 40 ASN N N 470 121.758 121.758 124.533 -2.775 18053
12178 1 19 . 1 1 40 40 ASN HA H 470 4.788 4.788 4.623 0.165 18053
12179 1 19 . 1 1 40 40 ASN C C 470 174.496 174.496 174.811 -0.315 18053
12180 1 19 . 1 1 40 40 ASN CA C 470 51.119 51.119 52.928 -1.809 18053
12181 1 19 . 1 1 40 40 ASN CB C 470 37.559 37.559 39.354 -1.795 18053
12182 1 19 . 1 1 40 40 ASN H H 470 8.283 8.283 8.728 -0.445 18053
12183 1 19 . 1 1 41 41 ASN N N 471 122.422 122.422 124.201 -1.779 18053
12184 1 19 . 1 1 41 41 ASN HA H 471 4.588 4.588 4.788 -0.200 18053
12185 1 19 . 1 1 41 41 ASN C C 471 174.810 174.810 174.312 0.498 18053
12186 1 19 . 1 1 41 41 ASN CA C 471 53.985 53.985 53.236 0.749 18053
12187 1 19 . 1 1 41 41 ASN CB C 471 39.600 39.600 39.316 0.284 18053
12188 1 19 . 1 1 41 41 ASN H H 471 8.681 8.681 8.463 0.218 18053
12189 1 19 . 1 1 42 42 SER N N 472 116.446 116.446 116.087 0.359 18053
12190 1 19 . 1 1 42 42 SER HA H 472 4.719 4.719 4.557 0.162 18053
12191 1 19 . 1 1 42 42 SER C C 472 172.804 172.804 174.520 -1.716 18053
12192 1 19 . 1 1 42 42 SER CA C 472 57.288 57.288 58.411 -1.123 18053
12193 1 19 . 1 1 42 42 SER CB C 472 66.241 66.241 64.727 1.514 18053
12194 1 19 . 1 1 42 42 SER H H 472 8.370 8.370 7.427 0.943 18053
12195 1 19 . 1 1 43 43 ASP N N 473 117.706 117.706 122.279 -4.573 18053
12196 1 19 . 1 1 43 43 ASP HA H 473 4.474 4.474 4.572 -0.098 18053
12197 1 19 . 1 1 43 43 ASP C C 473 175.343 175.343 175.394 -0.051 18053
12198 1 19 . 1 1 43 43 ASP CA C 473 53.521 53.521 55.999 -2.478 18053
12199 1 19 . 1 1 43 43 ASP CB C 473 40.322 40.322 41.064 -0.742 18053
12200 1 19 . 1 1 43 43 ASP H H 473 8.254 8.254 8.827 -0.573 18053
12201 1 19 . 1 1 44 44 LYS N N 474 120.209 120.209 117.344 2.865 18053
12202 1 19 . 1 1 44 44 LYS HA H 474 4.569 4.569 4.431 0.138 18053
12203 1 19 . 1 1 44 44 LYS C C 474 175.397 175.397 174.466 0.931 18053
12204 1 19 . 1 1 44 44 LYS CA C 474 54.012 54.012 54.047 -0.035 18053
12205 1 19 . 1 1 44 44 LYS CB C 474 35.383 35.383 34.684 0.699 18053
12206 1 19 . 1 1 44 44 LYS H H 474 8.305 8.305 7.503 0.802 18053
12207 1 19 . 1 1 45 45 ASP N N 475 124.993 124.993 118.228 6.765 18053
12208 1 19 . 1 1 45 45 ASP HA H 475 3.975 3.975 4.401 -0.426 18053
12209 1 19 . 1 1 45 45 ASP C C 475 174.810 174.810 175.785 -0.975 18053
12210 1 19 . 1 1 45 45 ASP CA C 475 54.995 54.995 54.277 0.718 18053
12211 1 19 . 1 1 45 45 ASP CB C 475 40.364 40.364 40.333 0.031 18053
12212 1 19 . 1 1 45 45 ASP H H 475 8.722 8.722 8.332 0.390 18053
12213 1 19 . 1 1 46 46 GLN N N 476 120.549 120.549 124.987 -4.438 18053
12214 1 19 . 1 1 46 46 GLN HA H 476 4.436 4.436 4.357 0.079 18053
12215 1 19 . 1 1 46 46 GLN C C 476 174.019 174.019 174.976 -0.957 18053
12216 1 19 . 1 1 46 46 GLN CA C 476 53.138 53.138 54.618 -1.480 18053
12217 1 19 . 1 1 46 46 GLN CB C 476 31.466 31.466 29.440 2.026 18053
12218 1 19 . 1 1 46 46 GLN H H 476 7.878 7.878 8.326 -0.448 18053
12219 1 19 . 1 1 47 47 SER N N 477 121.537 121.537 121.895 -0.358 18053
12220 1 19 . 1 1 47 47 SER HA H 477 4.229 4.229 4.235 -0.006 18053
12221 1 19 . 1 1 47 47 SER C C 477 174.565 174.565 173.872 0.693 18053
12222 1 19 . 1 1 47 47 SER CA C 477 58.706 58.706 58.948 -0.242 18053
12223 1 19 . 1 1 47 47 SER CB C 477 62.965 62.965 62.939 0.026 18053
12224 1 19 . 1 1 47 47 SER H H 477 8.748 8.748 8.582 0.166 18053
12225 1 19 . 1 1 48 48 LEU N N 478 127.751 127.751 125.856 1.895 18053
12226 1 19 . 1 1 48 48 LEU HA H 478 2.631 2.631 4.372 -1.741 18053
12227 1 19 . 1 1 48 48 LEU C C 478 176.789 176.789 176.300 0.489 18053
12228 1 19 . 1 1 48 48 LEU CA C 478 52.102 52.102 53.749 -1.647 18053
12229 1 19 . 1 1 48 48 LEU CB C 478 42.343 42.343 43.703 -1.360 18053
12230 1 19 . 1 1 48 48 LEU H H 478 7.856 7.856 7.991 -0.135 18053
12231 1 19 . 1 1 49 49 GLY N N 479 107.525 107.525 106.508 1.017 18053
12232 1 19 . 1 1 49 49 GLY C C 479 176.653 176.653 175.203 1.450 18053
12233 1 19 . 1 1 49 49 GLY CA C 479 48.062 48.062 45.588 2.474 18053
12234 1 19 . 1 1 49 49 GLY H H 479 7.728 7.728 8.712 -0.984 18053
12235 1 19 . 1 1 50 50 ASN N N 480 117.059 117.059 120.397 -3.338 18053
12236 1 19 . 1 1 50 50 ASN HA H 480 4.255 4.255 4.593 -0.338 18053
12237 1 19 . 1 1 50 50 ASN C C 480 174.961 174.961 175.539 -0.578 18053
12238 1 19 . 1 1 50 50 ASN CA C 480 56.360 56.360 53.897 2.463 18053
12239 1 19 . 1 1 50 50 ASN CB C 480 37.416 37.416 38.749 -1.333 18053
12240 1 19 . 1 1 50 50 ASN H H 480 7.552 7.552 8.691 -1.139 18053
12241 1 19 . 1 1 51 51 TRP N N 481 122.166 122.166 121.251 0.915 18053
12242 1 19 . 1 1 51 51 TRP HA H 481 4.477 4.477 4.673 -0.196 18053
12243 1 19 . 1 1 51 51 TRP C C 481 175.575 175.575 175.783 -0.208 18053
12244 1 19 . 1 1 51 51 TRP CA C 481 58.762 58.762 58.374 0.388 18053
12245 1 19 . 1 1 51 51 TRP CB C 481 28.041 28.041 29.772 -1.731 18053
12246 1 19 . 1 1 51 51 TRP H H 481 8.914 8.914 8.144 0.770 18053
12247 1 19 . 1 1 52 52 ARG N N 482 116.480 116.480 118.597 -2.117 18053
12248 1 19 . 1 1 52 52 ARG HA H 482 5.968 5.968 5.144 0.824 18053
12249 1 19 . 1 1 52 52 ARG C C 482 175.807 175.807 175.196 0.611 18053
12250 1 19 . 1 1 52 52 ARG CA C 482 54.121 54.121 54.971 -0.850 18053
12251 1 19 . 1 1 52 52 ARG CB C 482 35.124 35.124 33.263 1.861 18053
12252 1 19 . 1 1 52 52 ARG H H 482 9.147 9.147 9.051 0.096 18053
12253 1 19 . 1 1 53 53 ILE N N 483 119.579 119.579 125.995 -6.416 18053
12254 1 19 . 1 1 53 53 ILE HA H 483 4.985 4.985 4.776 0.209 18053
12255 1 19 . 1 1 53 53 ILE C C 483 175.670 175.670 175.792 -0.122 18053
12256 1 19 . 1 1 53 53 ILE CA C 483 60.400 60.400 61.246 -0.846 18053
12257 1 19 . 1 1 53 53 ILE CB C 483 40.227 40.227 38.396 1.831 18053
12258 1 19 . 1 1 53 53 ILE H H 483 9.000 9.000 8.864 0.136 18053
12259 1 19 . 1 1 54 54 LYS N N 484 124.737 124.737 127.918 -3.181 18053
12260 1 19 . 1 1 54 54 LYS HA H 484 5.463 5.463 5.024 0.439 18053
12261 1 19 . 1 1 54 54 LYS C C 484 175.575 175.575 176.099 -0.524 18053
12262 1 19 . 1 1 54 54 LYS CA C 484 54.613 54.613 56.140 -1.527 18053
12263 1 19 . 1 1 54 54 LYS CB C 484 35.041 35.041 34.109 0.932 18053
12264 1 19 . 1 1 54 54 LYS H H 484 9.678 9.678 8.584 1.094 18053
12265 1 19 . 1 1 55 55 ARG N N 485 124.090 124.090 123.342 0.748 18053
12266 1 19 . 1 1 55 55 ARG HA H 485 5.525 5.525 4.981 0.544 18053
12267 1 19 . 1 1 55 55 ARG C C 485 174.155 174.155 173.675 0.480 18053
12268 1 19 . 1 1 55 55 ARG CA C 485 53.903 53.903 55.356 -1.453 18053
12269 1 19 . 1 1 55 55 ARG H H 485 9.314 9.314 8.924 0.390 18053
12270 1 19 . 1 1 56 56 GLN N N 486 126.576 126.576 128.327 -1.751 18053
12271 1 19 . 1 1 56 56 GLN HA H 486 4.842 4.842 5.261 -0.419 18053
12272 1 19 . 1 1 56 56 GLN C C 486 174.991 174.991 174.227 0.764 18053
12273 1 19 . 1 1 56 56 GLN CA C 486 54.831 54.831 54.261 0.570 18053
12274 1 19 . 1 1 56 56 GLN CB C 486 31.465 31.465 31.489 -0.024 18053
12275 1 19 . 1 1 56 56 GLN H H 486 8.831 8.831 8.661 0.170 18053
12276 1 19 . 1 1 57 57 VAL N N 487 126.712 126.712 125.924 0.788 18053
12277 1 19 . 1 1 57 57 VAL HA H 487 4.266 4.266 4.391 -0.125 18053
12278 1 19 . 1 1 57 57 VAL C C 487 175.916 175.916 177.489 -1.573 18053
12279 1 19 . 1 1 57 57 VAL CA C 487 61.820 61.820 62.318 -0.498 18053
12280 1 19 . 1 1 57 57 VAL CB C 487 32.803 32.803 32.395 0.408 18053
12281 1 19 . 1 1 57 57 VAL H H 487 8.786 8.786 8.737 0.049 18053
12282 1 19 . 1 1 58 58 LEU N N 488 127.274 127.274 126.771 0.503 18053
12283 1 19 . 1 1 58 58 LEU HA H 488 4.085 4.085 3.979 0.106 18053
12284 1 19 . 1 1 58 58 LEU C C 488 177.158 177.158 178.226 -1.068 18053
12285 1 19 . 1 1 58 58 LEU CA C 488 56.906 56.906 58.208 -1.302 18053
12286 1 19 . 1 1 58 58 LEU CB C 488 41.374 41.374 42.217 -0.843 18053
12287 1 19 . 1 1 58 58 LEU H H 488 8.316 8.316 8.739 -0.423 18053
12288 1 19 . 1 1 59 59 GLU N N 489 119.647 119.647 117.435 2.212 18053
12289 1 19 . 1 1 59 59 GLU HA H 489 4.112 4.112 4.184 -0.072 18053
12290 1 19 . 1 1 59 59 GLU C C 489 176.230 176.230 176.867 -0.637 18053
12291 1 19 . 1 1 59 59 GLU CA C 489 57.015 57.015 58.061 -1.046 18053
12292 1 19 . 1 1 59 59 GLU CB C 489 28.149 28.149 29.631 -1.482 18053
12293 1 19 . 1 1 59 59 GLU H H 489 8.636 8.636 8.667 -0.031 18053
12294 1 19 . 1 1 60 60 GLY N N 490 108.819 108.819 104.749 4.070 18053
12295 1 19 . 1 1 60 60 GLY C C 490 173.568 173.568 173.566 0.002 18053
12296 1 19 . 1 1 60 60 GLY CA C 490 44.773 44.773 44.827 -0.054 18053
12297 1 19 . 1 1 60 60 GLY H H 490 8.160 8.160 7.586 0.574 18053
12298 1 19 . 1 1 61 61 GLU N N 491 121.009 121.009 123.419 -2.410 18053
12299 1 19 . 1 1 61 61 GLU HA H 491 4.323 4.323 4.161 0.162 18053
12300 1 19 . 1 1 61 61 GLU C C 491 175.725 175.725 175.709 0.016 18053
12301 1 19 . 1 1 61 61 GLU CA C 491 56.196 56.196 56.736 -0.540 18053
12302 1 19 . 1 1 61 61 GLU CB C 491 30.865 30.865 28.763 2.102 18053
12303 1 19 . 1 1 61 61 GLU H H 491 8.320 8.320 8.377 -0.057 18053
12304 1 19 . 1 1 62 62 GLU N N 492 123.426 123.426 125.070 -1.644 18053
12305 1 19 . 1 1 62 62 GLU HA H 492 5.054 5.054 4.998 0.056 18053
12306 1 19 . 1 1 62 62 GLU C C 492 175.930 175.930 176.124 -0.194 18053
12307 1 19 . 1 1 62 62 GLU CA C 492 55.650 55.650 55.014 0.636 18053
12308 1 19 . 1 1 62 62 GLU CB C 492 32.312 32.312 29.371 2.941 18053
12309 1 19 . 1 1 62 62 GLU H H 492 8.594 8.594 8.506 0.088 18053
12310 1 19 . 1 1 63 63 ILE N N 493 119.732 119.732 117.690 2.042 18053
12311 1 19 . 1 1 63 63 ILE HA H 493 4.788 4.788 4.918 -0.130 18053
12312 1 19 . 1 1 63 63 ILE C C 493 174.647 174.647 174.270 0.377 18053
12313 1 19 . 1 1 63 63 ILE CA C 493 60.181 60.181 59.486 0.695 18053
12314 1 19 . 1 1 63 63 ILE CB C 493 41.183 41.183 41.303 -0.121 18053
12315 1 19 . 1 1 63 63 ILE H H 493 8.523 8.523 8.672 -0.149 18053
12316 1 19 . 1 1 64 64 ALA N N 494 122.166 122.166 122.706 -0.540 18053
12317 1 19 . 1 1 64 64 ALA HA H 494 5.521 5.521 5.166 0.355 18053
12318 1 19 . 1 1 64 64 ALA C C 494 174.606 174.606 175.800 -1.194 18053
12319 1 19 . 1 1 64 64 ALA CA C 494 51.528 51.528 51.832 -0.304 18053
12320 1 19 . 1 1 64 64 ALA CB C 494 22.239 22.239 21.281 0.958 18053
12321 1 19 . 1 1 64 64 ALA H H 494 8.741 8.741 8.409 0.332 18053
12322 1 19 . 1 1 65 65 TYR N N 495 126.729 126.729 126.287 0.442 18053
12323 1 19 . 1 1 65 65 TYR HA H 495 3.094 3.094 3.831 -0.737 18053
12324 1 19 . 1 1 65 65 TYR C C 495 173.036 173.036 173.353 -0.317 18053
12325 1 19 . 1 1 65 65 TYR CA C 495 56.905 56.905 55.959 0.946 18053
12326 1 19 . 1 1 65 65 TYR CB C 495 40.269 40.269 39.477 0.792 18053
12327 1 19 . 1 1 65 65 TYR H H 495 8.462 8.462 8.606 -0.144 18053
12328 1 19 . 1 1 66 66 LYS N N 496 128.108 128.108 126.646 1.462 18053
12329 1 19 . 1 1 66 66 LYS HA H 496 4.822 4.822 4.414 0.408 18053
12330 1 19 . 1 1 66 66 LYS C C 496 174.906 174.906 174.843 0.063 18053
12331 1 19 . 1 1 66 66 LYS CA C 496 53.739 53.739 54.745 -1.006 18053
12332 1 19 . 1 1 66 66 LYS CB C 496 34.782 34.782 33.771 1.011 18053
12333 1 19 . 1 1 66 66 LYS H H 496 7.010 7.010 7.558 -0.548 18053
12334 1 19 . 1 1 67 67 PHE N N 497 125.299 125.299 121.094 4.205 18053
12335 1 19 . 1 1 67 67 PHE HA H 497 3.932 3.932 4.148 -0.216 18053
12336 1 19 . 1 1 67 67 PHE C C 497 177.990 177.990 175.953 2.037 18053
12337 1 19 . 1 1 67 67 PHE CA C 497 59.007 59.007 58.125 0.882 18053
12338 1 19 . 1 1 67 67 PHE CB C 497 40.981 40.981 40.049 0.932 18053
12339 1 19 . 1 1 67 67 PHE H H 497 8.509 8.509 8.307 0.202 18053
12340 1 19 . 1 1 68 68 THR N N 498 116.191 116.191 112.207 3.984 18053
12341 1 19 . 1 1 68 68 THR HA H 498 4.417 4.417 4.654 -0.237 18053
12342 1 19 . 1 1 68 68 THR CA C 498 60.855 60.855 59.338 1.517 18053
12343 1 19 . 1 1 68 68 THR CB C 498 68.019 68.019 69.412 -1.393 18053
12344 1 19 . 1 1 68 68 THR H H 498 8.688 8.688 8.362 0.326 18053
12345 1 19 . 1 1 69 69 PRO HA H 499 3.948 3.948 4.300 -0.352 18053
12346 1 19 . 1 1 69 69 PRO C C 499 177.444 177.444 176.945 0.499 18053
12347 1 19 . 1 1 69 69 PRO CA C 499 66.077 66.077 65.126 0.951 18053
12348 1 19 . 1 1 69 69 PRO CB C 499 32.776 32.776 31.838 0.938 18053
12349 1 19 . 1 1 70 70 LYS N N 500 113.552 113.552 114.046 -0.494 18053
12350 1 19 . 1 1 70 70 LYS HA H 500 4.385 4.385 4.203 0.182 18053
12351 1 19 . 1 1 70 70 LYS C C 500 176.325 176.325 176.620 -0.295 18053
12352 1 19 . 1 1 70 70 LYS CA C 500 54.995 54.995 56.369 -1.374 18053
12353 1 19 . 1 1 70 70 LYS CB C 500 31.793 31.793 31.919 -0.126 18053
12354 1 19 . 1 1 70 70 LYS H H 500 8.016 8.016 7.832 0.184 18053
12355 1 19 . 1 1 71 71 TYR N N 501 121.860 121.860 122.207 -0.347 18053
12356 1 19 . 1 1 71 71 TYR HA H 501 3.730 3.730 4.300 -0.570 18053
12357 1 19 . 1 1 71 71 TYR C C 501 174.838 174.838 174.314 0.524 18053
12358 1 19 . 1 1 71 71 TYR CA C 501 62.310 62.310 59.696 2.614 18053
12359 1 19 . 1 1 71 71 TYR CB C 501 38.781 38.781 39.278 -0.497 18053
12360 1 19 . 1 1 71 71 TYR H H 501 7.460 7.460 7.765 -0.305 18053
12361 1 19 . 1 1 72 72 ILE N N 502 129.487 129.487 127.595 1.892 18053
12362 1 19 . 1 1 72 72 ILE HA H 502 3.928 3.928 4.289 -0.361 18053
12363 1 19 . 1 1 72 72 ILE C C 502 172.968 172.968 173.517 -0.549 18053
12364 1 19 . 1 1 72 72 ILE CA C 502 59.308 59.308 59.529 -0.221 18053
12365 1 19 . 1 1 72 72 ILE CB C 502 40.910 40.910 41.492 -0.582 18053
12366 1 19 . 1 1 72 72 ILE H H 502 7.168 7.168 7.449 -0.281 18053
12367 1 19 . 1 1 73 73 LEU N N 503 128.278 128.278 128.227 0.051 18053
12368 1 19 . 1 1 73 73 LEU HA H 503 4.493 4.493 4.463 0.030 18053
12369 1 19 . 1 1 73 73 LEU C C 503 175.834 175.834 175.228 0.606 18053
12370 1 19 . 1 1 73 73 LEU CA C 503 51.965 51.965 53.955 -1.990 18053
12371 1 19 . 1 1 73 73 LEU CB C 503 42.548 42.548 43.558 -1.010 18053
12372 1 19 . 1 1 73 73 LEU H H 503 8.483 8.483 8.331 0.152 18053
12373 1 19 . 1 1 74 74 ARG N N 504 129.589 129.589 124.961 4.628 18053
12374 1 19 . 1 1 74 74 ARG HA H 504 3.743 3.743 4.197 -0.454 18053
12375 1 19 . 1 1 74 74 ARG C C 504 175.233 175.233 175.490 -0.257 18053
12376 1 19 . 1 1 74 74 ARG CA C 504 56.851 56.851 55.550 1.301 18053
12377 1 19 . 1 1 74 74 ARG CB C 504 30.292 30.292 30.730 -0.438 18053
12378 1 19 . 1 1 74 74 ARG H H 504 8.673 8.673 8.364 0.309 18053
12379 1 19 . 1 1 75 75 ALA N N 505 123.205 123.205 125.142 -1.937 18053
12380 1 19 . 1 1 75 75 ALA HA H 505 3.522 3.522 4.108 -0.586 18053
12381 1 19 . 1 1 75 75 ALA C C 505 178.441 178.441 178.144 0.297 18053
12382 1 19 . 1 1 75 75 ALA CA C 505 53.794 53.794 52.992 0.802 18053
12383 1 19 . 1 1 75 75 ALA CB C 505 18.910 18.910 18.161 0.749 18053
12384 1 19 . 1 1 75 75 ALA H H 505 8.564 8.564 8.426 0.138 18053
12385 1 19 . 1 1 76 76 GLY N N 506 112.241 112.241 113.188 -0.947 18053
12386 1 19 . 1 1 76 76 GLY C C 506 174.278 174.278 174.735 -0.457 18053
12387 1 19 . 1 1 76 76 GLY CA C 506 46.725 46.725 45.064 1.661 18053
12388 1 19 . 1 1 76 76 GLY H H 506 7.381 7.381 8.598 -1.217 18053
12389 1 19 . 1 1 77 77 GLN N N 507 117.382 117.382 118.963 -1.581 18053
12390 1 19 . 1 1 77 77 GLN HA H 507 4.364 4.364 4.548 -0.184 18053
12391 1 19 . 1 1 77 77 GLN C C 507 173.937 173.937 175.009 -1.072 18053
12392 1 19 . 1 1 77 77 GLN CA C 507 54.558 54.558 54.971 -0.413 18053
12393 1 19 . 1 1 77 77 GLN CB C 507 30.073 30.073 30.303 -0.230 18053
12394 1 19 . 1 1 77 77 GLN H H 507 7.996 7.996 7.803 0.193 18053
12395 1 19 . 1 1 78 78 MET N N 508 116.957 116.957 114.077 2.880 18053
12396 1 19 . 1 1 78 78 MET HA H 508 5.388 5.388 5.240 0.148 18053
12397 1 19 . 1 1 78 78 MET C C 508 175.807 175.807 174.193 1.614 18053
12398 1 19 . 1 1 78 78 MET CA C 508 54.067 54.067 54.748 -0.681 18053
12399 1 19 . 1 1 78 78 MET CB C 508 37.198 37.198 36.932 0.266 18053
12400 1 19 . 1 1 78 78 MET H H 508 8.092 8.092 8.389 -0.297 18053
12401 1 19 . 1 1 79 79 VAL N N 509 119.340 119.340 124.046 -4.706 18053
12402 1 19 . 1 1 79 79 VAL HA H 509 4.956 4.956 4.631 0.325 18053
12403 1 19 . 1 1 79 79 VAL C C 509 172.217 172.217 174.737 -2.520 18053
12404 1 19 . 1 1 79 79 VAL CA C 509 59.471 59.471 60.291 -0.820 18053
12405 1 19 . 1 1 79 79 VAL CB C 509 33.676 33.676 33.905 -0.229 18053
12406 1 19 . 1 1 79 79 VAL H H 509 8.534 8.534 8.798 -0.264 18053
12407 1 19 . 1 1 80 80 THR N N 510 124.533 124.533 126.421 -1.888 18053
12408 1 19 . 1 1 80 80 THR HA H 510 4.586 4.586 4.702 -0.116 18053
12409 1 19 . 1 1 80 80 THR C C 510 172.215 172.215 174.343 -2.128 18053
12410 1 19 . 1 1 80 80 THR CA C 510 62.119 62.119 62.424 -0.305 18053
12411 1 19 . 1 1 80 80 THR CB C 510 69.407 69.407 68.522 0.885 18053
12412 1 19 . 1 1 80 80 THR H H 510 8.301 8.301 8.706 -0.405 18053
12413 1 19 . 1 1 81 81 VAL N N 511 127.002 127.002 127.796 -0.794 18053
12414 1 19 . 1 1 81 81 VAL HA H 511 4.596 4.596 4.675 -0.079 18053
12415 1 19 . 1 1 81 81 VAL C C 511 176.667 176.667 175.587 1.080 18053
12416 1 19 . 1 1 81 81 VAL CA C 511 61.382 61.382 62.179 -0.797 18053
12417 1 19 . 1 1 81 81 VAL CB C 511 30.945 30.945 31.125 -0.180 18053
12418 1 19 . 1 1 81 81 VAL H H 511 8.796 8.796 8.609 0.187 18053
12419 1 19 . 1 1 82 82 TRP N N 512 131.479 131.479 129.346 2.133 18053
12420 1 19 . 1 1 82 82 TRP HA H 512 5.338 5.338 5.333 0.005 18053
12421 1 19 . 1 1 82 82 TRP C C 512 176.885 176.885 175.205 1.680 18053
12422 1 19 . 1 1 82 82 TRP CA C 512 56.442 56.442 56.603 -0.161 18053
12423 1 19 . 1 1 82 82 TRP CB C 512 30.701 30.701 32.329 -1.628 18053
12424 1 19 . 1 1 82 82 TRP H H 512 9.924 9.924 8.402 1.522 18053
12425 1 19 . 1 1 83 83 ALA N N 513 123.954 123.954 121.169 2.785 18053
12426 1 19 . 1 1 83 83 ALA HA H 513 4.308 4.308 4.752 -0.444 18053
12427 1 19 . 1 1 83 83 ALA C C 513 178.140 178.140 178.209 -0.069 18053
12428 1 19 . 1 1 83 83 ALA CA C 513 52.211 52.211 50.858 1.353 18053
12429 1 19 . 1 1 83 83 ALA CB C 513 18.745 18.745 20.183 -1.438 18053
12430 1 19 . 1 1 83 83 ALA H H 513 9.048 9.048 8.679 0.369 18053
12431 1 19 . 1 1 84 84 ALA N N 514 125.146 125.146 126.140 -0.994 18053
12432 1 19 . 1 1 84 84 ALA HA H 514 3.951 3.951 4.088 -0.137 18053
12433 1 19 . 1 1 84 84 ALA C C 514 179.519 179.519 178.967 0.552 18053
12434 1 19 . 1 1 84 84 ALA CA C 514 54.804 54.804 54.953 -0.149 18053
12435 1 19 . 1 1 84 84 ALA CB C 514 18.582 18.582 18.970 -0.388 18053
12436 1 19 . 1 1 84 84 ALA H H 514 8.341 8.341 8.300 0.041 18053
12437 1 19 . 1 1 85 85 GLY N N 515 103.388 103.388 105.245 -1.857 18053
12438 1 19 . 1 1 85 85 GLY C C 515 174.674 174.674 174.806 -0.132 18053
12439 1 19 . 1 1 85 85 GLY CA C 515 45.878 45.878 45.362 0.516 18053
12440 1 19 . 1 1 85 85 GLY H H 515 7.996 7.996 7.970 0.026 18053
12441 1 19 . 1 1 86 86 ALA N N 516 120.140 120.140 123.666 -3.526 18053
12442 1 19 . 1 1 86 86 ALA HA H 516 4.344 4.344 4.316 0.028 18053
12443 1 19 . 1 1 86 86 ALA C C 516 177.690 177.690 178.288 -0.598 18053
12444 1 19 . 1 1 86 86 ALA CA C 516 53.139 53.139 52.523 0.616 18053
12445 1 19 . 1 1 86 86 ALA CB C 516 20.547 20.547 19.815 0.732 18053
12446 1 19 . 1 1 86 86 ALA H H 516 7.474 7.474 7.354 0.120 18053
12447 1 19 . 1 1 87 87 GLY N N 517 105.720 105.720 107.282 -1.562 18053
12448 1 19 . 1 1 87 87 GLY C C 517 173.650 173.650 174.014 -0.364 18053
12449 1 19 . 1 1 87 87 GLY CA C 517 46.014 46.014 45.069 0.945 18053
12450 1 19 . 1 1 87 87 GLY H H 517 7.779 7.779 7.949 -0.170 18053
12451 1 19 . 1 1 88 88 VAL N N 518 121.537 121.537 118.958 2.579 18053
12452 1 19 . 1 1 88 88 VAL HA H 518 3.585 3.585 4.116 -0.531 18053
12453 1 19 . 1 1 88 88 VAL C C 518 174.851 174.851 174.946 -0.095 18053
12454 1 19 . 1 1 88 88 VAL CA C 518 61.274 61.274 60.769 0.505 18053
12455 1 19 . 1 1 88 88 VAL CB C 518 33.376 33.376 33.143 0.233 18053
12456 1 19 . 1 1 88 88 VAL H H 518 7.499 7.499 7.664 -0.165 18053
12457 1 19 . 1 1 89 89 ALA N N 519 128.295 128.295 129.262 -0.967 18053
12458 1 19 . 1 1 89 89 ALA HA H 519 4.192 4.192 4.359 -0.167 18053
12459 1 19 . 1 1 89 89 ALA C C 519 176.680 176.680 176.470 0.210 18053
12460 1 19 . 1 1 89 89 ALA CA C 519 51.283 51.283 51.547 -0.264 18053
12461 1 19 . 1 1 89 89 ALA CB C 519 19.292 19.292 19.266 0.026 18053
12462 1 19 . 1 1 89 89 ALA H H 519 7.960 7.960 8.079 -0.119 18053
12463 1 19 . 1 1 90 90 HIS N N 520 122.643 122.643 123.745 -1.102 18053
12464 1 19 . 1 1 90 90 HIS HA H 520 4.033 4.033 4.424 -0.391 18053
12465 1 19 . 1 1 90 90 HIS C C 520 175.793 175.793 174.335 1.458 18053
12466 1 19 . 1 1 90 90 HIS CA C 520 58.653 58.653 55.938 2.715 18053
12467 1 19 . 1 1 90 90 HIS CB C 520 32.285 32.285 29.982 2.303 18053
12468 1 19 . 1 1 90 90 HIS H H 520 8.394 8.394 8.885 -0.491 18053
12469 1 19 . 1 1 91 91 SER N N 521 121.247 121.247 124.379 -3.132 18053
12470 1 19 . 1 1 91 91 SER HA H 521 4.629 4.629 4.862 -0.233 18053
12471 1 19 . 1 1 91 91 SER CA C 521 55.843 55.843 56.007 -0.164 18053
12472 1 19 . 1 1 91 91 SER CB C 521 62.367 62.367 63.672 -1.305 18053
12473 1 19 . 1 1 91 91 SER H H 521 8.569 8.569 8.260 0.309 18053
12474 1 19 . 1 1 92 92 PRO HA H 522 4.002 4.002 4.847 -0.845 18053
12475 1 19 . 1 1 92 92 PRO CA C 522 62.244 62.244 62.491 -0.247 18053
12476 1 19 . 1 1 92 92 PRO CB C 522 30.931 30.931 31.576 -0.645 18053
12477 1 19 . 1 1 93 93 PRO HA H 523 4.672 4.672 4.808 -0.136 18053
12478 1 19 . 1 1 93 93 PRO C C 523 177.786 177.786 177.965 -0.179 18053
12479 1 19 . 1 1 93 93 PRO CA C 523 64.003 64.003 64.420 -0.417 18053
12480 1 19 . 1 1 93 93 PRO CB C 523 34.905 34.905 32.232 2.673 18053
12481 1 19 . 1 1 94 94 SER N N 524 117.212 117.212 116.318 0.894 18053
12482 1 19 . 1 1 94 94 SER HA H 524 4.678 4.678 4.772 -0.094 18053
12483 1 19 . 1 1 94 94 SER C C 524 174.851 174.851 174.440 0.411 18053
12484 1 19 . 1 1 94 94 SER CA C 524 61.874 61.874 60.858 1.016 18053
12485 1 19 . 1 1 94 94 SER CB C 524 64.057 64.057 63.701 0.356 18053
12486 1 19 . 1 1 94 94 SER H H 524 8.463 8.463 8.389 0.074 18053
12487 1 19 . 1 1 95 95 THR N N 525 121.588 121.588 118.737 2.851 18053
12488 1 19 . 1 1 95 95 THR HA H 525 4.859 4.859 4.991 -0.132 18053
12489 1 19 . 1 1 95 95 THR C C 525 172.094 172.094 172.474 -0.380 18053
12490 1 19 . 1 1 95 95 THR CA C 525 62.309 62.309 61.954 0.355 18053
12491 1 19 . 1 1 95 95 THR CB C 525 70.281 70.281 70.124 0.157 18053
12492 1 19 . 1 1 95 95 THR H H 525 7.631 7.631 8.075 -0.444 18053
12493 1 19 . 1 1 96 96 LEU N N 526 127.274 127.274 131.278 -4.004 18053
12494 1 19 . 1 1 96 96 LEU HA H 526 5.131 5.131 4.588 0.543 18053
12495 1 19 . 1 1 96 96 LEU C C 526 175.916 175.916 174.537 1.379 18053
12496 1 19 . 1 1 96 96 LEU CA C 526 52.075 52.075 53.196 -1.121 18053
12497 1 19 . 1 1 96 96 LEU CB C 526 43.790 43.790 44.407 -0.617 18053
12498 1 19 . 1 1 96 96 LEU H H 526 8.977 8.977 8.222 0.755 18053
12499 1 19 . 1 1 97 97 VAL N N 527 124.056 124.056 127.352 -3.296 18053
12500 1 19 . 1 1 97 97 VAL HA H 527 4.869 4.869 4.229 0.640 18053
12501 1 19 . 1 1 97 97 VAL C C 527 176.230 176.230 175.297 0.933 18053
12502 1 19 . 1 1 97 97 VAL CA C 527 61.519 61.519 61.843 -0.324 18053
12503 1 19 . 1 1 97 97 VAL CB C 527 33.704 33.704 31.983 1.721 18053
12504 1 19 . 1 1 97 97 VAL H H 527 10.724 10.724 7.175 3.549 18053
12505 1 19 . 1 1 98 98 TRP N N 528 132.586 132.586 131.564 1.022 18053
12506 1 19 . 1 1 98 98 TRP HA H 528 4.965 4.965 4.041 0.924 18053
12507 1 19 . 1 1 98 98 TRP C C 528 173.391 173.391 174.423 -1.032 18053
12508 1 19 . 1 1 98 98 TRP CA C 528 53.303 53.303 55.298 -1.995 18053
12509 1 19 . 1 1 98 98 TRP CB C 528 28.245 28.245 28.310 -0.065 18053
12510 1 19 . 1 1 98 98 TRP H H 528 9.400 9.400 8.690 0.710 18053
12511 1 19 . 1 1 99 99 LYS N N 529 126.644 126.644 128.435 -1.791 18053
12512 1 19 . 1 1 99 99 LYS HA H 529 3.839 3.839 4.102 -0.263 18053
12513 1 19 . 1 1 99 99 LYS C C 529 177.581 177.581 177.130 0.451 18053
12514 1 19 . 1 1 99 99 LYS CA C 529 58.543 58.543 57.379 1.164 18053
12515 1 19 . 1 1 99 99 LYS CB C 529 32.176 32.176 32.615 -0.439 18053
12516 1 19 . 1 1 99 99 LYS H H 529 8.153 8.153 8.007 0.146 18053
12517 1 19 . 1 1 100 100 GLY N N 530 110.385 110.385 113.640 -3.255 18053
12518 1 19 . 1 1 100 100 GLY C C 530 172.367 172.367 173.577 -1.210 18053
12519 1 19 . 1 1 100 100 GLY CA C 530 45.278 45.278 44.610 0.668 18053
12520 1 19 . 1 1 100 100 GLY H H 530 8.363 8.363 8.554 -0.191 18053
12521 1 19 . 1 1 101 101 GLN N N 531 121.162 121.162 121.664 -0.502 18053
12522 1 19 . 1 1 101 101 GLN HA H 531 3.972 3.972 4.347 -0.375 18053
12523 1 19 . 1 1 101 101 GLN CA C 531 52.620 52.620 53.726 -1.106 18053
12524 1 19 . 1 1 101 101 GLN CB C 531 27.595 27.595 28.983 -1.389 18053
12525 1 19 . 1 1 101 101 GLN H H 531 6.815 6.815 7.012 -0.197 18053
12526 1 19 . 1 1 102 102 SER N N 532 122.728 122.728 121.367 1.361 18053
12527 1 19 . 1 1 102 102 SER HA H 532 3.866 3.866 4.382 -0.516 18053
12528 1 19 . 1 1 102 102 SER C C 532 174.537 174.537 175.878 -1.341 18053
12529 1 19 . 1 1 102 102 SER CA C 532 61.983 61.983 60.468 1.515 18053
12530 1 19 . 1 1 102 102 SER CB C 532 62.802 62.802 63.311 -0.509 18053
12531 1 19 . 1 1 102 102 SER H H 532 8.662 8.662 9.030 -0.368 18053
12532 1 19 . 1 1 103 103 SER N N 533 110.811 110.811 116.077 -5.266 18053
12533 1 19 . 1 1 103 103 SER HA H 533 4.240 4.240 4.502 -0.262 18053
12534 1 19 . 1 1 103 103 SER C C 533 174.087 174.087 174.179 -0.092 18053
12535 1 19 . 1 1 103 103 SER CA C 533 56.633 56.633 59.164 -2.531 18053
12536 1 19 . 1 1 103 103 SER CB C 533 64.658 64.658 64.571 0.087 18053
12537 1 19 . 1 1 103 103 SER H H 533 7.134 7.134 7.974 -0.840 18053
12538 1 19 . 1 1 104 104 TRP N N 534 126.133 126.133 122.056 4.077 18053
12539 1 19 . 1 1 104 104 TRP HA H 534 4.098 4.098 4.243 -0.145 18053
12540 1 19 . 1 1 104 104 TRP C C 534 176.066 176.066 175.377 0.689 18053
12541 1 19 . 1 1 104 104 TRP CA C 534 60.127 60.127 57.343 2.784 18053
12542 1 19 . 1 1 104 104 TRP CB C 534 28.764 28.764 28.759 0.004 18053
12543 1 19 . 1 1 104 104 TRP H H 534 9.764 9.764 7.873 1.891 18053
12544 1 19 . 1 1 105 105 GLY N N 535 105.907 105.907 105.268 0.639 18053
12545 1 19 . 1 1 105 105 GLY C C 535 172.217 172.217 174.166 -1.949 18053
12546 1 19 . 1 1 105 105 GLY CA C 535 44.240 44.240 44.994 -0.754 18053
12547 1 19 . 1 1 105 105 GLY H H 535 8.095 8.095 7.934 0.162 18053
12548 1 19 . 1 1 106 106 THR N N 536 111.253 111.253 112.208 -0.955 18053
12549 1 19 . 1 1 106 106 THR HA H 536 3.859 3.859 4.759 -0.900 18053
12550 1 19 . 1 1 106 106 THR C C 536 172.872 172.872 174.755 -1.883 18053
12551 1 19 . 1 1 106 106 THR CA C 536 59.635 59.635 61.018 -1.383 18053
12552 1 19 . 1 1 106 106 THR CB C 536 70.526 70.526 69.745 0.781 18053
12553 1 19 . 1 1 106 106 THR H H 536 7.913 7.913 7.613 0.300 18053
12554 1 19 . 1 1 107 107 GLY N N 537 107.712 107.712 110.855 -3.143 18053
12555 1 19 . 1 1 107 107 GLY C C 537 172.709 172.709 173.031 -0.322 18053
12556 1 19 . 1 1 107 107 GLY CA C 537 45.166 45.166 45.468 -0.302 18053
12557 1 19 . 1 1 107 107 GLY H H 537 7.533 7.533 8.278 -0.745 18053
12558 1 19 . 1 1 108 108 GLU N N 538 118.864 118.864 121.143 -2.279 18053
12559 1 19 . 1 1 108 108 GLU HA H 538 4.136 4.136 4.291 -0.155 18053
12560 1 19 . 1 1 108 108 GLU C C 538 176.353 176.353 175.532 0.821 18053
12561 1 19 . 1 1 108 108 GLU CA C 538 58.352 58.352 58.718 -0.366 18053
12562 1 19 . 1 1 108 108 GLU CB C 538 30.156 30.156 31.029 -0.873 18053
12563 1 19 . 1 1 108 108 GLU H H 538 8.558 8.558 8.562 -0.004 18053
12564 1 19 . 1 1 109 109 SER N N 539 110.419 110.419 112.460 -2.041 18053
12565 1 19 . 1 1 109 109 SER HA H 539 4.963 4.963 5.072 -0.109 18053
12566 1 19 . 1 1 109 109 SER C C 539 173.787 173.787 172.968 0.819 18053
12567 1 19 . 1 1 109 109 SER CA C 539 57.125 57.125 56.497 0.628 18053
12568 1 19 . 1 1 109 109 SER CB C 539 64.439 64.439 65.652 -1.213 18053
12569 1 19 . 1 1 109 109 SER H H 539 7.620 7.620 7.998 -0.378 18053
12570 1 19 . 1 1 110 110 PHE N N 540 118.778 118.778 118.779 -0.001 18053
12571 1 19 . 1 1 110 110 PHE HA H 540 5.081 5.081 5.268 -0.187 18053
12572 1 19 . 1 1 110 110 PHE C C 540 176.052 176.052 173.649 2.403 18053
12573 1 19 . 1 1 110 110 PHE CA C 540 56.789 56.789 56.367 0.422 18053
12574 1 19 . 1 1 110 110 PHE CB C 540 40.760 40.760 41.767 -1.007 18053
12575 1 19 . 1 1 110 110 PHE H H 540 8.318 8.318 8.256 0.062 18053
12576 1 19 . 1 1 112 112 THR HA H 542 5.468 5.468 4.742 0.726 18053
12577 1 19 . 1 1 112 112 THR C C 542 172.381 172.381 173.620 -1.239 18053
12578 1 19 . 1 1 112 112 THR CA C 542 61.818 61.818 63.231 -1.413 18053
12579 1 19 . 1 1 112 112 THR CB C 542 70.990 70.990 69.144 1.846 18053
12580 1 19 . 1 1 113 113 VAL N N 543 124.771 124.771 127.860 -3.089 18053
12581 1 19 . 1 1 113 113 VAL HA H 543 4.864 4.864 4.529 0.335 18053
12582 1 19 . 1 1 113 113 VAL C C 543 173.132 173.132 173.985 -0.853 18053
12583 1 19 . 1 1 113 113 VAL CA C 543 60.099 60.099 61.142 -1.043 18053
12584 1 19 . 1 1 113 113 VAL CB C 543 36.433 36.433 34.899 1.534 18053
12585 1 19 . 1 1 113 113 VAL H H 543 9.380 9.380 8.787 0.593 18053
12586 1 19 . 1 1 114 114 LEU N N 544 128.789 128.789 127.605 1.184 18053
12587 1 19 . 1 1 114 114 LEU HA H 544 5.320 5.320 4.877 0.443 18053
12588 1 19 . 1 1 114 114 LEU C C 544 174.237 174.237 174.860 -0.623 18053
12589 1 19 . 1 1 114 114 LEU CA C 544 53.193 53.193 53.806 -0.613 18053
12590 1 19 . 1 1 114 114 LEU CB C 544 45.879 45.879 45.025 0.854 18053
12591 1 19 . 1 1 114 114 LEU H H 544 8.948 8.948 8.580 0.368 18053
12592 1 19 . 1 1 115 115 VAL N N 545 127.002 127.002 125.428 1.574 18053
12593 1 19 . 1 1 115 115 VAL HA H 545 4.854 4.854 4.596 0.258 18053
12594 1 19 . 1 1 115 115 VAL C C 545 175.206 175.206 175.109 0.097 18053
12595 1 19 . 1 1 115 115 VAL CA C 545 59.334 59.334 59.671 -0.337 18053
12596 1 19 . 1 1 115 115 VAL CB C 545 34.495 34.495 34.663 -0.168 18053
12597 1 19 . 1 1 115 115 VAL H H 545 9.564 9.564 8.646 0.918 18053
12598 1 19 . 1 1 116 116 ASN N N 546 121.179 121.179 124.116 -2.937 18053
12599 1 19 . 1 1 116 116 ASN HA H 546 2.897 2.897 3.487 -0.590 18053
12600 1 19 . 1 1 116 116 ASN C C 546 176.885 176.885 175.029 1.856 18053
12601 1 19 . 1 1 116 116 ASN CA C 546 50.409 50.409 51.433 -1.024 18053
12602 1 19 . 1 1 116 116 ASN CB C 546 36.639 36.639 39.421 -2.782 18053
12603 1 19 . 1 1 116 116 ASN H H 546 8.016 8.016 7.872 0.144 18053
12604 1 19 . 1 1 117 117 ALA N N 547 119.834 119.834 118.908 0.926 18053
12605 1 19 . 1 1 117 117 ALA HA H 547 3.866 3.866 4.203 -0.337 18053
12606 1 19 . 1 1 117 117 ALA C C 547 177.772 177.772 178.459 -0.687 18053
12607 1 19 . 1 1 117 117 ALA CA C 547 54.504 54.504 54.220 0.284 18053
12608 1 19 . 1 1 117 117 ALA CB C 547 18.200 18.200 18.345 -0.145 18053
12609 1 19 . 1 1 117 117 ALA H H 547 6.444 6.444 7.878 -1.434 18053
12610 1 19 . 1 1 118 118 ASP N N 548 115.646 115.646 117.600 -1.954 18053
12611 1 19 . 1 1 118 118 ASP HA H 548 4.644 4.644 4.414 0.230 18053
12612 1 19 . 1 1 118 118 ASP C C 548 176.052 176.052 177.401 -1.349 18053
12613 1 19 . 1 1 118 118 ASP CA C 548 54.067 54.067 55.276 -1.208 18053
12614 1 19 . 1 1 118 118 ASP CB C 548 41.674 41.674 41.420 0.254 18053
12615 1 19 . 1 1 118 118 ASP H H 548 7.181 7.181 8.033 -0.852 18053
12616 1 19 . 1 1 119 119 GLY N N 549 107.167 107.167 106.259 0.908 18053
12617 1 19 . 1 1 119 119 GLY C C 549 173.841 173.841 173.702 0.139 18053
12618 1 19 . 1 1 119 119 GLY CA C 549 45.455 45.455 44.640 0.815 18053
12619 1 19 . 1 1 119 119 GLY H H 549 7.738 7.738 7.693 0.045 18053
12620 1 19 . 1 1 120 120 GLU N N 550 121.196 121.196 120.724 0.472 18053
12621 1 19 . 1 1 120 120 GLU HA H 550 4.112 4.112 4.341 -0.229 18053
12622 1 19 . 1 1 120 120 GLU C C 550 175.588 175.588 175.671 -0.083 18053
12623 1 19 . 1 1 120 120 GLU CA C 550 54.831 54.831 55.432 -0.601 18053
12624 1 19 . 1 1 120 120 GLU CB C 550 29.937 29.937 30.584 -0.647 18053
12625 1 19 . 1 1 120 120 GLU H H 550 7.587 7.587 7.633 -0.046 18053
12626 1 19 . 1 1 121 121 GLU N N 551 123.886 123.886 122.961 0.925 18053
12627 1 19 . 1 1 121 121 GLU HA H 551 4.276 4.276 4.341 -0.065 18053
12628 1 19 . 1 1 121 121 GLU C C 551 176.817 176.817 176.540 0.277 18053
12629 1 19 . 1 1 121 121 GLU CA C 551 56.796 56.796 56.920 -0.124 18053
12630 1 19 . 1 1 121 121 GLU CB C 551 28.955 28.955 29.021 -0.066 18053
12631 1 19 . 1 1 121 121 GLU H H 551 8.697 8.697 8.705 -0.008 18053
12632 1 19 . 1 1 122 122 VAL N N 552 120.055 120.055 120.877 -0.822 18053
12633 1 19 . 1 1 122 122 VAL HA H 552 4.364 4.364 4.119 0.245 18053
12634 1 19 . 1 1 122 122 VAL C C 552 175.998 175.998 175.176 0.822 18053
12635 1 19 . 1 1 122 122 VAL CA C 552 61.655 61.655 62.053 -0.398 18053
12636 1 19 . 1 1 122 122 VAL CB C 552 33.049 33.049 32.598 0.451 18053
12637 1 19 . 1 1 122 122 VAL H H 552 8.845 8.845 8.162 0.683 18053
12638 1 19 . 1 1 123 123 ALA N N 553 122.098 122.098 120.035 2.063 18053
12639 1 19 . 1 1 123 123 ALA HA H 553 4.890 4.890 4.759 0.131 18053
12640 1 19 . 1 1 123 123 ALA C C 553 175.261 175.261 175.244 0.017 18053
12641 1 19 . 1 1 123 123 ALA CA C 553 52.757 52.757 51.331 1.425 18053
12642 1 19 . 1 1 123 123 ALA CB C 553 22.267 22.267 21.733 0.534 18053
12643 1 19 . 1 1 123 123 ALA H H 553 7.788 7.788 7.700 0.088 18053
12644 1 19 . 1 1 124 124 MET N N 554 118.217 118.217 121.718 -3.501 18053
12645 1 19 . 1 1 124 124 MET HA H 554 5.286 5.286 5.010 0.276 18053
12646 1 19 . 1 1 124 124 MET C C 554 174.428 174.428 174.223 0.205 18053
12647 1 19 . 1 1 124 124 MET CA C 554 55.104 55.104 55.306 -0.202 18053
12648 1 19 . 1 1 124 124 MET CB C 554 35.342 35.342 36.790 -1.448 18053
12649 1 19 . 1 1 124 124 MET H H 554 8.693 8.693 8.433 0.260 18053
12650 1 19 . 1 1 125 125 ARG N N 555 122.132 122.132 127.091 -4.959 18053
12651 1 19 . 1 1 125 125 ARG HA H 555 4.900 4.900 4.674 0.226 18053
12652 1 19 . 1 1 125 125 ARG CA C 555 56.388 56.388 56.297 0.091 18053
12653 1 19 . 1 1 125 125 ARG CB C 555 34.378 34.378 33.755 0.623 18053
12654 1 19 . 1 1 125 125 ARG H H 555 8.919 8.919 9.092 -0.173 18053
12655 1 19 . 1 1 126 126 THR HA H 556 4.685 4.685 4.852 -0.167 18053
12656 1 19 . 1 1 126 126 THR C C 556 172.436 172.436 173.826 -1.390 18053
12657 1 19 . 1 1 126 126 THR CA C 556 61.382 61.382 61.792 -0.410 18053
12658 1 19 . 1 1 126 126 THR CB C 556 70.444 70.444 69.541 0.903 18053
12659 1 19 . 1 1 127 127 VAL N N 557 124.976 124.976 129.066 -4.090 18053
12660 1 19 . 1 1 127 127 VAL HA H 557 4.146 4.146 4.106 0.040 18053
12661 1 19 . 1 1 127 127 VAL C C 557 173.937 173.937 174.480 -0.543 18053
12662 1 19 . 1 1 127 127 VAL CA C 557 61.109 61.109 60.694 0.415 18053
12663 1 19 . 1 1 127 127 VAL CB C 557 33.759 33.759 32.627 1.132 18053
12664 1 19 . 1 1 127 127 VAL H H 557 8.127 8.127 8.152 -0.025 18053
12665 1 19 . 1 1 128 128 LYS N N 558 125.384 125.384 126.264 -0.880 18053
12666 1 19 . 1 1 128 128 LYS HA H 558 4.706 4.706 4.712 -0.006 18053
12667 1 19 . 1 1 128 128 LYS C C 558 175.534 175.534 176.157 -0.623 18053
12668 1 19 . 1 1 128 128 LYS CA C 558 54.886 54.886 52.541 2.345 18053
12669 1 19 . 1 1 128 128 LYS CB C 558 34.673 34.673 33.838 0.835 18053
12670 1 19 . 1 1 128 128 LYS H H 558 8.289 8.289 8.274 0.015 18053
12671 1 19 . 1 1 129 129 LYS N N 559 124.005 124.005 123.168 0.837 18053
12672 1 19 . 1 1 129 129 LYS HA H 559 4.310 4.310 4.123 0.186 18053
12673 1 19 . 1 1 129 129 LYS C C 559 176.571 176.571 175.707 0.864 18053
12674 1 19 . 1 1 129 129 LYS CA C 559 56.742 56.742 57.392 -0.650 18053
12675 1 19 . 1 1 129 129 LYS CB C 559 33.362 33.362 31.106 2.256 18053
12676 1 19 . 1 1 129 129 LYS H H 559 8.461 8.461 8.181 0.280 18053
12677 1 19 . 1 1 130 130 SER N N 560 117.195 117.195 120.836 -3.641 18053
12678 1 19 . 1 1 130 130 SER HA H 560 4.384 4.384 4.517 -0.133 18053
12679 1 19 . 1 1 130 130 SER C C 560 174.565 174.565 173.240 1.325 18053
12680 1 19 . 1 1 130 130 SER CA C 560 58.434 58.434 57.270 1.164 18053
12681 1 19 . 1 1 130 130 SER CB C 560 63.812 63.812 63.427 0.385 18053
12682 1 19 . 1 1 130 130 SER H H 560 8.465 8.465 8.089 0.376 18053
12683 1 19 . 1 1 131 131 SER N N 561 118.149 118.149 119.218 -1.069 18053
12684 1 19 . 1 1 131 131 SER HA H 561 4.412 4.412 4.512 -0.100 18053
12685 1 19 . 1 1 131 131 SER C C 561 174.456 174.456 175.252 -0.796 18053
12686 1 19 . 1 1 131 131 SER CA C 561 58.489 58.489 57.904 0.585 18053
12687 1 19 . 1 1 131 131 SER CB C 561 63.811 63.811 63.206 0.605 18053
12688 1 19 . 1 1 131 131 SER H H 561 8.336 8.336 8.367 -0.031 18053
12689 1 19 . 1 1 132 132 VAL N N 562 121.332 121.332 121.459 -0.127 18053
12690 1 19 . 1 1 132 132 VAL HA H 562 4.035 4.035 4.061 -0.026 18053
12691 1 19 . 1 1 132 132 VAL C C 562 176.066 176.066 175.813 0.253 18053
12692 1 19 . 1 1 132 132 VAL CA C 562 62.446 62.446 63.333 -0.887 18053
12693 1 19 . 1 1 132 132 VAL CB C 562 32.394 32.394 31.911 0.483 18053
12694 1 19 . 1 1 132 132 VAL H H 562 7.982 7.982 8.538 -0.556 18053
12695 1 19 . 1 1 133 133 MET N N 563 124.022 124.022 117.884 6.138 18053
12696 1 19 . 1 1 133 133 MET HA H 563 4.385 4.385 4.265 0.120 18053
12697 1 19 . 1 1 133 133 MET C C 563 176.039 176.039 175.416 0.623 18053
12698 1 19 . 1 1 133 133 MET CA C 563 55.350 55.350 55.413 -0.064 18053
12699 1 19 . 1 1 133 133 MET CB C 563 32.503 32.503 32.385 0.118 18053
12700 1 19 . 1 1 133 133 MET H H 563 8.295 8.295 7.787 0.508 18053
12701 1 19 . 1 1 134 134 ARG N N 564 122.677 122.677 123.266 -0.589 18053
12702 1 19 . 1 1 134 134 ARG HA H 564 4.262 4.262 4.480 -0.218 18053
12703 1 19 . 1 1 134 134 ARG C C 564 176.298 176.298 175.936 0.362 18053
12704 1 19 . 1 1 134 134 ARG CA C 564 56.087 56.087 56.167 -0.080 18053
12705 1 19 . 1 1 134 134 ARG CB C 564 30.702 30.702 29.606 1.096 18053
12706 1 19 . 1 1 134 134 ARG H H 564 8.295 8.295 8.637 -0.342 18053
12707 1 19 . 1 1 135 135 GLU N N 565 121.945 121.945 123.660 -1.715 18053
12708 1 19 . 1 1 135 135 GLU HA H 565 4.160 4.160 4.518 -0.358 18053
12709 1 19 . 1 1 135 135 GLU C C 565 176.080 176.080 176.352 -0.272 18053
12710 1 19 . 1 1 135 135 GLU CA C 565 56.906 56.906 55.569 1.337 18053
12711 1 19 . 1 1 135 135 GLU CB C 565 29.774 29.774 30.955 -1.181 18053
12712 1 19 . 1 1 135 135 GLU H H 565 8.470 8.470 8.511 -0.041 18053
12713 1 19 . 1 1 136 136 ASN N N 566 118.761 118.761 119.192 -0.431 18053
12714 1 19 . 1 1 136 136 ASN HA H 566 4.617 4.617 4.769 -0.152 18053
12715 1 19 . 1 1 136 136 ASN C C 566 175.315 175.315 175.717 -0.402 18053
12716 1 19 . 1 1 136 136 ASN CA C 566 53.193 53.193 52.880 0.313 18053
12717 1 19 . 1 1 136 136 ASN CB C 566 38.836 38.836 38.841 -0.005 18053
12718 1 19 . 1 1 136 136 ASN H H 566 8.341 8.341 8.615 -0.274 18053
12719 1 19 . 1 1 137 137 GLU N N 567 121.349 121.349 120.104 1.245 18053
12720 1 19 . 1 1 137 137 GLU HA H 567 4.152 4.152 4.049 0.103 18053
12721 1 19 . 1 1 137 137 GLU C C 567 176.243 176.243 176.533 -0.290 18053
12722 1 19 . 1 1 137 137 GLU CA C 567 56.906 56.906 58.011 -1.105 18053
12723 1 19 . 1 1 137 137 GLU CB C 567 29.992 29.992 29.791 0.201 18053
12724 1 19 . 1 1 137 137 GLU H H 567 8.349 8.349 8.282 0.067 18053
12725 1 19 . 1 1 138 138 ASN N N 568 118.761 118.761 118.917 -0.156 18053
12726 1 19 . 1 1 138 138 ASN HA H 568 4.712 4.712 4.636 0.076 18053
12727 1 19 . 1 1 138 138 ASN C C 568 174.551 174.551 175.269 -0.718 18053
12728 1 19 . 1 1 138 138 ASN CA C 568 53.193 53.193 53.059 0.134 18053
12729 1 19 . 1 1 138 138 ASN CB C 568 39.327 39.327 38.645 0.682 18053
12730 1 19 . 1 1 138 138 ASN H H 568 8.397 8.397 8.239 0.158 18053
12731 1 20 . 1 1 20 20 ALA N N 450 125.180 125.180 126.332 -1.152 18053
12732 1 20 . 1 1 20 20 ALA HA H 450 4.706 4.706 4.496 0.210 18053
12733 1 20 . 1 1 20 20 ALA C C 450 177.226 177.226 177.051 0.175 18053
12734 1 20 . 1 1 20 20 ALA CA C 450 52.757 52.757 51.873 0.883 18053
12735 1 20 . 1 1 20 20 ALA CB C 450 20.411 20.411 18.463 1.948 18053
12736 1 20 . 1 1 20 20 ALA H H 450 8.484 8.484 8.560 -0.076 18053
12737 1 20 . 1 1 21 21 SER N N 451 115.714 115.714 118.008 -2.294 18053
12738 1 20 . 1 1 21 21 SER HA H 451 4.513 4.513 4.368 0.145 18053
12739 1 20 . 1 1 21 21 SER C C 451 174.742 174.742 175.544 -0.802 18053
12740 1 20 . 1 1 21 21 SER CA C 451 58.516 58.516 57.356 1.160 18053
12741 1 20 . 1 1 21 21 SER CB C 451 64.159 64.159 62.515 1.644 18053
12742 1 20 . 1 1 21 21 SER H H 451 8.487 8.487 7.881 0.606 18053
12743 1 20 . 1 1 22 22 GLY N N 452 111.509 111.509 114.064 -2.555 18053
12744 1 20 . 1 1 22 22 GLY C C 452 174.401 174.401 175.212 -0.811 18053
12745 1 20 . 1 1 22 22 GLY CA C 452 45.059 45.059 45.925 -0.866 18053
12746 1 20 . 1 1 22 22 GLY H H 452 8.198 8.198 8.243 -0.045 18053
12747 1 20 . 1 1 23 23 SER N N 453 116.191 116.191 115.546 0.645 18053
12748 1 20 . 1 1 23 23 SER HA H 453 4.364 4.364 4.278 0.086 18053
12749 1 20 . 1 1 23 23 SER C C 453 173.432 173.432 174.246 -0.814 18053
12750 1 20 . 1 1 23 23 SER CA C 453 59.744 59.744 61.678 -1.934 18053
12751 1 20 . 1 1 23 23 SER CB C 453 64.335 64.335 64.051 0.284 18053
12752 1 20 . 1 1 23 23 SER H H 453 8.494 8.494 8.108 0.386 18053
12753 1 20 . 1 1 24 24 VAL N N 454 121.656 121.656 118.817 2.839 18053
12754 1 20 . 1 1 24 24 VAL HA H 454 5.035 5.035 4.468 0.567 18053
12755 1 20 . 1 1 24 24 VAL C C 454 174.606 174.606 174.552 0.054 18053
12756 1 20 . 1 1 24 24 VAL CA C 454 61.055 61.055 60.943 0.112 18053
12757 1 20 . 1 1 24 24 VAL CB C 454 32.503 32.503 35.345 -2.842 18053
12758 1 20 . 1 1 24 24 VAL H H 454 7.830 7.830 7.916 -0.086 18053
12759 1 20 . 1 1 25 25 SER N N 455 119.323 119.323 118.122 1.201 18053
12760 1 20 . 1 1 25 25 SER HA H 455 4.672 4.672 4.963 -0.291 18053
12761 1 20 . 1 1 25 25 SER C C 455 174.426 174.426 172.800 1.626 18053
12762 1 20 . 1 1 25 25 SER CA C 455 55.268 55.268 56.351 -1.083 18053
12763 1 20 . 1 1 25 25 SER CB C 455 65.162 65.162 66.505 -1.343 18053
12764 1 20 . 1 1 25 25 SER H H 455 9.065 9.065 8.725 0.340 18053
12765 1 20 . 1 1 26 26 ILE N N 456 119.468 119.468 121.910 -2.442 18053
12766 1 20 . 1 1 26 26 ILE HA H 456 4.180 4.180 4.273 -0.093 18053
12767 1 20 . 1 1 26 26 ILE C C 456 175.506 175.506 176.285 -0.779 18053
12768 1 20 . 1 1 26 26 ILE CA C 456 61.328 61.328 61.290 0.038 18053
12769 1 20 . 1 1 26 26 ILE CB C 456 37.962 37.962 38.085 -0.123 18053
12770 1 20 . 1 1 26 26 ILE H H 456 8.295 8.295 8.565 -0.270 18053
12771 1 20 . 1 1 27 27 GLU N N 457 129.726 129.726 129.428 0.298 18053
12772 1 20 . 1 1 27 27 GLU HA H 457 4.228 4.228 4.262 -0.034 18053
12773 1 20 . 1 1 27 27 GLU C C 457 175.179 175.179 176.284 -1.105 18053
12774 1 20 . 1 1 27 27 GLU CA C 457 55.432 55.432 57.993 -2.561 18053
12775 1 20 . 1 1 27 27 GLU CB C 457 30.142 30.142 30.999 -0.857 18053
12776 1 20 . 1 1 27 27 GLU H H 457 8.393 8.393 8.622 -0.229 18053
12777 1 20 . 1 1 28 28 GLU N N 458 117.076 117.076 116.109 0.967 18053
12778 1 20 . 1 1 28 28 GLU HA H 458 4.168 4.168 4.782 -0.614 18053
12779 1 20 . 1 1 28 28 GLU C C 458 174.701 174.701 175.120 -0.419 18053
12780 1 20 . 1 1 28 28 GLU CA C 458 56.906 56.906 54.911 1.995 18053
12781 1 20 . 1 1 28 28 GLU CB C 458 31.848 31.848 34.005 -2.158 18053
12782 1 20 . 1 1 28 28 GLU H H 458 7.489 7.489 7.681 -0.192 18053
12783 1 20 . 1 1 29 29 ILE N N 459 122.183 122.183 120.133 2.050 18053
12784 1 20 . 1 1 29 29 ILE HA H 459 3.764 3.764 4.189 -0.425 18053
12785 1 20 . 1 1 29 29 ILE C C 459 174.169 174.169 174.548 -0.379 18053
12786 1 20 . 1 1 29 29 ILE CA C 459 59.526 59.526 59.569 -0.043 18053
12787 1 20 . 1 1 29 29 ILE CB C 459 40.309 40.309 41.177 -0.868 18053
12788 1 20 . 1 1 29 29 ILE H H 459 8.126 8.126 8.325 -0.199 18053
12789 1 20 . 1 1 30 30 ASP N N 460 123.205 123.205 125.481 -2.276 18053
12790 1 20 . 1 1 30 30 ASP HA H 460 4.183 4.183 4.279 -0.096 18053
12791 1 20 . 1 1 30 30 ASP C C 460 178.318 178.318 177.525 0.793 18053
12792 1 20 . 1 1 30 30 ASP CA C 460 53.930 53.930 53.838 0.092 18053
12793 1 20 . 1 1 30 30 ASP CB C 460 42.807 42.807 42.207 0.600 18053
12794 1 20 . 1 1 30 30 ASP H H 460 6.704 6.704 7.659 -0.955 18053
12795 1 20 . 1 1 31 31 LEU N N 461 128.551 128.551 121.896 6.655 18053
12796 1 20 . 1 1 31 31 LEU HA H 461 4.064 4.064 4.116 -0.052 18053
12797 1 20 . 1 1 31 31 LEU C C 461 177.513 177.513 177.664 -0.151 18053
12798 1 20 . 1 1 31 31 LEU CA C 461 57.124 57.124 57.249 -0.125 18053
12799 1 20 . 1 1 31 31 LEU CB C 461 41.237 41.237 41.874 -0.637 18053
12800 1 20 . 1 1 31 31 LEU H H 461 9.012 9.012 8.254 0.758 18053
12801 1 20 . 1 1 32 32 GLU N N 462 115.101 115.101 117.747 -2.646 18053
12802 1 20 . 1 1 32 32 GLU HA H 462 4.283 4.283 4.281 0.002 18053
12803 1 20 . 1 1 32 32 GLU C C 462 177.062 177.062 177.338 -0.276 18053
12804 1 20 . 1 1 32 32 GLU CA C 462 55.759 55.759 57.441 -1.682 18053
12805 1 20 . 1 1 32 32 GLU CB C 462 29.569 29.569 30.428 -0.859 18053
12806 1 20 . 1 1 32 32 GLU H H 462 7.588 7.588 7.852 -0.264 18053
12807 1 20 . 1 1 33 33 GLY N N 463 106.299 106.299 106.891 -0.592 18053
12808 1 20 . 1 1 33 33 GLY C C 463 174.824 174.824 175.136 -0.312 18053
12809 1 20 . 1 1 33 33 GLY CA C 463 46.806 46.806 45.148 1.658 18053
12810 1 20 . 1 1 33 33 GLY H H 463 7.372 7.372 8.038 -0.666 18053
12811 1 20 . 1 1 34 34 LYS N N 464 118.744 118.744 119.481 -0.737 18053
12812 1 20 . 1 1 34 34 LYS HA H 464 4.562 4.562 4.418 0.144 18053
12813 1 20 . 1 1 34 34 LYS C C 464 177.076 177.076 175.450 1.626 18053
12814 1 20 . 1 1 34 34 LYS CA C 464 59.963 59.963 58.342 1.621 18053
12815 1 20 . 1 1 34 34 LYS CB C 464 33.111 33.111 33.398 -0.287 18053
12816 1 20 . 1 1 34 34 LYS H H 464 9.547 9.547 8.227 1.320 18053
12817 1 20 . 1 1 35 35 PHE N N 465 109.125 109.125 112.031 -2.906 18053
12818 1 20 . 1 1 35 35 PHE HA H 465 5.514 5.514 5.639 -0.125 18053
12819 1 20 . 1 1 35 35 PHE C C 465 174.183 174.183 172.955 1.228 18053
12820 1 20 . 1 1 35 35 PHE CA C 465 56.632 56.632 55.836 0.796 18053
12821 1 20 . 1 1 35 35 PHE CB C 465 40.599 40.599 40.804 -0.205 18053
12822 1 20 . 1 1 35 35 PHE H H 465 6.740 6.740 7.215 -0.475 18053
12823 1 20 . 1 1 36 36 VAL N N 466 119.579 119.579 119.874 -0.295 18053
12824 1 20 . 1 1 36 36 VAL HA H 466 3.709 3.709 4.499 -0.790 18053
12825 1 20 . 1 1 36 36 VAL C C 466 172.668 172.668 174.308 -1.640 18053
12826 1 20 . 1 1 36 36 VAL CA C 466 62.692 62.692 61.326 1.366 18053
12827 1 20 . 1 1 36 36 VAL CB C 466 36.215 36.215 35.511 0.704 18053
12828 1 20 . 1 1 36 36 VAL H H 466 7.628 7.628 9.191 -1.563 18053
12829 1 20 . 1 1 37 37 GLN N N 467 126.831 126.831 126.070 0.761 18053
12830 1 20 . 1 1 37 37 GLN HA H 467 5.449 5.449 4.871 0.578 18053
12831 1 20 . 1 1 37 37 GLN C C 467 174.797 174.797 174.898 -0.101 18053
12832 1 20 . 1 1 37 37 GLN CA C 467 54.121 54.121 54.615 -0.494 18053
12833 1 20 . 1 1 37 37 GLN CB C 467 34.623 34.623 30.609 4.014 18053
12834 1 20 . 1 1 37 37 GLN H H 467 8.392 8.392 8.564 -0.172 18053
12835 1 20 . 1 1 38 38 LEU N N 468 123.018 123.018 125.917 -2.899 18053
12836 1 20 . 1 1 38 38 LEU HA H 468 5.422 5.422 5.275 0.147 18053
12837 1 20 . 1 1 38 38 LEU C C 468 175.588 175.588 175.804 -0.216 18053
12838 1 20 . 1 1 38 38 LEU CA C 468 52.702 52.702 53.438 -0.736 18053
12839 1 20 . 1 1 38 38 LEU CB C 468 45.046 45.046 45.970 -0.924 18053
12840 1 20 . 1 1 38 38 LEU H H 468 9.103 9.103 8.944 0.159 18053
12841 1 20 . 1 1 39 39 LYS N N 469 118.983 118.983 120.234 -1.251 18053
12842 1 20 . 1 1 39 39 LYS HA H 469 4.852 4.852 4.863 -0.011 18053
12843 1 20 . 1 1 39 39 LYS C C 469 173.309 173.309 174.364 -1.055 18053
12844 1 20 . 1 1 39 39 LYS CA C 469 54.994 54.994 54.696 0.298 18053
12845 1 20 . 1 1 39 39 LYS CB C 469 38.246 38.246 36.598 1.648 18053
12846 1 20 . 1 1 39 39 LYS H H 469 8.496 8.496 8.749 -0.253 18053
12847 1 20 . 1 1 40 40 ASN N N 470 121.758 121.758 125.089 -3.331 18053
12848 1 20 . 1 1 40 40 ASN HA H 470 4.788 4.788 4.770 0.018 18053
12849 1 20 . 1 1 40 40 ASN C C 470 174.496 174.496 175.442 -0.946 18053
12850 1 20 . 1 1 40 40 ASN CA C 470 51.119 51.119 52.543 -1.424 18053
12851 1 20 . 1 1 40 40 ASN CB C 470 37.559 37.559 39.313 -1.754 18053
12852 1 20 . 1 1 40 40 ASN H H 470 8.283 8.283 8.460 -0.177 18053
12853 1 20 . 1 1 41 41 ASN N N 471 122.422 122.422 124.357 -1.935 18053
12854 1 20 . 1 1 41 41 ASN HA H 471 4.588 4.588 4.664 -0.076 18053
12855 1 20 . 1 1 41 41 ASN C C 471 174.810 174.810 175.812 -1.002 18053
12856 1 20 . 1 1 41 41 ASN CA C 471 53.985 53.985 53.852 0.133 18053
12857 1 20 . 1 1 41 41 ASN CB C 471 39.600 39.600 38.805 0.795 18053
12858 1 20 . 1 1 41 41 ASN H H 471 8.681 8.681 8.634 0.047 18053
12859 1 20 . 1 1 42 42 SER N N 472 116.446 116.446 116.210 0.236 18053
12860 1 20 . 1 1 42 42 SER HA H 472 4.719 4.719 4.423 0.296 18053
12861 1 20 . 1 1 42 42 SER C C 472 172.804 172.804 174.310 -1.506 18053
12862 1 20 . 1 1 42 42 SER CA C 472 57.288 57.288 59.315 -2.027 18053
12863 1 20 . 1 1 42 42 SER CB C 472 66.241 66.241 63.968 2.273 18053
12864 1 20 . 1 1 42 42 SER H H 472 8.370 8.370 7.817 0.553 18053
12865 1 20 . 1 1 43 43 ASP N N 473 117.706 117.706 122.337 -4.631 18053
12866 1 20 . 1 1 43 43 ASP HA H 473 4.474 4.474 4.651 -0.177 18053
12867 1 20 . 1 1 43 43 ASP C C 473 175.343 175.343 175.052 0.291 18053
12868 1 20 . 1 1 43 43 ASP CA C 473 53.521 53.521 54.895 -1.374 18053
12869 1 20 . 1 1 43 43 ASP CB C 473 40.322 40.322 40.474 -0.152 18053
12870 1 20 . 1 1 43 43 ASP H H 473 8.254 8.254 8.752 -0.498 18053
12871 1 20 . 1 1 44 44 LYS N N 474 120.209 120.209 117.927 2.282 18053
12872 1 20 . 1 1 44 44 LYS HA H 474 4.569 4.569 4.461 0.108 18053
12873 1 20 . 1 1 44 44 LYS C C 474 175.397 175.397 174.040 1.357 18053
12874 1 20 . 1 1 44 44 LYS CA C 474 54.012 54.012 54.579 -0.567 18053
12875 1 20 . 1 1 44 44 LYS CB C 474 35.383 35.383 33.590 1.793 18053
12876 1 20 . 1 1 44 44 LYS H H 474 8.305 8.305 7.324 0.981 18053
12877 1 20 . 1 1 45 45 ASP N N 475 124.993 124.993 120.491 4.502 18053
12878 1 20 . 1 1 45 45 ASP HA H 475 3.975 3.975 4.315 -0.340 18053
12879 1 20 . 1 1 45 45 ASP C C 475 174.810 174.810 175.760 -0.950 18053
12880 1 20 . 1 1 45 45 ASP CA C 475 54.995 54.995 55.854 -0.859 18053
12881 1 20 . 1 1 45 45 ASP CB C 475 40.364 40.364 40.317 0.047 18053
12882 1 20 . 1 1 45 45 ASP H H 475 8.722 8.722 8.534 0.188 18053
12883 1 20 . 1 1 46 46 GLN N N 476 120.549 120.549 126.903 -6.354 18053
12884 1 20 . 1 1 46 46 GLN HA H 476 4.436 4.436 4.497 -0.061 18053
12885 1 20 . 1 1 46 46 GLN C C 476 174.019 174.019 175.206 -1.187 18053
12886 1 20 . 1 1 46 46 GLN CA C 476 53.138 53.138 53.655 -0.517 18053
12887 1 20 . 1 1 46 46 GLN CB C 476 31.466 31.466 29.308 2.158 18053
12888 1 20 . 1 1 46 46 GLN H H 476 7.878 7.878 8.235 -0.357 18053
12889 1 20 . 1 1 47 47 SER N N 477 121.537 121.537 121.891 -0.354 18053
12890 1 20 . 1 1 47 47 SER HA H 477 4.229 4.229 4.174 0.055 18053
12891 1 20 . 1 1 47 47 SER C C 477 174.565 174.565 173.443 1.122 18053
12892 1 20 . 1 1 47 47 SER CA C 477 58.706 58.706 58.963 -0.257 18053
12893 1 20 . 1 1 47 47 SER CB C 477 62.965 62.965 63.240 -0.275 18053
12894 1 20 . 1 1 47 47 SER H H 477 8.748 8.748 8.704 0.044 18053
12895 1 20 . 1 1 48 48 LEU N N 478 127.751 127.751 124.611 3.140 18053
12896 1 20 . 1 1 48 48 LEU HA H 478 2.631 2.631 4.327 -1.696 18053
12897 1 20 . 1 1 48 48 LEU C C 478 176.789 176.789 176.082 0.707 18053
12898 1 20 . 1 1 48 48 LEU CA C 478 52.102 52.102 54.132 -2.030 18053
12899 1 20 . 1 1 48 48 LEU CB C 478 42.343 42.343 43.806 -1.463 18053
12900 1 20 . 1 1 48 48 LEU H H 478 7.856 7.856 7.807 0.049 18053
12901 1 20 . 1 1 49 49 GLY N N 479 107.525 107.525 109.746 -2.221 18053
12902 1 20 . 1 1 49 49 GLY C C 479 176.653 176.653 175.027 1.626 18053
12903 1 20 . 1 1 49 49 GLY CA C 479 48.062 48.062 45.936 2.126 18053
12904 1 20 . 1 1 49 49 GLY H H 479 7.728 7.728 8.731 -1.003 18053
12905 1 20 . 1 1 50 50 ASN N N 480 117.059 117.059 119.558 -2.499 18053
12906 1 20 . 1 1 50 50 ASN HA H 480 4.255 4.255 4.620 -0.365 18053
12907 1 20 . 1 1 50 50 ASN C C 480 174.961 174.961 175.288 -0.327 18053
12908 1 20 . 1 1 50 50 ASN CA C 480 56.360 56.360 54.282 2.078 18053
12909 1 20 . 1 1 50 50 ASN CB C 480 37.416 37.416 38.884 -1.468 18053
12910 1 20 . 1 1 50 50 ASN H H 480 7.552 7.552 8.710 -1.158 18053
12911 1 20 . 1 1 51 51 TRP N N 481 122.166 122.166 120.760 1.406 18053
12912 1 20 . 1 1 51 51 TRP HA H 481 4.477 4.477 4.795 -0.318 18053
12913 1 20 . 1 1 51 51 TRP C C 481 175.575 175.575 175.698 -0.123 18053
12914 1 20 . 1 1 51 51 TRP CA C 481 58.762 58.762 57.393 1.369 18053
12915 1 20 . 1 1 51 51 TRP CB C 481 28.041 28.041 29.713 -1.672 18053
12916 1 20 . 1 1 51 51 TRP H H 481 8.914 8.914 8.126 0.788 18053
12917 1 20 . 1 1 52 52 ARG N N 482 116.480 116.480 119.753 -3.273 18053
12918 1 20 . 1 1 52 52 ARG HA H 482 5.968 5.968 5.352 0.616 18053
12919 1 20 . 1 1 52 52 ARG C C 482 175.807 175.807 175.218 0.589 18053
12920 1 20 . 1 1 52 52 ARG CA C 482 54.121 54.121 54.380 -0.259 18053
12921 1 20 . 1 1 52 52 ARG CB C 482 35.124 35.124 33.716 1.408 18053
12922 1 20 . 1 1 52 52 ARG H H 482 9.147 9.147 8.912 0.235 18053
12923 1 20 . 1 1 53 53 ILE N N 483 119.579 119.579 125.860 -6.281 18053
12924 1 20 . 1 1 53 53 ILE HA H 483 4.985 4.985 4.688 0.297 18053
12925 1 20 . 1 1 53 53 ILE C C 483 175.670 175.670 175.871 -0.201 18053
12926 1 20 . 1 1 53 53 ILE CA C 483 60.400 60.400 61.046 -0.646 18053
12927 1 20 . 1 1 53 53 ILE CB C 483 40.227 40.227 38.551 1.676 18053
12928 1 20 . 1 1 53 53 ILE H H 483 9.000 9.000 8.860 0.140 18053
12929 1 20 . 1 1 54 54 LYS N N 484 124.737 124.737 129.549 -4.812 18053
12930 1 20 . 1 1 54 54 LYS HA H 484 5.463 5.463 4.712 0.751 18053
12931 1 20 . 1 1 54 54 LYS C C 484 175.575 175.575 176.107 -0.532 18053
12932 1 20 . 1 1 54 54 LYS CA C 484 54.613 54.613 56.263 -1.650 18053
12933 1 20 . 1 1 54 54 LYS CB C 484 35.041 35.041 32.288 2.753 18053
12934 1 20 . 1 1 54 54 LYS H H 484 9.678 9.678 8.790 0.888 18053
12935 1 20 . 1 1 55 55 ARG N N 485 124.090 124.090 126.109 -2.019 18053
12936 1 20 . 1 1 55 55 ARG HA H 485 5.525 5.525 4.292 1.233 18053
12937 1 20 . 1 1 55 55 ARG C C 485 174.155 174.155 175.261 -1.106 18053
12938 1 20 . 1 1 55 55 ARG CA C 485 53.903 53.903 54.749 -0.846 18053
12939 1 20 . 1 1 55 55 ARG H H 485 9.314 9.314 8.604 0.710 18053
12940 1 20 . 1 1 56 56 GLN N N 486 126.576 126.576 125.722 0.854 18053
12941 1 20 . 1 1 56 56 GLN HA H 486 4.842 4.842 4.805 0.037 18053
12942 1 20 . 1 1 56 56 GLN C C 486 174.991 174.991 174.504 0.487 18053
12943 1 20 . 1 1 56 56 GLN CA C 486 54.831 54.831 54.175 0.656 18053
12944 1 20 . 1 1 56 56 GLN CB C 486 31.465 31.465 30.093 1.372 18053
12945 1 20 . 1 1 56 56 GLN H H 486 8.831 8.831 8.414 0.417 18053
12946 1 20 . 1 1 57 57 VAL N N 487 126.712 126.712 127.080 -0.368 18053
12947 1 20 . 1 1 57 57 VAL HA H 487 4.266 4.266 4.163 0.103 18053
12948 1 20 . 1 1 57 57 VAL C C 487 175.916 175.916 176.865 -0.949 18053
12949 1 20 . 1 1 57 57 VAL CA C 487 61.820 61.820 62.092 -0.272 18053
12950 1 20 . 1 1 57 57 VAL CB C 487 32.803 32.803 31.963 0.840 18053
12951 1 20 . 1 1 57 57 VAL H H 487 8.786 8.786 8.820 -0.034 18053
12952 1 20 . 1 1 58 58 LEU N N 488 127.274 127.274 125.105 2.169 18053
12953 1 20 . 1 1 58 58 LEU HA H 488 4.085 4.085 4.174 -0.089 18053
12954 1 20 . 1 1 58 58 LEU C C 488 177.158 177.158 177.645 -0.487 18053
12955 1 20 . 1 1 58 58 LEU CA C 488 56.906 56.906 57.395 -0.489 18053
12956 1 20 . 1 1 58 58 LEU CB C 488 41.374 41.374 41.455 -0.081 18053
12957 1 20 . 1 1 58 58 LEU H H 488 8.316 8.316 8.341 -0.025 18053
12958 1 20 . 1 1 59 59 GLU N N 489 119.647 119.647 118.760 0.887 18053
12959 1 20 . 1 1 59 59 GLU HA H 489 4.112 4.112 4.237 -0.125 18053
12960 1 20 . 1 1 59 59 GLU C C 489 176.230 176.230 177.366 -1.136 18053
12961 1 20 . 1 1 59 59 GLU CA C 489 57.015 57.015 56.904 0.111 18053
12962 1 20 . 1 1 59 59 GLU CB C 489 28.149 28.149 29.724 -1.575 18053
12963 1 20 . 1 1 59 59 GLU H H 489 8.636 8.636 8.346 0.290 18053
12964 1 20 . 1 1 60 60 GLY N N 490 108.819 108.819 107.665 1.154 18053
12965 1 20 . 1 1 60 60 GLY C C 490 173.568 173.568 173.524 0.044 18053
12966 1 20 . 1 1 60 60 GLY CA C 490 44.773 44.773 44.647 0.126 18053
12967 1 20 . 1 1 60 60 GLY H H 490 8.160 8.160 7.880 0.280 18053
12968 1 20 . 1 1 61 61 GLU N N 491 121.009 121.009 118.989 2.020 18053
12969 1 20 . 1 1 61 61 GLU HA H 491 4.323 4.323 4.740 -0.417 18053
12970 1 20 . 1 1 61 61 GLU C C 491 175.725 175.725 174.235 1.490 18053
12971 1 20 . 1 1 61 61 GLU CA C 491 56.196 56.196 54.896 1.300 18053
12972 1 20 . 1 1 61 61 GLU CB C 491 30.865 30.865 32.511 -1.646 18053
12973 1 20 . 1 1 61 61 GLU H H 491 8.320 8.320 7.933 0.387 18053
12974 1 20 . 1 1 62 62 GLU N N 492 123.426 123.426 120.695 2.731 18053
12975 1 20 . 1 1 62 62 GLU HA H 492 5.054 5.054 5.281 -0.227 18053
12976 1 20 . 1 1 62 62 GLU C C 492 175.930 175.930 175.641 0.289 18053
12977 1 20 . 1 1 62 62 GLU CA C 492 55.650 55.650 55.056 0.594 18053
12978 1 20 . 1 1 62 62 GLU CB C 492 32.312 32.312 31.618 0.694 18053
12979 1 20 . 1 1 62 62 GLU H H 492 8.594 8.594 8.452 0.142 18053
12980 1 20 . 1 1 63 63 ILE N N 493 119.732 119.732 119.651 0.081 18053
12981 1 20 . 1 1 63 63 ILE HA H 493 4.788 4.788 4.796 -0.008 18053
12982 1 20 . 1 1 63 63 ILE C C 493 174.647 174.647 174.558 0.089 18053
12983 1 20 . 1 1 63 63 ILE CA C 493 60.181 60.181 59.924 0.257 18053
12984 1 20 . 1 1 63 63 ILE CB C 493 41.183 41.183 40.915 0.268 18053
12985 1 20 . 1 1 63 63 ILE H H 493 8.523 8.523 8.101 0.422 18053
12986 1 20 . 1 1 64 64 ALA N N 494 122.166 122.166 126.904 -4.738 18053
12987 1 20 . 1 1 64 64 ALA HA H 494 5.521 5.521 5.099 0.422 18053
12988 1 20 . 1 1 64 64 ALA C C 494 174.606 174.606 176.239 -1.633 18053
12989 1 20 . 1 1 64 64 ALA CA C 494 51.528 51.528 50.503 1.025 18053
12990 1 20 . 1 1 64 64 ALA CB C 494 22.239 22.239 20.369 1.870 18053
12991 1 20 . 1 1 64 64 ALA H H 494 8.741 8.741 8.474 0.267 18053
12992 1 20 . 1 1 65 65 TYR N N 495 126.729 126.729 127.240 -0.511 18053
12993 1 20 . 1 1 65 65 TYR HA H 495 3.094 3.094 3.750 -0.656 18053
12994 1 20 . 1 1 65 65 TYR C C 495 173.036 173.036 173.810 -0.774 18053
12995 1 20 . 1 1 65 65 TYR CA C 495 56.905 56.905 56.087 0.818 18053
12996 1 20 . 1 1 65 65 TYR CB C 495 40.269 40.269 38.781 1.488 18053
12997 1 20 . 1 1 65 65 TYR H H 495 8.462 8.462 8.569 -0.107 18053
12998 1 20 . 1 1 66 66 LYS N N 496 128.108 128.108 127.283 0.825 18053
12999 1 20 . 1 1 66 66 LYS HA H 496 4.822 4.822 4.630 0.192 18053
13000 1 20 . 1 1 66 66 LYS C C 496 174.906 174.906 175.103 -0.197 18053
13001 1 20 . 1 1 66 66 LYS CA C 496 53.739 53.739 54.930 -1.191 18053
13002 1 20 . 1 1 66 66 LYS CB C 496 34.782 34.782 33.018 1.764 18053
13003 1 20 . 1 1 66 66 LYS H H 496 7.010 7.010 7.487 -0.477 18053
13004 1 20 . 1 1 67 67 PHE N N 497 125.299 125.299 124.178 1.121 18053
13005 1 20 . 1 1 67 67 PHE HA H 497 3.932 3.932 3.899 0.033 18053
13006 1 20 . 1 1 67 67 PHE C C 497 177.990 177.990 176.216 1.774 18053
13007 1 20 . 1 1 67 67 PHE CA C 497 59.007 59.007 59.137 -0.130 18053
13008 1 20 . 1 1 67 67 PHE CB C 497 40.981 40.981 39.704 1.277 18053
13009 1 20 . 1 1 67 67 PHE H H 497 8.509 8.509 8.350 0.159 18053
13010 1 20 . 1 1 68 68 THR N N 498 116.191 116.191 113.118 3.073 18053
13011 1 20 . 1 1 68 68 THR HA H 498 4.417 4.417 4.571 -0.154 18053
13012 1 20 . 1 1 68 68 THR CA C 498 60.855 60.855 60.160 0.695 18053
13013 1 20 . 1 1 68 68 THR CB C 498 68.019 68.019 69.073 -1.054 18053
13014 1 20 . 1 1 68 68 THR H H 498 8.688 8.688 8.565 0.123 18053
13015 1 20 . 1 1 69 69 PRO HA H 499 3.948 3.948 4.648 -0.700 18053
13016 1 20 . 1 1 69 69 PRO C C 499 177.444 177.444 177.005 0.439 18053
13017 1 20 . 1 1 69 69 PRO CA C 499 66.077 66.077 64.572 1.505 18053
13018 1 20 . 1 1 69 69 PRO CB C 499 32.776 32.776 31.961 0.815 18053
13019 1 20 . 1 1 70 70 LYS N N 500 113.552 113.552 116.806 -3.254 18053
13020 1 20 . 1 1 70 70 LYS HA H 500 4.385 4.385 4.171 0.214 18053
13021 1 20 . 1 1 70 70 LYS C C 500 176.325 176.325 176.710 -0.385 18053
13022 1 20 . 1 1 70 70 LYS CA C 500 54.995 54.995 56.770 -1.775 18053
13023 1 20 . 1 1 70 70 LYS CB C 500 31.793 31.793 31.755 0.038 18053
13024 1 20 . 1 1 70 70 LYS H H 500 8.016 8.016 7.870 0.146 18053
13025 1 20 . 1 1 71 71 TYR N N 501 121.860 121.860 121.642 0.218 18053
13026 1 20 . 1 1 71 71 TYR HA H 501 3.730 3.730 4.399 -0.669 18053
13027 1 20 . 1 1 71 71 TYR C C 501 174.838 174.838 173.976 0.862 18053
13028 1 20 . 1 1 71 71 TYR CA C 501 62.310 62.310 59.177 3.133 18053
13029 1 20 . 1 1 71 71 TYR CB C 501 38.781 38.781 39.501 -0.720 18053
13030 1 20 . 1 1 71 71 TYR H H 501 7.460 7.460 7.698 -0.238 18053
13031 1 20 . 1 1 72 72 ILE N N 502 129.487 129.487 126.704 2.783 18053
13032 1 20 . 1 1 72 72 ILE HA H 502 3.928 3.928 4.186 -0.258 18053
13033 1 20 . 1 1 72 72 ILE C C 502 172.968 172.968 173.525 -0.557 18053
13034 1 20 . 1 1 72 72 ILE CA C 502 59.308 59.308 59.500 -0.192 18053
13035 1 20 . 1 1 72 72 ILE CB C 502 40.910 40.910 41.247 -0.337 18053
13036 1 20 . 1 1 72 72 ILE H H 502 7.168 7.168 7.810 -0.642 18053
13037 1 20 . 1 1 73 73 LEU N N 503 128.278 128.278 128.826 -0.548 18053
13038 1 20 . 1 1 73 73 LEU HA H 503 4.493 4.493 4.539 -0.046 18053
13039 1 20 . 1 1 73 73 LEU C C 503 175.834 175.834 175.078 0.756 18053
13040 1 20 . 1 1 73 73 LEU CA C 503 51.965 51.965 53.217 -1.252 18053
13041 1 20 . 1 1 73 73 LEU CB C 503 42.548 42.548 43.404 -0.856 18053
13042 1 20 . 1 1 73 73 LEU H H 503 8.483 8.483 8.472 0.011 18053
13043 1 20 . 1 1 74 74 ARG N N 504 129.589 129.589 126.763 2.826 18053
13044 1 20 . 1 1 74 74 ARG HA H 504 3.743 3.743 4.239 -0.496 18053
13045 1 20 . 1 1 74 74 ARG C C 504 175.233 175.233 175.697 -0.464 18053
13046 1 20 . 1 1 74 74 ARG CA C 504 56.851 56.851 54.433 2.418 18053
13047 1 20 . 1 1 74 74 ARG CB C 504 30.292 30.292 30.810 -0.518 18053
13048 1 20 . 1 1 74 74 ARG H H 504 8.673 8.673 8.310 0.363 18053
13049 1 20 . 1 1 75 75 ALA N N 505 123.205 123.205 122.665 0.540 18053
13050 1 20 . 1 1 75 75 ALA HA H 505 3.522 3.522 4.398 -0.876 18053
13051 1 20 . 1 1 75 75 ALA C C 505 178.441 178.441 178.354 0.087 18053
13052 1 20 . 1 1 75 75 ALA CA C 505 53.794 53.794 53.524 0.270 18053
13053 1 20 . 1 1 75 75 ALA CB C 505 18.910 18.910 18.577 0.333 18053
13054 1 20 . 1 1 75 75 ALA H H 505 8.564 8.564 8.149 0.415 18053
13055 1 20 . 1 1 76 76 GLY N N 506 112.241 112.241 113.012 -0.771 18053
13056 1 20 . 1 1 76 76 GLY C C 506 174.278 174.278 175.134 -0.856 18053
13057 1 20 . 1 1 76 76 GLY CA C 506 46.725 46.725 45.541 1.184 18053
13058 1 20 . 1 1 76 76 GLY H H 506 7.381 7.381 8.450 -1.069 18053
13059 1 20 . 1 1 77 77 GLN N N 507 117.382 117.382 119.656 -2.274 18053
13060 1 20 . 1 1 77 77 GLN HA H 507 4.364 4.364 4.427 -0.063 18053
13061 1 20 . 1 1 77 77 GLN C C 507 173.937 173.937 174.961 -1.024 18053
13062 1 20 . 1 1 77 77 GLN CA C 507 54.558 54.558 55.071 -0.513 18053
13063 1 20 . 1 1 77 77 GLN CB C 507 30.073 30.073 30.060 0.013 18053
13064 1 20 . 1 1 77 77 GLN H H 507 7.996 7.996 7.706 0.290 18053
13065 1 20 . 1 1 78 78 MET N N 508 116.957 116.957 120.312 -3.355 18053
13066 1 20 . 1 1 78 78 MET HA H 508 5.388 5.388 5.028 0.360 18053
13067 1 20 . 1 1 78 78 MET C C 508 175.807 175.807 175.106 0.701 18053
13068 1 20 . 1 1 78 78 MET CA C 508 54.067 54.067 54.648 -0.581 18053
13069 1 20 . 1 1 78 78 MET CB C 508 37.198 37.198 36.214 0.984 18053
13070 1 20 . 1 1 78 78 MET H H 508 8.092 8.092 8.399 -0.307 18053
13071 1 20 . 1 1 79 79 VAL N N 509 119.340 119.340 122.478 -3.138 18053
13072 1 20 . 1 1 79 79 VAL HA H 509 4.956 4.956 4.537 0.419 18053
13073 1 20 . 1 1 79 79 VAL C C 509 172.217 172.217 174.470 -2.253 18053
13074 1 20 . 1 1 79 79 VAL CA C 509 59.471 59.471 60.288 -0.817 18053
13075 1 20 . 1 1 79 79 VAL CB C 509 33.676 33.676 35.190 -1.514 18053
13076 1 20 . 1 1 79 79 VAL H H 509 8.534 8.534 8.427 0.107 18053
13077 1 20 . 1 1 80 80 THR N N 510 124.533 124.533 126.285 -1.752 18053
13078 1 20 . 1 1 80 80 THR HA H 510 4.586 4.586 4.910 -0.324 18053
13079 1 20 . 1 1 80 80 THR C C 510 172.215 172.215 174.289 -2.074 18053
13080 1 20 . 1 1 80 80 THR CA C 510 62.119 62.119 61.658 0.461 18053
13081 1 20 . 1 1 80 80 THR CB C 510 69.407 69.407 68.938 0.469 18053
13082 1 20 . 1 1 80 80 THR H H 510 8.301 8.301 8.725 -0.424 18053
13083 1 20 . 1 1 81 81 VAL N N 511 127.002 127.002 128.693 -1.691 18053
13084 1 20 . 1 1 81 81 VAL HA H 511 4.596 4.596 4.740 -0.144 18053
13085 1 20 . 1 1 81 81 VAL C C 511 176.667 176.667 175.549 1.118 18053
13086 1 20 . 1 1 81 81 VAL CA C 511 61.382 61.382 62.512 -1.130 18053
13087 1 20 . 1 1 81 81 VAL CB C 511 30.945 30.945 30.968 -0.023 18053
13088 1 20 . 1 1 81 81 VAL H H 511 8.796 8.796 9.047 -0.251 18053
13089 1 20 . 1 1 82 82 TRP N N 512 131.479 131.479 129.492 1.987 18053
13090 1 20 . 1 1 82 82 TRP HA H 512 5.338 5.338 5.330 0.008 18053
13091 1 20 . 1 1 82 82 TRP C C 512 176.885 176.885 175.055 1.830 18053
13092 1 20 . 1 1 82 82 TRP CA C 512 56.442 56.442 56.726 -0.284 18053
13093 1 20 . 1 1 82 82 TRP CB C 512 30.701 30.701 31.591 -0.890 18053
13094 1 20 . 1 1 82 82 TRP H H 512 9.924 9.924 9.090 0.834 18053
13095 1 20 . 1 1 83 83 ALA N N 513 123.954 123.954 120.283 3.671 18053
13096 1 20 . 1 1 83 83 ALA HA H 513 4.308 4.308 4.523 -0.215 18053
13097 1 20 . 1 1 83 83 ALA C C 513 178.140 178.140 178.166 -0.026 18053
13098 1 20 . 1 1 83 83 ALA CA C 513 52.211 52.211 50.114 2.097 18053
13099 1 20 . 1 1 83 83 ALA CB C 513 18.745 18.745 20.407 -1.662 18053
13100 1 20 . 1 1 83 83 ALA H H 513 9.048 9.048 8.590 0.458 18053
13101 1 20 . 1 1 84 84 ALA N N 514 125.146 125.146 125.569 -0.423 18053
13102 1 20 . 1 1 84 84 ALA HA H 514 3.951 3.951 4.143 -0.192 18053
13103 1 20 . 1 1 84 84 ALA C C 514 179.519 179.519 179.399 0.120 18053
13104 1 20 . 1 1 84 84 ALA CA C 514 54.804 54.804 54.657 0.146 18053
13105 1 20 . 1 1 84 84 ALA CB C 514 18.582 18.582 19.086 -0.504 18053
13106 1 20 . 1 1 84 84 ALA H H 514 8.341 8.341 8.322 0.019 18053
13107 1 20 . 1 1 85 85 GLY N N 515 103.388 103.388 105.971 -2.583 18053
13108 1 20 . 1 1 85 85 GLY C C 515 174.674 174.674 174.918 -0.244 18053
13109 1 20 . 1 1 85 85 GLY CA C 515 45.878 45.878 45.672 0.206 18053
13110 1 20 . 1 1 85 85 GLY H H 515 7.996 7.996 7.928 0.069 18053
13111 1 20 . 1 1 86 86 ALA N N 516 120.140 120.140 123.394 -3.254 18053
13112 1 20 . 1 1 86 86 ALA HA H 516 4.344 4.344 4.489 -0.145 18053
13113 1 20 . 1 1 86 86 ALA C C 516 177.690 177.690 177.770 -0.080 18053
13114 1 20 . 1 1 86 86 ALA CA C 516 53.139 53.139 51.955 1.185 18053
13115 1 20 . 1 1 86 86 ALA CB C 516 20.547 20.547 19.486 1.061 18053
13116 1 20 . 1 1 86 86 ALA H H 516 7.474 7.474 7.371 0.103 18053
13117 1 20 . 1 1 87 87 GLY N N 517 105.720 105.720 106.947 -1.227 18053
13118 1 20 . 1 1 87 87 GLY C C 517 173.650 173.650 174.163 -0.513 18053
13119 1 20 . 1 1 87 87 GLY CA C 517 46.014 46.014 45.247 0.767 18053
13120 1 20 . 1 1 87 87 GLY H H 517 7.779 7.779 7.704 0.075 18053
13121 1 20 . 1 1 88 88 VAL N N 518 121.537 121.537 118.574 2.963 18053
13122 1 20 . 1 1 88 88 VAL HA H 518 3.585 3.585 4.215 -0.630 18053
13123 1 20 . 1 1 88 88 VAL C C 518 174.851 174.851 174.208 0.643 18053
13124 1 20 . 1 1 88 88 VAL CA C 518 61.274 61.274 60.590 0.684 18053
13125 1 20 . 1 1 88 88 VAL CB C 518 33.376 33.376 33.675 -0.299 18053
13126 1 20 . 1 1 88 88 VAL H H 518 7.499 7.499 7.570 -0.071 18053
13127 1 20 . 1 1 89 89 ALA N N 519 128.295 128.295 129.217 -0.922 18053
13128 1 20 . 1 1 89 89 ALA HA H 519 4.192 4.192 4.427 -0.235 18053
13129 1 20 . 1 1 89 89 ALA C C 519 176.680 176.680 176.682 -0.002 18053
13130 1 20 . 1 1 89 89 ALA CA C 519 51.283 51.283 51.018 0.265 18053
13131 1 20 . 1 1 89 89 ALA CB C 519 19.292 19.292 19.517 -0.225 18053
13132 1 20 . 1 1 89 89 ALA H H 519 7.960 7.960 8.207 -0.247 18053
13133 1 20 . 1 1 90 90 HIS N N 520 122.643 122.643 123.299 -0.656 18053
13134 1 20 . 1 1 90 90 HIS HA H 520 4.033 4.033 4.361 -0.328 18053
13135 1 20 . 1 1 90 90 HIS C C 520 175.793 175.793 174.276 1.517 18053
13136 1 20 . 1 1 90 90 HIS CA C 520 58.653 58.653 56.415 2.238 18053
13137 1 20 . 1 1 90 90 HIS CB C 520 32.285 32.285 29.608 2.677 18053
13138 1 20 . 1 1 90 90 HIS H H 520 8.394 8.394 8.813 -0.419 18053
13139 1 20 . 1 1 91 91 SER N N 521 121.247 121.247 123.711 -2.464 18053
13140 1 20 . 1 1 91 91 SER HA H 521 4.629 4.629 4.694 -0.065 18053
13141 1 20 . 1 1 91 91 SER CA C 521 55.843 55.843 55.764 0.079 18053
13142 1 20 . 1 1 91 91 SER CB C 521 62.367 62.367 63.451 -1.084 18053
13143 1 20 . 1 1 91 91 SER H H 521 8.569 8.569 8.236 0.333 18053
13144 1 20 . 1 1 92 92 PRO HA H 522 4.002 4.002 4.819 -0.817 18053
13145 1 20 . 1 1 92 92 PRO CA C 522 62.244 62.244 62.281 -0.037 18053
13146 1 20 . 1 1 92 92 PRO CB C 522 30.931 30.931 31.503 -0.573 18053
13147 1 20 . 1 1 93 93 PRO HA H 523 4.672 4.672 4.774 -0.102 18053
13148 1 20 . 1 1 93 93 PRO C C 523 177.786 177.786 178.348 -0.562 18053
13149 1 20 . 1 1 93 93 PRO CA C 523 64.003 64.003 64.270 -0.267 18053
13150 1 20 . 1 1 93 93 PRO CB C 523 34.905 34.905 32.169 2.736 18053
13151 1 20 . 1 1 94 94 SER N N 524 117.212 117.212 116.746 0.466 18053
13152 1 20 . 1 1 94 94 SER HA H 524 4.678 4.678 4.460 0.218 18053
13153 1 20 . 1 1 94 94 SER C C 524 174.851 174.851 174.545 0.306 18053
13154 1 20 . 1 1 94 94 SER CA C 524 61.874 61.874 61.478 0.396 18053
13155 1 20 . 1 1 94 94 SER CB C 524 64.057 64.057 63.602 0.455 18053
13156 1 20 . 1 1 94 94 SER H H 524 8.463 8.463 8.486 -0.023 18053
13157 1 20 . 1 1 95 95 THR N N 525 121.588 121.588 118.237 3.351 18053
13158 1 20 . 1 1 95 95 THR HA H 525 4.859 4.859 5.068 -0.209 18053
13159 1 20 . 1 1 95 95 THR C C 525 172.094 172.094 172.794 -0.700 18053
13160 1 20 . 1 1 95 95 THR CA C 525 62.309 62.309 61.729 0.580 18053
13161 1 20 . 1 1 95 95 THR CB C 525 70.281 70.281 70.237 0.044 18053
13162 1 20 . 1 1 95 95 THR H H 525 7.631 7.631 7.870 -0.239 18053
13163 1 20 . 1 1 96 96 LEU N N 526 127.274 127.274 129.320 -2.046 18053
13164 1 20 . 1 1 96 96 LEU HA H 526 5.131 5.131 4.972 0.159 18053
13165 1 20 . 1 1 96 96 LEU C C 526 175.916 175.916 175.431 0.485 18053
13166 1 20 . 1 1 96 96 LEU CA C 526 52.075 52.075 54.113 -2.038 18053
13167 1 20 . 1 1 96 96 LEU CB C 526 43.790 43.790 43.645 0.145 18053
13168 1 20 . 1 1 96 96 LEU H H 526 8.977 8.977 8.279 0.698 18053
13169 1 20 . 1 1 97 97 VAL N N 527 124.056 124.056 121.917 2.139 18053
13170 1 20 . 1 1 97 97 VAL HA H 527 4.869 4.869 4.486 0.383 18053
13171 1 20 . 1 1 97 97 VAL C C 527 176.230 176.230 175.313 0.917 18053
13172 1 20 . 1 1 97 97 VAL CA C 527 61.519 61.519 61.155 0.364 18053
13173 1 20 . 1 1 97 97 VAL CB C 527 33.704 33.704 33.724 -0.020 18053
13174 1 20 . 1 1 97 97 VAL H H 527 10.724 10.724 8.270 2.454 18053
13175 1 20 . 1 1 98 98 TRP N N 528 132.586 132.586 130.588 1.998 18053
13176 1 20 . 1 1 98 98 TRP HA H 528 4.965 4.965 4.203 0.762 18053
13177 1 20 . 1 1 98 98 TRP C C 528 173.391 173.391 174.464 -1.073 18053
13178 1 20 . 1 1 98 98 TRP CA C 528 53.303 53.303 55.394 -2.091 18053
13179 1 20 . 1 1 98 98 TRP CB C 528 28.245 28.245 28.679 -0.434 18053
13180 1 20 . 1 1 98 98 TRP H H 528 9.400 9.400 8.432 0.968 18053
13181 1 20 . 1 1 99 99 LYS N N 529 126.644 126.644 128.736 -2.092 18053
13182 1 20 . 1 1 99 99 LYS HA H 529 3.839 3.839 4.106 -0.267 18053
13183 1 20 . 1 1 99 99 LYS C C 529 177.581 177.581 177.361 0.220 18053
13184 1 20 . 1 1 99 99 LYS CA C 529 58.543 58.543 57.641 0.902 18053
13185 1 20 . 1 1 99 99 LYS CB C 529 32.176 32.176 32.895 -0.719 18053
13186 1 20 . 1 1 99 99 LYS H H 529 8.153 8.153 8.105 0.048 18053
13187 1 20 . 1 1 100 100 GLY N N 530 110.385 110.385 112.241 -1.856 18053
13188 1 20 . 1 1 100 100 GLY C C 530 172.367 172.367 173.835 -1.468 18053
13189 1 20 . 1 1 100 100 GLY CA C 530 45.278 45.278 45.023 0.256 18053
13190 1 20 . 1 1 100 100 GLY H H 530 8.363 8.363 8.548 -0.185 18053
13191 1 20 . 1 1 101 101 GLN N N 531 121.162 121.162 121.616 -0.454 18053
13192 1 20 . 1 1 101 101 GLN HA H 531 3.972 3.972 4.018 -0.046 18053
13193 1 20 . 1 1 101 101 GLN CA C 531 52.620 52.620 54.652 -2.032 18053
13194 1 20 . 1 1 101 101 GLN CB C 531 27.595 27.595 28.160 -0.565 18053
13195 1 20 . 1 1 101 101 GLN H H 531 6.815 6.815 7.283 -0.468 18053
13196 1 20 . 1 1 102 102 SER N N 532 122.728 122.728 122.853 -0.125 18053
13197 1 20 . 1 1 102 102 SER HA H 532 3.866 3.866 4.437 -0.571 18053
13198 1 20 . 1 1 102 102 SER C C 532 174.537 174.537 175.803 -1.266 18053
13199 1 20 . 1 1 102 102 SER CA C 532 61.983 61.983 60.536 1.447 18053
13200 1 20 . 1 1 102 102 SER CB C 532 62.802 62.802 63.594 -0.792 18053
13201 1 20 . 1 1 102 102 SER H H 532 8.662 8.662 8.695 -0.033 18053
13202 1 20 . 1 1 103 103 SER N N 533 110.811 110.811 115.858 -5.047 18053
13203 1 20 . 1 1 103 103 SER HA H 533 4.240 4.240 4.255 -0.015 18053
13204 1 20 . 1 1 103 103 SER C C 533 174.087 174.087 174.485 -0.398 18053
13205 1 20 . 1 1 103 103 SER CA C 533 56.633 56.633 58.779 -2.146 18053
13206 1 20 . 1 1 103 103 SER CB C 533 64.658 64.658 63.099 1.559 18053
13207 1 20 . 1 1 103 103 SER H H 533 7.134 7.134 8.013 -0.879 18053
13208 1 20 . 1 1 104 104 TRP N N 534 126.133 126.133 121.953 4.180 18053
13209 1 20 . 1 1 104 104 TRP HA H 534 4.098 4.098 4.101 -0.003 18053
13210 1 20 . 1 1 104 104 TRP C C 534 176.066 176.066 175.539 0.527 18053
13211 1 20 . 1 1 104 104 TRP CA C 534 60.127 60.127 56.982 3.145 18053
13212 1 20 . 1 1 104 104 TRP CB C 534 28.764 28.764 29.053 -0.289 18053
13213 1 20 . 1 1 104 104 TRP H H 534 9.764 9.764 7.748 2.016 18053
13214 1 20 . 1 1 105 105 GLY N N 535 105.907 105.907 104.826 1.081 18053
13215 1 20 . 1 1 105 105 GLY C C 535 172.217 172.217 173.709 -1.492 18053
13216 1 20 . 1 1 105 105 GLY CA C 535 44.240 44.240 44.816 -0.576 18053
13217 1 20 . 1 1 105 105 GLY H H 535 8.095 8.095 7.652 0.443 18053
13218 1 20 . 1 1 106 106 THR N N 536 111.253 111.253 113.684 -2.431 18053
13219 1 20 . 1 1 106 106 THR HA H 536 3.859 3.859 3.932 -0.073 18053
13220 1 20 . 1 1 106 106 THR C C 536 172.872 172.872 173.502 -0.630 18053
13221 1 20 . 1 1 106 106 THR CA C 536 59.635 59.635 61.977 -2.342 18053
13222 1 20 . 1 1 106 106 THR CB C 536 70.526 70.526 69.612 0.914 18053
13223 1 20 . 1 1 106 106 THR H H 536 7.913 7.913 7.908 0.005 18053
13224 1 20 . 1 1 107 107 GLY N N 537 107.712 107.712 113.856 -6.144 18053
13225 1 20 . 1 1 107 107 GLY C C 537 172.709 172.709 173.115 -0.406 18053
13226 1 20 . 1 1 107 107 GLY CA C 537 45.166 45.166 44.894 0.272 18053
13227 1 20 . 1 1 107 107 GLY H H 537 7.533 7.533 7.954 -0.421 18053
13228 1 20 . 1 1 108 108 GLU N N 538 118.864 118.864 119.588 -0.724 18053
13229 1 20 . 1 1 108 108 GLU HA H 538 4.136 4.136 4.281 -0.145 18053
13230 1 20 . 1 1 108 108 GLU C C 538 176.353 176.353 176.124 0.229 18053
13231 1 20 . 1 1 108 108 GLU CA C 538 58.352 58.352 58.469 -0.117 18053
13232 1 20 . 1 1 108 108 GLU CB C 538 30.156 30.156 30.918 -0.762 18053
13233 1 20 . 1 1 108 108 GLU H H 538 8.558 8.558 8.637 -0.079 18053
13234 1 20 . 1 1 109 109 SER N N 539 110.419 110.419 113.638 -3.219 18053
13235 1 20 . 1 1 109 109 SER HA H 539 4.963 4.963 4.764 0.199 18053
13236 1 20 . 1 1 109 109 SER C C 539 173.787 173.787 172.992 0.795 18053
13237 1 20 . 1 1 109 109 SER CA C 539 57.125 57.125 57.717 -0.592 18053
13238 1 20 . 1 1 109 109 SER CB C 539 64.439 64.439 65.040 -0.601 18053
13239 1 20 . 1 1 109 109 SER H H 539 7.620 7.620 7.713 -0.093 18053
13240 1 20 . 1 1 110 110 PHE N N 540 118.778 118.778 120.643 -1.865 18053
13241 1 20 . 1 1 110 110 PHE HA H 540 5.081 5.081 5.283 -0.202 18053
13242 1 20 . 1 1 110 110 PHE C C 540 176.052 176.052 172.951 3.101 18053
13243 1 20 . 1 1 110 110 PHE CA C 540 56.789 56.789 55.772 1.017 18053
13244 1 20 . 1 1 110 110 PHE CB C 540 40.760 40.760 42.282 -1.522 18053
13245 1 20 . 1 1 110 110 PHE H H 540 8.318 8.318 8.580 -0.262 18053
13246 1 20 . 1 1 112 112 THR HA H 542 5.468 5.468 4.771 0.697 18053
13247 1 20 . 1 1 112 112 THR C C 542 172.381 172.381 173.507 -1.126 18053
13248 1 20 . 1 1 112 112 THR CA C 542 61.818 61.818 63.016 -1.198 18053
13249 1 20 . 1 1 112 112 THR CB C 542 70.990 70.990 69.754 1.236 18053
13250 1 20 . 1 1 113 113 VAL N N 543 124.771 124.771 127.942 -3.171 18053
13251 1 20 . 1 1 113 113 VAL HA H 543 4.864 4.864 4.536 0.328 18053
13252 1 20 . 1 1 113 113 VAL C C 543 173.132 173.132 173.888 -0.756 18053
13253 1 20 . 1 1 113 113 VAL CA C 543 60.099 60.099 61.033 -0.934 18053
13254 1 20 . 1 1 113 113 VAL CB C 543 36.433 36.433 34.385 2.048 18053
13255 1 20 . 1 1 113 113 VAL H H 543 9.380 9.380 8.989 0.391 18053
13256 1 20 . 1 1 114 114 LEU N N 544 128.789 128.789 130.697 -1.908 18053
13257 1 20 . 1 1 114 114 LEU HA H 544 5.320 5.320 4.738 0.582 18053
13258 1 20 . 1 1 114 114 LEU C C 544 174.237 174.237 175.025 -0.788 18053
13259 1 20 . 1 1 114 114 LEU CA C 544 53.193 53.193 54.138 -0.945 18053
13260 1 20 . 1 1 114 114 LEU CB C 544 45.879 45.879 42.751 3.128 18053
13261 1 20 . 1 1 114 114 LEU H H 544 8.948 8.948 8.265 0.683 18053
13262 1 20 . 1 1 115 115 VAL N N 545 127.002 127.002 127.195 -0.193 18053
13263 1 20 . 1 1 115 115 VAL HA H 545 4.854 4.854 4.494 0.360 18053
13264 1 20 . 1 1 115 115 VAL C C 545 175.206 175.206 175.708 -0.502 18053
13265 1 20 . 1 1 115 115 VAL CA C 545 59.334 59.334 60.380 -1.046 18053
13266 1 20 . 1 1 115 115 VAL CB C 545 34.495 34.495 32.882 1.613 18053
13267 1 20 . 1 1 115 115 VAL H H 545 9.564 9.564 8.736 0.828 18053
13268 1 20 . 1 1 116 116 ASN N N 546 121.179 121.179 122.713 -1.534 18053
13269 1 20 . 1 1 116 116 ASN HA H 546 2.897 2.897 3.980 -1.083 18053
13270 1 20 . 1 1 116 116 ASN C C 546 176.885 176.885 175.612 1.273 18053
13271 1 20 . 1 1 116 116 ASN CA C 546 50.409 50.409 51.426 -1.017 18053
13272 1 20 . 1 1 116 116 ASN CB C 546 36.639 36.639 39.437 -2.798 18053
13273 1 20 . 1 1 116 116 ASN H H 546 8.016 8.016 7.932 0.084 18053
13274 1 20 . 1 1 117 117 ALA N N 547 119.834 119.834 121.700 -1.866 18053
13275 1 20 . 1 1 117 117 ALA HA H 547 3.866 3.866 4.059 -0.193 18053
13276 1 20 . 1 1 117 117 ALA C C 547 177.772 177.772 177.999 -0.227 18053
13277 1 20 . 1 1 117 117 ALA CA C 547 54.504 54.504 54.500 0.004 18053
13278 1 20 . 1 1 117 117 ALA CB C 547 18.200 18.200 18.418 -0.218 18053
13279 1 20 . 1 1 117 117 ALA H H 547 6.444 6.444 8.000 -1.556 18053
13280 1 20 . 1 1 118 118 ASP N N 548 115.646 115.646 116.956 -1.310 18053
13281 1 20 . 1 1 118 118 ASP HA H 548 4.644 4.644 4.345 0.299 18053
13282 1 20 . 1 1 118 118 ASP C C 548 176.052 176.052 177.534 -1.482 18053
13283 1 20 . 1 1 118 118 ASP CA C 548 54.067 54.067 55.668 -1.601 18053
13284 1 20 . 1 1 118 118 ASP CB C 548 41.674 41.674 41.325 0.349 18053
13285 1 20 . 1 1 118 118 ASP H H 548 7.181 7.181 7.935 -0.754 18053
13286 1 20 . 1 1 119 119 GLY N N 549 107.167 107.167 106.178 0.989 18053
13287 1 20 . 1 1 119 119 GLY C C 549 173.841 173.841 173.819 0.022 18053
13288 1 20 . 1 1 119 119 GLY CA C 549 45.455 45.455 44.672 0.783 18053
13289 1 20 . 1 1 119 119 GLY H H 549 7.738 7.738 7.693 0.045 18053
13290 1 20 . 1 1 120 120 GLU N N 550 121.196 121.196 121.038 0.158 18053
13291 1 20 . 1 1 120 120 GLU HA H 550 4.112 4.112 4.292 -0.180 18053
13292 1 20 . 1 1 120 120 GLU C C 550 175.588 175.588 175.840 -0.252 18053
13293 1 20 . 1 1 120 120 GLU CA C 550 54.831 54.831 55.805 -0.974 18053
13294 1 20 . 1 1 120 120 GLU CB C 550 29.937 29.937 30.380 -0.443 18053
13295 1 20 . 1 1 120 120 GLU H H 550 7.587 7.587 7.715 -0.128 18053
13296 1 20 . 1 1 121 121 GLU N N 551 123.886 123.886 123.179 0.707 18053
13297 1 20 . 1 1 121 121 GLU HA H 551 4.276 4.276 4.239 0.037 18053
13298 1 20 . 1 1 121 121 GLU C C 551 176.817 176.817 176.679 0.138 18053
13299 1 20 . 1 1 121 121 GLU CA C 551 56.796 56.796 56.554 0.242 18053
13300 1 20 . 1 1 121 121 GLU CB C 551 28.955 28.955 29.078 -0.123 18053
13301 1 20 . 1 1 121 121 GLU H H 551 8.697 8.697 8.685 0.012 18053
13302 1 20 . 1 1 122 122 VAL N N 552 120.055 120.055 117.935 2.120 18053
13303 1 20 . 1 1 122 122 VAL HA H 552 4.364 4.364 4.094 0.270 18053
13304 1 20 . 1 1 122 122 VAL C C 552 175.998 175.998 175.052 0.946 18053
13305 1 20 . 1 1 122 122 VAL CA C 552 61.655 61.655 62.637 -0.982 18053
13306 1 20 . 1 1 122 122 VAL CB C 552 33.049 33.049 32.358 0.691 18053
13307 1 20 . 1 1 122 122 VAL H H 552 8.845 8.845 8.011 0.834 18053
13308 1 20 . 1 1 123 123 ALA N N 553 122.098 122.098 120.591 1.507 18053
13309 1 20 . 1 1 123 123 ALA HA H 553 4.890 4.890 4.661 0.229 18053
13310 1 20 . 1 1 123 123 ALA C C 553 175.261 175.261 174.798 0.463 18053
13311 1 20 . 1 1 123 123 ALA CA C 553 52.757 52.757 51.672 1.085 18053
13312 1 20 . 1 1 123 123 ALA CB C 553 22.267 22.267 21.900 0.367 18053
13313 1 20 . 1 1 123 123 ALA H H 553 7.788 7.788 7.648 0.140 18053
13314 1 20 . 1 1 124 124 MET N N 554 118.217 118.217 122.558 -4.341 18053
13315 1 20 . 1 1 124 124 MET HA H 554 5.286 5.286 4.891 0.395 18053
13316 1 20 . 1 1 124 124 MET C C 554 174.428 174.428 174.318 0.110 18053
13317 1 20 . 1 1 124 124 MET CA C 554 55.104 55.104 55.686 -0.582 18053
13318 1 20 . 1 1 124 124 MET CB C 554 35.342 35.342 35.611 -0.269 18053
13319 1 20 . 1 1 124 124 MET H H 554 8.693 8.693 8.406 0.287 18053
13320 1 20 . 1 1 125 125 ARG N N 555 122.132 122.132 128.475 -6.343 18053
13321 1 20 . 1 1 125 125 ARG HA H 555 4.900 4.900 4.771 0.129 18053
13322 1 20 . 1 1 125 125 ARG CA C 555 56.388 56.388 54.918 1.470 18053
13323 1 20 . 1 1 125 125 ARG CB C 555 34.378 34.378 32.075 2.303 18053
13324 1 20 . 1 1 125 125 ARG H H 555 8.919 8.919 9.145 -0.226 18053
13325 1 20 . 1 1 126 126 THR HA H 556 4.685 4.685 4.280 0.405 18053
13326 1 20 . 1 1 126 126 THR C C 556 172.436 172.436 173.678 -1.242 18053
13327 1 20 . 1 1 126 126 THR CA C 556 61.382 61.382 63.136 -1.754 18053
13328 1 20 . 1 1 126 126 THR CB C 556 70.444 70.444 69.615 0.829 18053
13329 1 20 . 1 1 127 127 VAL N N 557 124.976 124.976 126.362 -1.386 18053
13330 1 20 . 1 1 127 127 VAL HA H 557 4.146 4.146 4.220 -0.074 18053
13331 1 20 . 1 1 127 127 VAL C C 557 173.937 173.937 173.206 0.731 18053
13332 1 20 . 1 1 127 127 VAL CA C 557 61.109 61.109 60.588 0.521 18053
13333 1 20 . 1 1 127 127 VAL CB C 557 33.759 33.759 34.278 -0.519 18053
13334 1 20 . 1 1 127 127 VAL H H 557 8.127 8.127 8.777 -0.650 18053
13335 1 20 . 1 1 128 128 LYS N N 558 125.384 125.384 129.395 -4.011 18053
13336 1 20 . 1 1 128 128 LYS HA H 558 4.706 4.706 4.234 0.472 18053
13337 1 20 . 1 1 128 128 LYS C C 558 175.534 175.534 175.647 -0.113 18053
13338 1 20 . 1 1 128 128 LYS CA C 558 54.886 54.886 54.757 0.129 18053
13339 1 20 . 1 1 128 128 LYS CB C 558 34.673 34.673 32.307 2.366 18053
13340 1 20 . 1 1 128 128 LYS H H 558 8.289 8.289 8.299 -0.010 18053
13341 1 20 . 1 1 129 129 LYS N N 559 124.005 124.005 126.889 -2.884 18053
13342 1 20 . 1 1 129 129 LYS HA H 559 4.310 4.310 4.063 0.247 18053
13343 1 20 . 1 1 129 129 LYS C C 559 176.571 176.571 176.394 0.177 18053
13344 1 20 . 1 1 129 129 LYS CA C 559 56.742 56.742 57.277 -0.535 18053
13345 1 20 . 1 1 129 129 LYS CB C 559 33.362 33.362 32.145 1.217 18053
13346 1 20 . 1 1 129 129 LYS H H 559 8.461 8.461 8.105 0.356 18053
13347 1 20 . 1 1 130 130 SER N N 560 117.195 117.195 120.387 -3.192 18053
13348 1 20 . 1 1 130 130 SER HA H 560 4.384 4.384 4.503 -0.119 18053
13349 1 20 . 1 1 130 130 SER C C 560 174.565 174.565 174.995 -0.430 18053
13350 1 20 . 1 1 130 130 SER CA C 560 58.434 58.434 58.734 -0.300 18053
13351 1 20 . 1 1 130 130 SER CB C 560 63.812 63.812 63.561 0.251 18053
13352 1 20 . 1 1 130 130 SER H H 560 8.465 8.465 8.352 0.113 18053
13353 1 20 . 1 1 131 131 SER N N 561 118.149 118.149 116.089 2.060 18053
13354 1 20 . 1 1 131 131 SER HA H 561 4.412 4.412 4.641 -0.229 18053
13355 1 20 . 1 1 131 131 SER C C 561 174.456 174.456 173.210 1.246 18053
13356 1 20 . 1 1 131 131 SER CA C 561 58.489 58.489 56.694 1.795 18053
13357 1 20 . 1 1 131 131 SER CB C 561 63.811 63.811 64.591 -0.780 18053
13358 1 20 . 1 1 131 131 SER H H 561 8.336 8.336 7.376 0.960 18053
13359 1 20 . 1 1 132 132 VAL N N 562 121.332 121.332 119.236 2.096 18053
13360 1 20 . 1 1 132 132 VAL HA H 562 4.035 4.035 4.342 -0.307 18053
13361 1 20 . 1 1 132 132 VAL C C 562 176.066 176.066 175.851 0.215 18053
13362 1 20 . 1 1 132 132 VAL CA C 562 62.446 62.446 61.134 1.312 18053
13363 1 20 . 1 1 132 132 VAL CB C 562 32.394 32.394 32.052 0.342 18053
13364 1 20 . 1 1 132 132 VAL H H 562 7.982 7.982 8.634 -0.652 18053
13365 1 20 . 1 1 133 133 MET N N 563 124.022 124.022 117.025 6.997 18053
13366 1 20 . 1 1 133 133 MET HA H 563 4.385 4.385 4.006 0.379 18053
13367 1 20 . 1 1 133 133 MET C C 563 176.039 176.039 175.147 0.892 18053
13368 1 20 . 1 1 133 133 MET CA C 563 55.350 55.350 57.080 -1.730 18053
13369 1 20 . 1 1 133 133 MET CB C 563 32.503 32.503 31.733 0.770 18053
13370 1 20 . 1 1 133 133 MET H H 563 8.295 8.295 7.730 0.565 18053
13371 1 20 . 1 1 134 134 ARG N N 564 122.677 122.677 120.704 1.973 18053
13372 1 20 . 1 1 134 134 ARG HA H 564 4.262 4.262 4.578 -0.316 18053
13373 1 20 . 1 1 134 134 ARG C C 564 176.298 176.298 175.919 0.379 18053
13374 1 20 . 1 1 134 134 ARG CA C 564 56.087 56.087 55.672 0.415 18053
13375 1 20 . 1 1 134 134 ARG CB C 564 30.702 30.702 31.081 -0.379 18053
13376 1 20 . 1 1 134 134 ARG H H 564 8.295 8.295 8.326 -0.031 18053
13377 1 20 . 1 1 135 135 GLU N N 565 121.945 121.945 119.122 2.823 18053
13378 1 20 . 1 1 135 135 GLU HA H 565 4.160 4.160 4.274 -0.114 18053
13379 1 20 . 1 1 135 135 GLU C C 565 176.080 176.080 176.342 -0.262 18053
13380 1 20 . 1 1 135 135 GLU CA C 565 56.906 56.906 56.199 0.707 18053
13381 1 20 . 1 1 135 135 GLU CB C 565 29.774 29.774 29.661 0.113 18053
13382 1 20 . 1 1 135 135 GLU H H 565 8.470 8.470 8.674 -0.204 18053
13383 1 20 . 1 1 136 136 ASN N N 566 118.761 118.761 119.963 -1.202 18053
13384 1 20 . 1 1 136 136 ASN HA H 566 4.617 4.617 4.604 0.013 18053
13385 1 20 . 1 1 136 136 ASN C C 566 175.315 175.315 175.530 -0.215 18053
13386 1 20 . 1 1 136 136 ASN CA C 566 53.193 53.193 53.092 0.101 18053
13387 1 20 . 1 1 136 136 ASN CB C 566 38.836 38.836 37.911 0.925 18053
13388 1 20 . 1 1 136 136 ASN H H 566 8.341 8.341 8.350 -0.009 18053
13389 1 20 . 1 1 137 137 GLU N N 567 121.349 121.349 123.002 -1.653 18053
13390 1 20 . 1 1 137 137 GLU HA H 567 4.152 4.152 4.373 -0.221 18053
13391 1 20 . 1 1 137 137 GLU C C 567 176.243 176.243 176.741 -0.498 18053
13392 1 20 . 1 1 137 137 GLU CA C 567 56.906 56.906 57.051 -0.145 18053
13393 1 20 . 1 1 137 137 GLU CB C 567 29.992 29.992 30.244 -0.252 18053
13394 1 20 . 1 1 137 137 GLU H H 567 8.349 8.349 8.456 -0.107 18053
13395 1 20 . 1 1 138 138 ASN N N 568 118.761 118.761 118.071 0.690 18053
13396 1 20 . 1 1 138 138 ASN HA H 568 4.712 4.712 4.791 -0.079 18053
13397 1 20 . 1 1 138 138 ASN C C 568 174.551 174.551 174.497 0.054 18053
13398 1 20 . 1 1 138 138 ASN CA C 568 53.193 53.193 53.620 -0.427 18053
13399 1 20 . 1 1 138 138 ASN CB C 568 39.327 39.327 39.873 -0.547 18053
13400 1 20 . 1 1 138 138 ASN H H 568 8.397 8.397 8.249 0.148 18053
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 113 2.577 0.243 2.576 18053
2 1 1 "Average Difference" HA 129 0.401 0.023 0.402 18053
3 1 1 "Average Difference" C 113 0.915 0.089 0.915 18053
4 1 1 "Average Difference" CA 118 1.147 -0.083 1.149 18053
5 1 1 "Average Difference" CB 106 1.303 -0.178 1.297 18053
6 1 1 "Average Difference" HN 113 0.612 -0.072 0.610 18053
7 1 2 "Average Difference" N 113 2.644 0.277 2.641 18053
8 1 2 "Average Difference" HA 129 0.419 0.033 0.419 18053
9 1 2 "Average Difference" C 113 0.972 0.024 0.976 18053
10 1 2 "Average Difference" CA 118 1.214 -0.026 1.219 18053
11 1 2 "Average Difference" CB 106 1.313 -0.062 1.318 18053
12 1 2 "Average Difference" HN 113 0.585 -0.057 0.585 18053
13 1 3 "Average Difference" N 113 2.646 0.445 2.620 18053
14 1 3 "Average Difference" HA 129 0.373 0.021 0.374 18053
15 1 3 "Average Difference" C 113 0.989 0.098 0.988 18053
16 1 3 "Average Difference" CA 118 1.245 0.029 1.250 18053
17 1 3 "Average Difference" CB 106 1.180 -0.107 1.181 18053
18 1 3 "Average Difference" HN 113 0.586 -0.023 0.588 18053
19 1 4 "Average Difference" N 113 2.739 0.394 2.723 18053
20 1 4 "Average Difference" HA 129 0.372 0.017 0.373 18053
21 1 4 "Average Difference" C 113 1.044 0.133 1.040 18053
22 1 4 "Average Difference" CA 118 1.210 0.059 1.214 18053
23 1 4 "Average Difference" CB 106 1.249 -0.184 1.241 18053
24 1 4 "Average Difference" HN 113 0.589 -0.052 0.590 18053
25 1 5 "Average Difference" N 113 2.855 0.719 2.775 18053
26 1 5 "Average Difference" HA 129 0.383 -0.006 0.385 18053
27 1 5 "Average Difference" C 113 0.987 0.092 0.987 18053
28 1 5 "Average Difference" CA 118 1.227 0.111 1.227 18053
29 1 5 "Average Difference" CB 106 1.339 -0.211 1.329 18053
30 1 5 "Average Difference" HN 113 0.596 -0.052 0.596 18053
31 1 6 "Average Difference" N 113 2.680 0.473 2.649 18053
32 1 6 "Average Difference" HA 129 0.379 0.051 0.377 18053
33 1 6 "Average Difference" C 113 0.979 0.069 0.980 18053
34 1 6 "Average Difference" CA 118 1.206 -0.049 1.210 18053
35 1 6 "Average Difference" CB 106 1.298 -0.143 1.297 18053
36 1 6 "Average Difference" HN 113 0.607 -0.050 0.608 18053
37 1 7 "Average Difference" N 113 3.033 0.361 3.025 18053
38 1 7 "Average Difference" HA 129 0.383 0.018 0.384 18053
39 1 7 "Average Difference" C 113 0.985 0.081 0.986 18053
40 1 7 "Average Difference" CA 118 1.260 0.057 1.264 18053
41 1 7 "Average Difference" CB 106 1.369 -0.159 1.366 18053
42 1 7 "Average Difference" HN 113 0.590 -0.054 0.590 18053
43 1 8 "Average Difference" N 113 2.698 0.161 2.705 18053
44 1 8 "Average Difference" HA 129 0.363 0.004 0.365 18053
45 1 8 "Average Difference" C 113 0.943 0.095 0.942 18053
46 1 8 "Average Difference" CA 118 1.114 -0.014 1.119 18053
47 1 8 "Average Difference" CB 106 1.347 -0.156 1.345 18053
48 1 8 "Average Difference" HN 113 0.602 -0.034 0.604 18053
49 1 9 "Average Difference" N 113 2.716 0.353 2.705 18053
50 1 9 "Average Difference" HA 129 0.369 0.024 0.370 18053
51 1 9 "Average Difference" C 113 1.043 0.033 1.047 18053
52 1 9 "Average Difference" CA 118 1.273 -0.039 1.278 18053
53 1 9 "Average Difference" CB 106 1.333 -0.065 1.338 18053
54 1 9 "Average Difference" HN 113 0.601 -0.035 0.603 18053
55 1 10 "Average Difference" N 113 2.413 0.340 2.399 18053
56 1 10 "Average Difference" HA 129 0.385 0.023 0.386 18053
57 1 10 "Average Difference" C 113 0.951 0.043 0.954 18053
58 1 10 "Average Difference" CA 118 1.186 -0.055 1.190 18053
59 1 10 "Average Difference" CB 106 1.342 -0.130 1.342 18053
60 1 10 "Average Difference" HN 113 0.586 -0.033 0.587 18053
61 1 11 "Average Difference" N 113 2.699 0.358 2.687 18053
62 1 11 "Average Difference" HA 129 0.380 -0.004 0.381 18053
63 1 11 "Average Difference" C 113 0.991 0.084 0.992 18053
64 1 11 "Average Difference" CA 118 1.264 -0.054 1.268 18053
65 1 11 "Average Difference" CB 106 1.313 -0.238 1.298 18053
66 1 11 "Average Difference" HN 113 0.611 -0.049 0.612 18053
67 1 12 "Average Difference" N 113 2.779 0.424 2.758 18053
68 1 12 "Average Difference" HA 129 0.374 0.019 0.375 18053
69 1 12 "Average Difference" C 113 1.001 0.096 1.000 18053
70 1 12 "Average Difference" CA 118 1.230 0.040 1.235 18053
71 1 12 "Average Difference" CB 106 1.269 -0.139 1.267 18053
72 1 12 "Average Difference" HN 113 0.572 -0.047 0.572 18053
73 1 13 "Average Difference" N 113 2.883 0.606 2.831 18053
74 1 13 "Average Difference" HA 129 0.398 0.022 0.399 18053
75 1 13 "Average Difference" C 113 0.964 0.163 0.954 18053
76 1 13 "Average Difference" CA 118 1.309 0.080 1.312 18053
77 1 13 "Average Difference" CB 106 1.211 -0.214 1.198 18053
78 1 13 "Average Difference" HN 113 0.583 -0.044 0.584 18053
79 1 14 "Average Difference" N 113 2.692 0.521 2.652 18053
80 1 14 "Average Difference" HA 129 0.361 0.017 0.362 18053
81 1 14 "Average Difference" C 113 1.021 0.113 1.020 18053
82 1 14 "Average Difference" CA 118 1.170 0.015 1.174 18053
83 1 14 "Average Difference" CB 106 1.318 -0.314 1.286 18053
84 1 14 "Average Difference" HN 113 0.614 -0.036 0.615 18053
85 1 15 "Average Difference" N 113 2.667 0.105 2.677 18053
86 1 15 "Average Difference" HA 129 0.385 0.039 0.385 18053
87 1 15 "Average Difference" C 113 0.972 0.089 0.972 18053
88 1 15 "Average Difference" CA 118 1.275 0.021 1.280 18053
89 1 15 "Average Difference" CB 106 1.238 -0.133 1.237 18053
90 1 15 "Average Difference" HN 113 0.550 -0.026 0.552 18053
91 1 16 "Average Difference" N 113 2.919 0.299 2.916 18053
92 1 16 "Average Difference" HA 129 0.402 0.013 0.403 18053
93 1 16 "Average Difference" C 113 1.039 0.096 1.039 18053
94 1 16 "Average Difference" CA 118 1.245 0.011 1.250 18053
95 1 16 "Average Difference" CB 106 1.485 -0.327 1.456 18053
96 1 16 "Average Difference" HN 113 0.579 -0.054 0.579 18053
97 1 17 "Average Difference" N 113 3.005 0.291 3.004 18053
98 1 17 "Average Difference" HA 129 0.351 0.006 0.353 18053
99 1 17 "Average Difference" C 113 0.946 0.035 0.950 18053
100 1 17 "Average Difference" CA 118 1.245 0.004 1.250 18053
101 1 17 "Average Difference" CB 106 1.227 -0.226 1.212 18053
102 1 17 "Average Difference" HN 113 0.556 -0.038 0.557 18053
103 1 18 "Average Difference" N 113 2.865 0.603 2.813 18053
104 1 18 "Average Difference" HA 129 0.419 0.027 0.420 18053
105 1 18 "Average Difference" C 113 0.979 0.035 0.983 18053
106 1 18 "Average Difference" CA 118 1.144 -0.097 1.144 18053
107 1 18 "Average Difference" CB 106 1.322 -0.203 1.312 18053
108 1 18 "Average Difference" HN 113 0.595 -0.044 0.596 18053
109 1 19 "Average Difference" N 113 2.664 0.512 2.626 18053
110 1 19 "Average Difference" HA 129 0.381 0.010 0.383 18053
111 1 19 "Average Difference" C 113 0.934 0.079 0.935 18053
112 1 19 "Average Difference" CA 118 1.172 0.013 1.177 18053
113 1 19 "Average Difference" CB 106 1.254 -0.182 1.247 18053
114 1 19 "Average Difference" HN 113 0.626 -0.041 0.628 18053
115 1 20 "Average Difference" N 113 2.682 0.553 2.636 18053
116 1 20 "Average Difference" HA 129 0.398 -0.000 0.400 18053
117 1 20 "Average Difference" C 113 0.926 0.085 0.926 18053
118 1 20 "Average Difference" CA 118 1.195 0.018 1.200 18053
119 1 20 "Average Difference" CB 106 1.301 -0.195 1.292 18053
120 1 20 "Average Difference" HN 113 0.585 -0.053 0.585 18053
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 18053
_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 20 20 ALA N N 450 125.180 125.180 126.597 -1.417 18053
2 1 . 1 1 20 20 ALA HA H 450 4.706 4.706 4.533 0.173 18053
3 1 . 1 1 20 20 ALA C C 450 177.226 177.226 177.011 0.215 18053
4 1 . 1 1 20 20 ALA CA C 450 52.757 52.757 52.073 0.684 18053
5 1 . 1 1 20 20 ALA CB C 450 20.411 20.411 19.166 1.245 18053
6 1 . 1 1 20 20 ALA H H 450 8.484 8.484 8.475 0.009 18053
7 1 . 1 1 21 21 SER N N 451 115.714 115.714 119.243 -3.529 18053
8 1 . 1 1 21 21 SER HA H 451 4.513 4.513 4.437 0.076 18053
9 1 . 1 1 21 21 SER C C 451 174.742 174.742 175.383 -0.641 18053
10 1 . 1 1 21 21 SER CA C 451 58.516 58.516 58.117 0.399 18053
11 1 . 1 1 21 21 SER CB C 451 64.159 64.159 62.689 1.470 18053
12 1 . 1 1 21 21 SER H H 451 8.487 8.487 8.202 0.285 18053
13 1 . 1 1 22 22 GLY N N 452 111.509 111.509 115.118 -3.609 18053
14 1 . 1 1 22 22 GLY C C 452 174.401 174.401 175.027 -0.626 18053
15 1 . 1 1 22 22 GLY CA C 452 45.059 45.059 45.867 -0.808 18053
16 1 . 1 1 22 22 GLY H H 452 8.198 8.198 8.565 -0.367 18053
17 1 . 1 1 23 23 SER N N 453 116.191 116.191 115.238 0.953 18053
18 1 . 1 1 23 23 SER HA H 453 4.364 4.364 4.388 -0.024 18053
19 1 . 1 1 23 23 SER C C 453 173.432 173.432 173.879 -0.447 18053
20 1 . 1 1 23 23 SER CA C 453 59.744 59.744 60.426 -0.682 18053
21 1 . 1 1 23 23 SER CB C 453 64.335 64.335 64.142 0.193 18053
22 1 . 1 1 23 23 SER H H 453 8.494 8.494 8.210 0.284 18053
23 1 . 1 1 24 24 VAL N N 454 121.656 121.656 120.030 1.626 18053
24 1 . 1 1 24 24 VAL HA H 454 5.035 5.035 4.446 0.589 18053
25 1 . 1 1 24 24 VAL C C 454 174.606 174.606 175.131 -0.525 18053
26 1 . 1 1 24 24 VAL CA C 454 61.055 61.055 61.394 -0.339 18053
27 1 . 1 1 24 24 VAL CB C 454 32.503 32.503 33.474 -0.971 18053
28 1 . 1 1 24 24 VAL H H 454 7.830 7.830 7.853 -0.023 18053
29 1 . 1 1 25 25 SER N N 455 119.323 119.323 119.463 -0.140 18053
30 1 . 1 1 25 25 SER HA H 455 4.672 4.672 4.883 -0.211 18053
31 1 . 1 1 25 25 SER C C 455 174.426 174.426 173.439 0.987 18053
32 1 . 1 1 25 25 SER CA C 455 55.268 55.268 56.080 -0.812 18053
33 1 . 1 1 25 25 SER CB C 455 65.162 65.162 65.844 -0.682 18053
34 1 . 1 1 25 25 SER H H 455 9.065 9.065 8.745 0.320 18053
35 1 . 1 1 26 26 ILE N N 456 119.468 119.468 123.859 -4.391 18053
36 1 . 1 1 26 26 ILE HA H 456 4.180 4.180 4.163 0.017 18053
37 1 . 1 1 26 26 ILE C C 456 175.506 175.506 175.967 -0.461 18053
38 1 . 1 1 26 26 ILE CA C 456 61.328 61.328 61.876 -0.548 18053
39 1 . 1 1 26 26 ILE CB C 456 37.962 37.962 37.403 0.559 18053
40 1 . 1 1 26 26 ILE H H 456 8.295 8.295 8.709 -0.414 18053
41 1 . 1 1 27 27 GLU N N 457 129.726 129.726 129.236 0.490 18053
42 1 . 1 1 27 27 GLU HA H 457 4.228 4.228 4.278 -0.049 18053
43 1 . 1 1 27 27 GLU C C 457 175.179 175.179 176.376 -1.197 18053
44 1 . 1 1 27 27 GLU CA C 457 55.432 55.432 57.897 -2.465 18053
45 1 . 1 1 27 27 GLU CB C 457 30.142 30.142 30.871 -0.729 18053
46 1 . 1 1 27 27 GLU H H 457 8.393 8.393 8.553 -0.160 18053
47 1 . 1 1 28 28 GLU N N 458 117.076 117.076 116.436 0.640 18053
48 1 . 1 1 28 28 GLU HA H 458 4.168 4.168 4.652 -0.484 18053
49 1 . 1 1 28 28 GLU C C 458 174.701 174.701 174.781 -0.080 18053
50 1 . 1 1 28 28 GLU CA C 458 56.906 56.906 55.131 1.775 18053
51 1 . 1 1 28 28 GLU CB C 458 31.848 31.848 33.561 -1.713 18053
52 1 . 1 1 28 28 GLU H H 458 7.489 7.489 7.937 -0.448 18053
53 1 . 1 1 29 29 ILE N N 459 122.183 122.183 120.059 2.124 18053
54 1 . 1 1 29 29 ILE HA H 459 3.764 3.764 4.032 -0.268 18053
55 1 . 1 1 29 29 ILE C C 459 174.169 174.169 174.602 -0.433 18053
56 1 . 1 1 29 29 ILE CA C 459 59.526 59.526 59.396 0.130 18053
57 1 . 1 1 29 29 ILE CB C 459 40.309 40.309 41.461 -1.152 18053
58 1 . 1 1 29 29 ILE H H 459 8.126 8.126 8.295 -0.169 18053
59 1 . 1 1 30 30 ASP N N 460 123.205 123.205 124.036 -0.831 18053
60 1 . 1 1 30 30 ASP HA H 460 4.183 4.183 4.238 -0.055 18053
61 1 . 1 1 30 30 ASP C C 460 178.318 178.318 177.496 0.822 18053
62 1 . 1 1 30 30 ASP CA C 460 53.930 53.930 53.688 0.242 18053
63 1 . 1 1 30 30 ASP CB C 460 42.807 42.807 42.225 0.582 18053
64 1 . 1 1 30 30 ASP H H 460 6.704 6.704 7.474 -0.770 18053
65 1 . 1 1 31 31 LEU N N 461 128.551 128.551 120.785 7.766 18053
66 1 . 1 1 31 31 LEU HA H 461 4.064 4.064 4.156 -0.092 18053
67 1 . 1 1 31 31 LEU C C 461 177.513 177.513 177.591 -0.078 18053
68 1 . 1 1 31 31 LEU CA C 461 57.124 57.124 56.940 0.184 18053
69 1 . 1 1 31 31 LEU CB C 461 41.237 41.237 41.779 -0.542 18053
70 1 . 1 1 31 31 LEU H H 461 9.012 9.012 8.308 0.704 18053
71 1 . 1 1 32 32 GLU N N 462 115.101 115.101 117.631 -2.530 18053
72 1 . 1 1 32 32 GLU HA H 462 4.283 4.283 4.440 -0.157 18053
73 1 . 1 1 32 32 GLU C C 462 177.062 177.062 176.959 0.103 18053
74 1 . 1 1 32 32 GLU CA C 462 55.759 55.759 56.780 -1.021 18053
75 1 . 1 1 32 32 GLU CB C 462 29.569 29.569 30.710 -1.141 18053
76 1 . 1 1 32 32 GLU H H 462 7.588 7.588 8.005 -0.417 18053
77 1 . 1 1 33 33 GLY N N 463 106.299 106.299 106.676 -0.377 18053
78 1 . 1 1 33 33 GLY C C 463 174.824 174.824 174.969 -0.145 18053
79 1 . 1 1 33 33 GLY CA C 463 46.806 46.806 45.152 1.654 18053
80 1 . 1 1 33 33 GLY H H 463 7.372 7.372 8.062 -0.690 18053
81 1 . 1 1 34 34 LYS N N 464 118.744 118.744 118.726 0.018 18053
82 1 . 1 1 34 34 LYS HA H 464 4.562 4.562 4.385 0.177 18053
83 1 . 1 1 34 34 LYS C C 464 177.076 177.076 175.116 1.960 18053
84 1 . 1 1 34 34 LYS CA C 464 59.963 59.963 57.326 2.637 18053
85 1 . 1 1 34 34 LYS CB C 464 33.111 33.111 33.363 -0.252 18053
86 1 . 1 1 34 34 LYS H H 464 9.547 9.547 8.175 1.371 18053
87 1 . 1 1 35 35 PHE N N 465 109.125 109.125 112.544 -3.419 18053
88 1 . 1 1 35 35 PHE HA H 465 5.514 5.514 5.171 0.343 18053
89 1 . 1 1 35 35 PHE C C 465 174.183 174.183 172.794 1.389 18053
90 1 . 1 1 35 35 PHE CA C 465 56.632 56.632 55.469 1.163 18053
91 1 . 1 1 35 35 PHE CB C 465 40.599 40.599 40.980 -0.381 18053
92 1 . 1 1 35 35 PHE H H 465 6.740 6.740 7.115 -0.375 18053
93 1 . 1 1 36 36 VAL N N 466 119.579 119.579 119.797 -0.218 18053
94 1 . 1 1 36 36 VAL HA H 466 3.709 3.709 4.157 -0.448 18053
95 1 . 1 1 36 36 VAL C C 466 172.668 172.668 174.262 -1.594 18053
96 1 . 1 1 36 36 VAL CA C 466 62.692 62.692 61.194 1.498 18053
97 1 . 1 1 36 36 VAL CB C 466 36.215 36.215 34.500 1.715 18053
98 1 . 1 1 36 36 VAL H H 466 7.628 7.628 8.584 -0.956 18053
99 1 . 1 1 37 37 GLN N N 467 126.831 126.831 127.504 -0.673 18053
100 1 . 1 1 37 37 GLN HA H 467 5.449 5.449 4.805 0.644 18053
101 1 . 1 1 37 37 GLN C C 467 174.797 174.797 174.701 0.096 18053
102 1 . 1 1 37 37 GLN CA C 467 54.121 54.121 54.737 -0.616 18053
103 1 . 1 1 37 37 GLN CB C 467 34.623 34.623 29.643 4.980 18053
104 1 . 1 1 37 37 GLN H H 467 8.392 8.392 8.497 -0.105 18053
105 1 . 1 1 38 38 LEU N N 468 123.018 123.018 127.971 -4.953 18053
106 1 . 1 1 38 38 LEU HA H 468 5.422 5.422 5.086 0.336 18053
107 1 . 1 1 38 38 LEU C C 468 175.588 175.588 175.687 -0.099 18053
108 1 . 1 1 38 38 LEU CA C 468 52.702 52.702 53.875 -1.173 18053
109 1 . 1 1 38 38 LEU CB C 468 45.046 45.046 44.749 0.297 18053
110 1 . 1 1 38 38 LEU H H 468 9.103 9.103 8.940 0.163 18053
111 1 . 1 1 39 39 LYS N N 469 118.983 118.983 121.458 -2.475 18053
112 1 . 1 1 39 39 LYS HA H 469 4.852 4.852 4.772 0.080 18053
113 1 . 1 1 39 39 LYS C C 469 173.309 173.309 174.460 -1.151 18053
114 1 . 1 1 39 39 LYS CA C 469 54.994 54.994 54.607 0.387 18053
115 1 . 1 1 39 39 LYS CB C 469 38.246 38.246 36.227 2.019 18053
116 1 . 1 1 39 39 LYS H H 469 8.496 8.496 8.717 -0.221 18053
117 1 . 1 1 40 40 ASN N N 470 121.758 121.758 124.447 -2.689 18053
118 1 . 1 1 40 40 ASN HA H 470 4.788 4.788 4.876 -0.088 18053
119 1 . 1 1 40 40 ASN C C 470 174.496 174.496 175.051 -0.555 18053
120 1 . 1 1 40 40 ASN CA C 470 51.119 51.119 52.480 -1.361 18053
121 1 . 1 1 40 40 ASN CB C 470 37.559 37.559 39.347 -1.788 18053
122 1 . 1 1 40 40 ASN H H 470 8.283 8.283 8.622 -0.339 18053
123 1 . 1 1 41 41 ASN N N 471 122.422 122.422 123.995 -1.573 18053
124 1 . 1 1 41 41 ASN HA H 471 4.588 4.588 4.749 -0.161 18053
125 1 . 1 1 41 41 ASN C C 471 174.810 174.810 175.097 -0.287 18053
126 1 . 1 1 41 41 ASN CA C 471 53.985 53.985 53.418 0.567 18053
127 1 . 1 1 41 41 ASN CB C 471 39.600 39.600 39.288 0.312 18053
128 1 . 1 1 41 41 ASN H H 471 8.681 8.681 8.502 0.179 18053
129 1 . 1 1 42 42 SER N N 472 116.446 116.446 116.210 0.236 18053
130 1 . 1 1 42 42 SER HA H 472 4.719 4.719 4.458 0.261 18053
131 1 . 1 1 42 42 SER C C 472 172.804 172.804 174.520 -1.716 18053
132 1 . 1 1 42 42 SER CA C 472 57.288 57.288 58.349 -1.061 18053
133 1 . 1 1 42 42 SER CB C 472 66.241 66.241 64.515 1.726 18053
134 1 . 1 1 42 42 SER H H 472 8.370 8.370 7.808 0.562 18053
135 1 . 1 1 43 43 ASP N N 473 117.706 117.706 122.006 -4.300 18053
136 1 . 1 1 43 43 ASP HA H 473 4.474 4.474 4.557 -0.083 18053
137 1 . 1 1 43 43 ASP C C 473 175.343 175.343 175.734 -0.391 18053
138 1 . 1 1 43 43 ASP CA C 473 53.521 53.521 55.420 -1.899 18053
139 1 . 1 1 43 43 ASP CB C 473 40.322 40.322 40.982 -0.660 18053
140 1 . 1 1 43 43 ASP H H 473 8.254 8.254 8.697 -0.443 18053
141 1 . 1 1 44 44 LYS N N 474 120.209 120.209 118.410 1.799 18053
142 1 . 1 1 44 44 LYS HA H 474 4.569 4.569 4.465 0.104 18053
143 1 . 1 1 44 44 LYS C C 474 175.397 175.397 174.789 0.608 18053
144 1 . 1 1 44 44 LYS CA C 474 54.012 54.012 54.510 -0.498 18053
145 1 . 1 1 44 44 LYS CB C 474 35.383 35.383 34.116 1.267 18053
146 1 . 1 1 44 44 LYS H H 474 8.305 8.305 7.466 0.839 18053
147 1 . 1 1 45 45 ASP N N 475 124.993 124.993 120.078 4.915 18053
148 1 . 1 1 45 45 ASP HA H 475 3.975 3.975 4.449 -0.474 18053
149 1 . 1 1 45 45 ASP C C 475 174.810 174.810 175.940 -1.130 18053
150 1 . 1 1 45 45 ASP CA C 475 54.995 54.995 54.846 0.148 18053
151 1 . 1 1 45 45 ASP CB C 475 40.364 40.364 40.681 -0.317 18053
152 1 . 1 1 45 45 ASP H H 475 8.722 8.722 8.429 0.293 18053
153 1 . 1 1 46 46 GLN N N 476 120.549 120.549 124.915 -4.366 18053
154 1 . 1 1 46 46 GLN HA H 476 4.436 4.436 4.401 0.035 18053
155 1 . 1 1 46 46 GLN C C 476 174.019 174.019 175.065 -1.046 18053
156 1 . 1 1 46 46 GLN CA C 476 53.138 53.138 54.501 -1.363 18053
157 1 . 1 1 46 46 GLN CB C 476 31.466 31.466 29.750 1.716 18053
158 1 . 1 1 46 46 GLN H H 476 7.878 7.878 8.275 -0.397 18053
159 1 . 1 1 47 47 SER N N 477 121.537 121.537 121.803 -0.266 18053
160 1 . 1 1 47 47 SER HA H 477 4.229 4.229 4.243 -0.014 18053
161 1 . 1 1 47 47 SER C C 477 174.565 174.565 173.794 0.771 18053
162 1 . 1 1 47 47 SER CA C 477 58.706 58.706 58.712 -0.006 18053
163 1 . 1 1 47 47 SER CB C 477 62.965 62.965 62.980 -0.015 18053
164 1 . 1 1 47 47 SER H H 477 8.748 8.748 8.655 0.093 18053
165 1 . 1 1 48 48 LEU N N 478 127.751 127.751 125.441 2.310 18053
166 1 . 1 1 48 48 LEU HA H 478 2.631 2.631 4.312 -1.681 18053
167 1 . 1 1 48 48 LEU C C 478 176.789 176.789 176.958 -0.169 18053
168 1 . 1 1 48 48 LEU CA C 478 52.102 52.102 54.089 -1.987 18053
169 1 . 1 1 48 48 LEU CB C 478 42.343 42.343 43.626 -1.283 18053
170 1 . 1 1 48 48 LEU H H 478 7.856 7.856 7.747 0.109 18053
171 1 . 1 1 49 49 GLY N N 479 107.525 107.525 107.873 -0.348 18053
172 1 . 1 1 49 49 GLY C C 479 176.653 176.653 175.270 1.383 18053
173 1 . 1 1 49 49 GLY CA C 479 48.062 48.062 45.819 2.243 18053
174 1 . 1 1 49 49 GLY H H 479 7.728 7.728 8.725 -0.997 18053
175 1 . 1 1 50 50 ASN N N 480 117.059 117.059 119.650 -2.591 18053
176 1 . 1 1 50 50 ASN HA H 480 4.255 4.255 4.601 -0.346 18053
177 1 . 1 1 50 50 ASN C C 480 174.961 174.961 175.260 -0.299 18053
178 1 . 1 1 50 50 ASN CA C 480 56.360 56.360 54.429 1.931 18053
179 1 . 1 1 50 50 ASN CB C 480 37.416 37.416 38.857 -1.441 18053
180 1 . 1 1 50 50 ASN H H 480 7.552 7.552 8.700 -1.148 18053
181 1 . 1 1 51 51 TRP N N 481 122.166 122.166 118.890 3.276 18053
182 1 . 1 1 51 51 TRP HA H 481 4.477 4.477 4.849 -0.372 18053
183 1 . 1 1 51 51 TRP C C 481 175.575 175.575 175.743 -0.168 18053
184 1 . 1 1 51 51 TRP CA C 481 58.762 58.762 57.949 0.813 18053
185 1 . 1 1 51 51 TRP CB C 481 28.041 28.041 30.046 -2.005 18053
186 1 . 1 1 51 51 TRP H H 481 8.914 8.914 7.921 0.993 18053
187 1 . 1 1 52 52 ARG N N 482 116.480 116.480 117.803 -1.323 18053
188 1 . 1 1 52 52 ARG HA H 482 5.968 5.968 5.247 0.721 18053
189 1 . 1 1 52 52 ARG C C 482 175.807 175.807 174.901 0.906 18053
190 1 . 1 1 52 52 ARG CA C 482 54.121 54.121 54.910 -0.789 18053
191 1 . 1 1 52 52 ARG CB C 482 35.124 35.124 33.922 1.202 18053
192 1 . 1 1 52 52 ARG H H 482 9.147 9.147 9.061 0.086 18053
193 1 . 1 1 53 53 ILE N N 483 119.579 119.579 124.963 -5.384 18053
194 1 . 1 1 53 53 ILE HA H 483 4.985 4.985 4.879 0.106 18053
195 1 . 1 1 53 53 ILE C C 483 175.670 175.670 175.825 -0.155 18053
196 1 . 1 1 53 53 ILE CA C 483 60.400 60.400 60.769 -0.369 18053
197 1 . 1 1 53 53 ILE CB C 483 40.227 40.227 38.566 1.661 18053
198 1 . 1 1 53 53 ILE H H 483 9.000 9.000 8.763 0.237 18053
199 1 . 1 1 54 54 LYS N N 484 124.737 124.737 128.355 -3.618 18053
200 1 . 1 1 54 54 LYS HA H 484 5.463 5.463 4.939 0.524 18053
201 1 . 1 1 54 54 LYS C C 484 175.575 175.575 176.099 -0.524 18053
202 1 . 1 1 54 54 LYS CA C 484 54.613 54.613 56.173 -1.560 18053
203 1 . 1 1 54 54 LYS CB C 484 35.041 35.041 33.551 1.490 18053
204 1 . 1 1 54 54 LYS H H 484 9.678 9.678 8.675 1.003 18053
205 1 . 1 1 55 55 ARG N N 485 124.090 124.090 124.084 0.006 18053
206 1 . 1 1 55 55 ARG HA H 485 5.525 5.525 4.840 0.685 18053
207 1 . 1 1 55 55 ARG C C 485 174.155 174.155 174.516 -0.361 18053
208 1 . 1 1 55 55 ARG CA C 485 53.903 53.903 55.275 -1.372 18053
209 1 . 1 1 55 55 ARG H H 485 9.314 9.314 8.748 0.566 18053
210 1 . 1 1 56 56 GLN N N 486 126.576 126.576 126.710 -0.134 18053
211 1 . 1 1 56 56 GLN HA H 486 4.842 4.842 4.823 0.019 18053
212 1 . 1 1 56 56 GLN C C 486 174.991 174.991 174.638 0.353 18053
213 1 . 1 1 56 56 GLN CA C 486 54.831 54.831 54.659 0.172 18053
214 1 . 1 1 56 56 GLN CB C 486 31.465 31.465 29.995 1.470 18053
215 1 . 1 1 56 56 GLN H H 486 8.831 8.831 8.526 0.305 18053
216 1 . 1 1 57 57 VAL N N 487 126.712 126.712 125.328 1.384 18053
217 1 . 1 1 57 57 VAL HA H 487 4.266 4.266 4.247 0.019 18053
218 1 . 1 1 57 57 VAL C C 487 175.916 175.916 177.603 -1.687 18053
219 1 . 1 1 57 57 VAL CA C 487 61.820 61.820 62.146 -0.326 18053
220 1 . 1 1 57 57 VAL CB C 487 32.803 32.803 32.405 0.398 18053
221 1 . 1 1 57 57 VAL H H 487 8.786 8.786 8.595 0.191 18053
222 1 . 1 1 58 58 LEU N N 488 127.274 127.274 124.884 2.390 18053
223 1 . 1 1 58 58 LEU HA H 488 4.085 4.085 4.146 -0.061 18053
224 1 . 1 1 58 58 LEU C C 488 177.158 177.158 177.962 -0.804 18053
225 1 . 1 1 58 58 LEU CA C 488 56.906 56.906 57.816 -0.910 18053
226 1 . 1 1 58 58 LEU CB C 488 41.374 41.374 41.611 -0.237 18053
227 1 . 1 1 58 58 LEU H H 488 8.316 8.316 8.461 -0.145 18053
228 1 . 1 1 59 59 GLU N N 489 119.647 119.647 118.535 1.112 18053
229 1 . 1 1 59 59 GLU HA H 489 4.112 4.112 4.219 -0.107 18053
230 1 . 1 1 59 59 GLU C C 489 176.230 176.230 177.289 -1.059 18053
231 1 . 1 1 59 59 GLU CA C 489 57.015 57.015 56.870 0.145 18053
232 1 . 1 1 59 59 GLU CB C 489 28.149 28.149 29.663 -1.514 18053
233 1 . 1 1 59 59 GLU H H 489 8.636 8.636 8.241 0.395 18053
234 1 . 1 1 60 60 GLY N N 490 108.819 108.819 107.325 1.494 18053
235 1 . 1 1 60 60 GLY C C 490 173.568 173.568 173.681 -0.114 18053
236 1 . 1 1 60 60 GLY CA C 490 44.773 44.773 44.841 -0.068 18053
237 1 . 1 1 60 60 GLY H H 490 8.160 8.160 7.817 0.343 18053
238 1 . 1 1 61 61 GLU N N 491 121.009 121.009 121.856 -0.847 18053
239 1 . 1 1 61 61 GLU HA H 491 4.323 4.323 4.387 -0.064 18053
240 1 . 1 1 61 61 GLU C C 491 175.725 175.725 175.302 0.423 18053
241 1 . 1 1 61 61 GLU CA C 491 56.196 56.196 55.912 0.284 18053
242 1 . 1 1 61 61 GLU CB C 491 30.865 30.865 29.974 0.891 18053
243 1 . 1 1 61 61 GLU H H 491 8.320 8.320 8.272 0.048 18053
244 1 . 1 1 62 62 GLU N N 492 123.426 123.426 123.865 -0.439 18053
245 1 . 1 1 62 62 GLU HA H 492 5.054 5.054 5.221 -0.167 18053
246 1 . 1 1 62 62 GLU C C 492 175.930 175.930 176.097 -0.167 18053
247 1 . 1 1 62 62 GLU CA C 492 55.650 55.650 54.872 0.778 18053
248 1 . 1 1 62 62 GLU CB C 492 32.312 32.312 30.787 1.525 18053
249 1 . 1 1 62 62 GLU H H 492 8.594 8.594 8.537 0.057 18053
250 1 . 1 1 63 63 ILE N N 493 119.732 119.732 118.295 1.437 18053
251 1 . 1 1 63 63 ILE HA H 493 4.788 4.788 4.758 0.030 18053
252 1 . 1 1 63 63 ILE C C 493 174.647 174.647 174.324 0.323 18053
253 1 . 1 1 63 63 ILE CA C 493 60.181 60.181 59.714 0.467 18053
254 1 . 1 1 63 63 ILE CB C 493 41.183 41.183 41.066 0.117 18053
255 1 . 1 1 63 63 ILE H H 493 8.523 8.523 8.219 0.304 18053
256 1 . 1 1 64 64 ALA N N 494 122.166 122.166 124.760 -2.594 18053
257 1 . 1 1 64 64 ALA HA H 494 5.521 5.521 5.025 0.496 18053
258 1 . 1 1 64 64 ALA C C 494 174.606 174.606 175.918 -1.312 18053
259 1 . 1 1 64 64 ALA CA C 494 51.528 51.528 51.066 0.462 18053
260 1 . 1 1 64 64 ALA CB C 494 22.239 22.239 20.951 1.288 18053
261 1 . 1 1 64 64 ALA H H 494 8.741 8.741 8.359 0.382 18053
262 1 . 1 1 65 65 TYR N N 495 126.729 126.729 126.447 0.282 18053
263 1 . 1 1 65 65 TYR HA H 495 3.094 3.094 3.630 -0.536 18053
264 1 . 1 1 65 65 TYR C C 495 173.036 173.036 173.777 -0.741 18053
265 1 . 1 1 65 65 TYR CA C 495 56.905 56.905 56.423 0.482 18053
266 1 . 1 1 65 65 TYR CB C 495 40.269 40.269 38.837 1.432 18053
267 1 . 1 1 65 65 TYR H H 495 8.462 8.462 8.495 -0.033 18053
268 1 . 1 1 66 66 LYS N N 496 128.108 128.108 126.758 1.350 18053
269 1 . 1 1 66 66 LYS HA H 496 4.822 4.822 4.377 0.445 18053
270 1 . 1 1 66 66 LYS C C 496 174.906 174.906 174.892 0.014 18053
271 1 . 1 1 66 66 LYS CA C 496 53.739 53.739 54.900 -1.161 18053
272 1 . 1 1 66 66 LYS CB C 496 34.782 34.782 33.200 1.582 18053
273 1 . 1 1 66 66 LYS H H 496 7.010 7.010 7.417 -0.407 18053
274 1 . 1 1 67 67 PHE N N 497 125.299 125.299 122.045 3.254 18053
275 1 . 1 1 67 67 PHE HA H 497 3.932 3.932 4.162 -0.230 18053
276 1 . 1 1 67 67 PHE C C 497 177.990 177.990 175.726 2.264 18053
277 1 . 1 1 67 67 PHE CA C 497 59.007 59.007 57.901 1.106 18053
278 1 . 1 1 67 67 PHE CB C 497 40.981 40.981 40.240 0.741 18053
279 1 . 1 1 67 67 PHE H H 497 8.509 8.509 8.144 0.365 18053
280 1 . 1 1 68 68 THR N N 498 116.191 116.191 112.192 3.999 18053
281 1 . 1 1 68 68 THR HA H 498 4.417 4.417 4.654 -0.237 18053
282 1 . 1 1 68 68 THR CA C 498 60.855 60.855 59.317 1.538 18053
283 1 . 1 1 68 68 THR CB C 498 68.019 68.019 69.389 -1.370 18053
284 1 . 1 1 68 68 THR H H 498 8.688 8.688 8.372 0.316 18053
285 1 . 1 1 69 69 PRO HA H 499 3.948 3.948 4.561 -0.613 18053
286 1 . 1 1 69 69 PRO C C 499 177.444 177.444 177.022 0.422 18053
287 1 . 1 1 69 69 PRO CA C 499 66.077 66.077 64.622 1.455 18053
288 1 . 1 1 69 69 PRO CB C 499 32.776 32.776 31.935 0.841 18053
289 1 . 1 1 70 70 LYS N N 500 113.552 113.552 115.566 -2.013 18053
290 1 . 1 1 70 70 LYS HA H 500 4.385 4.385 4.183 0.202 18053
291 1 . 1 1 70 70 LYS C C 500 176.325 176.325 176.472 -0.147 18053
292 1 . 1 1 70 70 LYS CA C 500 54.995 54.995 56.668 -1.673 18053
293 1 . 1 1 70 70 LYS CB C 500 31.793 31.793 31.959 -0.166 18053
294 1 . 1 1 70 70 LYS H H 500 8.016 8.016 7.979 0.037 18053
295 1 . 1 1 71 71 TYR N N 501 121.860 121.860 121.762 0.098 18053
296 1 . 1 1 71 71 TYR HA H 501 3.730 3.730 4.404 -0.674 18053
297 1 . 1 1 71 71 TYR C C 501 174.838 174.838 173.936 0.902 18053
298 1 . 1 1 71 71 TYR CA C 501 62.310 62.310 59.067 3.243 18053
299 1 . 1 1 71 71 TYR CB C 501 38.781 38.781 39.407 -0.626 18053
300 1 . 1 1 71 71 TYR H H 501 7.460 7.460 7.731 -0.271 18053
301 1 . 1 1 72 72 ILE N N 502 129.487 129.487 126.898 2.589 18053
302 1 . 1 1 72 72 ILE HA H 502 3.928 3.928 4.326 -0.398 18053
303 1 . 1 1 72 72 ILE C C 502 172.968 172.968 173.796 -0.828 18053
304 1 . 1 1 72 72 ILE CA C 502 59.308 59.308 59.501 -0.193 18053
305 1 . 1 1 72 72 ILE CB C 502 40.910 40.910 40.934 -0.024 18053
306 1 . 1 1 72 72 ILE H H 502 7.168 7.168 7.830 -0.662 18053
307 1 . 1 1 73 73 LEU N N 503 128.278 128.278 127.890 0.388 18053
308 1 . 1 1 73 73 LEU HA H 503 4.493 4.493 4.496 -0.003 18053
309 1 . 1 1 73 73 LEU C C 503 175.834 175.834 175.252 0.582 18053
310 1 . 1 1 73 73 LEU CA C 503 51.965 51.965 53.207 -1.242 18053
311 1 . 1 1 73 73 LEU CB C 503 42.548 42.548 44.147 -1.599 18053
312 1 . 1 1 73 73 LEU H H 503 8.483 8.483 8.413 0.070 18053
313 1 . 1 1 74 74 ARG N N 504 129.589 129.589 124.562 5.027 18053
314 1 . 1 1 74 74 ARG HA H 504 3.743 3.743 4.357 -0.614 18053
315 1 . 1 1 74 74 ARG C C 504 175.233 175.233 175.784 -0.551 18053
316 1 . 1 1 74 74 ARG CA C 504 56.851 56.851 55.112 1.739 18053
317 1 . 1 1 74 74 ARG CB C 504 30.292 30.292 30.903 -0.611 18053
318 1 . 1 1 74 74 ARG H H 504 8.673 8.673 8.393 0.280 18053
319 1 . 1 1 75 75 ALA N N 505 123.205 123.205 124.373 -1.168 18053
320 1 . 1 1 75 75 ALA HA H 505 3.522 3.522 4.186 -0.664 18053
321 1 . 1 1 75 75 ALA C C 505 178.441 178.441 178.151 0.290 18053
322 1 . 1 1 75 75 ALA CA C 505 53.794 53.794 53.051 0.743 18053
323 1 . 1 1 75 75 ALA CB C 505 18.910 18.910 18.416 0.494 18053
324 1 . 1 1 75 75 ALA H H 505 8.564 8.564 8.309 0.255 18053
325 1 . 1 1 76 76 GLY N N 506 112.241 112.241 112.645 -0.404 18053
326 1 . 1 1 76 76 GLY C C 506 174.278 174.278 174.599 -0.321 18053
327 1 . 1 1 76 76 GLY CA C 506 46.725 46.725 45.323 1.402 18053
328 1 . 1 1 76 76 GLY H H 506 7.381 7.381 8.571 -1.190 18053
329 1 . 1 1 77 77 GLN N N 507 117.382 117.382 119.370 -1.988 18053
330 1 . 1 1 77 77 GLN HA H 507 4.364 4.364 4.582 -0.218 18053
331 1 . 1 1 77 77 GLN C C 507 173.937 173.937 174.814 -0.877 18053
332 1 . 1 1 77 77 GLN CA C 507 54.558 54.558 54.587 -0.029 18053
333 1 . 1 1 77 77 GLN CB C 507 30.073 30.073 30.438 -0.365 18053
334 1 . 1 1 77 77 GLN H H 507 7.996 7.996 7.652 0.344 18053
335 1 . 1 1 78 78 MET N N 508 116.957 116.957 115.730 1.227 18053
336 1 . 1 1 78 78 MET HA H 508 5.388 5.388 4.949 0.439 18053
337 1 . 1 1 78 78 MET C C 508 175.807 175.807 174.189 1.618 18053
338 1 . 1 1 78 78 MET CA C 508 54.067 54.067 54.597 -0.530 18053
339 1 . 1 1 78 78 MET CB C 508 37.198 37.198 36.236 0.962 18053
340 1 . 1 1 78 78 MET H H 508 8.092 8.092 8.282 -0.190 18053
341 1 . 1 1 79 79 VAL N N 509 119.340 119.340 121.394 -2.054 18053
342 1 . 1 1 79 79 VAL HA H 509 4.956 4.956 4.759 0.197 18053
343 1 . 1 1 79 79 VAL C C 509 172.217 172.217 174.393 -2.176 18053
344 1 . 1 1 79 79 VAL CA C 509 59.471 59.471 60.422 -0.951 18053
345 1 . 1 1 79 79 VAL CB C 509 33.676 33.676 35.015 -1.339 18053
346 1 . 1 1 79 79 VAL H H 509 8.534 8.534 8.556 -0.022 18053
347 1 . 1 1 80 80 THR N N 510 124.533 124.533 125.841 -1.308 18053
348 1 . 1 1 80 80 THR HA H 510 4.586 4.586 4.885 -0.299 18053
349 1 . 1 1 80 80 THR C C 510 172.215 172.215 174.056 -1.841 18053
350 1 . 1 1 80 80 THR CA C 510 62.119 62.119 61.842 0.277 18053
351 1 . 1 1 80 80 THR CB C 510 69.407 69.407 69.189 0.218 18053
352 1 . 1 1 80 80 THR H H 510 8.301 8.301 8.771 -0.470 18053
353 1 . 1 1 81 81 VAL N N 511 127.002 127.002 127.435 -0.433 18053
354 1 . 1 1 81 81 VAL HA H 511 4.596 4.596 4.618 -0.022 18053
355 1 . 1 1 81 81 VAL C C 511 176.667 176.667 175.557 1.110 18053
356 1 . 1 1 81 81 VAL CA C 511 61.382 61.382 61.970 -0.588 18053
357 1 . 1 1 81 81 VAL CB C 511 30.945 30.945 31.160 -0.215 18053
358 1 . 1 1 81 81 VAL H H 511 8.796 8.796 8.705 0.090 18053
359 1 . 1 1 82 82 TRP N N 512 131.479 131.479 129.270 2.209 18053
360 1 . 1 1 82 82 TRP HA H 512 5.338 5.338 5.286 0.052 18053
361 1 . 1 1 82 82 TRP C C 512 176.885 176.885 175.486 1.399 18053
362 1 . 1 1 82 82 TRP CA C 512 56.442 56.442 56.924 -0.482 18053
363 1 . 1 1 82 82 TRP CB C 512 30.701 30.701 31.553 -0.852 18053
364 1 . 1 1 82 82 TRP H H 512 9.924 9.924 9.148 0.776 18053
365 1 . 1 1 83 83 ALA N N 513 123.954 123.954 120.760 3.193 18053
366 1 . 1 1 83 83 ALA HA H 513 4.308 4.308 4.862 -0.554 18053
367 1 . 1 1 83 83 ALA C C 513 178.140 178.140 178.006 0.134 18053
368 1 . 1 1 83 83 ALA CA C 513 52.211 52.211 50.553 1.658 18053
369 1 . 1 1 83 83 ALA CB C 513 18.745 18.745 20.614 -1.869 18053
370 1 . 1 1 83 83 ALA H H 513 9.048 9.048 8.652 0.396 18053
371 1 . 1 1 84 84 ALA N N 514 125.146 125.146 124.769 0.377 18053
372 1 . 1 1 84 84 ALA HA H 514 3.951 3.951 4.130 -0.179 18053
373 1 . 1 1 84 84 ALA C C 514 179.519 179.519 178.981 0.538 18053
374 1 . 1 1 84 84 ALA CA C 514 54.804 54.804 54.795 0.009 18053
375 1 . 1 1 84 84 ALA CB C 514 18.582 18.582 19.044 -0.462 18053
376 1 . 1 1 84 84 ALA H H 514 8.341 8.341 8.294 0.047 18053
377 1 . 1 1 85 85 GLY N N 515 103.388 103.388 104.682 -1.294 18053
378 1 . 1 1 85 85 GLY C C 515 174.674 174.674 174.839 -0.165 18053
379 1 . 1 1 85 85 GLY CA C 515 45.878 45.878 45.056 0.822 18053
380 1 . 1 1 85 85 GLY H H 515 7.996 7.996 7.868 0.128 18053
381 1 . 1 1 86 86 ALA N N 516 120.140 120.140 123.108 -2.968 18053
382 1 . 1 1 86 86 ALA HA H 516 4.344 4.344 4.479 -0.135 18053
383 1 . 1 1 86 86 ALA C C 516 177.690 177.690 178.039 -0.349 18053
384 1 . 1 1 86 86 ALA CA C 516 53.139 53.139 52.191 0.948 18053
385 1 . 1 1 86 86 ALA CB C 516 20.547 20.547 19.319 1.228 18053
386 1 . 1 1 86 86 ALA H H 516 7.474 7.474 7.362 0.112 18053
387 1 . 1 1 87 87 GLY N N 517 105.720 105.720 107.509 -1.789 18053
388 1 . 1 1 87 87 GLY C C 517 173.650 173.650 174.407 -0.757 18053
389 1 . 1 1 87 87 GLY CA C 517 46.014 46.014 45.356 0.658 18053
390 1 . 1 1 87 87 GLY H H 517 7.779 7.779 7.914 -0.135 18053
391 1 . 1 1 88 88 VAL N N 518 121.537 121.537 119.147 2.390 18053
392 1 . 1 1 88 88 VAL HA H 518 3.585 3.585 4.104 -0.519 18053
393 1 . 1 1 88 88 VAL C C 518 174.851 174.851 174.885 -0.034 18053
394 1 . 1 1 88 88 VAL CA C 518 61.274 61.274 61.022 0.252 18053
395 1 . 1 1 88 88 VAL CB C 518 33.376 33.376 33.130 0.246 18053
396 1 . 1 1 88 88 VAL H H 518 7.499 7.499 7.677 -0.178 18053
397 1 . 1 1 89 89 ALA N N 519 128.295 128.295 129.530 -1.235 18053
398 1 . 1 1 89 89 ALA HA H 519 4.192 4.192 4.385 -0.193 18053
399 1 . 1 1 89 89 ALA C C 519 176.680 176.680 176.571 0.109 18053
400 1 . 1 1 89 89 ALA CA C 519 51.283 51.283 51.459 -0.176 18053
401 1 . 1 1 89 89 ALA CB C 519 19.292 19.292 19.318 -0.026 18053
402 1 . 1 1 89 89 ALA H H 519 7.960 7.960 8.122 -0.162 18053
403 1 . 1 1 90 90 HIS N N 520 122.643 122.643 123.790 -1.147 18053
404 1 . 1 1 90 90 HIS HA H 520 4.033 4.033 4.396 -0.363 18053
405 1 . 1 1 90 90 HIS C C 520 175.793 175.793 174.452 1.341 18053
406 1 . 1 1 90 90 HIS CA C 520 58.653 58.653 56.194 2.459 18053
407 1 . 1 1 90 90 HIS CB C 520 32.285 32.285 29.832 2.453 18053
408 1 . 1 1 90 90 HIS H H 520 8.394 8.394 8.827 -0.433 18053
409 1 . 1 1 91 91 SER N N 521 121.247 121.247 123.709 -2.462 18053
410 1 . 1 1 91 91 SER HA H 521 4.629 4.629 4.725 -0.096 18053
411 1 . 1 1 91 91 SER CA C 521 55.843 55.843 55.980 -0.137 18053
412 1 . 1 1 91 91 SER CB C 521 62.367 62.367 63.515 -1.148 18053
413 1 . 1 1 91 91 SER H H 521 8.569 8.569 8.404 0.165 18053
414 1 . 1 1 92 92 PRO HA H 522 4.002 4.002 4.806 -0.804 18053
415 1 . 1 1 92 92 PRO CA C 522 62.244 62.244 62.280 -0.036 18053
416 1 . 1 1 92 92 PRO CB C 522 30.931 30.931 31.509 -0.578 18053
417 1 . 1 1 93 93 PRO HA H 523 4.672 4.672 4.819 -0.147 18053
418 1 . 1 1 93 93 PRO C C 523 177.786 177.786 177.891 -0.105 18053
419 1 . 1 1 93 93 PRO CA C 523 64.003 64.003 63.934 0.069 18053
420 1 . 1 1 93 93 PRO CB C 523 34.905 34.905 32.451 2.454 18053
421 1 . 1 1 94 94 SER N N 524 117.212 117.212 116.671 0.541 18053
422 1 . 1 1 94 94 SER HA H 524 4.678 4.678 4.550 0.128 18053
423 1 . 1 1 94 94 SER C C 524 174.851 174.851 174.565 0.286 18053
424 1 . 1 1 94 94 SER CA C 524 61.874 61.874 60.965 0.908 18053
425 1 . 1 1 94 94 SER CB C 524 64.057 64.057 63.843 0.214 18053
426 1 . 1 1 94 94 SER H H 524 8.463 8.463 8.160 0.303 18053
427 1 . 1 1 95 95 THR N N 525 121.588 121.588 119.117 2.471 18053
428 1 . 1 1 95 95 THR HA H 525 4.859 4.859 5.012 -0.153 18053
429 1 . 1 1 95 95 THR C C 525 172.094 172.094 173.061 -0.967 18053
430 1 . 1 1 95 95 THR CA C 525 62.309 62.309 62.130 0.179 18053
431 1 . 1 1 95 95 THR CB C 525 70.281 70.281 69.415 0.866 18053
432 1 . 1 1 95 95 THR H H 525 7.631 7.631 7.962 -0.331 18053
433 1 . 1 1 96 96 LEU N N 526 127.274 127.274 129.134 -1.860 18053
434 1 . 1 1 96 96 LEU HA H 526 5.131 5.131 4.998 0.133 18053
435 1 . 1 1 96 96 LEU C C 526 175.916 175.916 175.579 0.337 18053
436 1 . 1 1 96 96 LEU CA C 526 52.075 52.075 54.110 -2.035 18053
437 1 . 1 1 96 96 LEU CB C 526 43.790 43.790 43.846 -0.056 18053
438 1 . 1 1 96 96 LEU H H 526 8.977 8.977 8.331 0.646 18053
439 1 . 1 1 97 97 VAL N N 527 124.056 124.056 121.649 2.407 18053
440 1 . 1 1 97 97 VAL HA H 527 4.869 4.869 4.536 0.333 18053
441 1 . 1 1 97 97 VAL C C 527 176.230 176.230 175.244 0.986 18053
442 1 . 1 1 97 97 VAL CA C 527 61.519 61.519 61.288 0.231 18053
443 1 . 1 1 97 97 VAL CB C 527 33.704 33.704 33.655 0.049 18053
444 1 . 1 1 97 97 VAL H H 527 10.724 10.724 8.008 2.716 18053
445 1 . 1 1 98 98 TRP N N 528 132.586 132.586 131.085 1.501 18053
446 1 . 1 1 98 98 TRP HA H 528 4.965 4.965 4.346 0.619 18053
447 1 . 1 1 98 98 TRP C C 528 173.391 173.391 174.601 -1.210 18053
448 1 . 1 1 98 98 TRP CA C 528 53.303 53.303 55.159 -1.855 18053
449 1 . 1 1 98 98 TRP CB C 528 28.245 28.245 28.405 -0.160 18053
450 1 . 1 1 98 98 TRP H H 528 9.400 9.400 8.811 0.589 18053
451 1 . 1 1 99 99 LYS N N 529 126.644 126.644 128.447 -1.803 18053
452 1 . 1 1 99 99 LYS HA H 529 3.839 3.839 4.132 -0.293 18053
453 1 . 1 1 99 99 LYS C C 529 177.581 177.581 177.219 0.362 18053
454 1 . 1 1 99 99 LYS CA C 529 58.543 58.543 57.369 1.174 18053
455 1 . 1 1 99 99 LYS CB C 529 32.176 32.176 32.629 -0.453 18053
456 1 . 1 1 99 99 LYS H H 529 8.153 8.153 8.043 0.110 18053
457 1 . 1 1 100 100 GLY N N 530 110.385 110.385 113.239 -2.854 18053
458 1 . 1 1 100 100 GLY C C 530 172.367 172.367 173.711 -1.344 18053
459 1 . 1 1 100 100 GLY CA C 530 45.278 45.278 44.852 0.426 18053
460 1 . 1 1 100 100 GLY H H 530 8.363 8.363 8.567 -0.204 18053
461 1 . 1 1 101 101 GLN N N 531 121.162 121.162 121.853 -0.691 18053
462 1 . 1 1 101 101 GLN HA H 531 3.972 3.972 4.225 -0.253 18053
463 1 . 1 1 101 101 GLN CA C 531 52.620 52.620 53.958 -1.338 18053
464 1 . 1 1 101 101 GLN CB C 531 27.595 27.595 28.343 -0.748 18053
465 1 . 1 1 101 101 GLN H H 531 6.815 6.815 7.287 -0.472 18053
466 1 . 1 1 102 102 SER N N 532 122.728 122.728 122.185 0.543 18053
467 1 . 1 1 102 102 SER HA H 532 3.866 3.866 4.402 -0.536 18053
468 1 . 1 1 102 102 SER C C 532 174.537 174.537 175.843 -1.306 18053
469 1 . 1 1 102 102 SER CA C 532 61.983 61.983 60.991 0.992 18053
470 1 . 1 1 102 102 SER CB C 532 62.802 62.802 63.265 -0.463 18053
471 1 . 1 1 102 102 SER H H 532 8.662 8.662 8.694 -0.032 18053
472 1 . 1 1 103 103 SER N N 533 110.811 110.811 116.159 -5.348 18053
473 1 . 1 1 103 103 SER HA H 533 4.240 4.240 4.430 -0.190 18053
474 1 . 1 1 103 103 SER C C 533 174.087 174.087 174.450 -0.363 18053
475 1 . 1 1 103 103 SER CA C 533 56.633 56.633 58.880 -2.247 18053
476 1 . 1 1 103 103 SER CB C 533 64.658 64.658 63.648 1.010 18053
477 1 . 1 1 103 103 SER H H 533 7.134 7.134 7.839 -0.705 18053
478 1 . 1 1 104 104 TRP N N 534 126.133 126.133 121.156 4.977 18053
479 1 . 1 1 104 104 TRP HA H 534 4.098 4.098 4.151 -0.053 18053
480 1 . 1 1 104 104 TRP C C 534 176.066 176.066 175.489 0.577 18053
481 1 . 1 1 104 104 TRP CA C 534 60.127 60.127 57.605 2.522 18053
482 1 . 1 1 104 104 TRP CB C 534 28.764 28.764 28.750 0.014 18053
483 1 . 1 1 104 104 TRP H H 534 9.764 9.764 7.829 1.935 18053
484 1 . 1 1 105 105 GLY N N 535 105.907 105.907 105.620 0.287 18053
485 1 . 1 1 105 105 GLY C C 535 172.217 172.217 174.047 -1.830 18053
486 1 . 1 1 105 105 GLY CA C 535 44.240 44.240 44.932 -0.692 18053
487 1 . 1 1 105 105 GLY H H 535 8.095 8.095 7.864 0.231 18053
488 1 . 1 1 106 106 THR N N 536 111.253 111.253 113.702 -2.449 18053
489 1 . 1 1 106 106 THR HA H 536 3.859 3.859 4.245 -0.386 18053
490 1 . 1 1 106 106 THR C C 536 172.872 172.872 174.324 -1.452 18053
491 1 . 1 1 106 106 THR CA C 536 59.635 59.635 61.991 -2.356 18053
492 1 . 1 1 106 106 THR CB C 536 70.526 70.526 69.652 0.874 18053
493 1 . 1 1 106 106 THR H H 536 7.913 7.913 7.733 0.180 18053
494 1 . 1 1 107 107 GLY N N 537 107.712 107.712 111.850 -4.138 18053
495 1 . 1 1 107 107 GLY C C 537 172.709 172.709 173.190 -0.481 18053
496 1 . 1 1 107 107 GLY CA C 537 45.166 45.166 45.164 0.002 18053
497 1 . 1 1 107 107 GLY H H 537 7.533 7.533 8.004 -0.471 18053
498 1 . 1 1 108 108 GLU N N 538 118.864 118.864 119.261 -0.396 18053
499 1 . 1 1 108 108 GLU HA H 538 4.136 4.136 4.246 -0.110 18053
500 1 . 1 1 108 108 GLU C C 538 176.353 176.353 175.650 0.702 18053
501 1 . 1 1 108 108 GLU CA C 538 58.352 58.352 57.865 0.487 18053
502 1 . 1 1 108 108 GLU CB C 538 30.156 30.156 30.450 -0.294 18053
503 1 . 1 1 108 108 GLU H H 538 8.558 8.558 8.658 -0.100 18053
504 1 . 1 1 109 109 SER N N 539 110.419 110.419 112.890 -2.471 18053
505 1 . 1 1 109 109 SER HA H 539 4.963 4.963 4.898 0.065 18053
506 1 . 1 1 109 109 SER C C 539 173.787 173.787 172.711 1.076 18053
507 1 . 1 1 109 109 SER CA C 539 57.125 57.125 57.538 -0.413 18053
508 1 . 1 1 109 109 SER CB C 539 64.439 64.439 65.152 -0.713 18053
509 1 . 1 1 109 109 SER H H 539 7.620 7.620 7.739 -0.119 18053
510 1 . 1 1 110 110 PHE N N 540 118.778 118.778 118.960 -0.182 18053
511 1 . 1 1 110 110 PHE HA H 540 5.081 5.081 5.241 -0.160 18053
512 1 . 1 1 110 110 PHE C C 540 176.052 176.052 173.266 2.786 18053
513 1 . 1 1 110 110 PHE CA C 540 56.789 56.789 56.474 0.315 18053
514 1 . 1 1 110 110 PHE CB C 540 40.760 40.760 41.973 -1.213 18053
515 1 . 1 1 110 110 PHE H H 540 8.318 8.318 8.540 -0.222 18053
516 1 . 1 1 112 112 THR HA H 542 5.468 5.468 4.930 0.538 18053
517 1 . 1 1 112 112 THR C C 542 172.381 172.381 173.580 -1.199 18053
518 1 . 1 1 112 112 THR CA C 542 61.818 61.818 62.845 -1.027 18053
519 1 . 1 1 112 112 THR CB C 542 70.990 70.990 69.703 1.287 18053
520 1 . 1 1 113 113 VAL N N 543 124.771 124.771 127.248 -2.477 18053
521 1 . 1 1 113 113 VAL HA H 543 4.864 4.864 4.520 0.345 18053
522 1 . 1 1 113 113 VAL C C 543 173.132 173.132 174.050 -0.919 18053
523 1 . 1 1 113 113 VAL CA C 543 60.099 60.099 61.015 -0.916 18053
524 1 . 1 1 113 113 VAL CB C 543 36.433 36.433 34.476 1.957 18053
525 1 . 1 1 113 113 VAL H H 543 9.380 9.380 8.822 0.558 18053
526 1 . 1 1 114 114 LEU N N 544 128.789 128.789 128.676 0.112 18053
527 1 . 1 1 114 114 LEU HA H 544 5.320 5.320 4.978 0.342 18053
528 1 . 1 1 114 114 LEU C C 544 174.237 174.237 174.999 -0.762 18053
529 1 . 1 1 114 114 LEU CA C 544 53.193 53.193 53.891 -0.698 18053
530 1 . 1 1 114 114 LEU CB C 544 45.879 45.879 44.161 1.718 18053
531 1 . 1 1 114 114 LEU H H 544 8.948 8.948 8.479 0.469 18053
532 1 . 1 1 115 115 VAL N N 545 127.002 127.002 126.365 0.637 18053
533 1 . 1 1 115 115 VAL HA H 545 4.854 4.854 4.668 0.186 18053
534 1 . 1 1 115 115 VAL C C 545 175.206 175.206 174.818 0.388 18053
535 1 . 1 1 115 115 VAL CA C 545 59.334 59.334 60.161 -0.827 18053
536 1 . 1 1 115 115 VAL CB C 545 34.495 34.495 34.557 -0.062 18053
537 1 . 1 1 115 115 VAL H H 545 9.564 9.564 8.850 0.714 18053
538 1 . 1 1 116 116 ASN N N 546 121.179 121.179 122.532 -1.353 18053
539 1 . 1 1 116 116 ASN HA H 546 2.897 2.897 3.786 -0.889 18053
540 1 . 1 1 116 116 ASN C C 546 176.885 176.885 175.355 1.530 18053
541 1 . 1 1 116 116 ASN CA C 546 50.409 50.409 51.129 -0.720 18053
542 1 . 1 1 116 116 ASN CB C 546 36.639 36.639 39.550 -2.911 18053
543 1 . 1 1 116 116 ASN H H 546 8.016 8.016 7.911 0.105 18053
544 1 . 1 1 117 117 ALA N N 547 119.834 119.834 121.382 -1.548 18053
545 1 . 1 1 117 117 ALA HA H 547 3.866 3.866 4.039 -0.173 18053
546 1 . 1 1 117 117 ALA C C 547 177.772 177.772 178.346 -0.574 18053
547 1 . 1 1 117 117 ALA CA C 547 54.504 54.504 54.458 0.046 18053
548 1 . 1 1 117 117 ALA CB C 547 18.200 18.200 18.450 -0.250 18053
549 1 . 1 1 117 117 ALA H H 547 6.444 6.444 8.122 -1.678 18053
550 1 . 1 1 118 118 ASP N N 548 115.646 115.646 117.399 -1.753 18053
551 1 . 1 1 118 118 ASP HA H 548 4.644 4.644 4.384 0.260 18053
552 1 . 1 1 118 118 ASP C C 548 176.052 176.052 177.435 -1.383 18053
553 1 . 1 1 118 118 ASP CA C 548 54.067 54.067 55.447 -1.380 18053
554 1 . 1 1 118 118 ASP CB C 548 41.674 41.674 41.261 0.414 18053
555 1 . 1 1 118 118 ASP H H 548 7.181 7.181 8.018 -0.837 18053
556 1 . 1 1 119 119 GLY N N 549 107.167 107.167 106.686 0.481 18053
557 1 . 1 1 119 119 GLY C C 549 173.841 173.841 173.714 0.127 18053
558 1 . 1 1 119 119 GLY CA C 549 45.455 45.455 44.734 0.721 18053
559 1 . 1 1 119 119 GLY H H 549 7.738 7.738 7.648 0.090 18053
560 1 . 1 1 120 120 GLU N N 550 121.196 121.196 120.474 0.722 18053
561 1 . 1 1 120 120 GLU HA H 550 4.112 4.112 4.289 -0.177 18053
562 1 . 1 1 120 120 GLU C C 550 175.588 175.588 175.621 -0.032 18053
563 1 . 1 1 120 120 GLU CA C 550 54.831 54.831 55.579 -0.748 18053
564 1 . 1 1 120 120 GLU CB C 550 29.937 29.937 30.355 -0.418 18053
565 1 . 1 1 120 120 GLU H H 550 7.587 7.587 7.774 -0.187 18053
566 1 . 1 1 121 121 GLU N N 551 123.886 123.886 123.794 0.092 18053
567 1 . 1 1 121 121 GLU HA H 551 4.276 4.276 4.291 -0.015 18053
568 1 . 1 1 121 121 GLU C C 551 176.817 176.817 176.400 0.417 18053
569 1 . 1 1 121 121 GLU CA C 551 56.796 56.796 56.519 0.277 18053
570 1 . 1 1 121 121 GLU CB C 551 28.955 28.955 29.014 -0.060 18053
571 1 . 1 1 121 121 GLU H H 551 8.697 8.697 8.718 -0.021 18053
572 1 . 1 1 122 122 VAL N N 552 120.055 120.055 120.428 -0.373 18053
573 1 . 1 1 122 122 VAL HA H 552 4.364 4.364 4.037 0.327 18053
574 1 . 1 1 122 122 VAL C C 552 175.998 175.998 175.298 0.701 18053
575 1 . 1 1 122 122 VAL CA C 552 61.655 61.655 62.801 -1.146 18053
576 1 . 1 1 122 122 VAL CB C 552 33.049 33.049 32.389 0.661 18053
577 1 . 1 1 122 122 VAL H H 552 8.845 8.845 8.130 0.715 18053
578 1 . 1 1 123 123 ALA N N 553 122.098 122.098 120.675 1.423 18053
579 1 . 1 1 123 123 ALA HA H 553 4.890 4.890 4.704 0.186 18053
580 1 . 1 1 123 123 ALA C C 553 175.261 175.261 175.082 0.179 18053
581 1 . 1 1 123 123 ALA CA C 553 52.757 52.757 51.449 1.308 18053
582 1 . 1 1 123 123 ALA CB C 553 22.267 22.267 21.930 0.337 18053
583 1 . 1 1 123 123 ALA H H 553 7.788 7.788 7.708 0.079 18053
584 1 . 1 1 124 124 MET N N 554 118.217 118.217 120.722 -2.505 18053
585 1 . 1 1 124 124 MET HA H 554 5.286 5.286 5.043 0.243 18053
586 1 . 1 1 124 124 MET C C 554 174.428 174.428 174.310 0.118 18053
587 1 . 1 1 124 124 MET CA C 554 55.104 55.104 55.569 -0.465 18053
588 1 . 1 1 124 124 MET CB C 554 35.342 35.342 36.264 -0.922 18053
589 1 . 1 1 124 124 MET H H 554 8.693 8.693 8.483 0.210 18053
590 1 . 1 1 125 125 ARG N N 555 122.132 122.132 126.180 -4.048 18053
591 1 . 1 1 125 125 ARG HA H 555 4.900 4.900 4.764 0.136 18053
592 1 . 1 1 125 125 ARG CA C 555 56.388 56.388 55.357 1.031 18053
593 1 . 1 1 125 125 ARG CB C 555 34.378 34.378 33.384 0.994 18053
594 1 . 1 1 125 125 ARG H H 555 8.919 8.919 8.980 -0.061 18053
595 1 . 1 1 126 126 THR HA H 556 4.685 4.685 4.515 0.170 18053
596 1 . 1 1 126 126 THR C C 556 172.436 172.436 173.730 -1.294 18053
597 1 . 1 1 126 126 THR CA C 556 61.382 61.382 62.651 -1.269 18053
598 1 . 1 1 126 126 THR CB C 556 70.444 70.444 69.349 1.095 18053
599 1 . 1 1 127 127 VAL N N 557 124.976 124.976 127.257 -2.281 18053
600 1 . 1 1 127 127 VAL HA H 557 4.146 4.146 4.176 -0.030 18053
601 1 . 1 1 127 127 VAL C C 557 173.937 173.937 173.711 0.226 18053
602 1 . 1 1 127 127 VAL CA C 557 61.109 61.109 60.496 0.613 18053
603 1 . 1 1 127 127 VAL CB C 557 33.759 33.759 33.727 0.032 18053
604 1 . 1 1 127 127 VAL H H 557 8.127 8.127 8.498 -0.371 18053
605 1 . 1 1 128 128 LYS N N 558 125.384 125.384 126.048 -0.664 18053
606 1 . 1 1 128 128 LYS HA H 558 4.706 4.706 4.499 0.206 18053
607 1 . 1 1 128 128 LYS C C 558 175.534 175.534 175.553 -0.019 18053
608 1 . 1 1 128 128 LYS CA C 558 54.886 54.886 53.748 1.138 18053
609 1 . 1 1 128 128 LYS CB C 558 34.673 34.673 33.692 0.981 18053
610 1 . 1 1 128 128 LYS H H 558 8.289 8.289 8.301 -0.012 18053
611 1 . 1 1 129 129 LYS N N 559 124.005 124.005 125.743 -1.738 18053
612 1 . 1 1 129 129 LYS HA H 559 4.310 4.310 4.158 0.152 18053
613 1 . 1 1 129 129 LYS C C 559 176.571 176.571 176.134 0.437 18053
614 1 . 1 1 129 129 LYS CA C 559 56.742 56.742 57.125 -0.384 18053
615 1 . 1 1 129 129 LYS CB C 559 33.362 33.362 31.827 1.535 18053
616 1 . 1 1 129 129 LYS H H 559 8.461 8.461 8.220 0.241 18053
617 1 . 1 1 130 130 SER N N 560 117.195 117.195 120.793 -3.598 18053
618 1 . 1 1 130 130 SER HA H 560 4.384 4.384 4.496 -0.112 18053
619 1 . 1 1 130 130 SER C C 560 174.565 174.565 174.059 0.506 18053
620 1 . 1 1 130 130 SER CA C 560 58.434 58.434 58.622 -0.188 18053
621 1 . 1 1 130 130 SER CB C 560 63.812 63.812 63.763 0.049 18053
622 1 . 1 1 130 130 SER H H 560 8.465 8.465 8.305 0.160 18053
623 1 . 1 1 131 131 SER N N 561 118.149 118.149 116.927 1.222 18053
624 1 . 1 1 131 131 SER HA H 561 4.412 4.412 4.477 -0.065 18053
625 1 . 1 1 131 131 SER C C 561 174.456 174.456 173.964 0.492 18053
626 1 . 1 1 131 131 SER CA C 561 58.489 58.489 58.165 0.324 18053
627 1 . 1 1 131 131 SER CB C 561 63.811 63.811 64.029 -0.218 18053
628 1 . 1 1 131 131 SER H H 561 8.336 8.336 8.019 0.317 18053
629 1 . 1 1 132 132 VAL N N 562 121.332 121.332 121.516 -0.184 18053
630 1 . 1 1 132 132 VAL HA H 562 4.035 4.035 4.151 -0.116 18053
631 1 . 1 1 132 132 VAL C C 562 176.066 176.066 175.459 0.607 18053
632 1 . 1 1 132 132 VAL CA C 562 62.446 62.446 62.542 -0.096 18053
633 1 . 1 1 132 132 VAL CB C 562 32.394 32.394 31.985 0.409 18053
634 1 . 1 1 132 132 VAL H H 562 7.982 7.982 8.400 -0.418 18053
635 1 . 1 1 133 133 MET N N 563 124.022 124.022 120.298 3.724 18053
636 1 . 1 1 133 133 MET HA H 563 4.385 4.385 4.499 -0.114 18053
637 1 . 1 1 133 133 MET C C 563 176.039 176.039 175.719 0.320 18053
638 1 . 1 1 133 133 MET CA C 563 55.350 55.350 55.465 -0.115 18053
639 1 . 1 1 133 133 MET CB C 563 32.503 32.503 32.808 -0.305 18053
640 1 . 1 1 133 133 MET H H 563 8.295 8.295 7.696 0.599 18053
641 1 . 1 1 134 134 ARG N N 564 122.677 122.677 122.478 0.199 18053
642 1 . 1 1 134 134 ARG HA H 564 4.262 4.262 4.413 -0.151 18053
643 1 . 1 1 134 134 ARG C C 564 176.298 176.298 175.882 0.416 18053
644 1 . 1 1 134 134 ARG CA C 564 56.087 56.087 55.664 0.423 18053
645 1 . 1 1 134 134 ARG CB C 564 30.702 30.702 30.902 -0.200 18053
646 1 . 1 1 134 134 ARG H H 564 8.295 8.295 8.433 -0.138 18053
647 1 . 1 1 135 135 GLU N N 565 121.945 121.945 122.218 -0.273 18053
648 1 . 1 1 135 135 GLU HA H 565 4.160 4.160 4.277 -0.117 18053
649 1 . 1 1 135 135 GLU C C 565 176.080 176.080 175.951 0.129 18053
650 1 . 1 1 135 135 GLU CA C 565 56.906 56.906 56.594 0.312 18053
651 1 . 1 1 135 135 GLU CB C 565 29.774 29.774 29.646 0.128 18053
652 1 . 1 1 135 135 GLU H H 565 8.470 8.470 8.661 -0.191 18053
653 1 . 1 1 136 136 ASN N N 566 118.761 118.761 121.721 -2.960 18053
654 1 . 1 1 136 136 ASN HA H 566 4.617 4.617 4.739 -0.122 18053
655 1 . 1 1 136 136 ASN C C 566 175.315 175.315 175.479 -0.164 18053
656 1 . 1 1 136 136 ASN CA C 566 53.193 53.193 53.526 -0.333 18053
657 1 . 1 1 136 136 ASN CB C 566 38.836 38.836 38.593 0.243 18053
658 1 . 1 1 136 136 ASN H H 566 8.341 8.341 8.563 -0.222 18053
659 1 . 1 1 137 137 GLU N N 567 121.349 121.349 121.501 -0.152 18053
660 1 . 1 1 137 137 GLU HA H 567 4.152 4.152 4.217 -0.065 18053
661 1 . 1 1 137 137 GLU C C 567 176.243 176.243 176.497 -0.254 18053
662 1 . 1 1 137 137 GLU CA C 567 56.906 56.906 57.610 -0.705 18053
663 1 . 1 1 137 137 GLU CB C 567 29.992 29.992 29.933 0.059 18053
664 1 . 1 1 137 137 GLU H H 567 8.349 8.349 8.421 -0.072 18053
665 1 . 1 1 138 138 ASN N N 568 118.761 118.761 118.490 0.271 18053
666 1 . 1 1 138 138 ASN HA H 568 4.712 4.712 4.720 -0.008 18053
667 1 . 1 1 138 138 ASN C C 568 174.551 174.551 174.663 -0.112 18053
668 1 . 1 1 138 138 ASN CA C 568 53.193 53.193 53.318 -0.125 18053
669 1 . 1 1 138 138 ASN CB C 568 39.327 39.327 38.605 0.722 18053
670 1 . 1 1 138 138 ASN H H 568 8.397 8.397 8.221 0.176 18053
stop_
save_