data_18522
save_entry_information
_Entry.Sf_category entry_information
_Entry.NMR_STAR_version 3.0.9.13
_Entry.Entry_ID 18522
_Entry.PDB_ID 2LUI
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 18522
_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 3 3 PRO C C 15 177.225 177.225 176.940 0.285 18522
2 1 1 . 1 1 3 3 PRO CA C 15 63.508 63.508 63.044 0.464 18522
3 1 1 . 1 1 3 3 PRO CB C 15 32.090 32.090 31.630 0.461 18522
4 1 1 . 1 1 4 4 GLY N N 16 108.829 108.829 110.695 -1.866 18522
5 1 1 . 1 1 4 4 GLY C C 16 173.398 173.398 174.815 -1.417 18522
6 1 1 . 1 1 4 4 GLY CA C 16 45.128 45.128 45.130 -0.002 18522
7 1 1 . 1 1 4 4 GLY H H 16 8.489 8.489 7.931 0.558 18522
8 1 1 . 1 1 5 5 ILE N N 17 121.763 121.763 118.808 2.955 18522
9 1 1 . 1 1 5 5 ILE HA H 17 4.554 4.554 4.519 0.035 18522
10 1 1 . 1 1 5 5 ILE C C 17 174.332 174.332 174.701 -0.369 18522
11 1 1 . 1 1 5 5 ILE CA C 17 58.245 58.245 58.706 -0.461 18522
12 1 1 . 1 1 5 5 ILE CB C 17 38.762 38.762 37.669 1.093 18522
13 1 1 . 1 1 5 5 ILE H H 17 8.014 8.014 7.964 0.050 18522
14 1 1 . 1 1 6 6 PRO C C 18 176.437 176.437 176.557 -0.120 18522
15 1 1 . 1 1 6 6 PRO CA C 18 62.667 62.667 64.110 -1.443 18522
16 1 1 . 1 1 6 6 PRO CB C 18 32.469 32.469 32.179 0.290 18522
17 1 1 . 1 1 7 7 VAL N N 19 123.849 123.849 115.359 8.490 18522
18 1 1 . 1 1 7 7 VAL HA H 19 4.550 4.550 4.537 0.013 18522
19 1 1 . 1 1 7 7 VAL C C 19 174.453 174.453 174.133 0.320 18522
20 1 1 . 1 1 7 7 VAL CA C 19 59.846 59.846 58.771 1.075 18522
21 1 1 . 1 1 7 7 VAL CB C 19 33.510 33.510 31.352 2.158 18522
22 1 1 . 1 1 7 7 VAL H H 19 8.754 8.754 7.940 0.814 18522
23 1 1 . 1 1 8 8 PRO HA H 20 5.338 5.338 5.340 -0.002 18522
24 1 1 . 1 1 8 8 PRO C C 20 177.585 177.585 176.413 1.172 18522
25 1 1 . 1 1 8 8 PRO CA C 20 62.406 62.406 61.663 0.743 18522
26 1 1 . 1 1 8 8 PRO CB C 20 32.891 32.891 32.584 0.307 18522
27 1 1 . 1 1 9 9 GLY N N 21 108.426 108.426 108.853 -0.427 18522
28 1 1 . 1 1 9 9 GLY C C 21 171.443 171.443 171.275 0.168 18522
29 1 1 . 1 1 9 9 GLY CA C 21 44.581 44.581 44.493 0.088 18522
30 1 1 . 1 1 9 9 GLY H H 21 8.258 8.258 8.459 -0.201 18522
31 1 1 . 1 1 10 10 LYS N N 22 117.372 117.372 118.626 -1.254 18522
32 1 1 . 1 1 10 10 LYS HA H 22 4.039 4.039 5.304 -1.265 18522
33 1 1 . 1 1 10 10 LYS C C 22 174.463 174.463 174.704 -0.241 18522
34 1 1 . 1 1 10 10 LYS CA C 22 55.263 55.263 54.906 0.357 18522
35 1 1 . 1 1 10 10 LYS CB C 22 35.227 35.227 36.447 -1.220 18522
36 1 1 . 1 1 10 10 LYS H H 22 8.175 8.175 8.047 0.128 18522
37 1 1 . 1 1 11 11 VAL N N 23 120.387 120.387 121.726 -1.339 18522
38 1 1 . 1 1 11 11 VAL HA H 23 4.708 4.708 4.455 0.253 18522
39 1 1 . 1 1 11 11 VAL C C 23 171.873 171.873 174.139 -2.266 18522
40 1 1 . 1 1 11 11 VAL CA C 23 59.866 59.866 60.513 -0.647 18522
41 1 1 . 1 1 11 11 VAL CB C 23 35.269 35.269 36.164 -0.895 18522
42 1 1 . 1 1 11 11 VAL H H 23 8.862 8.862 8.670 0.192 18522
43 1 1 . 1 1 12 12 THR N N 24 125.797 125.797 123.303 2.494 18522
44 1 1 . 1 1 12 12 THR HA H 24 5.121 5.121 4.876 0.245 18522
45 1 1 . 1 1 12 12 THR C C 24 173.407 173.407 173.543 -0.136 18522
46 1 1 . 1 1 12 12 THR CA C 24 62.115 62.115 60.965 1.149 18522
47 1 1 . 1 1 12 12 THR CB C 24 69.606 69.606 68.932 0.674 18522
48 1 1 . 1 1 12 12 THR H H 24 8.859 8.859 8.355 0.504 18522
49 1 1 . 1 1 13 13 LEU N N 25 127.960 127.960 127.241 0.719 18522
50 1 1 . 1 1 13 13 LEU HA H 25 4.809 4.809 4.853 -0.044 18522
51 1 1 . 1 1 13 13 LEU C C 25 175.029 175.029 174.937 0.092 18522
52 1 1 . 1 1 13 13 LEU CA C 25 52.623 52.623 53.021 -0.398 18522
53 1 1 . 1 1 13 13 LEU CB C 25 46.242 46.242 44.715 1.527 18522
54 1 1 . 1 1 13 13 LEU H H 25 9.258 9.258 9.042 0.216 18522
55 1 1 . 1 1 14 14 GLN N N 26 120.858 120.858 116.710 4.148 18522
56 1 1 . 1 1 14 14 GLN HA H 26 4.482 4.482 4.558 -0.076 18522
57 1 1 . 1 1 14 14 GLN C C 26 174.515 174.515 174.813 -0.298 18522
58 1 1 . 1 1 14 14 GLN CA C 26 54.576 54.576 54.161 0.415 18522
59 1 1 . 1 1 14 14 GLN CB C 26 29.516 29.516 32.683 -3.167 18522
60 1 1 . 1 1 14 14 GLN H H 26 8.530 8.530 8.302 0.228 18522
61 1 1 . 1 1 15 15 LYS N N 27 119.583 119.583 121.476 -1.893 18522
62 1 1 . 1 1 15 15 LYS HA H 27 4.180 4.180 4.216 -0.036 18522
63 1 1 . 1 1 15 15 LYS C C 27 177.468 177.468 176.983 0.485 18522
64 1 1 . 1 1 15 15 LYS CA C 27 55.956 55.956 57.245 -1.289 18522
65 1 1 . 1 1 15 15 LYS CB C 27 34.099 34.099 32.736 1.363 18522
66 1 1 . 1 1 15 15 LYS H H 27 8.099 8.099 8.131 -0.032 18522
67 1 1 . 1 1 16 16 ASP N N 28 121.439 121.439 121.585 -0.146 18522
68 1 1 . 1 1 16 16 ASP HA H 28 4.590 4.590 4.648 -0.058 18522
69 1 1 . 1 1 16 16 ASP C C 28 178.392 178.392 177.845 0.547 18522
70 1 1 . 1 1 16 16 ASP CA C 28 52.426 52.426 53.479 -1.053 18522
71 1 1 . 1 1 16 16 ASP CB C 28 41.377 41.377 42.667 -1.290 18522
72 1 1 . 1 1 16 16 ASP H H 28 8.888 8.888 8.599 0.289 18522
73 1 1 . 1 1 17 17 ALA N N 29 119.578 119.578 124.290 -4.712 18522
74 1 1 . 1 1 17 17 ALA HA H 29 4.188 4.188 4.053 0.135 18522
75 1 1 . 1 1 17 17 ALA C C 29 178.763 178.763 178.256 0.507 18522
76 1 1 . 1 1 17 17 ALA CA C 29 54.434 54.434 54.586 -0.152 18522
77 1 1 . 1 1 17 17 ALA CB C 29 18.293 18.293 18.723 -0.430 18522
78 1 1 . 1 1 17 17 ALA H H 29 8.392 8.392 8.748 -0.356 18522
79 1 1 . 1 1 18 18 GLN N N 30 117.564 117.564 117.123 0.441 18522
80 1 1 . 1 1 18 18 GLN HA H 30 4.399 4.399 4.299 0.100 18522
81 1 1 . 1 1 18 18 GLN C C 30 175.168 175.168 175.375 -0.207 18522
82 1 1 . 1 1 18 18 GLN CA C 30 55.339 55.339 55.137 0.202 18522
83 1 1 . 1 1 18 18 GLN CB C 30 28.589 28.589 29.256 -0.667 18522
84 1 1 . 1 1 18 18 GLN H H 30 8.353 8.353 8.041 0.312 18522
85 1 1 . 1 1 19 19 ASN N N 31 115.365 115.365 115.961 -0.596 18522
86 1 1 . 1 1 19 19 ASN HA H 31 4.315 4.315 4.372 -0.057 18522
87 1 1 . 1 1 19 19 ASN C C 31 174.043 174.043 172.892 1.151 18522
88 1 1 . 1 1 19 19 ASN CA C 31 54.303 54.303 54.367 -0.064 18522
89 1 1 . 1 1 19 19 ASN CB C 31 37.610 37.610 37.529 0.081 18522
90 1 1 . 1 1 19 19 ASN H H 31 8.521 8.521 8.303 0.218 18522
91 1 1 . 1 1 20 20 LEU N N 32 118.660 118.660 111.688 6.972 18522
92 1 1 . 1 1 20 20 LEU HA H 32 4.900 4.900 4.811 0.089 18522
93 1 1 . 1 1 20 20 LEU C C 32 178.117 178.117 176.142 1.975 18522
94 1 1 . 1 1 20 20 LEU CA C 32 53.957 53.957 53.740 0.217 18522
95 1 1 . 1 1 20 20 LEU CB C 32 44.774 44.774 43.330 1.444 18522
96 1 1 . 1 1 20 20 LEU H H 32 8.155 8.155 7.350 0.805 18522
97 1 1 . 1 1 21 21 ILE N N 33 116.785 116.785 115.305 1.480 18522
98 1 1 . 1 1 21 21 ILE HA H 33 4.674 4.674 4.556 0.118 18522
99 1 1 . 1 1 21 21 ILE C C 33 176.185 176.185 176.599 -0.414 18522
100 1 1 . 1 1 21 21 ILE CA C 33 62.602 62.602 61.359 1.243 18522
101 1 1 . 1 1 21 21 ILE CB C 33 39.016 39.016 39.198 -0.182 18522
102 1 1 . 1 1 21 21 ILE H H 33 11.488 11.488 8.587 2.901 18522
103 1 1 . 1 1 22 22 GLY N N 34 111.234 111.234 108.598 2.636 18522
104 1 1 . 1 1 22 22 GLY C C 34 173.993 173.993 173.430 0.563 18522
105 1 1 . 1 1 22 22 GLY CA C 34 45.980 45.980 45.122 0.858 18522
106 1 1 . 1 1 22 22 GLY H H 34 9.854 9.854 8.814 1.040 18522
107 1 1 . 1 1 23 23 ILE N N 35 111.117 111.117 114.124 -3.007 18522
108 1 1 . 1 1 23 23 ILE HA H 35 5.535 5.535 5.479 0.056 18522
109 1 1 . 1 1 23 23 ILE C C 35 175.033 175.033 174.296 0.737 18522
110 1 1 . 1 1 23 23 ILE CA C 35 58.415 58.415 57.843 0.572 18522
111 1 1 . 1 1 23 23 ILE CB C 35 41.577 41.577 41.462 0.115 18522
112 1 1 . 1 1 23 23 ILE H H 35 7.835 7.835 7.473 0.362 18522
113 1 1 . 1 1 24 24 SER N N 36 114.908 114.908 115.647 -0.739 18522
114 1 1 . 1 1 24 24 SER HA H 36 4.232 4.232 5.158 -0.926 18522
115 1 1 . 1 1 24 24 SER C C 36 174.735 174.735 172.866 1.869 18522
116 1 1 . 1 1 24 24 SER CA C 36 56.121 56.121 57.492 -1.371 18522
117 1 1 . 1 1 24 24 SER CB C 36 66.097 66.097 66.000 0.097 18522
118 1 1 . 1 1 24 24 SER H H 36 8.623 8.623 8.288 0.335 18522
119 1 1 . 1 1 25 25 ILE N N 37 117.739 117.739 125.692 -7.953 18522
120 1 1 . 1 1 25 25 ILE C C 37 174.340 174.340 175.481 -1.141 18522
121 1 1 . 1 1 25 25 ILE CA C 37 59.123 59.123 58.734 0.389 18522
122 1 1 . 1 1 25 25 ILE CB C 37 41.637 41.637 39.960 1.677 18522
123 1 1 . 1 1 25 25 ILE H H 37 9.130 9.130 9.088 0.042 18522
124 1 1 . 1 1 26 26 GLY N N 38 108.069 108.069 114.476 -6.407 18522
125 1 1 . 1 1 26 26 GLY CA C 38 44.112 44.112 44.627 -0.515 18522
126 1 1 . 1 1 26 26 GLY H H 38 8.841 8.841 9.169 -0.328 18522
127 1 1 . 1 1 27 27 GLY N N 39 109.016 109.016 110.309 -1.293 18522
128 1 1 . 1 1 27 27 GLY C C 39 173.956 173.956 174.030 -0.074 18522
129 1 1 . 1 1 27 27 GLY H H 39 8.187 8.187 8.759 -0.572 18522
130 1 1 . 1 1 28 28 GLY N N 40 111.783 111.783 109.752 2.031 18522
131 1 1 . 1 1 28 28 GLY C C 40 174.255 174.255 173.146 1.109 18522
132 1 1 . 1 1 28 28 GLY CA C 40 47.098 47.098 44.484 2.614 18522
133 1 1 . 1 1 28 28 GLY H H 40 8.275 8.275 7.557 0.718 18522
134 1 1 . 1 1 29 29 ALA N N 41 123.128 123.128 124.748 -1.620 18522
135 1 1 . 1 1 29 29 ALA HA H 41 4.559 4.559 4.386 0.173 18522
136 1 1 . 1 1 29 29 ALA CA C 41 51.073 51.073 52.417 -1.344 18522
137 1 1 . 1 1 29 29 ALA CB C 41 21.926 21.926 20.768 1.158 18522
138 1 1 . 1 1 29 29 ALA H H 41 8.012 8.012 8.098 -0.086 18522
139 1 1 . 1 1 31 31 TYR HA H 43 4.549 4.549 4.213 0.336 18522
140 1 1 . 1 1 31 31 TYR CA C 43 57.147 57.147 59.524 -2.377 18522
141 1 1 . 1 1 31 31 TYR CB C 43 37.495 37.495 36.700 0.795 18522
142 1 1 . 1 1 32 32 CYS N N 44 119.332 119.332 115.574 3.758 18522
143 1 1 . 1 1 32 32 CYS HA H 44 4.859 4.859 4.222 0.637 18522
144 1 1 . 1 1 32 32 CYS CA C 44 57.406 57.406 58.951 -1.545 18522
145 1 1 . 1 1 32 32 CYS CB C 44 27.673 27.673 25.859 1.814 18522
146 1 1 . 1 1 32 32 CYS H H 44 7.504 7.504 7.715 -0.211 18522
147 1 1 . 1 1 33 33 PRO HA H 45 4.413 4.413 4.318 0.095 18522
148 1 1 . 1 1 33 33 PRO CA C 45 64.885 64.885 64.810 0.075 18522
149 1 1 . 1 1 33 33 PRO CB C 45 32.318 32.318 32.426 -0.108 18522
150 1 1 . 1 1 34 34 CYS N N 46 117.327 117.327 110.828 6.499 18522
151 1 1 . 1 1 34 34 CYS C C 46 172.064 172.064 174.968 -2.904 18522
152 1 1 . 1 1 34 34 CYS CA C 46 60.066 60.066 58.556 1.510 18522
153 1 1 . 1 1 34 34 CYS CB C 46 28.715 28.715 29.828 -1.113 18522
154 1 1 . 1 1 34 34 CYS H H 46 7.973 7.973 7.878 0.095 18522
155 1 1 . 1 1 35 35 LEU N N 47 124.270 124.270 119.178 5.092 18522
156 1 1 . 1 1 35 35 LEU HA H 47 4.928 4.928 3.778 1.150 18522
157 1 1 . 1 1 35 35 LEU C C 47 175.076 175.076 177.571 -2.495 18522
158 1 1 . 1 1 35 35 LEU CA C 47 53.278 53.278 57.500 -4.222 18522
159 1 1 . 1 1 35 35 LEU CB C 47 44.321 44.321 40.065 4.256 18522
160 1 1 . 1 1 35 35 LEU H H 47 8.629 8.629 8.540 0.089 18522
161 1 1 . 1 1 36 36 TYR N N 48 119.326 119.326 112.613 6.713 18522
162 1 1 . 1 1 36 36 TYR HA H 48 5.255 5.255 4.176 1.079 18522
163 1 1 . 1 1 36 36 TYR C C 48 175.766 175.766 176.710 -0.944 18522
164 1 1 . 1 1 36 36 TYR CA C 48 56.696 56.696 60.932 -4.236 18522
165 1 1 . 1 1 36 36 TYR CB C 48 42.590 42.590 36.987 5.603 18522
166 1 1 . 1 1 36 36 TYR H H 48 8.761 8.761 8.213 0.548 18522
167 1 1 . 1 1 37 37 ILE N N 49 120.259 120.259 121.559 -1.300 18522
168 1 1 . 1 1 37 37 ILE HA H 49 4.215 4.215 4.617 -0.402 18522
169 1 1 . 1 1 37 37 ILE C C 49 177.429 177.429 176.503 0.926 18522
170 1 1 . 1 1 37 37 ILE CA C 49 62.456 62.456 60.851 1.605 18522
171 1 1 . 1 1 37 37 ILE CB C 49 37.352 37.352 37.976 -0.624 18522
172 1 1 . 1 1 37 37 ILE H H 49 8.959 8.959 7.892 1.067 18522
173 1 1 . 1 1 38 38 VAL HA H 50 3.937 3.937 3.885 0.052 18522
174 1 1 . 1 1 38 38 VAL C C 50 174.408 174.408 175.469 -1.061 18522
175 1 1 . 1 1 38 38 VAL CA C 50 62.259 62.259 63.677 -1.418 18522
176 1 1 . 1 1 38 38 VAL CB C 50 31.584 31.584 32.003 -0.419 18522
177 1 1 . 1 1 39 39 GLN N N 51 116.821 116.821 116.259 0.562 18522
178 1 1 . 1 1 39 39 GLN HA H 51 4.103 4.103 4.525 -0.422 18522
179 1 1 . 1 1 39 39 GLN C C 51 172.856 172.856 173.007 -0.151 18522
180 1 1 . 1 1 39 39 GLN CA C 51 55.127 55.127 55.078 0.049 18522
181 1 1 . 1 1 39 39 GLN CB C 51 32.376 32.376 32.597 -0.221 18522
182 1 1 . 1 1 39 39 GLN H H 51 6.967 6.967 7.475 -0.508 18522
183 1 1 . 1 1 40 40 VAL N N 52 123.482 123.482 119.284 4.198 18522
184 1 1 . 1 1 40 40 VAL HA H 52 4.277 4.277 4.994 -0.717 18522
185 1 1 . 1 1 40 40 VAL C C 52 176.198 176.198 174.050 2.148 18522
186 1 1 . 1 1 40 40 VAL CA C 52 61.574 61.574 59.785 1.789 18522
187 1 1 . 1 1 40 40 VAL CB C 52 32.875 32.875 35.263 -2.388 18522
188 1 1 . 1 1 40 40 VAL H H 52 8.447 8.447 8.116 0.331 18522
189 1 1 . 1 1 41 41 PHE N N 53 128.296 128.296 122.426 5.870 18522
190 1 1 . 1 1 41 41 PHE HA H 53 4.400 4.400 4.835 -0.435 18522
191 1 1 . 1 1 41 41 PHE C C 53 175.299 175.299 175.876 -0.577 18522
192 1 1 . 1 1 41 41 PHE CA C 53 58.494 58.494 57.141 1.353 18522
193 1 1 . 1 1 41 41 PHE CB C 53 39.561 39.561 40.866 -1.305 18522
194 1 1 . 1 1 41 41 PHE H H 53 8.707 8.707 8.564 0.143 18522
195 1 1 . 1 1 42 42 ASP N N 54 122.696 122.696 123.584 -0.888 18522
196 1 1 . 1 1 42 42 ASP HA H 54 4.272 4.272 4.287 -0.015 18522
197 1 1 . 1 1 42 42 ASP C C 54 176.837 176.837 176.429 0.408 18522
198 1 1 . 1 1 42 42 ASP CA C 54 55.291 55.291 57.099 -1.808 18522
199 1 1 . 1 1 42 42 ASP CB C 54 41.093 41.093 41.106 -0.013 18522
200 1 1 . 1 1 42 42 ASP H H 54 8.901 8.901 9.011 -0.110 18522
201 1 1 . 1 1 43 43 ASN N N 55 113.923 113.923 112.921 1.002 18522
202 1 1 . 1 1 43 43 ASN HA H 55 4.258 4.258 4.739 -0.481 18522
203 1 1 . 1 1 43 43 ASN C C 55 173.714 173.714 175.006 -1.292 18522
204 1 1 . 1 1 43 43 ASN CA C 55 54.958 54.958 52.891 2.067 18522
205 1 1 . 1 1 43 43 ASN CB C 55 37.150 37.150 39.218 -2.068 18522
206 1 1 . 1 1 43 43 ASN H H 55 9.319 9.319 8.056 1.263 18522
207 1 1 . 1 1 44 44 THR N N 56 108.020 108.020 113.177 -5.157 18522
208 1 1 . 1 1 44 44 THR HA H 56 5.377 5.377 4.841 0.536 18522
209 1 1 . 1 1 44 44 THR CA C 56 59.712 59.712 59.353 0.359 18522
210 1 1 . 1 1 44 44 THR CB C 56 69.529 69.529 69.941 -0.412 18522
211 1 1 . 1 1 44 44 THR H H 56 7.149 7.149 7.839 -0.690 18522
212 1 1 . 1 1 45 45 PRO HA H 57 4.304 4.304 4.078 0.226 18522
213 1 1 . 1 1 45 45 PRO C C 57 180.141 180.141 177.896 2.245 18522
214 1 1 . 1 1 45 45 PRO CA C 57 66.090 66.090 65.626 0.464 18522
215 1 1 . 1 1 45 45 PRO CB C 57 33.194 33.194 31.509 1.685 18522
216 1 1 . 1 1 46 46 ALA N N 58 116.854 116.854 119.689 -2.835 18522
217 1 1 . 1 1 46 46 ALA HA H 58 4.035 4.035 4.009 0.026 18522
218 1 1 . 1 1 46 46 ALA C C 58 180.647 180.647 179.491 1.156 18522
219 1 1 . 1 1 46 46 ALA CA C 58 55.195 55.195 55.196 -0.001 18522
220 1 1 . 1 1 46 46 ALA CB C 58 18.880 18.880 18.152 0.728 18522
221 1 1 . 1 1 46 46 ALA H H 58 8.938 8.938 7.818 1.120 18522
222 1 1 . 1 1 47 47 ALA N N 59 123.250 123.250 120.564 2.686 18522
223 1 1 . 1 1 47 47 ALA HA H 59 4.030 4.030 4.177 -0.147 18522
224 1 1 . 1 1 47 47 ALA C C 59 179.852 179.852 179.946 -0.094 18522
225 1 1 . 1 1 47 47 ALA CA C 59 54.939 54.939 54.372 0.567 18522
226 1 1 . 1 1 47 47 ALA CB C 59 19.688 19.688 18.690 0.998 18522
227 1 1 . 1 1 47 47 ALA H H 59 7.658 7.658 7.579 0.079 18522
228 1 1 . 1 1 48 48 LEU N N 60 118.654 118.654 119.543 -0.889 18522
229 1 1 . 1 1 48 48 LEU HA H 60 4.026 4.026 4.149 -0.122 18522
230 1 1 . 1 1 48 48 LEU C C 60 179.238 179.238 178.367 0.871 18522
231 1 1 . 1 1 48 48 LEU CA C 60 57.261 57.261 58.163 -0.902 18522
232 1 1 . 1 1 48 48 LEU CB C 60 41.445 41.445 41.327 0.118 18522
233 1 1 . 1 1 48 48 LEU H H 60 8.636 8.636 8.522 0.114 18522
234 1 1 . 1 1 49 49 ASP N N 61 117.382 117.382 117.695 -0.313 18522
235 1 1 . 1 1 49 49 ASP HA H 61 4.421 4.421 4.607 -0.186 18522
236 1 1 . 1 1 49 49 ASP C C 61 177.668 177.668 177.491 0.177 18522
237 1 1 . 1 1 49 49 ASP CA C 61 57.087 57.087 54.097 2.990 18522
238 1 1 . 1 1 49 49 ASP CB C 61 44.478 44.478 41.233 3.245 18522
239 1 1 . 1 1 49 49 ASP H H 61 7.665 7.665 7.901 -0.236 18522
240 1 1 . 1 1 50 50 GLY N N 62 103.228 103.228 108.179 -4.951 18522
241 1 1 . 1 1 50 50 GLY C C 62 174.776 174.776 174.652 0.124 18522
242 1 1 . 1 1 50 50 GLY CA C 62 46.533 46.533 45.624 0.909 18522
243 1 1 . 1 1 50 50 GLY H H 62 7.216 7.216 7.785 -0.569 18522
244 1 1 . 1 1 51 51 THR N N 63 117.230 117.230 110.971 6.259 18522
245 1 1 . 1 1 51 51 THR HA H 63 3.907 3.907 3.864 0.043 18522
246 1 1 . 1 1 51 51 THR C C 63 175.961 175.961 174.982 0.979 18522
247 1 1 . 1 1 51 51 THR CA C 63 66.478 66.478 62.910 3.568 18522
248 1 1 . 1 1 51 51 THR CB C 63 68.268 68.268 67.151 1.117 18522
249 1 1 . 1 1 51 51 THR H H 63 8.319 8.319 7.814 0.505 18522
250 1 1 . 1 1 52 52 VAL N N 64 113.826 113.826 115.430 -1.604 18522
251 1 1 . 1 1 52 52 VAL HA H 64 3.950 3.950 4.444 -0.494 18522
252 1 1 . 1 1 52 52 VAL C C 64 173.883 173.883 174.836 -0.953 18522
253 1 1 . 1 1 52 52 VAL CA C 64 60.708 60.708 60.276 0.432 18522
254 1 1 . 1 1 52 52 VAL CB C 64 33.079 33.079 30.472 2.607 18522
255 1 1 . 1 1 52 52 VAL H H 64 8.147 8.147 7.571 0.576 18522
256 1 1 . 1 1 53 53 ALA N N 65 123.521 123.521 124.891 -1.370 18522
257 1 1 . 1 1 53 53 ALA HA H 65 4.414 4.414 4.317 0.097 18522
258 1 1 . 1 1 53 53 ALA C C 65 175.247 175.247 176.676 -1.429 18522
259 1 1 . 1 1 53 53 ALA CA C 65 50.440 50.440 50.846 -0.406 18522
260 1 1 . 1 1 53 53 ALA CB C 65 23.266 23.266 20.188 3.078 18522
261 1 1 . 1 1 53 53 ALA H H 65 8.633 8.633 7.310 1.323 18522
262 1 1 . 1 1 54 54 ALA N N 66 120.818 120.818 121.697 -0.879 18522
263 1 1 . 1 1 54 54 ALA HA H 66 3.720 3.720 3.813 -0.093 18522
264 1 1 . 1 1 54 54 ALA C C 66 178.411 178.411 178.571 -0.160 18522
265 1 1 . 1 1 54 54 ALA CA C 66 53.016 53.016 53.332 -0.316 18522
266 1 1 . 1 1 54 54 ALA CB C 66 17.840 17.840 17.706 0.134 18522
267 1 1 . 1 1 54 54 ALA H H 66 8.451 8.451 8.145 0.306 18522
268 1 1 . 1 1 55 55 GLY N N 67 112.260 112.260 113.311 -1.051 18522
269 1 1 . 1 1 55 55 GLY C C 67 173.296 173.296 173.647 -0.351 18522
270 1 1 . 1 1 55 55 GLY CA C 67 45.025 45.025 44.522 0.503 18522
271 1 1 . 1 1 55 55 GLY H H 67 9.600 9.600 8.500 1.100 18522
272 1 1 . 1 1 56 56 ASP N N 68 121.293 121.293 121.021 0.272 18522
273 1 1 . 1 1 56 56 ASP HA H 68 4.861 4.861 4.769 0.092 18522
274 1 1 . 1 1 56 56 ASP C C 68 174.937 174.937 175.053 -0.116 18522
275 1 1 . 1 1 56 56 ASP CA C 68 55.641 55.641 52.296 3.345 18522
276 1 1 . 1 1 56 56 ASP CB C 68 40.696 40.696 42.927 -2.231 18522
277 1 1 . 1 1 56 56 ASP H H 68 8.043 8.043 7.614 0.429 18522
278 1 1 . 1 1 57 57 GLU N N 69 122.814 122.814 125.353 -2.539 18522
279 1 1 . 1 1 57 57 GLU C C 69 177.202 177.202 175.835 1.367 18522
280 1 1 . 1 1 57 57 GLU CA C 69 54.472 54.472 54.809 -0.337 18522
281 1 1 . 1 1 57 57 GLU CB C 69 32.800 32.800 30.073 2.727 18522
282 1 1 . 1 1 57 57 GLU H H 69 8.455 8.455 8.129 0.326 18522
283 1 1 . 1 1 58 58 ILE N N 70 125.862 125.862 126.589 -0.727 18522
284 1 1 . 1 1 58 58 ILE HA H 70 4.526 4.526 4.302 0.224 18522
285 1 1 . 1 1 58 58 ILE C C 70 175.035 175.035 175.971 -0.936 18522
286 1 1 . 1 1 58 58 ILE CA C 70 60.918 60.918 61.574 -0.656 18522
287 1 1 . 1 1 58 58 ILE CB C 70 39.236 39.236 36.699 2.537 18522
288 1 1 . 1 1 58 58 ILE H H 70 8.619 8.619 8.003 0.616 18522
289 1 1 . 1 1 59 59 THR N N 71 115.507 115.507 122.152 -6.645 18522
290 1 1 . 1 1 59 59 THR HA H 71 4.513 4.513 4.069 0.444 18522
291 1 1 . 1 1 59 59 THR C C 71 176.425 176.425 173.734 2.691 18522
292 1 1 . 1 1 59 59 THR CA C 71 61.158 61.158 62.043 -0.885 18522
293 1 1 . 1 1 59 59 THR CB C 71 69.604 69.604 70.550 -0.946 18522
294 1 1 . 1 1 59 59 THR H H 71 9.242 9.242 8.585 0.657 18522
295 1 1 . 1 1 60 60 GLY N N 72 111.789 111.789 108.309 3.480 18522
296 1 1 . 1 1 60 60 GLY C C 72 170.981 170.981 171.405 -0.424 18522
297 1 1 . 1 1 60 60 GLY CA C 72 46.554 46.554 44.974 1.580 18522
298 1 1 . 1 1 60 60 GLY H H 72 7.883 7.883 7.605 0.278 18522
299 1 1 . 1 1 61 61 VAL N N 73 119.277 119.277 121.781 -2.504 18522
300 1 1 . 1 1 61 61 VAL C C 73 175.951 175.951 175.745 0.206 18522
301 1 1 . 1 1 61 61 VAL CA C 73 60.982 60.982 59.486 1.496 18522
302 1 1 . 1 1 61 61 VAL CB C 73 36.197 36.197 33.870 2.326 18522
303 1 1 . 1 1 61 61 VAL H H 73 8.424 8.424 8.901 -0.477 18522
304 1 1 . 1 1 62 62 ASN N N 74 127.731 127.731 127.744 -0.013 18522
305 1 1 . 1 1 62 62 ASN HA H 74 4.520 4.520 4.391 0.129 18522
306 1 1 . 1 1 62 62 ASN C C 74 174.878 174.878 175.146 -0.268 18522
307 1 1 . 1 1 62 62 ASN CA C 74 54.418 54.418 54.396 0.022 18522
308 1 1 . 1 1 62 62 ASN CB C 74 36.655 36.655 37.995 -1.340 18522
309 1 1 . 1 1 62 62 ASN H H 74 10.384 10.384 9.364 1.020 18522
310 1 1 . 1 1 63 63 GLY N N 75 104.633 104.633 102.698 1.935 18522
311 1 1 . 1 1 63 63 GLY C C 75 173.610 173.610 173.618 -0.008 18522
312 1 1 . 1 1 63 63 GLY CA C 75 45.261 45.261 44.957 0.304 18522
313 1 1 . 1 1 63 63 GLY H H 75 8.926 8.926 8.674 0.252 18522
314 1 1 . 1 1 64 64 ARG N N 76 120.451 120.451 122.136 -1.685 18522
315 1 1 . 1 1 64 64 ARG HA H 76 4.501 4.501 4.697 -0.196 18522
316 1 1 . 1 1 64 64 ARG C C 76 175.085 175.085 175.646 -0.561 18522
317 1 1 . 1 1 64 64 ARG CA C 76 54.252 54.252 54.273 -0.021 18522
318 1 1 . 1 1 64 64 ARG CB C 76 31.482 31.482 31.316 0.166 18522
319 1 1 . 1 1 64 64 ARG H H 76 7.753 7.753 7.904 -0.151 18522
320 1 1 . 1 1 65 65 SER N N 77 116.586 116.586 120.067 -3.481 18522
321 1 1 . 1 1 65 65 SER HA H 77 4.483 4.483 4.643 -0.160 18522
322 1 1 . 1 1 65 65 SER C C 77 176.953 176.953 175.773 1.180 18522
323 1 1 . 1 1 65 65 SER CA C 77 58.292 58.292 58.243 0.049 18522
324 1 1 . 1 1 65 65 SER CB C 77 63.643 63.643 63.656 -0.013 18522
325 1 1 . 1 1 65 65 SER H H 77 8.555 8.555 9.036 -0.481 18522
326 1 1 . 1 1 66 66 ILE N N 78 116.618 116.618 118.270 -1.652 18522
327 1 1 . 1 1 66 66 ILE HA H 78 4.420 4.420 4.403 0.017 18522
328 1 1 . 1 1 66 66 ILE C C 78 175.072 175.072 176.216 -1.144 18522
329 1 1 . 1 1 66 66 ILE CA C 78 59.122 59.122 60.858 -1.736 18522
330 1 1 . 1 1 66 66 ILE CB C 78 36.758 36.758 38.019 -1.261 18522
331 1 1 . 1 1 66 66 ILE H H 78 7.599 7.599 7.869 -0.270 18522
332 1 1 . 1 1 67 67 LYS N N 79 123.287 123.287 122.690 0.597 18522
333 1 1 . 1 1 67 67 LYS HA H 79 4.049 4.049 4.260 -0.211 18522
334 1 1 . 1 1 67 67 LYS C C 79 178.333 178.333 176.398 1.935 18522
335 1 1 . 1 1 67 67 LYS CA C 79 58.321 58.321 56.695 1.626 18522
336 1 1 . 1 1 67 67 LYS CB C 79 31.635 31.635 30.811 0.824 18522
337 1 1 . 1 1 67 67 LYS H H 79 7.898 7.898 7.945 -0.047 18522
338 1 1 . 1 1 68 68 GLY N N 80 114.933 114.933 114.109 0.824 18522
339 1 1 . 1 1 68 68 GLY C C 80 174.385 174.385 174.163 0.222 18522
340 1 1 . 1 1 68 68 GLY CA C 80 45.518 45.518 45.366 0.152 18522
341 1 1 . 1 1 68 68 GLY H H 80 8.999 8.999 8.376 0.623 18522
342 1 1 . 1 1 69 69 LYS N N 81 119.403 119.403 120.990 -1.587 18522
343 1 1 . 1 1 69 69 LYS HA H 81 4.043 4.043 4.593 -0.550 18522
344 1 1 . 1 1 69 69 LYS C C 81 177.064 177.064 175.753 1.311 18522
345 1 1 . 1 1 69 69 LYS CA C 81 54.722 54.722 55.516 -0.794 18522
346 1 1 . 1 1 69 69 LYS CB C 81 33.560 33.560 33.606 -0.046 18522
347 1 1 . 1 1 69 69 LYS H H 81 7.845 7.845 7.977 -0.132 18522
348 1 1 . 1 1 70 70 THR N N 82 112.066 112.066 115.838 -3.772 18522
349 1 1 . 1 1 70 70 THR HA H 82 4.666 4.666 4.654 0.012 18522
350 1 1 . 1 1 70 70 THR C C 82 175.955 175.955 174.707 1.248 18522
351 1 1 . 1 1 70 70 THR CA C 82 60.438 60.438 61.252 -0.814 18522
352 1 1 . 1 1 70 70 THR CB C 82 71.629 71.629 72.861 -1.232 18522
353 1 1 . 1 1 70 70 THR H H 82 9.153 9.153 8.228 0.925 18522
354 1 1 . 1 1 71 71 LYS N N 83 118.730 118.730 125.830 -7.100 18522
355 1 1 . 1 1 71 71 LYS HA H 83 3.870 3.870 4.044 -0.174 18522
356 1 1 . 1 1 71 71 LYS C C 83 177.464 177.464 178.671 -1.207 18522
357 1 1 . 1 1 71 71 LYS CA C 83 60.357 60.357 59.852 0.504 18522
358 1 1 . 1 1 71 71 LYS CB C 83 31.350 31.350 31.966 -0.616 18522
359 1 1 . 1 1 71 71 LYS H H 83 8.969 8.969 8.928 0.040 18522
360 1 1 . 1 1 72 72 VAL N N 84 117.444 117.444 118.670 -1.226 18522
361 1 1 . 1 1 72 72 VAL HA H 84 3.633 3.633 3.691 -0.058 18522
362 1 1 . 1 1 72 72 VAL C C 84 178.315 178.315 177.358 0.957 18522
363 1 1 . 1 1 72 72 VAL CA C 84 66.079 66.079 66.069 0.010 18522
364 1 1 . 1 1 72 72 VAL CB C 84 32.091 32.091 31.598 0.493 18522
365 1 1 . 1 1 72 72 VAL H H 84 7.631 7.631 8.249 -0.618 18522
366 1 1 . 1 1 73 73 GLU N N 85 120.890 120.890 118.987 1.903 18522
367 1 1 . 1 1 73 73 GLU HA H 85 3.964 3.964 4.092 -0.128 18522
368 1 1 . 1 1 73 73 GLU C C 85 179.971 179.971 178.898 1.073 18522
369 1 1 . 1 1 73 73 GLU CA C 85 59.316 59.316 59.434 -0.117 18522
370 1 1 . 1 1 73 73 GLU CB C 85 30.355 30.355 29.603 0.752 18522
371 1 1 . 1 1 73 73 GLU H H 85 7.617 7.617 7.538 0.079 18522
372 1 1 . 1 1 74 74 VAL N N 86 121.246 121.246 117.606 3.640 18522
373 1 1 . 1 1 74 74 VAL HA H 86 3.630 3.630 3.911 -0.281 18522
374 1 1 . 1 1 74 74 VAL C C 86 177.217 177.217 177.888 -0.671 18522
375 1 1 . 1 1 74 74 VAL CA C 86 66.678 66.678 65.611 1.067 18522
376 1 1 . 1 1 74 74 VAL CB C 86 31.307 31.307 31.601 -0.294 18522
377 1 1 . 1 1 74 74 VAL H H 86 8.368 8.368 8.356 0.012 18522
378 1 1 . 1 1 75 75 ALA N N 87 122.148 122.148 122.346 -0.198 18522
379 1 1 . 1 1 75 75 ALA HA H 87 3.947 3.947 3.956 -0.009 18522
380 1 1 . 1 1 75 75 ALA C C 87 179.545 179.545 179.183 0.362 18522
381 1 1 . 1 1 75 75 ALA CA C 87 55.851 55.851 55.364 0.488 18522
382 1 1 . 1 1 75 75 ALA CB C 87 18.491 18.491 18.014 0.477 18522
383 1 1 . 1 1 75 75 ALA H H 87 8.577 8.577 7.894 0.683 18522
384 1 1 . 1 1 76 76 LYS N N 88 117.733 117.733 119.674 -1.941 18522
385 1 1 . 1 1 76 76 LYS HA H 88 4.051 4.051 4.005 0.046 18522
386 1 1 . 1 1 76 76 LYS CA C 88 59.393 59.393 59.246 0.147 18522
387 1 1 . 1 1 76 76 LYS CB C 88 32.058 32.058 32.350 -0.292 18522
388 1 1 . 1 1 76 76 LYS H H 88 7.854 7.854 7.495 0.359 18522
389 1 1 . 1 1 77 77 MET N N 89 117.676 117.676 117.988 -0.312 18522
390 1 1 . 1 1 77 77 MET HA H 89 4.048 4.048 4.073 -0.025 18522
391 1 1 . 1 1 77 77 MET C C 89 178.791 178.791 178.890 -0.099 18522
392 1 1 . 1 1 77 77 MET CA C 89 59.128 59.128 59.390 -0.262 18522
393 1 1 . 1 1 77 77 MET CB C 89 33.801 33.801 32.592 1.209 18522
394 1 1 . 1 1 77 77 MET H H 89 7.759 7.759 8.228 -0.469 18522
395 1 1 . 1 1 78 78 ILE N N 90 117.305 117.305 119.483 -2.178 18522
396 1 1 . 1 1 78 78 ILE HA H 90 3.590 3.590 3.629 -0.039 18522
397 1 1 . 1 1 78 78 ILE C C 90 178.658 178.658 177.741 0.917 18522
398 1 1 . 1 1 78 78 ILE CA C 90 65.482 65.482 64.854 0.628 18522
399 1 1 . 1 1 78 78 ILE CB C 90 38.845 38.845 37.749 1.096 18522
400 1 1 . 1 1 78 78 ILE H H 90 7.972 7.972 7.723 0.249 18522
401 1 1 . 1 1 79 79 GLN N N 91 120.935 120.935 118.872 2.063 18522
402 1 1 . 1 1 79 79 GLN HA H 91 3.998 3.998 4.063 -0.065 18522
403 1 1 . 1 1 79 79 GLN C C 91 178.274 178.274 179.204 -0.930 18522
404 1 1 . 1 1 79 79 GLN CA C 91 59.151 59.151 58.604 0.547 18522
405 1 1 . 1 1 79 79 GLN CB C 91 28.934 28.934 28.733 0.201 18522
406 1 1 . 1 1 79 79 GLN H H 91 8.826 8.826 8.276 0.550 18522
407 1 1 . 1 1 80 80 GLU N N 92 115.213 115.213 121.726 -6.513 18522
408 1 1 . 1 1 80 80 GLU HA H 92 4.061 4.061 4.138 -0.077 18522
409 1 1 . 1 1 80 80 GLU C C 92 176.824 176.824 177.363 -0.539 18522
410 1 1 . 1 1 80 80 GLU CA C 92 58.006 58.006 59.006 -1.000 18522
411 1 1 . 1 1 80 80 GLU CB C 92 29.890 29.890 30.025 -0.135 18522
412 1 1 . 1 1 80 80 GLU H H 92 8.020 8.020 8.436 -0.416 18522
413 1 1 . 1 1 81 81 VAL N N 93 119.047 119.047 116.330 2.717 18522
414 1 1 . 1 1 81 81 VAL HA H 93 3.930 3.930 4.072 -0.142 18522
415 1 1 . 1 1 81 81 VAL C C 93 176.016 176.016 175.042 0.974 18522
416 1 1 . 1 1 81 81 VAL CA C 93 63.153 63.153 61.622 1.531 18522
417 1 1 . 1 1 81 81 VAL CB C 93 32.154 32.154 29.500 2.654 18522
418 1 1 . 1 1 81 81 VAL H H 93 7.073 7.073 7.512 -0.439 18522
419 1 1 . 1 1 82 82 LYS N N 94 128.366 128.366 128.144 0.222 18522
420 1 1 . 1 1 82 82 LYS C C 94 177.460 177.460 177.272 0.188 18522
421 1 1 . 1 1 82 82 LYS CA C 94 55.753 55.753 57.586 -1.833 18522
422 1 1 . 1 1 82 82 LYS CB C 94 32.332 32.332 32.431 -0.099 18522
423 1 1 . 1 1 82 82 LYS H H 94 8.762 8.762 8.155 0.607 18522
424 1 1 . 1 1 83 83 GLY N N 95 112.528 112.528 113.924 -1.396 18522
425 1 1 . 1 1 83 83 GLY C C 95 173.468 173.468 173.792 -0.324 18522
426 1 1 . 1 1 83 83 GLY CA C 95 46.243 46.243 44.889 1.354 18522
427 1 1 . 1 1 83 83 GLY H H 95 8.673 8.673 8.867 -0.194 18522
428 1 1 . 1 1 84 84 GLU N N 96 121.485 121.485 119.900 1.585 18522
429 1 1 . 1 1 84 84 GLU HA H 96 4.749 4.749 4.756 -0.007 18522
430 1 1 . 1 1 84 84 GLU C C 96 174.583 174.583 174.275 0.308 18522
431 1 1 . 1 1 84 84 GLU CA C 96 55.821 55.821 54.436 1.385 18522
432 1 1 . 1 1 84 84 GLU CB C 96 31.410 31.410 33.623 -2.213 18522
433 1 1 . 1 1 84 84 GLU H H 96 8.297 8.297 7.513 0.784 18522
434 1 1 . 1 1 85 85 VAL N N 97 120.501 120.501 117.868 2.633 18522
435 1 1 . 1 1 85 85 VAL HA H 97 4.665 4.665 4.339 0.326 18522
436 1 1 . 1 1 85 85 VAL C C 97 173.047 173.047 173.834 -0.787 18522
437 1 1 . 1 1 85 85 VAL CA C 97 60.114 60.114 61.805 -1.691 18522
438 1 1 . 1 1 85 85 VAL CB C 97 35.184 35.184 35.739 -0.555 18522
439 1 1 . 1 1 85 85 VAL H H 97 9.096 9.096 8.052 1.044 18522
440 1 1 . 1 1 86 86 THR N N 98 125.019 125.019 123.407 1.612 18522
441 1 1 . 1 1 86 86 THR HA H 98 4.076 4.076 5.206 -1.130 18522
442 1 1 . 1 1 86 86 THR C C 98 173.807 173.807 173.383 0.424 18522
443 1 1 . 1 1 86 86 THR CA C 98 61.735 61.735 61.519 0.216 18522
444 1 1 . 1 1 86 86 THR CB C 98 69.531 69.531 70.841 -1.310 18522
445 1 1 . 1 1 86 86 THR H H 98 9.352 9.352 8.335 1.017 18522
446 1 1 . 1 1 87 87 ILE N N 99 128.383 128.383 122.769 5.614 18522
447 1 1 . 1 1 87 87 ILE HA H 99 4.661 4.661 4.967 -0.306 18522
448 1 1 . 1 1 87 87 ILE C C 99 174.614 174.614 173.971 0.643 18522
449 1 1 . 1 1 87 87 ILE CA C 99 58.258 58.258 58.984 -0.726 18522
450 1 1 . 1 1 87 87 ILE CB C 99 38.528 38.528 40.012 -1.484 18522
451 1 1 . 1 1 87 87 ILE H H 99 9.329 9.329 9.014 0.315 18522
452 1 1 . 1 1 88 88 HIS N N 100 128.279 128.279 126.762 1.517 18522
453 1 1 . 1 1 88 88 HIS HA H 100 4.948 4.948 5.276 -0.328 18522
454 1 1 . 1 1 88 88 HIS C C 100 174.787 174.787 174.201 0.586 18522
455 1 1 . 1 1 88 88 HIS CA C 100 54.620 54.620 53.649 0.971 18522
456 1 1 . 1 1 88 88 HIS H H 100 8.647 8.647 8.972 -0.325 18522
457 1 1 . 1 1 89 89 TYR N N 101 121.320 121.320 122.788 -1.468 18522
458 1 1 . 1 1 89 89 TYR HA H 101 5.947 5.947 5.678 0.269 18522
459 1 1 . 1 1 89 89 TYR C C 101 173.769 173.769 173.373 0.396 18522
460 1 1 . 1 1 89 89 TYR CA C 101 55.669 55.669 54.852 0.817 18522
461 1 1 . 1 1 89 89 TYR CB C 101 42.195 42.195 41.108 1.087 18522
462 1 1 . 1 1 89 89 TYR H H 101 8.414 8.414 8.749 -0.335 18522
463 1 1 . 1 1 90 90 ASN N N 102 116.679 116.679 117.153 -0.474 18522
464 1 1 . 1 1 90 90 ASN HA H 102 5.335 5.335 5.289 0.046 18522
465 1 1 . 1 1 90 90 ASN C C 102 175.406 175.406 173.897 1.509 18522
466 1 1 . 1 1 90 90 ASN CA C 102 51.961 51.961 51.763 0.198 18522
467 1 1 . 1 1 90 90 ASN CB C 102 41.800 41.800 43.527 -1.727 18522
468 1 1 . 1 1 90 90 ASN H H 102 9.282 9.282 8.256 1.026 18522
469 1 1 . 1 1 91 91 LYS N N 103 124.129 124.129 121.049 3.080 18522
470 1 1 . 1 1 91 91 LYS C C 103 176.678 176.678 174.863 1.815 18522
471 1 1 . 1 1 91 91 LYS CA C 103 55.006 55.006 55.561 -0.555 18522
472 1 1 . 1 1 91 91 LYS H H 103 8.949 8.949 8.427 0.522 18522
473 1 1 . 1 1 92 92 LEU N N 104 127.043 127.043 124.292 2.751 18522
474 1 1 . 1 1 92 92 LEU HA H 104 4.425 4.425 4.512 -0.087 18522
475 1 1 . 1 1 92 92 LEU CA C 104 55.060 55.060 53.227 1.833 18522
476 1 1 . 1 1 92 92 LEU CB C 104 42.559 42.559 42.938 -0.380 18522
477 1 1 . 1 1 92 92 LEU H H 104 9.150 9.150 8.578 0.572 18522
478 1 1 . 1 1 93 93 GLN HA H 105 4.315 4.315 4.288 0.027 18522
479 1 1 . 1 1 93 93 GLN C C 105 175.070 175.070 175.681 -0.611 18522
480 1 1 . 1 1 93 93 GLN CA C 105 55.490 55.490 56.084 -0.594 18522
481 1 1 . 1 1 93 93 GLN CB C 105 28.909 28.909 29.158 -0.249 18522
482 1 1 . 1 1 94 94 ALA N N 106 125.133 125.133 121.905 3.228 18522
483 1 1 . 1 1 94 94 ALA HA H 106 4.366 4.366 4.088 0.278 18522
484 1 1 . 1 1 94 94 ALA C C 106 176.392 176.392 176.080 0.312 18522
485 1 1 . 1 1 94 94 ALA CA C 106 51.723 51.723 52.976 -1.253 18522
486 1 1 . 1 1 94 94 ALA CB C 106 20.185 20.185 18.577 1.608 18522
487 1 1 . 1 1 94 94 ALA H H 106 8.226 8.226 7.625 0.601 18522
488 1 1 . 1 1 95 95 ASP N N 107 122.013 122.013 119.060 2.953 18522
489 1 1 . 1 1 95 95 ASP HA H 107 4.413 4.413 4.941 -0.528 18522
490 1 1 . 1 1 95 95 ASP C C 107 175.019 175.019 175.271 -0.252 18522
491 1 1 . 1 1 95 95 ASP CA C 107 55.642 55.642 51.789 3.853 18522
492 1 1 . 1 1 95 95 ASP CB C 107 41.266 41.266 42.311 -1.045 18522
493 1 1 . 1 1 95 95 ASP H H 107 8.429 8.429 8.257 0.172 18522
494 1 1 . 1 1 96 96 PRO HA H 108 4.207 4.207 3.983 0.224 18522
495 1 1 . 1 1 96 96 PRO C C 108 178.840 178.840 178.205 0.635 18522
496 1 1 . 1 1 96 96 PRO CA C 108 65.396 65.396 66.463 -1.067 18522
497 1 1 . 1 1 96 96 PRO CB C 108 32.181 32.181 31.825 0.356 18522
498 1 1 . 1 1 97 97 LYS N N 109 117.942 117.942 115.019 2.923 18522
499 1 1 . 1 1 97 97 LYS HA H 109 4.143 4.143 4.029 0.114 18522
500 1 1 . 1 1 97 97 LYS C C 109 178.099 178.099 179.081 -0.982 18522
501 1 1 . 1 1 97 97 LYS CA C 109 58.167 58.167 59.060 -0.894 18522
502 1 1 . 1 1 97 97 LYS CB C 109 31.649 31.649 31.450 0.199 18522
503 1 1 . 1 1 97 97 LYS H H 109 8.335 8.335 8.325 0.010 18522
504 1 1 . 1 1 98 98 GLN N N 110 119.159 119.159 118.349 0.810 18522
505 1 1 . 1 1 98 98 GLN HA H 110 4.130 4.130 4.262 -0.132 18522
506 1 1 . 1 1 98 98 GLN C C 110 178.298 178.298 178.363 -0.065 18522
507 1 1 . 1 1 98 98 GLN CA C 110 57.660 57.660 57.161 0.499 18522
508 1 1 . 1 1 98 98 GLN CB C 110 28.720 28.720 28.628 0.092 18522
509 1 1 . 1 1 98 98 GLN H H 110 7.985 7.985 8.043 -0.058 18522
510 1 1 . 1 1 99 99 LEU N N 111 120.490 120.490 123.033 -2.543 18522
511 1 1 . 1 1 99 99 LEU HA H 111 3.877 3.877 4.198 -0.321 18522
512 1 1 . 1 1 99 99 LEU C C 111 177.729 177.729 178.212 -0.483 18522
513 1 1 . 1 1 99 99 LEU CA C 111 57.049 57.049 58.066 -1.017 18522
514 1 1 . 1 1 99 99 LEU CB C 111 41.466 41.466 41.722 -0.256 18522
515 1 1 . 1 1 99 99 LEU H H 111 7.994 7.994 8.555 -0.561 18522
516 1 1 . 1 1 100 100 GLU N N 112 118.251 118.251 118.522 -0.271 18522
517 1 1 . 1 1 100 100 GLU HA H 112 3.972 3.972 4.120 -0.148 18522
518 1 1 . 1 1 100 100 GLU C C 112 178.402 178.402 179.321 -0.919 18522
519 1 1 . 1 1 100 100 GLU CA C 112 59.056 59.056 59.114 -0.058 18522
520 1 1 . 1 1 100 100 GLU CB C 112 29.732 29.732 29.002 0.730 18522
521 1 1 . 1 1 100 100 GLU H H 112 7.760 7.760 8.001 -0.241 18522
522 1 1 . 1 1 101 101 VAL N N 113 117.229 117.229 120.132 -2.903 18522
523 1 1 . 1 1 101 101 VAL HA H 113 3.762 3.762 3.904 -0.142 18522
524 1 1 . 1 1 101 101 VAL C C 113 178.107 178.107 178.277 -0.170 18522
525 1 1 . 1 1 101 101 VAL CA C 113 64.791 64.791 65.610 -0.819 18522
526 1 1 . 1 1 101 101 VAL CB C 113 32.149 32.149 31.962 0.187 18522
527 1 1 . 1 1 101 101 VAL H H 113 7.437 7.437 7.329 0.108 18522
528 1 1 . 1 1 102 102 LEU N N 114 122.124 122.124 120.134 1.990 18522
529 1 1 . 1 1 102 102 LEU HA H 114 4.033 4.033 4.162 -0.129 18522
530 1 1 . 1 1 102 102 LEU C C 114 178.506 178.506 177.415 1.091 18522
531 1 1 . 1 1 102 102 LEU CA C 114 57.243 57.243 56.470 0.773 18522
532 1 1 . 1 1 102 102 LEU CB C 114 42.028 42.028 41.959 0.069 18522
533 1 1 . 1 1 102 102 LEU H H 114 7.765 7.765 7.948 -0.183 18522
534 1 1 . 1 1 103 103 PHE N N 115 115.346 115.346 117.217 -1.871 18522
535 1 1 . 1 1 103 103 PHE HA H 115 4.224 4.224 4.245 -0.021 18522
536 1 1 . 1 1 103 103 PHE C C 115 175.621 175.621 175.165 0.456 18522
537 1 1 . 1 1 103 103 PHE CA C 115 57.537 57.537 60.017 -2.481 18522
538 1 1 . 1 1 103 103 PHE CB C 115 38.057 38.057 39.756 -1.699 18522
539 1 1 . 1 1 103 103 PHE H H 115 7.805 7.805 7.701 0.104 18522
540 1 1 . 1 1 104 104 GLN N N 116 119.021 119.021 116.757 2.264 18522
541 1 1 . 1 1 104 104 GLN HA H 116 4.407 4.407 4.276 0.131 18522
542 1 1 . 1 1 104 104 GLN C C 116 176.402 176.402 175.282 1.120 18522
543 1 1 . 1 1 104 104 GLN CA C 116 55.521 55.521 56.723 -1.202 18522
544 1 1 . 1 1 104 104 GLN CB C 116 29.170 29.170 26.718 2.452 18522
545 1 1 . 1 1 104 104 GLN H H 116 7.974 7.974 7.678 0.296 18522
546 1 1 . 1 1 105 105 GLY N N 117 108.868 108.868 113.803 -4.935 18522
547 1 1 . 1 1 105 105 GLY CA C 117 45.124 45.124 45.651 -0.527 18522
548 1 1 . 1 1 105 105 GLY H H 117 8.195 8.195 8.489 -0.294 18522
549 1 1 . 1 1 106 106 PRO HA H 118 4.490 4.490 4.486 0.004 18522
550 1 1 . 1 1 106 106 PRO C C 118 176.001 176.001 175.986 0.015 18522
551 1 1 . 1 1 106 106 PRO CA C 118 63.523 63.523 63.281 0.242 18522
552 1 1 . 1 1 106 106 PRO CB C 118 32.078 32.078 32.495 -0.417 18522
553 1 1 . 1 1 107 107 GLN N N 119 126.950 126.950 121.648 5.302 18522
554 1 1 . 1 1 107 107 GLN C C 119 181.211 181.211 175.632 5.579 18522
555 1 1 . 1 1 107 107 GLN CA C 119 57.416 57.416 55.002 2.414 18522
556 1 1 . 1 1 107 107 GLN H H 119 8.079 8.079 8.649 -0.570 18522
557 1 1 . 1 1 111 111 ARG C C 123 174.608 174.608 175.289 -0.681 18522
558 1 1 . 1 1 111 111 ARG CA C 123 55.099 55.099 56.876 -1.777 18522
559 1 1 . 1 1 112 112 HIS N N 124 122.212 122.212 120.974 1.238 18522
560 1 1 . 1 1 112 112 HIS HA H 124 4.718 4.718 4.671 0.047 18522
561 1 1 . 1 1 112 112 HIS C C 124 176.040 176.040 174.239 1.801 18522
562 1 1 . 1 1 112 112 HIS CA C 124 54.213 54.213 54.657 -0.444 18522
563 1 1 . 1 1 112 112 HIS CB C 124 31.164 31.164 29.627 1.537 18522
564 1 1 . 1 1 112 112 HIS H H 124 7.640 7.640 8.581 -0.941 18522
565 1 1 . 1 1 113 113 TRP C C 125 176.168 176.168 174.610 1.558 18522
566 1 1 . 1 1 114 114 LEU N N 126 121.893 121.893 116.675 5.218 18522
567 1 1 . 1 1 114 114 LEU HA H 126 4.869 4.869 4.767 0.102 18522
568 1 1 . 1 1 114 114 LEU CA C 126 54.151 54.151 53.632 0.519 18522
569 1 1 . 1 1 114 114 LEU CB C 126 45.144 45.144 45.535 -0.391 18522
570 1 1 . 1 1 114 114 LEU H H 126 8.606 8.606 8.952 -0.346 18522
571 1 1 . 1 1 115 115 LYS N N 127 125.850 125.850 118.252 7.598 18522
572 1 1 . 1 1 115 115 LYS HA H 127 4.203 4.203 4.813 -0.610 18522
573 1 1 . 1 1 115 115 LYS C C 127 175.564 175.564 175.008 0.556 18522
574 1 1 . 1 1 115 115 LYS CA C 127 57.252 57.252 55.641 1.611 18522
575 1 1 . 1 1 115 115 LYS CB C 127 33.406 33.406 35.385 -1.979 18522
576 1 1 . 1 1 115 115 LYS H H 127 8.647 8.647 8.152 0.495 18522
577 1 2 . 1 1 3 3 PRO C C 15 177.225 177.225 176.940 0.285 18522
578 1 2 . 1 1 3 3 PRO CA C 15 63.508 63.508 62.280 1.228 18522
579 1 2 . 1 1 3 3 PRO CB C 15 32.090 32.090 30.212 1.878 18522
580 1 2 . 1 1 4 4 GLY N N 16 108.829 108.829 108.779 0.050 18522
581 1 2 . 1 1 4 4 GLY C C 16 173.398 173.398 173.309 0.089 18522
582 1 2 . 1 1 4 4 GLY CA C 16 45.128 45.128 44.611 0.516 18522
583 1 2 . 1 1 4 4 GLY H H 16 8.489 8.489 7.802 0.687 18522
584 1 2 . 1 1 5 5 ILE N N 17 121.763 121.763 118.788 2.975 18522
585 1 2 . 1 1 5 5 ILE HA H 17 4.554 4.554 4.688 -0.134 18522
586 1 2 . 1 1 5 5 ILE C C 17 174.332 174.332 174.983 -0.651 18522
587 1 2 . 1 1 5 5 ILE CA C 17 58.245 58.245 57.992 0.253 18522
588 1 2 . 1 1 5 5 ILE CB C 17 38.762 38.762 38.574 0.188 18522
589 1 2 . 1 1 5 5 ILE H H 17 8.014 8.014 8.106 -0.092 18522
590 1 2 . 1 1 6 6 PRO C C 18 176.437 176.437 176.795 -0.358 18522
591 1 2 . 1 1 6 6 PRO CA C 18 62.667 62.667 63.995 -1.328 18522
592 1 2 . 1 1 6 6 PRO CB C 18 32.469 32.469 32.316 0.154 18522
593 1 2 . 1 1 7 7 VAL N N 19 123.849 123.849 114.039 9.810 18522
594 1 2 . 1 1 7 7 VAL HA H 19 4.550 4.550 4.604 -0.054 18522
595 1 2 . 1 1 7 7 VAL C C 19 174.453 174.453 173.693 0.760 18522
596 1 2 . 1 1 7 7 VAL CA C 19 59.846 59.846 58.214 1.632 18522
597 1 2 . 1 1 7 7 VAL CB C 19 33.510 33.510 32.244 1.266 18522
598 1 2 . 1 1 7 7 VAL H H 19 8.754 8.754 7.749 1.005 18522
599 1 2 . 1 1 8 8 PRO HA H 20 5.338 5.338 5.636 -0.298 18522
600 1 2 . 1 1 8 8 PRO C C 20 177.585 177.585 176.446 1.139 18522
601 1 2 . 1 1 8 8 PRO CA C 20 62.406 62.406 61.280 1.126 18522
602 1 2 . 1 1 8 8 PRO CB C 20 32.891 32.891 33.254 -0.363 18522
603 1 2 . 1 1 9 9 GLY N N 21 108.426 108.426 109.035 -0.609 18522
604 1 2 . 1 1 9 9 GLY C C 21 171.443 171.443 171.090 0.353 18522
605 1 2 . 1 1 9 9 GLY CA C 21 44.581 44.581 45.205 -0.624 18522
606 1 2 . 1 1 9 9 GLY H H 21 8.258 8.258 8.385 -0.127 18522
607 1 2 . 1 1 10 10 LYS N N 22 117.372 117.372 117.830 -0.458 18522
608 1 2 . 1 1 10 10 LYS HA H 22 4.039 4.039 5.078 -1.039 18522
609 1 2 . 1 1 10 10 LYS C C 22 174.463 174.463 174.765 -0.302 18522
610 1 2 . 1 1 10 10 LYS CA C 22 55.263 55.263 54.247 1.016 18522
611 1 2 . 1 1 10 10 LYS CB C 22 35.227 35.227 36.962 -1.736 18522
612 1 2 . 1 1 10 10 LYS H H 22 8.175 8.175 8.093 0.082 18522
613 1 2 . 1 1 11 11 VAL N N 23 120.387 120.387 120.063 0.324 18522
614 1 2 . 1 1 11 11 VAL HA H 23 4.708 4.708 4.568 0.140 18522
615 1 2 . 1 1 11 11 VAL C C 23 171.873 171.873 173.429 -1.556 18522
616 1 2 . 1 1 11 11 VAL CA C 23 59.866 59.866 60.885 -1.019 18522
617 1 2 . 1 1 11 11 VAL CB C 23 35.269 35.269 35.684 -0.414 18522
618 1 2 . 1 1 11 11 VAL H H 23 8.862 8.862 8.641 0.221 18522
619 1 2 . 1 1 12 12 THR N N 24 125.797 125.797 122.816 2.981 18522
620 1 2 . 1 1 12 12 THR HA H 24 5.121 5.121 4.975 0.146 18522
621 1 2 . 1 1 12 12 THR C C 24 173.407 173.407 173.389 0.018 18522
622 1 2 . 1 1 12 12 THR CA C 24 62.115 62.115 60.091 2.024 18522
623 1 2 . 1 1 12 12 THR CB C 24 69.606 69.606 69.207 0.399 18522
624 1 2 . 1 1 12 12 THR H H 24 8.859 8.859 8.342 0.517 18522
625 1 2 . 1 1 13 13 LEU N N 25 127.960 127.960 127.503 0.457 18522
626 1 2 . 1 1 13 13 LEU HA H 25 4.809 4.809 4.885 -0.076 18522
627 1 2 . 1 1 13 13 LEU C C 25 175.029 175.029 175.360 -0.331 18522
628 1 2 . 1 1 13 13 LEU CA C 25 52.623 52.623 52.541 0.082 18522
629 1 2 . 1 1 13 13 LEU CB C 25 46.242 46.242 45.723 0.519 18522
630 1 2 . 1 1 13 13 LEU H H 25 9.258 9.258 8.218 1.040 18522
631 1 2 . 1 1 14 14 GLN N N 26 120.858 120.858 118.100 2.758 18522
632 1 2 . 1 1 14 14 GLN HA H 26 4.482 4.482 4.580 -0.098 18522
633 1 2 . 1 1 14 14 GLN C C 26 174.515 174.515 175.088 -0.573 18522
634 1 2 . 1 1 14 14 GLN CA C 26 54.576 54.576 54.233 0.343 18522
635 1 2 . 1 1 14 14 GLN CB C 26 29.516 29.516 31.796 -2.280 18522
636 1 2 . 1 1 14 14 GLN H H 26 8.530 8.530 8.350 0.180 18522
637 1 2 . 1 1 15 15 LYS N N 27 119.583 119.583 123.680 -4.097 18522
638 1 2 . 1 1 15 15 LYS HA H 27 4.180 4.180 4.305 -0.125 18522
639 1 2 . 1 1 15 15 LYS C C 27 177.468 177.468 177.072 0.396 18522
640 1 2 . 1 1 15 15 LYS CA C 27 55.956 55.956 56.858 -0.902 18522
641 1 2 . 1 1 15 15 LYS CB C 27 34.099 34.099 32.344 1.755 18522
642 1 2 . 1 1 15 15 LYS H H 27 8.099 8.099 8.077 0.022 18522
643 1 2 . 1 1 16 16 ASP N N 28 121.439 121.439 122.348 -0.909 18522
644 1 2 . 1 1 16 16 ASP HA H 28 4.590 4.590 4.672 -0.082 18522
645 1 2 . 1 1 16 16 ASP C C 28 178.392 178.392 177.745 0.647 18522
646 1 2 . 1 1 16 16 ASP CA C 28 52.426 52.426 53.342 -0.916 18522
647 1 2 . 1 1 16 16 ASP CB C 28 41.377 41.377 41.547 -0.170 18522
648 1 2 . 1 1 16 16 ASP H H 28 8.888 8.888 8.501 0.387 18522
649 1 2 . 1 1 17 17 ALA N N 29 119.578 119.578 120.473 -0.895 18522
650 1 2 . 1 1 17 17 ALA HA H 29 4.188 4.188 4.150 0.038 18522
651 1 2 . 1 1 17 17 ALA C C 29 178.763 178.763 178.385 0.378 18522
652 1 2 . 1 1 17 17 ALA CA C 29 54.434 54.434 54.489 -0.055 18522
653 1 2 . 1 1 17 17 ALA CB C 29 18.293 18.293 18.694 -0.401 18522
654 1 2 . 1 1 17 17 ALA H H 29 8.392 8.392 8.474 -0.082 18522
655 1 2 . 1 1 18 18 GLN N N 30 117.564 117.564 116.550 1.014 18522
656 1 2 . 1 1 18 18 GLN HA H 30 4.399 4.399 4.299 0.100 18522
657 1 2 . 1 1 18 18 GLN C C 30 175.168 175.168 175.676 -0.508 18522
658 1 2 . 1 1 18 18 GLN CA C 30 55.339 55.339 55.208 0.131 18522
659 1 2 . 1 1 18 18 GLN CB C 30 28.589 28.589 28.918 -0.329 18522
660 1 2 . 1 1 18 18 GLN H H 30 8.353 8.353 8.500 -0.147 18522
661 1 2 . 1 1 19 19 ASN N N 31 115.365 115.365 116.297 -0.932 18522
662 1 2 . 1 1 19 19 ASN HA H 31 4.315 4.315 4.414 -0.099 18522
663 1 2 . 1 1 19 19 ASN C C 31 174.043 174.043 173.757 0.286 18522
664 1 2 . 1 1 19 19 ASN CA C 31 54.303 54.303 54.452 -0.149 18522
665 1 2 . 1 1 19 19 ASN CB C 31 37.610 37.610 37.915 -0.305 18522
666 1 2 . 1 1 19 19 ASN H H 31 8.521 8.521 7.933 0.588 18522
667 1 2 . 1 1 20 20 LEU N N 32 118.660 118.660 113.256 5.404 18522
668 1 2 . 1 1 20 20 LEU HA H 32 4.900 4.900 4.930 -0.030 18522
669 1 2 . 1 1 20 20 LEU C C 32 178.117 178.117 176.409 1.708 18522
670 1 2 . 1 1 20 20 LEU CA C 32 53.957 53.957 53.243 0.714 18522
671 1 2 . 1 1 20 20 LEU CB C 32 44.774 44.774 43.408 1.366 18522
672 1 2 . 1 1 20 20 LEU H H 32 8.155 8.155 8.402 -0.247 18522
673 1 2 . 1 1 21 21 ILE N N 33 116.785 116.785 115.733 1.052 18522
674 1 2 . 1 1 21 21 ILE HA H 33 4.674 4.674 4.426 0.248 18522
675 1 2 . 1 1 21 21 ILE C C 33 176.185 176.185 176.470 -0.285 18522
676 1 2 . 1 1 21 21 ILE CA C 33 62.602 62.602 61.217 1.385 18522
677 1 2 . 1 1 21 21 ILE CB C 33 39.016 39.016 39.377 -0.361 18522
678 1 2 . 1 1 21 21 ILE H H 33 11.488 11.488 8.329 3.159 18522
679 1 2 . 1 1 22 22 GLY N N 34 111.234 111.234 108.822 2.412 18522
680 1 2 . 1 1 22 22 GLY C C 34 173.993 173.993 173.200 0.793 18522
681 1 2 . 1 1 22 22 GLY CA C 34 45.980 45.980 45.128 0.852 18522
682 1 2 . 1 1 22 22 GLY H H 34 9.854 9.854 8.568 1.286 18522
683 1 2 . 1 1 23 23 ILE N N 35 111.117 111.117 113.927 -2.810 18522
684 1 2 . 1 1 23 23 ILE HA H 35 5.535 5.535 5.157 0.378 18522
685 1 2 . 1 1 23 23 ILE C C 35 175.033 175.033 174.149 0.884 18522
686 1 2 . 1 1 23 23 ILE CA C 35 58.415 58.415 57.745 0.670 18522
687 1 2 . 1 1 23 23 ILE CB C 35 41.577 41.577 41.328 0.249 18522
688 1 2 . 1 1 23 23 ILE H H 35 7.835 7.835 7.247 0.588 18522
689 1 2 . 1 1 24 24 SER N N 36 114.908 114.908 115.948 -1.040 18522
690 1 2 . 1 1 24 24 SER HA H 36 4.232 4.232 4.634 -0.402 18522
691 1 2 . 1 1 24 24 SER C C 36 174.735 174.735 172.652 2.083 18522
692 1 2 . 1 1 24 24 SER CA C 36 56.121 56.121 56.844 -0.723 18522
693 1 2 . 1 1 24 24 SER CB C 36 66.097 66.097 65.524 0.573 18522
694 1 2 . 1 1 24 24 SER H H 36 8.623 8.623 8.550 0.073 18522
695 1 2 . 1 1 25 25 ILE N N 37 117.739 117.739 124.683 -6.944 18522
696 1 2 . 1 1 25 25 ILE C C 37 174.340 174.340 175.918 -1.578 18522
697 1 2 . 1 1 25 25 ILE CA C 37 59.123 59.123 58.736 0.387 18522
698 1 2 . 1 1 25 25 ILE CB C 37 41.637 41.637 39.442 2.195 18522
699 1 2 . 1 1 25 25 ILE H H 37 9.130 9.130 8.145 0.985 18522
700 1 2 . 1 1 26 26 GLY N N 38 108.069 108.069 111.423 -3.354 18522
701 1 2 . 1 1 26 26 GLY CA C 38 44.112 44.112 44.090 0.022 18522
702 1 2 . 1 1 26 26 GLY H H 38 8.841 8.841 8.310 0.531 18522
703 1 2 . 1 1 27 27 GLY N N 39 109.016 109.016 108.382 0.634 18522
704 1 2 . 1 1 27 27 GLY C C 39 173.956 173.956 175.029 -1.073 18522
705 1 2 . 1 1 27 27 GLY H H 39 8.187 8.187 8.509 -0.322 18522
706 1 2 . 1 1 28 28 GLY N N 40 111.783 111.783 108.984 2.799 18522
707 1 2 . 1 1 28 28 GLY C C 40 174.255 174.255 172.897 1.358 18522
708 1 2 . 1 1 28 28 GLY CA C 40 47.098 47.098 45.053 2.045 18522
709 1 2 . 1 1 28 28 GLY H H 40 8.275 8.275 8.188 0.087 18522
710 1 2 . 1 1 29 29 ALA N N 41 123.128 123.128 123.476 -0.348 18522
711 1 2 . 1 1 29 29 ALA HA H 41 4.559 4.559 4.458 0.101 18522
712 1 2 . 1 1 29 29 ALA CA C 41 51.073 51.073 51.753 -0.680 18522
713 1 2 . 1 1 29 29 ALA CB C 41 21.926 21.926 20.360 1.566 18522
714 1 2 . 1 1 29 29 ALA H H 41 8.012 8.012 7.622 0.390 18522
715 1 2 . 1 1 31 31 TYR HA H 43 4.549 4.549 4.173 0.376 18522
716 1 2 . 1 1 31 31 TYR CA C 43 57.147 57.147 59.137 -1.990 18522
717 1 2 . 1 1 31 31 TYR CB C 43 37.495 37.495 37.575 -0.080 18522
718 1 2 . 1 1 32 32 CYS N N 44 119.332 119.332 119.227 0.105 18522
719 1 2 . 1 1 32 32 CYS HA H 44 4.859 4.859 4.828 0.031 18522
720 1 2 . 1 1 32 32 CYS CA C 44 57.406 57.406 57.064 0.342 18522
721 1 2 . 1 1 32 32 CYS CB C 44 27.673 27.673 29.052 -1.379 18522
722 1 2 . 1 1 32 32 CYS H H 44 7.504 7.504 7.681 -0.177 18522
723 1 2 . 1 1 33 33 PRO HA H 45 4.413 4.413 4.587 -0.174 18522
724 1 2 . 1 1 33 33 PRO CA C 45 64.885 64.885 63.062 1.823 18522
725 1 2 . 1 1 33 33 PRO CB C 45 32.318 32.318 30.702 1.616 18522
726 1 2 . 1 1 34 34 CYS N N 46 117.327 117.327 114.801 2.526 18522
727 1 2 . 1 1 34 34 CYS C C 46 172.064 172.064 175.227 -3.163 18522
728 1 2 . 1 1 34 34 CYS CA C 46 60.066 60.066 58.826 1.240 18522
729 1 2 . 1 1 34 34 CYS CB C 46 28.715 28.715 29.913 -1.198 18522
730 1 2 . 1 1 34 34 CYS H H 46 7.973 7.973 7.411 0.562 18522
731 1 2 . 1 1 35 35 LEU N N 47 124.270 124.270 117.342 6.928 18522
732 1 2 . 1 1 35 35 LEU HA H 47 4.928 4.928 3.875 1.053 18522
733 1 2 . 1 1 35 35 LEU C C 47 175.076 175.076 177.920 -2.844 18522
734 1 2 . 1 1 35 35 LEU CA C 47 53.278 53.278 56.992 -3.714 18522
735 1 2 . 1 1 35 35 LEU CB C 47 44.321 44.321 40.522 3.799 18522
736 1 2 . 1 1 35 35 LEU H H 47 8.629 8.629 8.491 0.138 18522
737 1 2 . 1 1 36 36 TYR N N 48 119.326 119.326 113.599 5.727 18522
738 1 2 . 1 1 36 36 TYR HA H 48 5.255 5.255 4.221 1.034 18522
739 1 2 . 1 1 36 36 TYR C C 48 175.766 175.766 177.148 -1.382 18522
740 1 2 . 1 1 36 36 TYR CA C 48 56.696 56.696 61.129 -4.433 18522
741 1 2 . 1 1 36 36 TYR CB C 48 42.590 42.590 37.487 5.103 18522
742 1 2 . 1 1 36 36 TYR H H 48 8.761 8.761 7.848 0.913 18522
743 1 2 . 1 1 37 37 ILE N N 49 120.259 120.259 122.692 -2.433 18522
744 1 2 . 1 1 37 37 ILE HA H 49 4.215 4.215 4.474 -0.259 18522
745 1 2 . 1 1 37 37 ILE C C 49 177.429 177.429 176.661 0.768 18522
746 1 2 . 1 1 37 37 ILE CA C 49 62.456 62.456 60.737 1.718 18522
747 1 2 . 1 1 37 37 ILE CB C 49 37.352 37.352 37.148 0.204 18522
748 1 2 . 1 1 37 37 ILE H H 49 8.959 8.959 7.870 1.089 18522
749 1 2 . 1 1 38 38 VAL HA H 50 3.937 3.937 4.338 -0.401 18522
750 1 2 . 1 1 38 38 VAL C C 50 174.408 174.408 175.287 -0.879 18522
751 1 2 . 1 1 38 38 VAL CA C 50 62.259 62.259 62.108 0.151 18522
752 1 2 . 1 1 38 38 VAL CB C 50 31.584 31.584 32.764 -1.180 18522
753 1 2 . 1 1 39 39 GLN N N 51 116.821 116.821 118.088 -1.267 18522
754 1 2 . 1 1 39 39 GLN HA H 51 4.103 4.103 4.613 -0.510 18522
755 1 2 . 1 1 39 39 GLN C C 51 172.856 172.856 172.888 -0.032 18522
756 1 2 . 1 1 39 39 GLN CA C 51 55.127 55.127 55.643 -0.516 18522
757 1 2 . 1 1 39 39 GLN CB C 51 32.376 32.376 32.892 -0.515 18522
758 1 2 . 1 1 39 39 GLN H H 51 6.967 6.967 7.484 -0.517 18522
759 1 2 . 1 1 40 40 VAL N N 52 123.482 123.482 121.981 1.501 18522
760 1 2 . 1 1 40 40 VAL HA H 52 4.277 4.277 4.606 -0.329 18522
761 1 2 . 1 1 40 40 VAL C C 52 176.198 176.198 173.970 2.228 18522
762 1 2 . 1 1 40 40 VAL CA C 52 61.574 61.574 59.471 2.103 18522
763 1 2 . 1 1 40 40 VAL CB C 52 32.875 32.875 34.310 -1.435 18522
764 1 2 . 1 1 40 40 VAL H H 52 8.447 8.447 8.208 0.239 18522
765 1 2 . 1 1 41 41 PHE N N 53 128.296 128.296 123.684 4.612 18522
766 1 2 . 1 1 41 41 PHE HA H 53 4.400 4.400 4.736 -0.336 18522
767 1 2 . 1 1 41 41 PHE C C 53 175.299 175.299 175.056 0.243 18522
768 1 2 . 1 1 41 41 PHE CA C 53 58.494 58.494 57.914 0.580 18522
769 1 2 . 1 1 41 41 PHE CB C 53 39.561 39.561 39.598 -0.037 18522
770 1 2 . 1 1 41 41 PHE H H 53 8.707 8.707 8.118 0.589 18522
771 1 2 . 1 1 42 42 ASP N N 54 122.696 122.696 115.889 6.807 18522
772 1 2 . 1 1 42 42 ASP HA H 54 4.272 4.272 4.680 -0.408 18522
773 1 2 . 1 1 42 42 ASP C C 54 176.837 176.837 175.924 0.913 18522
774 1 2 . 1 1 42 42 ASP CA C 54 55.291 55.291 55.018 0.273 18522
775 1 2 . 1 1 42 42 ASP CB C 54 41.093 41.093 42.575 -1.482 18522
776 1 2 . 1 1 42 42 ASP H H 54 8.901 8.901 8.401 0.500 18522
777 1 2 . 1 1 43 43 ASN N N 55 113.923 113.923 117.276 -3.353 18522
778 1 2 . 1 1 43 43 ASN HA H 55 4.258 4.258 4.847 -0.589 18522
779 1 2 . 1 1 43 43 ASN C C 55 173.714 173.714 174.517 -0.803 18522
780 1 2 . 1 1 43 43 ASN CA C 55 54.958 54.958 53.657 1.301 18522
781 1 2 . 1 1 43 43 ASN CB C 55 37.150 37.150 39.432 -2.282 18522
782 1 2 . 1 1 43 43 ASN H H 55 9.319 9.319 8.303 1.016 18522
783 1 2 . 1 1 44 44 THR N N 56 108.020 108.020 111.505 -3.485 18522
784 1 2 . 1 1 44 44 THR HA H 56 5.377 5.377 4.729 0.648 18522
785 1 2 . 1 1 44 44 THR CA C 56 59.712 59.712 59.160 0.552 18522
786 1 2 . 1 1 44 44 THR CB C 56 69.529 69.529 69.944 -0.415 18522
787 1 2 . 1 1 44 44 THR H H 56 7.149 7.149 7.512 -0.363 18522
788 1 2 . 1 1 45 45 PRO HA H 57 4.304 4.304 4.094 0.210 18522
789 1 2 . 1 1 45 45 PRO C C 57 180.141 180.141 178.149 1.992 18522
790 1 2 . 1 1 45 45 PRO CA C 57 66.090 66.090 65.697 0.393 18522
791 1 2 . 1 1 45 45 PRO CB C 57 33.194 33.194 31.470 1.724 18522
792 1 2 . 1 1 46 46 ALA N N 58 116.854 116.854 119.923 -3.069 18522
793 1 2 . 1 1 46 46 ALA HA H 58 4.035 4.035 4.022 0.013 18522
794 1 2 . 1 1 46 46 ALA C C 58 180.647 180.647 179.513 1.134 18522
795 1 2 . 1 1 46 46 ALA CA C 58 55.195 55.195 55.239 -0.044 18522
796 1 2 . 1 1 46 46 ALA CB C 58 18.880 18.880 18.127 0.753 18522
797 1 2 . 1 1 46 46 ALA H H 58 8.938 8.938 7.931 1.007 18522
798 1 2 . 1 1 47 47 ALA N N 59 123.250 123.250 121.014 2.236 18522
799 1 2 . 1 1 47 47 ALA HA H 59 4.030 4.030 4.046 -0.016 18522
800 1 2 . 1 1 47 47 ALA C C 59 179.852 179.852 179.516 0.336 18522
801 1 2 . 1 1 47 47 ALA CA C 59 54.939 54.939 54.504 0.435 18522
802 1 2 . 1 1 47 47 ALA CB C 59 19.688 19.688 18.605 1.083 18522
803 1 2 . 1 1 47 47 ALA H H 59 7.658 7.658 7.444 0.214 18522
804 1 2 . 1 1 48 48 LEU N N 60 118.654 118.654 119.666 -1.012 18522
805 1 2 . 1 1 48 48 LEU HA H 60 4.026 4.026 4.129 -0.103 18522
806 1 2 . 1 1 48 48 LEU C C 60 179.238 179.238 178.594 0.644 18522
807 1 2 . 1 1 48 48 LEU CA C 60 57.261 57.261 58.112 -0.851 18522
808 1 2 . 1 1 48 48 LEU CB C 60 41.445 41.445 40.930 0.515 18522
809 1 2 . 1 1 48 48 LEU H H 60 8.636 8.636 8.375 0.261 18522
810 1 2 . 1 1 49 49 ASP N N 61 117.382 117.382 116.908 0.474 18522
811 1 2 . 1 1 49 49 ASP HA H 61 4.421 4.421 4.654 -0.233 18522
812 1 2 . 1 1 49 49 ASP C C 61 177.668 177.668 178.140 -0.472 18522
813 1 2 . 1 1 49 49 ASP CA C 61 57.087 57.087 54.900 2.187 18522
814 1 2 . 1 1 49 49 ASP CB C 61 44.478 44.478 41.899 2.579 18522
815 1 2 . 1 1 49 49 ASP H H 61 7.665 7.665 7.905 -0.240 18522
816 1 2 . 1 1 50 50 GLY N N 62 103.228 103.228 107.217 -3.989 18522
817 1 2 . 1 1 50 50 GLY C C 62 174.776 174.776 175.221 -0.445 18522
818 1 2 . 1 1 50 50 GLY CA C 62 46.533 46.533 45.788 0.745 18522
819 1 2 . 1 1 50 50 GLY H H 62 7.216 7.216 8.251 -1.035 18522
820 1 2 . 1 1 51 51 THR N N 63 117.230 117.230 114.226 3.004 18522
821 1 2 . 1 1 51 51 THR HA H 63 3.907 3.907 3.870 0.037 18522
822 1 2 . 1 1 51 51 THR C C 63 175.961 175.961 174.006 1.955 18522
823 1 2 . 1 1 51 51 THR CA C 63 66.478 66.478 62.637 3.841 18522
824 1 2 . 1 1 51 51 THR CB C 63 68.268 68.268 67.632 0.636 18522
825 1 2 . 1 1 51 51 THR H H 63 8.319 8.319 7.752 0.567 18522
826 1 2 . 1 1 52 52 VAL N N 64 113.826 113.826 114.828 -1.002 18522
827 1 2 . 1 1 52 52 VAL HA H 64 3.950 3.950 4.239 -0.289 18522
828 1 2 . 1 1 52 52 VAL C C 64 173.883 173.883 174.280 -0.397 18522
829 1 2 . 1 1 52 52 VAL CA C 64 60.708 60.708 60.041 0.667 18522
830 1 2 . 1 1 52 52 VAL CB C 64 33.079 33.079 30.396 2.683 18522
831 1 2 . 1 1 52 52 VAL H H 64 8.147 8.147 7.339 0.808 18522
832 1 2 . 1 1 53 53 ALA N N 65 123.521 123.521 123.938 -0.417 18522
833 1 2 . 1 1 53 53 ALA HA H 65 4.414 4.414 4.429 -0.015 18522
834 1 2 . 1 1 53 53 ALA C C 65 175.247 175.247 176.766 -1.519 18522
835 1 2 . 1 1 53 53 ALA CA C 65 50.440 50.440 50.824 -0.384 18522
836 1 2 . 1 1 53 53 ALA CB C 65 23.266 23.266 20.578 2.688 18522
837 1 2 . 1 1 53 53 ALA H H 65 8.633 8.633 7.156 1.477 18522
838 1 2 . 1 1 54 54 ALA N N 66 120.818 120.818 122.493 -1.675 18522
839 1 2 . 1 1 54 54 ALA HA H 66 3.720 3.720 3.911 -0.191 18522
840 1 2 . 1 1 54 54 ALA C C 66 178.411 178.411 178.245 0.166 18522
841 1 2 . 1 1 54 54 ALA CA C 66 53.016 53.016 53.309 -0.293 18522
842 1 2 . 1 1 54 54 ALA CB C 66 17.840 17.840 18.392 -0.552 18522
843 1 2 . 1 1 54 54 ALA H H 66 8.451 8.451 8.206 0.245 18522
844 1 2 . 1 1 55 55 GLY N N 67 112.260 112.260 112.017 0.243 18522
845 1 2 . 1 1 55 55 GLY C C 67 173.296 173.296 173.396 -0.100 18522
846 1 2 . 1 1 55 55 GLY CA C 67 45.025 45.025 44.837 0.189 18522
847 1 2 . 1 1 55 55 GLY H H 67 9.600 9.600 8.805 0.795 18522
848 1 2 . 1 1 56 56 ASP N N 68 121.293 121.293 120.012 1.281 18522
849 1 2 . 1 1 56 56 ASP HA H 68 4.861 4.861 4.825 0.036 18522
850 1 2 . 1 1 56 56 ASP C C 68 174.937 174.937 173.937 1.000 18522
851 1 2 . 1 1 56 56 ASP CA C 68 55.641 55.641 53.551 2.090 18522
852 1 2 . 1 1 56 56 ASP CB C 68 40.696 40.696 43.925 -3.228 18522
853 1 2 . 1 1 56 56 ASP H H 68 8.043 8.043 7.532 0.511 18522
854 1 2 . 1 1 57 57 GLU N N 69 122.814 122.814 122.025 0.789 18522
855 1 2 . 1 1 57 57 GLU C C 69 177.202 177.202 175.802 1.400 18522
856 1 2 . 1 1 57 57 GLU CA C 69 54.472 54.472 54.816 -0.344 18522
857 1 2 . 1 1 57 57 GLU CB C 69 32.800 32.800 31.025 1.775 18522
858 1 2 . 1 1 57 57 GLU H H 69 8.455 8.455 8.075 0.380 18522
859 1 2 . 1 1 58 58 ILE N N 70 125.862 125.862 129.261 -3.399 18522
860 1 2 . 1 1 58 58 ILE HA H 70 4.526 4.526 4.364 0.162 18522
861 1 2 . 1 1 58 58 ILE C C 70 175.035 175.035 175.853 -0.818 18522
862 1 2 . 1 1 58 58 ILE CA C 70 60.918 60.918 60.263 0.655 18522
863 1 2 . 1 1 58 58 ILE CB C 70 39.236 39.236 35.374 3.862 18522
864 1 2 . 1 1 58 58 ILE H H 70 8.619 8.619 8.150 0.469 18522
865 1 2 . 1 1 59 59 THR N N 71 115.507 115.507 120.151 -4.644 18522
866 1 2 . 1 1 59 59 THR HA H 71 4.513 4.513 4.284 0.229 18522
867 1 2 . 1 1 59 59 THR C C 71 176.425 176.425 174.225 2.200 18522
868 1 2 . 1 1 59 59 THR CA C 71 61.158 61.158 62.374 -1.216 18522
869 1 2 . 1 1 59 59 THR CB C 71 69.604 69.604 70.540 -0.936 18522
870 1 2 . 1 1 59 59 THR H H 71 9.242 9.242 8.538 0.704 18522
871 1 2 . 1 1 60 60 GLY N N 72 111.789 111.789 109.603 2.186 18522
872 1 2 . 1 1 60 60 GLY C C 72 170.981 170.981 171.639 -0.658 18522
873 1 2 . 1 1 60 60 GLY CA C 72 46.554 46.554 44.870 1.685 18522
874 1 2 . 1 1 60 60 GLY H H 72 7.883 7.883 7.813 0.070 18522
875 1 2 . 1 1 61 61 VAL N N 73 119.277 119.277 123.207 -3.930 18522
876 1 2 . 1 1 61 61 VAL C C 73 175.951 175.951 175.497 0.454 18522
877 1 2 . 1 1 61 61 VAL CA C 73 60.982 60.982 60.198 0.784 18522
878 1 2 . 1 1 61 61 VAL CB C 73 36.197 36.197 34.278 1.919 18522
879 1 2 . 1 1 61 61 VAL H H 73 8.424 8.424 8.957 -0.533 18522
880 1 2 . 1 1 62 62 ASN N N 74 127.731 127.731 127.389 0.342 18522
881 1 2 . 1 1 62 62 ASN HA H 74 4.520 4.520 4.472 0.048 18522
882 1 2 . 1 1 62 62 ASN C C 74 174.878 174.878 175.072 -0.194 18522
883 1 2 . 1 1 62 62 ASN CA C 74 54.418 54.418 54.372 0.046 18522
884 1 2 . 1 1 62 62 ASN CB C 74 36.655 36.655 37.800 -1.145 18522
885 1 2 . 1 1 62 62 ASN H H 74 10.384 10.384 8.857 1.527 18522
886 1 2 . 1 1 63 63 GLY N N 75 104.633 104.633 102.638 1.995 18522
887 1 2 . 1 1 63 63 GLY C C 75 173.610 173.610 173.421 0.189 18522
888 1 2 . 1 1 63 63 GLY CA C 75 45.261 45.261 44.973 0.288 18522
889 1 2 . 1 1 63 63 GLY H H 75 8.926 8.926 8.126 0.800 18522
890 1 2 . 1 1 64 64 ARG N N 76 120.451 120.451 121.820 -1.369 18522
891 1 2 . 1 1 64 64 ARG HA H 76 4.501 4.501 4.618 -0.117 18522
892 1 2 . 1 1 64 64 ARG C C 76 175.085 175.085 175.777 -0.692 18522
893 1 2 . 1 1 64 64 ARG CA C 76 54.252 54.252 54.283 -0.031 18522
894 1 2 . 1 1 64 64 ARG CB C 76 31.482 31.482 31.444 0.038 18522
895 1 2 . 1 1 64 64 ARG H H 76 7.753 7.753 7.948 -0.195 18522
896 1 2 . 1 1 65 65 SER N N 77 116.586 116.586 120.568 -3.982 18522
897 1 2 . 1 1 65 65 SER HA H 77 4.483 4.483 4.558 -0.075 18522
898 1 2 . 1 1 65 65 SER C C 77 176.953 176.953 176.376 0.577 18522
899 1 2 . 1 1 65 65 SER CA C 77 58.292 58.292 60.090 -1.798 18522
900 1 2 . 1 1 65 65 SER CB C 77 63.643 63.643 63.520 0.123 18522
901 1 2 . 1 1 65 65 SER H H 77 8.555 8.555 8.931 -0.376 18522
902 1 2 . 1 1 66 66 ILE N N 78 116.618 116.618 123.123 -6.505 18522
903 1 2 . 1 1 66 66 ILE HA H 78 4.420 4.420 4.066 0.354 18522
904 1 2 . 1 1 66 66 ILE C C 78 175.072 175.072 176.890 -1.818 18522
905 1 2 . 1 1 66 66 ILE CA C 78 59.122 59.122 62.212 -3.091 18522
906 1 2 . 1 1 66 66 ILE CB C 78 36.758 36.758 36.970 -0.212 18522
907 1 2 . 1 1 66 66 ILE H H 78 7.599 7.599 8.603 -1.004 18522
908 1 2 . 1 1 67 67 LYS N N 79 123.287 123.287 121.846 1.441 18522
909 1 2 . 1 1 67 67 LYS HA H 79 4.049 4.049 4.181 -0.132 18522
910 1 2 . 1 1 67 67 LYS C C 79 178.333 178.333 177.783 0.550 18522
911 1 2 . 1 1 67 67 LYS CA C 79 58.321 58.321 58.099 0.222 18522
912 1 2 . 1 1 67 67 LYS CB C 79 31.635 31.635 32.043 -0.408 18522
913 1 2 . 1 1 67 67 LYS H H 79 7.898 7.898 8.266 -0.368 18522
914 1 2 . 1 1 68 68 GLY N N 80 114.933 114.933 106.895 8.038 18522
915 1 2 . 1 1 68 68 GLY C C 80 174.385 174.385 174.913 -0.528 18522
916 1 2 . 1 1 68 68 GLY CA C 80 45.518 45.518 45.429 0.089 18522
917 1 2 . 1 1 68 68 GLY H H 80 8.999 8.999 7.755 1.244 18522
918 1 2 . 1 1 69 69 LYS N N 81 119.403 119.403 119.917 -0.514 18522
919 1 2 . 1 1 69 69 LYS HA H 81 4.043 4.043 4.580 -0.537 18522
920 1 2 . 1 1 69 69 LYS C C 81 177.064 177.064 175.473 1.591 18522
921 1 2 . 1 1 69 69 LYS CA C 81 54.722 54.722 55.456 -0.734 18522
922 1 2 . 1 1 69 69 LYS CB C 81 33.560 33.560 33.999 -0.439 18522
923 1 2 . 1 1 69 69 LYS H H 81 7.845 7.845 7.906 -0.061 18522
924 1 2 . 1 1 70 70 THR N N 82 112.066 112.066 112.907 -0.841 18522
925 1 2 . 1 1 70 70 THR HA H 82 4.666 4.666 4.564 0.102 18522
926 1 2 . 1 1 70 70 THR C C 82 175.955 175.955 174.922 1.033 18522
927 1 2 . 1 1 70 70 THR CA C 82 60.438 60.438 60.903 -0.465 18522
928 1 2 . 1 1 70 70 THR CB C 82 71.629 71.629 71.826 -0.197 18522
929 1 2 . 1 1 70 70 THR H H 82 9.153 9.153 7.944 1.209 18522
930 1 2 . 1 1 71 71 LYS N N 83 118.730 118.730 124.988 -6.258 18522
931 1 2 . 1 1 71 71 LYS HA H 83 3.870 3.870 4.023 -0.153 18522
932 1 2 . 1 1 71 71 LYS C C 83 177.464 177.464 178.763 -1.299 18522
933 1 2 . 1 1 71 71 LYS CA C 83 60.357 60.357 60.068 0.289 18522
934 1 2 . 1 1 71 71 LYS CB C 83 31.350 31.350 31.903 -0.553 18522
935 1 2 . 1 1 71 71 LYS H H 83 8.969 8.969 8.851 0.118 18522
936 1 2 . 1 1 72 72 VAL N N 84 117.444 117.444 118.367 -0.923 18522
937 1 2 . 1 1 72 72 VAL HA H 84 3.633 3.633 3.616 0.017 18522
938 1 2 . 1 1 72 72 VAL C C 84 178.315 178.315 177.353 0.962 18522
939 1 2 . 1 1 72 72 VAL CA C 84 66.079 66.079 65.946 0.133 18522
940 1 2 . 1 1 72 72 VAL CB C 84 32.091 32.091 31.519 0.572 18522
941 1 2 . 1 1 72 72 VAL H H 84 7.631 7.631 8.223 -0.592 18522
942 1 2 . 1 1 73 73 GLU N N 85 120.890 120.890 119.521 1.369 18522
943 1 2 . 1 1 73 73 GLU HA H 85 3.964 3.964 3.982 -0.018 18522
944 1 2 . 1 1 73 73 GLU C C 85 179.971 179.971 178.837 1.134 18522
945 1 2 . 1 1 73 73 GLU CA C 85 59.316 59.316 59.331 -0.015 18522
946 1 2 . 1 1 73 73 GLU CB C 85 30.355 30.355 29.758 0.597 18522
947 1 2 . 1 1 73 73 GLU H H 85 7.617 7.617 7.371 0.246 18522
948 1 2 . 1 1 74 74 VAL N N 86 121.246 121.246 118.132 3.114 18522
949 1 2 . 1 1 74 74 VAL HA H 86 3.630 3.630 3.627 0.003 18522
950 1 2 . 1 1 74 74 VAL C C 86 177.217 177.217 177.684 -0.467 18522
951 1 2 . 1 1 74 74 VAL CA C 86 66.678 66.678 66.566 0.112 18522
952 1 2 . 1 1 74 74 VAL CB C 86 31.307 31.307 31.383 -0.076 18522
953 1 2 . 1 1 74 74 VAL H H 86 8.368 8.368 8.588 -0.220 18522
954 1 2 . 1 1 75 75 ALA N N 87 122.148 122.148 121.814 0.334 18522
955 1 2 . 1 1 75 75 ALA HA H 87 3.947 3.947 3.917 0.030 18522
956 1 2 . 1 1 75 75 ALA C C 87 179.545 179.545 179.152 0.393 18522
957 1 2 . 1 1 75 75 ALA CA C 87 55.851 55.851 55.324 0.527 18522
958 1 2 . 1 1 75 75 ALA CB C 87 18.491 18.491 17.938 0.553 18522
959 1 2 . 1 1 75 75 ALA H H 87 8.577 8.577 7.956 0.621 18522
960 1 2 . 1 1 76 76 LYS N N 88 117.733 117.733 119.579 -1.846 18522
961 1 2 . 1 1 76 76 LYS HA H 88 4.051 4.051 3.964 0.087 18522
962 1 2 . 1 1 76 76 LYS CA C 88 59.393 59.393 59.472 -0.079 18522
963 1 2 . 1 1 76 76 LYS CB C 88 32.058 32.058 32.383 -0.325 18522
964 1 2 . 1 1 76 76 LYS H H 88 7.854 7.854 7.348 0.506 18522
965 1 2 . 1 1 77 77 MET N N 89 117.676 117.676 117.779 -0.103 18522
966 1 2 . 1 1 77 77 MET HA H 89 4.048 4.048 4.103 -0.055 18522
967 1 2 . 1 1 77 77 MET C C 89 178.791 178.791 179.114 -0.323 18522
968 1 2 . 1 1 77 77 MET CA C 89 59.128 59.128 57.793 1.335 18522
969 1 2 . 1 1 77 77 MET CB C 89 33.801 33.801 31.500 2.301 18522
970 1 2 . 1 1 77 77 MET H H 89 7.759 7.759 8.432 -0.673 18522
971 1 2 . 1 1 78 78 ILE N N 90 117.305 117.305 119.152 -1.847 18522
972 1 2 . 1 1 78 78 ILE HA H 90 3.590 3.590 3.599 -0.009 18522
973 1 2 . 1 1 78 78 ILE C C 90 178.658 178.658 178.032 0.626 18522
974 1 2 . 1 1 78 78 ILE CA C 90 65.482 65.482 65.491 -0.009 18522
975 1 2 . 1 1 78 78 ILE CB C 90 38.845 38.845 37.625 1.220 18522
976 1 2 . 1 1 78 78 ILE H H 90 7.972 7.972 8.407 -0.435 18522
977 1 2 . 1 1 79 79 GLN N N 91 120.935 120.935 118.063 2.872 18522
978 1 2 . 1 1 79 79 GLN HA H 91 3.998 3.998 4.264 -0.266 18522
979 1 2 . 1 1 79 79 GLN C C 91 178.274 178.274 177.634 0.640 18522
980 1 2 . 1 1 79 79 GLN CA C 91 59.151 59.151 57.599 1.552 18522
981 1 2 . 1 1 79 79 GLN CB C 91 28.934 28.934 28.971 -0.037 18522
982 1 2 . 1 1 79 79 GLN H H 91 8.826 8.826 8.044 0.782 18522
983 1 2 . 1 1 80 80 GLU N N 92 115.213 115.213 120.812 -5.599 18522
984 1 2 . 1 1 80 80 GLU HA H 92 4.061 4.061 4.098 -0.037 18522
985 1 2 . 1 1 80 80 GLU C C 92 176.824 176.824 178.431 -1.607 18522
986 1 2 . 1 1 80 80 GLU CA C 92 58.006 58.006 58.812 -0.806 18522
987 1 2 . 1 1 80 80 GLU CB C 92 29.890 29.890 29.877 0.013 18522
988 1 2 . 1 1 80 80 GLU H H 92 8.020 8.020 8.204 -0.184 18522
989 1 2 . 1 1 81 81 VAL N N 93 119.047 119.047 114.812 4.235 18522
990 1 2 . 1 1 81 81 VAL HA H 93 3.930 3.930 3.793 0.137 18522
991 1 2 . 1 1 81 81 VAL C C 93 176.016 176.016 175.899 0.117 18522
992 1 2 . 1 1 81 81 VAL CA C 93 63.153 63.153 63.723 -0.570 18522
993 1 2 . 1 1 81 81 VAL CB C 93 32.154 32.154 32.097 0.057 18522
994 1 2 . 1 1 81 81 VAL H H 93 7.073 7.073 7.587 -0.514 18522
995 1 2 . 1 1 82 82 LYS N N 94 128.366 128.366 119.240 9.126 18522
996 1 2 . 1 1 82 82 LYS C C 94 177.460 177.460 176.709 0.751 18522
997 1 2 . 1 1 82 82 LYS CA C 94 55.753 55.753 57.068 -1.315 18522
998 1 2 . 1 1 82 82 LYS CB C 94 32.332 32.332 32.228 0.104 18522
999 1 2 . 1 1 82 82 LYS H H 94 8.762 8.762 7.435 1.327 18522
1000 1 2 . 1 1 83 83 GLY N N 95 112.528 112.528 113.122 -0.594 18522
1001 1 2 . 1 1 83 83 GLY C C 95 173.468 173.468 172.783 0.685 18522
1002 1 2 . 1 1 83 83 GLY CA C 95 46.243 46.243 45.145 1.098 18522
1003 1 2 . 1 1 83 83 GLY H H 95 8.673 8.673 8.933 -0.260 18522
1004 1 2 . 1 1 84 84 GLU N N 96 121.485 121.485 119.366 2.119 18522
1005 1 2 . 1 1 84 84 GLU HA H 96 4.749 4.749 4.890 -0.141 18522
1006 1 2 . 1 1 84 84 GLU C C 96 174.583 174.583 174.117 0.466 18522
1007 1 2 . 1 1 84 84 GLU CA C 96 55.821 55.821 54.820 1.001 18522
1008 1 2 . 1 1 84 84 GLU CB C 96 31.410 31.410 33.653 -2.243 18522
1009 1 2 . 1 1 84 84 GLU H H 96 8.297 8.297 7.324 0.973 18522
1010 1 2 . 1 1 85 85 VAL N N 97 120.501 120.501 111.693 8.808 18522
1011 1 2 . 1 1 85 85 VAL HA H 97 4.665 4.665 4.725 -0.060 18522
1012 1 2 . 1 1 85 85 VAL C C 97 173.047 173.047 173.538 -0.491 18522
1013 1 2 . 1 1 85 85 VAL CA C 97 60.114 60.114 59.990 0.124 18522
1014 1 2 . 1 1 85 85 VAL CB C 97 35.184 35.184 35.330 -0.146 18522
1015 1 2 . 1 1 85 85 VAL H H 97 9.096 9.096 8.623 0.473 18522
1016 1 2 . 1 1 86 86 THR N N 98 125.019 125.019 119.545 5.474 18522
1017 1 2 . 1 1 86 86 THR HA H 98 4.076 4.076 4.959 -0.883 18522
1018 1 2 . 1 1 86 86 THR C C 98 173.807 173.807 173.509 0.298 18522
1019 1 2 . 1 1 86 86 THR CA C 98 61.735 61.735 61.929 -0.194 18522
1020 1 2 . 1 1 86 86 THR CB C 98 69.531 69.531 69.257 0.274 18522
1021 1 2 . 1 1 86 86 THR H H 98 9.352 9.352 8.391 0.961 18522
1022 1 2 . 1 1 87 87 ILE N N 99 128.383 128.383 123.835 4.548 18522
1023 1 2 . 1 1 87 87 ILE HA H 99 4.661 4.661 4.809 -0.148 18522
1024 1 2 . 1 1 87 87 ILE C C 99 174.614 174.614 174.592 0.022 18522
1025 1 2 . 1 1 87 87 ILE CA C 99 58.258 58.258 59.212 -0.954 18522
1026 1 2 . 1 1 87 87 ILE CB C 99 38.528 38.528 38.041 0.487 18522
1027 1 2 . 1 1 87 87 ILE H H 99 9.329 9.329 8.637 0.692 18522
1028 1 2 . 1 1 88 88 HIS N N 100 128.279 128.279 128.065 0.214 18522
1029 1 2 . 1 1 88 88 HIS HA H 100 4.948 4.948 4.977 -0.029 18522
1030 1 2 . 1 1 88 88 HIS C C 100 174.787 174.787 174.426 0.361 18522
1031 1 2 . 1 1 88 88 HIS CA C 100 54.620 54.620 54.034 0.586 18522
1032 1 2 . 1 1 88 88 HIS H H 100 8.647 8.647 8.546 0.101 18522
1033 1 2 . 1 1 89 89 TYR N N 101 121.320 121.320 123.349 -2.029 18522
1034 1 2 . 1 1 89 89 TYR HA H 101 5.947 5.947 5.451 0.496 18522
1035 1 2 . 1 1 89 89 TYR C C 101 173.769 173.769 173.322 0.447 18522
1036 1 2 . 1 1 89 89 TYR CA C 101 55.669 55.669 54.457 1.212 18522
1037 1 2 . 1 1 89 89 TYR CB C 101 42.195 42.195 40.946 1.249 18522
1038 1 2 . 1 1 89 89 TYR H H 101 8.414 8.414 8.734 -0.320 18522
1039 1 2 . 1 1 90 90 ASN N N 102 116.679 116.679 119.543 -2.864 18522
1040 1 2 . 1 1 90 90 ASN HA H 102 5.335 5.335 5.432 -0.097 18522
1041 1 2 . 1 1 90 90 ASN C C 102 175.406 175.406 174.446 0.960 18522
1042 1 2 . 1 1 90 90 ASN CA C 102 51.961 51.961 52.299 -0.338 18522
1043 1 2 . 1 1 90 90 ASN CB C 102 41.800 41.800 40.778 1.022 18522
1044 1 2 . 1 1 90 90 ASN H H 102 9.282 9.282 8.713 0.569 18522
1045 1 2 . 1 1 91 91 LYS N N 103 124.129 124.129 124.427 -0.298 18522
1046 1 2 . 1 1 91 91 LYS C C 103 176.678 176.678 175.761 0.917 18522
1047 1 2 . 1 1 91 91 LYS CA C 103 55.006 55.006 56.026 -1.020 18522
1048 1 2 . 1 1 91 91 LYS H H 103 8.949 8.949 8.583 0.366 18522
1049 1 2 . 1 1 92 92 LEU N N 104 127.043 127.043 119.497 7.546 18522
1050 1 2 . 1 1 92 92 LEU HA H 104 4.425 4.425 4.592 -0.167 18522
1051 1 2 . 1 1 92 92 LEU CA C 104 55.060 55.060 55.785 -0.725 18522
1052 1 2 . 1 1 92 92 LEU CB C 104 42.559 42.559 42.694 -0.135 18522
1053 1 2 . 1 1 92 92 LEU H H 104 9.150 9.150 8.203 0.947 18522
1054 1 2 . 1 1 93 93 GLN HA H 105 4.315 4.315 4.118 0.197 18522
1055 1 2 . 1 1 93 93 GLN C C 105 175.070 175.070 174.912 0.158 18522
1056 1 2 . 1 1 93 93 GLN CA C 105 55.490 55.490 56.692 -1.202 18522
1057 1 2 . 1 1 93 93 GLN CB C 105 28.909 28.909 26.972 1.937 18522
1058 1 2 . 1 1 94 94 ALA N N 106 125.133 125.133 118.738 6.395 18522
1059 1 2 . 1 1 94 94 ALA HA H 106 4.366 4.366 4.016 0.350 18522
1060 1 2 . 1 1 94 94 ALA C C 106 176.392 176.392 175.155 1.237 18522
1061 1 2 . 1 1 94 94 ALA CA C 106 51.723 51.723 52.584 -0.862 18522
1062 1 2 . 1 1 94 94 ALA CB C 106 20.185 20.185 19.049 1.136 18522
1063 1 2 . 1 1 94 94 ALA H H 106 8.226 8.226 8.002 0.224 18522
1064 1 2 . 1 1 95 95 ASP N N 107 122.013 122.013 120.145 1.868 18522
1065 1 2 . 1 1 95 95 ASP HA H 107 4.413 4.413 4.914 -0.501 18522
1066 1 2 . 1 1 95 95 ASP C C 107 175.019 175.019 175.527 -0.508 18522
1067 1 2 . 1 1 95 95 ASP CA C 107 55.642 55.642 51.119 4.523 18522
1068 1 2 . 1 1 95 95 ASP CB C 107 41.266 41.266 42.365 -1.099 18522
1069 1 2 . 1 1 95 95 ASP H H 107 8.429 8.429 8.292 0.137 18522
1070 1 2 . 1 1 96 96 PRO HA H 108 4.207 4.207 3.984 0.223 18522
1071 1 2 . 1 1 96 96 PRO C C 108 178.840 178.840 178.185 0.655 18522
1072 1 2 . 1 1 96 96 PRO CA C 108 65.396 65.396 65.792 -0.396 18522
1073 1 2 . 1 1 96 96 PRO CB C 108 32.181 32.181 32.020 0.161 18522
1074 1 2 . 1 1 97 97 LYS N N 109 117.942 117.942 115.316 2.626 18522
1075 1 2 . 1 1 97 97 LYS HA H 109 4.143 4.143 4.022 0.121 18522
1076 1 2 . 1 1 97 97 LYS C C 109 178.099 178.099 179.402 -1.303 18522
1077 1 2 . 1 1 97 97 LYS CA C 109 58.167 58.167 59.062 -0.895 18522
1078 1 2 . 1 1 97 97 LYS CB C 109 31.649 31.649 31.451 0.198 18522
1079 1 2 . 1 1 97 97 LYS H H 109 8.335 8.335 7.749 0.586 18522
1080 1 2 . 1 1 98 98 GLN N N 110 119.159 119.159 118.371 0.788 18522
1081 1 2 . 1 1 98 98 GLN HA H 110 4.130 4.130 4.297 -0.167 18522
1082 1 2 . 1 1 98 98 GLN C C 110 178.298 178.298 178.373 -0.075 18522
1083 1 2 . 1 1 98 98 GLN CA C 110 57.660 57.660 57.256 0.404 18522
1084 1 2 . 1 1 98 98 GLN CB C 110 28.720 28.720 28.637 0.083 18522
1085 1 2 . 1 1 98 98 GLN H H 110 7.985 7.985 8.254 -0.269 18522
1086 1 2 . 1 1 99 99 LEU N N 111 120.490 120.490 122.407 -1.917 18522
1087 1 2 . 1 1 99 99 LEU HA H 111 3.877 3.877 4.170 -0.293 18522
1088 1 2 . 1 1 99 99 LEU C C 111 177.729 177.729 178.489 -0.760 18522
1089 1 2 . 1 1 99 99 LEU CA C 111 57.049 57.049 58.149 -1.100 18522
1090 1 2 . 1 1 99 99 LEU CB C 111 41.466 41.466 41.733 -0.267 18522
1091 1 2 . 1 1 99 99 LEU H H 111 7.994 7.994 8.441 -0.447 18522
1092 1 2 . 1 1 100 100 GLU N N 112 118.251 118.251 118.920 -0.669 18522
1093 1 2 . 1 1 100 100 GLU HA H 112 3.972 3.972 4.128 -0.156 18522
1094 1 2 . 1 1 100 100 GLU C C 112 178.402 178.402 179.105 -0.703 18522
1095 1 2 . 1 1 100 100 GLU CA C 112 59.056 59.056 59.361 -0.305 18522
1096 1 2 . 1 1 100 100 GLU CB C 112 29.732 29.732 29.026 0.706 18522
1097 1 2 . 1 1 100 100 GLU H H 112 7.760 7.760 8.039 -0.279 18522
1098 1 2 . 1 1 101 101 VAL N N 113 117.229 117.229 120.304 -3.075 18522
1099 1 2 . 1 1 101 101 VAL HA H 113 3.762 3.762 3.782 -0.020 18522
1100 1 2 . 1 1 101 101 VAL C C 113 178.107 178.107 177.529 0.578 18522
1101 1 2 . 1 1 101 101 VAL CA C 113 64.791 64.791 65.785 -0.994 18522
1102 1 2 . 1 1 101 101 VAL CB C 113 32.149 32.149 31.846 0.303 18522
1103 1 2 . 1 1 101 101 VAL H H 113 7.437 7.437 7.259 0.178 18522
1104 1 2 . 1 1 102 102 LEU N N 114 122.124 122.124 118.602 3.522 18522
1105 1 2 . 1 1 102 102 LEU HA H 114 4.033 4.033 4.186 -0.153 18522
1106 1 2 . 1 1 102 102 LEU C C 114 178.506 178.506 178.850 -0.344 18522
1107 1 2 . 1 1 102 102 LEU CA C 114 57.243 57.243 57.184 0.059 18522
1108 1 2 . 1 1 102 102 LEU CB C 114 42.028 42.028 42.149 -0.121 18522
1109 1 2 . 1 1 102 102 LEU H H 114 7.765 7.765 7.898 -0.133 18522
1110 1 2 . 1 1 103 103 PHE N N 115 115.346 115.346 119.999 -4.653 18522
1111 1 2 . 1 1 103 103 PHE HA H 115 4.224 4.224 4.326 -0.102 18522
1112 1 2 . 1 1 103 103 PHE C C 115 175.621 175.621 177.311 -1.690 18522
1113 1 2 . 1 1 103 103 PHE CA C 115 57.537 57.537 60.807 -3.270 18522
1114 1 2 . 1 1 103 103 PHE CB C 115 38.057 38.057 39.817 -1.760 18522
1115 1 2 . 1 1 103 103 PHE H H 115 7.805 7.805 7.822 -0.017 18522
1116 1 2 . 1 1 104 104 GLN N N 116 119.021 119.021 117.382 1.639 18522
1117 1 2 . 1 1 104 104 GLN HA H 116 4.407 4.407 4.283 0.124 18522
1118 1 2 . 1 1 104 104 GLN C C 116 176.402 176.402 175.786 0.616 18522
1119 1 2 . 1 1 104 104 GLN CA C 116 55.521 55.521 55.928 -0.408 18522
1120 1 2 . 1 1 104 104 GLN CB C 116 29.170 29.170 27.534 1.636 18522
1121 1 2 . 1 1 104 104 GLN H H 116 7.974 7.974 8.602 -0.628 18522
1122 1 2 . 1 1 105 105 GLY N N 117 108.868 108.868 108.186 0.682 18522
1123 1 2 . 1 1 105 105 GLY CA C 117 45.124 45.124 45.466 -0.342 18522
1124 1 2 . 1 1 105 105 GLY H H 117 8.195 8.195 7.786 0.409 18522
1125 1 2 . 1 1 106 106 PRO HA H 118 4.490 4.490 3.882 0.608 18522
1126 1 2 . 1 1 106 106 PRO C C 118 176.001 176.001 175.276 0.725 18522
1127 1 2 . 1 1 106 106 PRO CA C 118 63.523 63.523 64.112 -0.590 18522
1128 1 2 . 1 1 106 106 PRO CB C 118 32.078 32.078 30.305 1.773 18522
1129 1 2 . 1 1 107 107 GLN N N 119 126.950 126.950 119.968 6.982 18522
1130 1 2 . 1 1 107 107 GLN C C 119 181.211 181.211 174.440 6.771 18522
1131 1 2 . 1 1 107 107 GLN CA C 119 57.416 57.416 55.679 1.737 18522
1132 1 2 . 1 1 107 107 GLN H H 119 8.079 8.079 8.045 0.034 18522
1133 1 2 . 1 1 111 111 ARG C C 123 174.608 174.608 174.751 -0.143 18522
1134 1 2 . 1 1 111 111 ARG CA C 123 55.099 55.099 54.191 0.907 18522
1135 1 2 . 1 1 112 112 HIS N N 124 122.212 122.212 119.762 2.450 18522
1136 1 2 . 1 1 112 112 HIS HA H 124 4.718 4.718 4.742 -0.024 18522
1137 1 2 . 1 1 112 112 HIS C C 124 176.040 176.040 174.685 1.355 18522
1138 1 2 . 1 1 112 112 HIS CA C 124 54.213 54.213 55.955 -1.742 18522
1139 1 2 . 1 1 112 112 HIS CB C 124 31.164 31.164 29.824 1.340 18522
1140 1 2 . 1 1 112 112 HIS H H 124 7.640 7.640 8.562 -0.922 18522
1141 1 2 . 1 1 113 113 TRP C C 125 176.168 176.168 174.596 1.572 18522
1142 1 2 . 1 1 114 114 LEU N N 126 121.893 121.893 124.828 -2.935 18522
1143 1 2 . 1 1 114 114 LEU HA H 126 4.869 4.869 4.621 0.248 18522
1144 1 2 . 1 1 114 114 LEU CA C 126 54.151 54.151 52.682 1.469 18522
1145 1 2 . 1 1 114 114 LEU CB C 126 45.144 45.144 45.926 -0.782 18522
1146 1 2 . 1 1 114 114 LEU H H 126 8.606 8.606 7.481 1.125 18522
1147 1 2 . 1 1 115 115 LYS N N 127 125.850 125.850 118.746 7.104 18522
1148 1 2 . 1 1 115 115 LYS HA H 127 4.203 4.203 4.429 -0.226 18522
1149 1 2 . 1 1 115 115 LYS C C 127 175.564 175.564 173.859 1.705 18522
1150 1 2 . 1 1 115 115 LYS CA C 127 57.252 57.252 55.528 1.724 18522
1151 1 2 . 1 1 115 115 LYS CB C 127 33.406 33.406 34.223 -0.817 18522
1152 1 2 . 1 1 115 115 LYS H H 127 8.647 8.647 7.898 0.749 18522
1153 1 3 . 1 1 3 3 PRO C C 15 177.225 177.225 176.727 0.498 18522
1154 1 3 . 1 1 3 3 PRO CA C 15 63.508 63.508 62.585 0.923 18522
1155 1 3 . 1 1 3 3 PRO CB C 15 32.090 32.090 30.367 1.723 18522
1156 1 3 . 1 1 4 4 GLY N N 16 108.829 108.829 110.202 -1.373 18522
1157 1 3 . 1 1 4 4 GLY C C 16 173.398 173.398 174.534 -1.136 18522
1158 1 3 . 1 1 4 4 GLY CA C 16 45.128 45.128 45.115 0.013 18522
1159 1 3 . 1 1 4 4 GLY H H 16 8.489 8.489 8.459 0.030 18522
1160 1 3 . 1 1 5 5 ILE N N 17 121.763 121.763 117.939 3.824 18522
1161 1 3 . 1 1 5 5 ILE HA H 17 4.554 4.554 4.779 -0.225 18522
1162 1 3 . 1 1 5 5 ILE C C 17 174.332 174.332 173.716 0.616 18522
1163 1 3 . 1 1 5 5 ILE CA C 17 58.245 58.245 57.813 0.432 18522
1164 1 3 . 1 1 5 5 ILE CB C 17 38.762 38.762 38.519 0.243 18522
1165 1 3 . 1 1 5 5 ILE H H 17 8.014 8.014 7.590 0.424 18522
1166 1 3 . 1 1 6 6 PRO C C 18 176.437 176.437 176.439 -0.002 18522
1167 1 3 . 1 1 6 6 PRO CA C 18 62.667 62.667 62.203 0.464 18522
1168 1 3 . 1 1 6 6 PRO CB C 18 32.469 32.469 32.456 0.013 18522
1169 1 3 . 1 1 7 7 VAL N N 19 123.849 123.849 117.536 6.313 18522
1170 1 3 . 1 1 7 7 VAL HA H 19 4.550 4.550 3.935 0.615 18522
1171 1 3 . 1 1 7 7 VAL C C 19 174.453 174.453 174.434 0.019 18522
1172 1 3 . 1 1 7 7 VAL CA C 19 59.846 59.846 62.182 -2.336 18522
1173 1 3 . 1 1 7 7 VAL CB C 19 33.510 33.510 30.789 2.721 18522
1174 1 3 . 1 1 7 7 VAL H H 19 8.754 8.754 8.364 0.390 18522
1175 1 3 . 1 1 8 8 PRO HA H 20 5.338 5.338 4.606 0.732 18522
1176 1 3 . 1 1 8 8 PRO C C 20 177.585 177.585 176.098 1.487 18522
1177 1 3 . 1 1 8 8 PRO CA C 20 62.406 62.406 61.879 0.527 18522
1178 1 3 . 1 1 8 8 PRO CB C 20 32.891 32.891 32.226 0.665 18522
1179 1 3 . 1 1 9 9 GLY N N 21 108.426 108.426 111.428 -3.002 18522
1180 1 3 . 1 1 9 9 GLY C C 21 171.443 171.443 171.498 -0.055 18522
1181 1 3 . 1 1 9 9 GLY CA C 21 44.581 44.581 43.694 0.887 18522
1182 1 3 . 1 1 9 9 GLY H H 21 8.258 8.258 8.820 -0.562 18522
1183 1 3 . 1 1 10 10 LYS N N 22 117.372 117.372 122.176 -4.804 18522
1184 1 3 . 1 1 10 10 LYS HA H 22 4.039 4.039 5.318 -1.279 18522
1185 1 3 . 1 1 10 10 LYS C C 22 174.463 174.463 174.718 -0.255 18522
1186 1 3 . 1 1 10 10 LYS CA C 22 55.263 55.263 54.923 0.340 18522
1187 1 3 . 1 1 10 10 LYS CB C 22 35.227 35.227 34.753 0.474 18522
1188 1 3 . 1 1 10 10 LYS H H 22 8.175 8.175 7.950 0.225 18522
1189 1 3 . 1 1 11 11 VAL N N 23 120.387 120.387 118.544 1.843 18522
1190 1 3 . 1 1 11 11 VAL HA H 23 4.708 4.708 4.574 0.134 18522
1191 1 3 . 1 1 11 11 VAL C C 23 171.873 171.873 174.421 -2.548 18522
1192 1 3 . 1 1 11 11 VAL CA C 23 59.866 59.866 59.921 -0.055 18522
1193 1 3 . 1 1 11 11 VAL CB C 23 35.269 35.269 35.772 -0.503 18522
1194 1 3 . 1 1 11 11 VAL H H 23 8.862 8.862 8.320 0.542 18522
1195 1 3 . 1 1 12 12 THR N N 24 125.797 125.797 118.904 6.893 18522
1196 1 3 . 1 1 12 12 THR HA H 24 5.121 5.121 5.058 0.063 18522
1197 1 3 . 1 1 12 12 THR C C 24 173.407 173.407 173.951 -0.544 18522
1198 1 3 . 1 1 12 12 THR CA C 24 62.115 62.115 60.165 1.950 18522
1199 1 3 . 1 1 12 12 THR CB C 24 69.606 69.606 69.401 0.205 18522
1200 1 3 . 1 1 12 12 THR H H 24 8.859 8.859 8.299 0.560 18522
1201 1 3 . 1 1 13 13 LEU N N 25 127.960 127.960 127.299 0.661 18522
1202 1 3 . 1 1 13 13 LEU HA H 25 4.809 4.809 4.853 -0.044 18522
1203 1 3 . 1 1 13 13 LEU C C 25 175.029 175.029 175.107 -0.078 18522
1204 1 3 . 1 1 13 13 LEU CA C 25 52.623 52.623 52.881 -0.258 18522
1205 1 3 . 1 1 13 13 LEU CB C 25 46.242 46.242 45.075 1.167 18522
1206 1 3 . 1 1 13 13 LEU H H 25 9.258 9.258 8.355 0.903 18522
1207 1 3 . 1 1 14 14 GLN N N 26 120.858 120.858 117.530 3.328 18522
1208 1 3 . 1 1 14 14 GLN HA H 26 4.482 4.482 4.600 -0.118 18522
1209 1 3 . 1 1 14 14 GLN C C 26 174.515 174.515 175.006 -0.491 18522
1210 1 3 . 1 1 14 14 GLN CA C 26 54.576 54.576 54.327 0.249 18522
1211 1 3 . 1 1 14 14 GLN CB C 26 29.516 29.516 32.058 -2.542 18522
1212 1 3 . 1 1 14 14 GLN H H 26 8.530 8.530 8.355 0.175 18522
1213 1 3 . 1 1 15 15 LYS N N 27 119.583 119.583 122.811 -3.228 18522
1214 1 3 . 1 1 15 15 LYS HA H 27 4.180 4.180 4.224 -0.044 18522
1215 1 3 . 1 1 15 15 LYS C C 27 177.468 177.468 176.913 0.555 18522
1216 1 3 . 1 1 15 15 LYS CA C 27 55.956 55.956 56.931 -0.975 18522
1217 1 3 . 1 1 15 15 LYS CB C 27 34.099 34.099 32.497 1.602 18522
1218 1 3 . 1 1 15 15 LYS H H 27 8.099 8.099 8.047 0.052 18522
1219 1 3 . 1 1 16 16 ASP N N 28 121.439 121.439 122.644 -1.205 18522
1220 1 3 . 1 1 16 16 ASP HA H 28 4.590 4.590 4.634 -0.044 18522
1221 1 3 . 1 1 16 16 ASP C C 28 178.392 178.392 177.754 0.638 18522
1222 1 3 . 1 1 16 16 ASP CA C 28 52.426 52.426 53.570 -1.144 18522
1223 1 3 . 1 1 16 16 ASP CB C 28 41.377 41.377 42.726 -1.349 18522
1224 1 3 . 1 1 16 16 ASP H H 28 8.888 8.888 8.639 0.249 18522
1225 1 3 . 1 1 17 17 ALA N N 29 119.578 119.578 123.344 -3.766 18522
1226 1 3 . 1 1 17 17 ALA HA H 29 4.188 4.188 4.077 0.111 18522
1227 1 3 . 1 1 17 17 ALA C C 29 178.763 178.763 178.085 0.678 18522
1228 1 3 . 1 1 17 17 ALA CA C 29 54.434 54.434 54.548 -0.114 18522
1229 1 3 . 1 1 17 17 ALA CB C 29 18.293 18.293 18.750 -0.457 18522
1230 1 3 . 1 1 17 17 ALA H H 29 8.392 8.392 8.690 -0.298 18522
1231 1 3 . 1 1 18 18 GLN N N 30 117.564 117.564 118.368 -0.804 18522
1232 1 3 . 1 1 18 18 GLN HA H 30 4.399 4.399 4.382 0.017 18522
1233 1 3 . 1 1 18 18 GLN C C 30 175.168 175.168 175.365 -0.197 18522
1234 1 3 . 1 1 18 18 GLN CA C 30 55.339 55.339 54.719 0.620 18522
1235 1 3 . 1 1 18 18 GLN CB C 30 28.589 28.589 28.950 -0.361 18522
1236 1 3 . 1 1 18 18 GLN H H 30 8.353 8.353 7.792 0.561 18522
1237 1 3 . 1 1 19 19 ASN N N 31 115.365 115.365 115.124 0.241 18522
1238 1 3 . 1 1 19 19 ASN HA H 31 4.315 4.315 4.372 -0.057 18522
1239 1 3 . 1 1 19 19 ASN C C 31 174.043 174.043 173.097 0.946 18522
1240 1 3 . 1 1 19 19 ASN CA C 31 54.303 54.303 54.666 -0.363 18522
1241 1 3 . 1 1 19 19 ASN CB C 31 37.610 37.610 37.541 0.069 18522
1242 1 3 . 1 1 19 19 ASN H H 31 8.521 8.521 8.284 0.237 18522
1243 1 3 . 1 1 20 20 LEU N N 32 118.660 118.660 112.326 6.334 18522
1244 1 3 . 1 1 20 20 LEU HA H 32 4.900 4.900 4.846 0.054 18522
1245 1 3 . 1 1 20 20 LEU C C 32 178.117 178.117 176.553 1.564 18522
1246 1 3 . 1 1 20 20 LEU CA C 32 53.957 53.957 53.378 0.579 18522
1247 1 3 . 1 1 20 20 LEU CB C 32 44.774 44.774 43.730 1.044 18522
1248 1 3 . 1 1 20 20 LEU H H 32 8.155 8.155 7.413 0.742 18522
1249 1 3 . 1 1 21 21 ILE N N 33 116.785 116.785 116.243 0.542 18522
1250 1 3 . 1 1 21 21 ILE HA H 33 4.674 4.674 4.436 0.238 18522
1251 1 3 . 1 1 21 21 ILE C C 33 176.185 176.185 176.585 -0.400 18522
1252 1 3 . 1 1 21 21 ILE CA C 33 62.602 62.602 61.446 1.156 18522
1253 1 3 . 1 1 21 21 ILE CB C 33 39.016 39.016 39.439 -0.423 18522
1254 1 3 . 1 1 21 21 ILE H H 33 11.488 11.488 8.370 3.118 18522
1255 1 3 . 1 1 22 22 GLY N N 34 111.234 111.234 108.454 2.780 18522
1256 1 3 . 1 1 22 22 GLY C C 34 173.993 173.993 174.197 -0.204 18522
1257 1 3 . 1 1 22 22 GLY CA C 34 45.980 45.980 45.084 0.896 18522
1258 1 3 . 1 1 22 22 GLY H H 34 9.854 9.854 8.638 1.216 18522
1259 1 3 . 1 1 23 23 ILE N N 35 111.117 111.117 114.020 -2.903 18522
1260 1 3 . 1 1 23 23 ILE HA H 35 5.535 5.535 5.232 0.303 18522
1261 1 3 . 1 1 23 23 ILE C C 35 175.033 175.033 173.943 1.090 18522
1262 1 3 . 1 1 23 23 ILE CA C 35 58.415 58.415 58.002 0.413 18522
1263 1 3 . 1 1 23 23 ILE CB C 35 41.577 41.577 42.395 -0.818 18522
1264 1 3 . 1 1 23 23 ILE H H 35 7.835 7.835 7.127 0.708 18522
1265 1 3 . 1 1 24 24 SER N N 36 114.908 114.908 115.595 -0.687 18522
1266 1 3 . 1 1 24 24 SER HA H 36 4.232 4.232 5.202 -0.970 18522
1267 1 3 . 1 1 24 24 SER C C 36 174.735 174.735 173.001 1.734 18522
1268 1 3 . 1 1 24 24 SER CA C 36 56.121 56.121 57.493 -1.373 18522
1269 1 3 . 1 1 24 24 SER CB C 36 66.097 66.097 65.789 0.308 18522
1270 1 3 . 1 1 24 24 SER H H 36 8.623 8.623 8.463 0.160 18522
1271 1 3 . 1 1 25 25 ILE N N 37 117.739 117.739 121.175 -3.436 18522
1272 1 3 . 1 1 25 25 ILE C C 37 174.340 174.340 174.305 0.035 18522
1273 1 3 . 1 1 25 25 ILE CA C 37 59.123 59.123 58.609 0.514 18522
1274 1 3 . 1 1 25 25 ILE CB C 37 41.637 41.637 41.793 -0.156 18522
1275 1 3 . 1 1 25 25 ILE H H 37 9.130 9.130 8.183 0.947 18522
1276 1 3 . 1 1 26 26 GLY N N 38 108.069 108.069 111.290 -3.221 18522
1277 1 3 . 1 1 26 26 GLY CA C 38 44.112 44.112 43.429 0.683 18522
1278 1 3 . 1 1 26 26 GLY H H 38 8.841 8.841 8.874 -0.033 18522
1279 1 3 . 1 1 27 27 GLY N N 39 109.016 109.016 108.890 0.126 18522
1280 1 3 . 1 1 27 27 GLY C C 39 173.956 173.956 175.765 -1.809 18522
1281 1 3 . 1 1 27 27 GLY H H 39 8.187 8.187 8.284 -0.096 18522
1282 1 3 . 1 1 28 28 GLY N N 40 111.783 111.783 107.731 4.052 18522
1283 1 3 . 1 1 28 28 GLY C C 40 174.255 174.255 173.668 0.587 18522
1284 1 3 . 1 1 28 28 GLY CA C 40 47.098 47.098 44.326 2.772 18522
1285 1 3 . 1 1 28 28 GLY H H 40 8.275 8.275 7.577 0.698 18522
1286 1 3 . 1 1 29 29 ALA N N 41 123.128 123.128 118.169 4.959 18522
1287 1 3 . 1 1 29 29 ALA HA H 41 4.559 4.559 3.773 0.786 18522
1288 1 3 . 1 1 29 29 ALA CA C 41 51.073 51.073 53.331 -2.258 18522
1289 1 3 . 1 1 29 29 ALA CB C 41 21.926 21.926 17.803 4.123 18522
1290 1 3 . 1 1 29 29 ALA H H 41 8.012 8.012 8.375 -0.363 18522
1291 1 3 . 1 1 31 31 TYR HA H 43 4.549 4.549 4.241 0.308 18522
1292 1 3 . 1 1 31 31 TYR CA C 43 57.147 57.147 59.785 -2.638 18522
1293 1 3 . 1 1 31 31 TYR CB C 43 37.495 37.495 39.498 -2.003 18522
1294 1 3 . 1 1 32 32 CYS N N 44 119.332 119.332 112.119 7.213 18522
1295 1 3 . 1 1 32 32 CYS HA H 44 4.859 4.859 4.010 0.849 18522
1296 1 3 . 1 1 32 32 CYS CA C 44 57.406 57.406 59.268 -1.862 18522
1297 1 3 . 1 1 32 32 CYS CB C 44 27.673 27.673 27.738 -0.065 18522
1298 1 3 . 1 1 32 32 CYS H H 44 7.504 7.504 7.750 -0.246 18522
1299 1 3 . 1 1 33 33 PRO HA H 45 4.413 4.413 4.478 -0.065 18522
1300 1 3 . 1 1 33 33 PRO CA C 45 64.885 64.885 63.053 1.832 18522
1301 1 3 . 1 1 33 33 PRO CB C 45 32.318 32.318 32.535 -0.216 18522
1302 1 3 . 1 1 34 34 CYS N N 46 117.327 117.327 121.739 -4.412 18522
1303 1 3 . 1 1 34 34 CYS C C 46 172.064 172.064 176.176 -4.112 18522
1304 1 3 . 1 1 34 34 CYS CA C 46 60.066 60.066 62.882 -2.816 18522
1305 1 3 . 1 1 34 34 CYS CB C 46 28.715 28.715 28.063 0.652 18522
1306 1 3 . 1 1 34 34 CYS H H 46 7.973 7.973 8.597 -0.624 18522
1307 1 3 . 1 1 35 35 LEU N N 47 124.270 124.270 115.607 8.663 18522
1308 1 3 . 1 1 35 35 LEU HA H 47 4.928 4.928 3.797 1.131 18522
1309 1 3 . 1 1 35 35 LEU C C 47 175.076 175.076 177.315 -2.239 18522
1310 1 3 . 1 1 35 35 LEU CA C 47 53.278 53.278 57.498 -4.220 18522
1311 1 3 . 1 1 35 35 LEU CB C 47 44.321 44.321 40.020 4.301 18522
1312 1 3 . 1 1 35 35 LEU H H 47 8.629 8.629 8.202 0.427 18522
1313 1 3 . 1 1 36 36 TYR N N 48 119.326 119.326 112.734 6.592 18522
1314 1 3 . 1 1 36 36 TYR HA H 48 5.255 5.255 4.200 1.055 18522
1315 1 3 . 1 1 36 36 TYR C C 48 175.766 175.766 176.929 -1.163 18522
1316 1 3 . 1 1 36 36 TYR CA C 48 56.696 56.696 60.871 -4.175 18522
1317 1 3 . 1 1 36 36 TYR CB C 48 42.590 42.590 36.641 5.949 18522
1318 1 3 . 1 1 36 36 TYR H H 48 8.761 8.761 8.144 0.617 18522
1319 1 3 . 1 1 37 37 ILE N N 49 120.259 120.259 121.989 -1.730 18522
1320 1 3 . 1 1 37 37 ILE HA H 49 4.215 4.215 4.216 -0.001 18522
1321 1 3 . 1 1 37 37 ILE C C 49 177.429 177.429 177.032 0.397 18522
1322 1 3 . 1 1 37 37 ILE CA C 49 62.456 62.456 62.115 0.341 18522
1323 1 3 . 1 1 37 37 ILE CB C 49 37.352 37.352 38.112 -0.760 18522
1324 1 3 . 1 1 37 37 ILE H H 49 8.959 8.959 7.882 1.077 18522
1325 1 3 . 1 1 38 38 VAL HA H 50 3.937 3.937 4.353 -0.416 18522
1326 1 3 . 1 1 38 38 VAL C C 50 174.408 174.408 175.016 -0.608 18522
1327 1 3 . 1 1 38 38 VAL CA C 50 62.259 62.259 61.811 0.448 18522
1328 1 3 . 1 1 38 38 VAL CB C 50 31.584 31.584 32.877 -1.293 18522
1329 1 3 . 1 1 39 39 GLN N N 51 116.821 116.821 119.414 -2.593 18522
1330 1 3 . 1 1 39 39 GLN HA H 51 4.103 4.103 4.430 -0.327 18522
1331 1 3 . 1 1 39 39 GLN C C 51 172.856 172.856 172.973 -0.117 18522
1332 1 3 . 1 1 39 39 GLN CA C 51 55.127 55.127 55.399 -0.272 18522
1333 1 3 . 1 1 39 39 GLN CB C 51 32.376 32.376 32.555 -0.179 18522
1334 1 3 . 1 1 39 39 GLN H H 51 6.967 6.967 7.687 -0.720 18522
1335 1 3 . 1 1 40 40 VAL N N 52 123.482 123.482 122.358 1.124 18522
1336 1 3 . 1 1 40 40 VAL HA H 52 4.277 4.277 4.507 -0.230 18522
1337 1 3 . 1 1 40 40 VAL C C 52 176.198 176.198 174.245 1.953 18522
1338 1 3 . 1 1 40 40 VAL CA C 52 61.574 61.574 60.044 1.530 18522
1339 1 3 . 1 1 40 40 VAL CB C 52 32.875 32.875 34.967 -2.092 18522
1340 1 3 . 1 1 40 40 VAL H H 52 8.447 8.447 8.101 0.346 18522
1341 1 3 . 1 1 41 41 PHE N N 53 128.296 128.296 123.867 4.429 18522
1342 1 3 . 1 1 41 41 PHE HA H 53 4.400 4.400 4.752 -0.352 18522
1343 1 3 . 1 1 41 41 PHE C C 53 175.299 175.299 175.154 0.145 18522
1344 1 3 . 1 1 41 41 PHE CA C 53 58.494 58.494 58.114 0.380 18522
1345 1 3 . 1 1 41 41 PHE CB C 53 39.561 39.561 39.809 -0.248 18522
1346 1 3 . 1 1 41 41 PHE H H 53 8.707 8.707 8.138 0.569 18522
1347 1 3 . 1 1 42 42 ASP N N 54 122.696 122.696 115.813 6.883 18522
1348 1 3 . 1 1 42 42 ASP HA H 54 4.272 4.272 4.658 -0.386 18522
1349 1 3 . 1 1 42 42 ASP C C 54 176.837 176.837 176.117 0.720 18522
1350 1 3 . 1 1 42 42 ASP CA C 54 55.291 55.291 54.946 0.345 18522
1351 1 3 . 1 1 42 42 ASP CB C 54 41.093 41.093 42.479 -1.386 18522
1352 1 3 . 1 1 42 42 ASP H H 54 8.901 8.901 8.470 0.431 18522
1353 1 3 . 1 1 43 43 ASN N N 55 113.923 113.923 116.730 -2.807 18522
1354 1 3 . 1 1 43 43 ASN HA H 55 4.258 4.258 4.856 -0.598 18522
1355 1 3 . 1 1 43 43 ASN C C 55 173.714 173.714 174.832 -1.118 18522
1356 1 3 . 1 1 43 43 ASN CA C 55 54.958 54.958 53.510 1.448 18522
1357 1 3 . 1 1 43 43 ASN CB C 55 37.150 37.150 39.570 -2.420 18522
1358 1 3 . 1 1 43 43 ASN H H 55 9.319 9.319 8.295 1.024 18522
1359 1 3 . 1 1 44 44 THR N N 56 108.020 108.020 110.608 -2.588 18522
1360 1 3 . 1 1 44 44 THR HA H 56 5.377 5.377 4.837 0.540 18522
1361 1 3 . 1 1 44 44 THR CA C 56 59.712 59.712 59.072 0.640 18522
1362 1 3 . 1 1 44 44 THR CB C 56 69.529 69.529 70.136 -0.607 18522
1363 1 3 . 1 1 44 44 THR H H 56 7.149 7.149 7.520 -0.371 18522
1364 1 3 . 1 1 45 45 PRO HA H 57 4.304 4.304 4.087 0.217 18522
1365 1 3 . 1 1 45 45 PRO C C 57 180.141 180.141 177.852 2.289 18522
1366 1 3 . 1 1 45 45 PRO CA C 57 66.090 66.090 65.622 0.468 18522
1367 1 3 . 1 1 45 45 PRO CB C 57 33.194 33.194 31.515 1.679 18522
1368 1 3 . 1 1 46 46 ALA N N 58 116.854 116.854 119.296 -2.442 18522
1369 1 3 . 1 1 46 46 ALA HA H 58 4.035 4.035 4.017 0.018 18522
1370 1 3 . 1 1 46 46 ALA C C 58 180.647 180.647 179.395 1.252 18522
1371 1 3 . 1 1 46 46 ALA CA C 58 55.195 55.195 55.167 0.028 18522
1372 1 3 . 1 1 46 46 ALA CB C 58 18.880 18.880 18.116 0.764 18522
1373 1 3 . 1 1 46 46 ALA H H 58 8.938 8.938 7.942 0.996 18522
1374 1 3 . 1 1 47 47 ALA N N 59 123.250 123.250 121.018 2.232 18522
1375 1 3 . 1 1 47 47 ALA HA H 59 4.030 4.030 4.064 -0.034 18522
1376 1 3 . 1 1 47 47 ALA C C 59 179.852 179.852 179.731 0.121 18522
1377 1 3 . 1 1 47 47 ALA CA C 59 54.939 54.939 54.683 0.256 18522
1378 1 3 . 1 1 47 47 ALA CB C 59 19.688 19.688 18.774 0.914 18522
1379 1 3 . 1 1 47 47 ALA H H 59 7.658 7.658 7.390 0.268 18522
1380 1 3 . 1 1 48 48 LEU N N 60 118.654 118.654 118.245 0.409 18522
1381 1 3 . 1 1 48 48 LEU HA H 60 4.026 4.026 4.133 -0.107 18522
1382 1 3 . 1 1 48 48 LEU C C 60 179.238 179.238 178.157 1.081 18522
1383 1 3 . 1 1 48 48 LEU CA C 60 57.261 57.261 57.795 -0.534 18522
1384 1 3 . 1 1 48 48 LEU CB C 60 41.445 41.445 41.711 -0.265 18522
1385 1 3 . 1 1 48 48 LEU H H 60 8.636 8.636 8.444 0.192 18522
1386 1 3 . 1 1 49 49 ASP N N 61 117.382 117.382 119.244 -1.862 18522
1387 1 3 . 1 1 49 49 ASP HA H 61 4.421 4.421 4.626 -0.205 18522
1388 1 3 . 1 1 49 49 ASP C C 61 177.668 177.668 177.639 0.029 18522
1389 1 3 . 1 1 49 49 ASP CA C 61 57.087 57.087 54.520 2.567 18522
1390 1 3 . 1 1 49 49 ASP CB C 61 44.478 44.478 41.676 2.802 18522
1391 1 3 . 1 1 49 49 ASP H H 61 7.665 7.665 7.724 -0.059 18522
1392 1 3 . 1 1 50 50 GLY N N 62 103.228 103.228 109.764 -6.536 18522
1393 1 3 . 1 1 50 50 GLY C C 62 174.776 174.776 175.173 -0.397 18522
1394 1 3 . 1 1 50 50 GLY CA C 62 46.533 46.533 46.041 0.492 18522
1395 1 3 . 1 1 50 50 GLY H H 62 7.216 7.216 8.163 -0.947 18522
1396 1 3 . 1 1 51 51 THR N N 63 117.230 117.230 111.256 5.974 18522
1397 1 3 . 1 1 51 51 THR HA H 63 3.907 3.907 3.827 0.080 18522
1398 1 3 . 1 1 51 51 THR C C 63 175.961 175.961 173.932 2.029 18522
1399 1 3 . 1 1 51 51 THR CA C 63 66.478 66.478 63.435 3.042 18522
1400 1 3 . 1 1 51 51 THR CB C 63 68.268 68.268 66.244 2.024 18522
1401 1 3 . 1 1 51 51 THR H H 63 8.319 8.319 7.852 0.467 18522
1402 1 3 . 1 1 52 52 VAL N N 64 113.826 113.826 113.218 0.608 18522
1403 1 3 . 1 1 52 52 VAL HA H 64 3.950 3.950 4.132 -0.182 18522
1404 1 3 . 1 1 52 52 VAL C C 64 173.883 173.883 174.681 -0.798 18522
1405 1 3 . 1 1 52 52 VAL CA C 64 60.708 60.708 59.964 0.744 18522
1406 1 3 . 1 1 52 52 VAL CB C 64 33.079 33.079 31.023 2.056 18522
1407 1 3 . 1 1 52 52 VAL H H 64 8.147 8.147 7.268 0.879 18522
1408 1 3 . 1 1 53 53 ALA N N 65 123.521 123.521 123.818 -0.297 18522
1409 1 3 . 1 1 53 53 ALA HA H 65 4.414 4.414 4.489 -0.075 18522
1410 1 3 . 1 1 53 53 ALA C C 65 175.247 175.247 176.440 -1.193 18522
1411 1 3 . 1 1 53 53 ALA CA C 65 50.440 50.440 50.713 -0.273 18522
1412 1 3 . 1 1 53 53 ALA CB C 65 23.266 23.266 20.742 2.524 18522
1413 1 3 . 1 1 53 53 ALA H H 65 8.633 8.633 7.303 1.330 18522
1414 1 3 . 1 1 54 54 ALA N N 66 120.818 120.818 122.389 -1.571 18522
1415 1 3 . 1 1 54 54 ALA HA H 66 3.720 3.720 3.874 -0.154 18522
1416 1 3 . 1 1 54 54 ALA C C 66 178.411 178.411 177.627 0.784 18522
1417 1 3 . 1 1 54 54 ALA CA C 66 53.016 53.016 53.308 -0.292 18522
1418 1 3 . 1 1 54 54 ALA CB C 66 17.840 17.840 17.691 0.149 18522
1419 1 3 . 1 1 54 54 ALA H H 66 8.451 8.451 8.342 0.109 18522
1420 1 3 . 1 1 55 55 GLY N N 67 112.260 112.260 113.723 -1.463 18522
1421 1 3 . 1 1 55 55 GLY C C 67 173.296 173.296 174.464 -1.168 18522
1422 1 3 . 1 1 55 55 GLY CA C 67 45.025 45.025 44.663 0.362 18522
1423 1 3 . 1 1 55 55 GLY H H 67 9.600 9.600 8.383 1.217 18522
1424 1 3 . 1 1 56 56 ASP N N 68 121.293 121.293 122.935 -1.642 18522
1425 1 3 . 1 1 56 56 ASP HA H 68 4.861 4.861 4.760 0.101 18522
1426 1 3 . 1 1 56 56 ASP C C 68 174.937 174.937 174.830 0.107 18522
1427 1 3 . 1 1 56 56 ASP CA C 68 55.641 55.641 54.929 0.712 18522
1428 1 3 . 1 1 56 56 ASP CB C 68 40.696 40.696 42.041 -1.345 18522
1429 1 3 . 1 1 56 56 ASP H H 68 8.043 8.043 7.692 0.351 18522
1430 1 3 . 1 1 57 57 GLU N N 69 122.814 122.814 122.103 0.711 18522
1431 1 3 . 1 1 57 57 GLU C C 69 177.202 177.202 176.076 1.126 18522
1432 1 3 . 1 1 57 57 GLU CA C 69 54.472 54.472 55.327 -0.855 18522
1433 1 3 . 1 1 57 57 GLU CB C 69 32.800 32.800 30.343 2.457 18522
1434 1 3 . 1 1 57 57 GLU H H 69 8.455 8.455 8.164 0.291 18522
1435 1 3 . 1 1 58 58 ILE N N 70 125.862 125.862 126.017 -0.155 18522
1436 1 3 . 1 1 58 58 ILE HA H 70 4.526 4.526 4.107 0.419 18522
1437 1 3 . 1 1 58 58 ILE C C 70 175.035 175.035 175.445 -0.410 18522
1438 1 3 . 1 1 58 58 ILE CA C 70 60.918 60.918 62.012 -1.094 18522
1439 1 3 . 1 1 58 58 ILE CB C 70 39.236 39.236 38.012 1.224 18522
1440 1 3 . 1 1 58 58 ILE H H 70 8.619 8.619 8.203 0.416 18522
1441 1 3 . 1 1 59 59 THR N N 71 115.507 115.507 119.914 -4.407 18522
1442 1 3 . 1 1 59 59 THR HA H 71 4.513 4.513 4.313 0.200 18522
1443 1 3 . 1 1 59 59 THR C C 71 176.425 176.425 173.956 2.469 18522
1444 1 3 . 1 1 59 59 THR CA C 71 61.158 61.158 61.741 -0.583 18522
1445 1 3 . 1 1 59 59 THR CB C 71 69.604 69.604 70.768 -1.164 18522
1446 1 3 . 1 1 59 59 THR H H 71 9.242 9.242 8.975 0.267 18522
1447 1 3 . 1 1 60 60 GLY N N 72 111.789 111.789 109.343 2.446 18522
1448 1 3 . 1 1 60 60 GLY C C 72 170.981 170.981 171.105 -0.124 18522
1449 1 3 . 1 1 60 60 GLY CA C 72 46.554 46.554 45.075 1.479 18522
1450 1 3 . 1 1 60 60 GLY H H 72 7.883 7.883 7.826 0.057 18522
1451 1 3 . 1 1 61 61 VAL N N 73 119.277 119.277 120.747 -1.470 18522
1452 1 3 . 1 1 61 61 VAL C C 73 175.951 175.951 175.521 0.430 18522
1453 1 3 . 1 1 61 61 VAL CA C 73 60.982 60.982 59.077 1.905 18522
1454 1 3 . 1 1 61 61 VAL CB C 73 36.197 36.197 34.672 1.526 18522
1455 1 3 . 1 1 61 61 VAL H H 73 8.424 8.424 8.831 -0.407 18522
1456 1 3 . 1 1 62 62 ASN N N 74 127.731 127.731 126.885 0.846 18522
1457 1 3 . 1 1 62 62 ASN HA H 74 4.520 4.520 4.384 0.136 18522
1458 1 3 . 1 1 62 62 ASN C C 74 174.878 174.878 174.978 -0.100 18522
1459 1 3 . 1 1 62 62 ASN CA C 74 54.418 54.418 54.704 -0.286 18522
1460 1 3 . 1 1 62 62 ASN CB C 74 36.655 36.655 37.556 -0.901 18522
1461 1 3 . 1 1 62 62 ASN H H 74 10.384 10.384 9.443 0.941 18522
1462 1 3 . 1 1 63 63 GLY N N 75 104.633 104.633 101.145 3.488 18522
1463 1 3 . 1 1 63 63 GLY C C 75 173.610 173.610 173.565 0.045 18522
1464 1 3 . 1 1 63 63 GLY CA C 75 45.261 45.261 44.658 0.603 18522
1465 1 3 . 1 1 63 63 GLY H H 75 8.926 8.926 8.166 0.760 18522
1466 1 3 . 1 1 64 64 ARG N N 76 120.451 120.451 121.572 -1.121 18522
1467 1 3 . 1 1 64 64 ARG HA H 76 4.501 4.501 4.676 -0.175 18522
1468 1 3 . 1 1 64 64 ARG C C 76 175.085 175.085 175.502 -0.417 18522
1469 1 3 . 1 1 64 64 ARG CA C 76 54.252 54.252 54.276 -0.025 18522
1470 1 3 . 1 1 64 64 ARG CB C 76 31.482 31.482 31.627 -0.145 18522
1471 1 3 . 1 1 64 64 ARG H H 76 7.753 7.753 8.099 -0.346 18522
1472 1 3 . 1 1 65 65 SER N N 77 116.586 116.586 119.608 -3.022 18522
1473 1 3 . 1 1 65 65 SER HA H 77 4.483 4.483 4.703 -0.220 18522
1474 1 3 . 1 1 65 65 SER C C 77 176.953 176.953 175.744 1.209 18522
1475 1 3 . 1 1 65 65 SER CA C 77 58.292 58.292 58.575 -0.283 18522
1476 1 3 . 1 1 65 65 SER CB C 77 63.643 63.643 63.812 -0.169 18522
1477 1 3 . 1 1 65 65 SER H H 77 8.555 8.555 8.798 -0.243 18522
1478 1 3 . 1 1 66 66 ILE N N 78 116.618 116.618 118.865 -2.247 18522
1479 1 3 . 1 1 66 66 ILE HA H 78 4.420 4.420 4.106 0.314 18522
1480 1 3 . 1 1 66 66 ILE C C 78 175.072 175.072 177.892 -2.820 18522
1481 1 3 . 1 1 66 66 ILE CA C 78 59.122 59.122 61.603 -2.481 18522
1482 1 3 . 1 1 66 66 ILE CB C 78 36.758 36.758 37.073 -0.315 18522
1483 1 3 . 1 1 66 66 ILE H H 78 7.599 7.599 8.240 -0.641 18522
1484 1 3 . 1 1 67 67 LYS N N 79 123.287 123.287 121.438 1.849 18522
1485 1 3 . 1 1 67 67 LYS HA H 79 4.049 4.049 4.201 -0.152 18522
1486 1 3 . 1 1 67 67 LYS C C 79 178.333 178.333 177.834 0.499 18522
1487 1 3 . 1 1 67 67 LYS CA C 79 58.321 58.321 57.569 0.752 18522
1488 1 3 . 1 1 67 67 LYS CB C 79 31.635 31.635 31.891 -0.256 18522
1489 1 3 . 1 1 67 67 LYS H H 79 7.898 7.898 8.210 -0.312 18522
1490 1 3 . 1 1 68 68 GLY N N 80 114.933 114.933 107.099 7.834 18522
1491 1 3 . 1 1 68 68 GLY C C 80 174.385 174.385 174.498 -0.113 18522
1492 1 3 . 1 1 68 68 GLY CA C 80 45.518 45.518 45.925 -0.407 18522
1493 1 3 . 1 1 68 68 GLY H H 80 8.999 8.999 7.614 1.385 18522
1494 1 3 . 1 1 69 69 LYS N N 81 119.403 119.403 118.754 0.649 18522
1495 1 3 . 1 1 69 69 LYS HA H 81 4.043 4.043 4.663 -0.620 18522
1496 1 3 . 1 1 69 69 LYS C C 81 177.064 177.064 174.586 2.478 18522
1497 1 3 . 1 1 69 69 LYS CA C 81 54.722 54.722 55.074 -0.352 18522
1498 1 3 . 1 1 69 69 LYS CB C 81 33.560 33.560 33.696 -0.135 18522
1499 1 3 . 1 1 69 69 LYS H H 81 7.845 7.845 7.747 0.098 18522
1500 1 3 . 1 1 70 70 THR N N 82 112.066 112.066 108.777 3.289 18522
1501 1 3 . 1 1 70 70 THR HA H 82 4.666 4.666 4.731 -0.065 18522
1502 1 3 . 1 1 70 70 THR C C 82 175.955 175.955 175.516 0.439 18522
1503 1 3 . 1 1 70 70 THR CA C 82 60.438 60.438 59.112 1.326 18522
1504 1 3 . 1 1 70 70 THR CB C 82 71.629 71.629 72.572 -0.943 18522
1505 1 3 . 1 1 70 70 THR H H 82 9.153 9.153 7.845 1.308 18522
1506 1 3 . 1 1 71 71 LYS N N 83 118.730 118.730 121.504 -2.774 18522
1507 1 3 . 1 1 71 71 LYS HA H 83 3.870 3.870 3.996 -0.126 18522
1508 1 3 . 1 1 71 71 LYS C C 83 177.464 177.464 178.750 -1.286 18522
1509 1 3 . 1 1 71 71 LYS CA C 83 60.357 60.357 59.965 0.392 18522
1510 1 3 . 1 1 71 71 LYS CB C 83 31.350 31.350 31.652 -0.302 18522
1511 1 3 . 1 1 71 71 LYS H H 83 8.969 8.969 8.889 0.080 18522
1512 1 3 . 1 1 72 72 VAL N N 84 117.444 117.444 118.858 -1.414 18522
1513 1 3 . 1 1 72 72 VAL HA H 84 3.633 3.633 3.829 -0.196 18522
1514 1 3 . 1 1 72 72 VAL C C 84 178.315 178.315 177.363 0.952 18522
1515 1 3 . 1 1 72 72 VAL CA C 84 66.079 66.079 65.501 0.578 18522
1516 1 3 . 1 1 72 72 VAL CB C 84 32.091 32.091 31.309 0.782 18522
1517 1 3 . 1 1 72 72 VAL H H 84 7.631 7.631 8.186 -0.555 18522
1518 1 3 . 1 1 73 73 GLU N N 85 120.890 120.890 119.434 1.456 18522
1519 1 3 . 1 1 73 73 GLU HA H 85 3.964 3.964 4.107 -0.143 18522
1520 1 3 . 1 1 73 73 GLU C C 85 179.971 179.971 178.960 1.011 18522
1521 1 3 . 1 1 73 73 GLU CA C 85 59.316 59.316 59.438 -0.122 18522
1522 1 3 . 1 1 73 73 GLU CB C 85 30.355 30.355 29.688 0.667 18522
1523 1 3 . 1 1 73 73 GLU H H 85 7.617 7.617 7.662 -0.045 18522
1524 1 3 . 1 1 74 74 VAL N N 86 121.246 121.246 118.337 2.909 18522
1525 1 3 . 1 1 74 74 VAL HA H 86 3.630 3.630 3.807 -0.177 18522
1526 1 3 . 1 1 74 74 VAL C C 86 177.217 177.217 177.732 -0.515 18522
1527 1 3 . 1 1 74 74 VAL CA C 86 66.678 66.678 66.108 0.570 18522
1528 1 3 . 1 1 74 74 VAL CB C 86 31.307 31.307 30.516 0.791 18522
1529 1 3 . 1 1 74 74 VAL H H 86 8.368 8.368 8.620 -0.252 18522
1530 1 3 . 1 1 75 75 ALA N N 87 122.148 122.148 122.825 -0.677 18522
1531 1 3 . 1 1 75 75 ALA HA H 87 3.947 3.947 3.964 -0.017 18522
1532 1 3 . 1 1 75 75 ALA C C 87 179.545 179.545 179.328 0.217 18522
1533 1 3 . 1 1 75 75 ALA CA C 87 55.851 55.851 55.386 0.465 18522
1534 1 3 . 1 1 75 75 ALA CB C 87 18.491 18.491 18.108 0.383 18522
1535 1 3 . 1 1 75 75 ALA H H 87 8.577 8.577 7.878 0.699 18522
1536 1 3 . 1 1 76 76 LYS N N 88 117.733 117.733 119.585 -1.852 18522
1537 1 3 . 1 1 76 76 LYS HA H 88 4.051 4.051 4.015 0.036 18522
1538 1 3 . 1 1 76 76 LYS CA C 88 59.393 59.393 59.487 -0.094 18522
1539 1 3 . 1 1 76 76 LYS CB C 88 32.058 32.058 32.412 -0.354 18522
1540 1 3 . 1 1 76 76 LYS H H 88 7.854 7.854 7.516 0.338 18522
1541 1 3 . 1 1 77 77 MET N N 89 117.676 117.676 118.139 -0.463 18522
1542 1 3 . 1 1 77 77 MET HA H 89 4.048 4.048 4.130 -0.082 18522
1543 1 3 . 1 1 77 77 MET C C 89 178.791 178.791 179.004 -0.213 18522
1544 1 3 . 1 1 77 77 MET CA C 89 59.128 59.128 58.306 0.822 18522
1545 1 3 . 1 1 77 77 MET CB C 89 33.801 33.801 31.870 1.931 18522
1546 1 3 . 1 1 77 77 MET H H 89 7.759 7.759 8.469 -0.710 18522
1547 1 3 . 1 1 78 78 ILE N N 90 117.305 117.305 118.737 -1.432 18522
1548 1 3 . 1 1 78 78 ILE HA H 90 3.590 3.590 3.634 -0.044 18522
1549 1 3 . 1 1 78 78 ILE C C 90 178.658 178.658 178.151 0.507 18522
1550 1 3 . 1 1 78 78 ILE CA C 90 65.482 65.482 65.345 0.137 18522
1551 1 3 . 1 1 78 78 ILE CB C 90 38.845 38.845 37.689 1.156 18522
1552 1 3 . 1 1 78 78 ILE H H 90 7.972 7.972 8.019 -0.047 18522
1553 1 3 . 1 1 79 79 GLN N N 91 120.935 120.935 118.652 2.283 18522
1554 1 3 . 1 1 79 79 GLN HA H 91 3.998 3.998 4.309 -0.311 18522
1555 1 3 . 1 1 79 79 GLN C C 91 178.274 178.274 178.695 -0.421 18522
1556 1 3 . 1 1 79 79 GLN CA C 91 59.151 59.151 58.048 1.103 18522
1557 1 3 . 1 1 79 79 GLN CB C 91 28.934 28.934 28.726 0.208 18522
1558 1 3 . 1 1 79 79 GLN H H 91 8.826 8.826 8.250 0.576 18522
1559 1 3 . 1 1 80 80 GLU N N 92 115.213 115.213 122.260 -7.047 18522
1560 1 3 . 1 1 80 80 GLU HA H 92 4.061 4.061 4.074 -0.013 18522
1561 1 3 . 1 1 80 80 GLU C C 92 176.824 176.824 178.631 -1.807 18522
1562 1 3 . 1 1 80 80 GLU CA C 92 58.006 58.006 59.295 -1.289 18522
1563 1 3 . 1 1 80 80 GLU CB C 92 29.890 29.890 29.439 0.451 18522
1564 1 3 . 1 1 80 80 GLU H H 92 8.020 8.020 8.609 -0.589 18522
1565 1 3 . 1 1 81 81 VAL N N 93 119.047 119.047 113.690 5.357 18522
1566 1 3 . 1 1 81 81 VAL HA H 93 3.930 3.930 3.866 0.064 18522
1567 1 3 . 1 1 81 81 VAL C C 93 176.016 176.016 176.254 -0.238 18522
1568 1 3 . 1 1 81 81 VAL CA C 93 63.153 63.153 64.441 -1.288 18522
1569 1 3 . 1 1 81 81 VAL CB C 93 32.154 32.154 32.031 0.123 18522
1570 1 3 . 1 1 81 81 VAL H H 93 7.073 7.073 7.534 -0.461 18522
1571 1 3 . 1 1 82 82 LYS N N 94 128.366 128.366 118.202 10.164 18522
1572 1 3 . 1 1 82 82 LYS C C 94 177.460 177.460 177.535 -0.075 18522
1573 1 3 . 1 1 82 82 LYS CA C 94 55.753 55.753 57.074 -1.321 18522
1574 1 3 . 1 1 82 82 LYS CB C 94 32.332 32.332 31.961 0.371 18522
1575 1 3 . 1 1 82 82 LYS H H 94 8.762 8.762 7.509 1.253 18522
1576 1 3 . 1 1 83 83 GLY N N 95 112.528 112.528 109.152 3.376 18522
1577 1 3 . 1 1 83 83 GLY C C 95 173.468 173.468 173.704 -0.236 18522
1578 1 3 . 1 1 83 83 GLY CA C 95 46.243 46.243 45.485 0.758 18522
1579 1 3 . 1 1 83 83 GLY H H 95 8.673 8.673 8.957 -0.284 18522
1580 1 3 . 1 1 84 84 GLU N N 96 121.485 121.485 120.473 1.012 18522
1581 1 3 . 1 1 84 84 GLU HA H 96 4.749 4.749 5.097 -0.348 18522
1582 1 3 . 1 1 84 84 GLU C C 96 174.583 174.583 174.323 0.260 18522
1583 1 3 . 1 1 84 84 GLU CA C 96 55.821 55.821 54.931 0.890 18522
1584 1 3 . 1 1 84 84 GLU CB C 96 31.410 31.410 34.080 -2.670 18522
1585 1 3 . 1 1 84 84 GLU H H 96 8.297 8.297 7.932 0.365 18522
1586 1 3 . 1 1 85 85 VAL N N 97 120.501 120.501 111.348 9.153 18522
1587 1 3 . 1 1 85 85 VAL HA H 97 4.665 4.665 4.585 0.080 18522
1588 1 3 . 1 1 85 85 VAL C C 97 173.047 173.047 174.219 -1.172 18522
1589 1 3 . 1 1 85 85 VAL CA C 97 60.114 60.114 60.341 -0.227 18522
1590 1 3 . 1 1 85 85 VAL CB C 97 35.184 35.184 35.386 -0.202 18522
1591 1 3 . 1 1 85 85 VAL H H 97 9.096 9.096 8.706 0.390 18522
1592 1 3 . 1 1 86 86 THR N N 98 125.019 125.019 121.220 3.799 18522
1593 1 3 . 1 1 86 86 THR HA H 98 4.076 4.076 5.122 -1.046 18522
1594 1 3 . 1 1 86 86 THR C C 98 173.807 173.807 173.798 0.009 18522
1595 1 3 . 1 1 86 86 THR CA C 98 61.735 61.735 61.941 -0.206 18522
1596 1 3 . 1 1 86 86 THR CB C 98 69.531 69.531 69.936 -0.405 18522
1597 1 3 . 1 1 86 86 THR H H 98 9.352 9.352 8.573 0.779 18522
1598 1 3 . 1 1 87 87 ILE N N 99 128.383 128.383 124.510 3.873 18522
1599 1 3 . 1 1 87 87 ILE HA H 99 4.661 4.661 4.746 -0.085 18522
1600 1 3 . 1 1 87 87 ILE C C 99 174.614 174.614 174.471 0.143 18522
1601 1 3 . 1 1 87 87 ILE CA C 99 58.258 58.258 59.550 -1.292 18522
1602 1 3 . 1 1 87 87 ILE CB C 99 38.528 38.528 38.307 0.221 18522
1603 1 3 . 1 1 87 87 ILE H H 99 9.329 9.329 8.972 0.357 18522
1604 1 3 . 1 1 88 88 HIS N N 100 128.279 128.279 126.371 1.908 18522
1605 1 3 . 1 1 88 88 HIS HA H 100 4.948 4.948 5.416 -0.468 18522
1606 1 3 . 1 1 88 88 HIS C C 100 174.787 174.787 174.730 0.057 18522
1607 1 3 . 1 1 88 88 HIS CA C 100 54.620 54.620 53.917 0.703 18522
1608 1 3 . 1 1 88 88 HIS H H 100 8.647 8.647 9.138 -0.491 18522
1609 1 3 . 1 1 89 89 TYR N N 101 121.320 121.320 121.900 -0.580 18522
1610 1 3 . 1 1 89 89 TYR HA H 101 5.947 5.947 5.243 0.704 18522
1611 1 3 . 1 1 89 89 TYR C C 101 173.769 173.769 172.876 0.893 18522
1612 1 3 . 1 1 89 89 TYR CA C 101 55.669 55.669 55.467 0.202 18522
1613 1 3 . 1 1 89 89 TYR CB C 101 42.195 42.195 40.542 1.653 18522
1614 1 3 . 1 1 89 89 TYR H H 101 8.414 8.414 9.077 -0.663 18522
1615 1 3 . 1 1 90 90 ASN N N 102 116.679 116.679 117.317 -0.638 18522
1616 1 3 . 1 1 90 90 ASN HA H 102 5.335 5.335 5.565 -0.230 18522
1617 1 3 . 1 1 90 90 ASN C C 102 175.406 175.406 173.818 1.588 18522
1618 1 3 . 1 1 90 90 ASN CA C 102 51.961 51.961 52.187 -0.226 18522
1619 1 3 . 1 1 90 90 ASN CB C 102 41.800 41.800 43.390 -1.590 18522
1620 1 3 . 1 1 90 90 ASN H H 102 9.282 9.282 8.966 0.316 18522
1621 1 3 . 1 1 91 91 LYS N N 103 124.129 124.129 119.276 4.853 18522
1622 1 3 . 1 1 91 91 LYS C C 103 176.678 176.678 174.746 1.932 18522
1623 1 3 . 1 1 91 91 LYS CA C 103 55.006 55.006 56.053 -1.047 18522
1624 1 3 . 1 1 91 91 LYS H H 103 8.949 8.949 8.362 0.587 18522
1625 1 3 . 1 1 92 92 LEU N N 104 127.043 127.043 123.376 3.667 18522
1626 1 3 . 1 1 92 92 LEU HA H 104 4.425 4.425 4.761 -0.336 18522
1627 1 3 . 1 1 92 92 LEU CA C 104 55.060 55.060 53.105 1.955 18522
1628 1 3 . 1 1 92 92 LEU CB C 104 42.559 42.559 43.786 -1.227 18522
1629 1 3 . 1 1 92 92 LEU H H 104 9.150 9.150 9.266 -0.116 18522
1630 1 3 . 1 1 93 93 GLN HA H 105 4.315 4.315 4.411 -0.096 18522
1631 1 3 . 1 1 93 93 GLN C C 105 175.070 175.070 176.099 -1.029 18522
1632 1 3 . 1 1 93 93 GLN CA C 105 55.490 55.490 55.535 -0.045 18522
1633 1 3 . 1 1 93 93 GLN CB C 105 28.909 28.909 28.874 0.035 18522
1634 1 3 . 1 1 94 94 ALA N N 106 125.133 125.133 123.388 1.745 18522
1635 1 3 . 1 1 94 94 ALA HA H 106 4.366 4.366 4.081 0.285 18522
1636 1 3 . 1 1 94 94 ALA C C 106 176.392 176.392 176.109 0.283 18522
1637 1 3 . 1 1 94 94 ALA CA C 106 51.723 51.723 52.720 -0.997 18522
1638 1 3 . 1 1 94 94 ALA CB C 106 20.185 20.185 18.627 1.558 18522
1639 1 3 . 1 1 94 94 ALA H H 106 8.226 8.226 8.054 0.172 18522
1640 1 3 . 1 1 95 95 ASP N N 107 122.013 122.013 118.570 3.443 18522
1641 1 3 . 1 1 95 95 ASP HA H 107 4.413 4.413 4.686 -0.273 18522
1642 1 3 . 1 1 95 95 ASP C C 107 175.019 175.019 174.512 0.507 18522
1643 1 3 . 1 1 95 95 ASP CA C 107 55.642 55.642 52.457 3.185 18522
1644 1 3 . 1 1 95 95 ASP CB C 107 41.266 41.266 42.615 -1.349 18522
1645 1 3 . 1 1 95 95 ASP H H 107 8.429 8.429 7.995 0.434 18522
1646 1 3 . 1 1 96 96 PRO HA H 108 4.207 4.207 4.027 0.180 18522
1647 1 3 . 1 1 96 96 PRO C C 108 178.840 178.840 178.034 0.806 18522
1648 1 3 . 1 1 96 96 PRO CA C 108 65.396 65.396 65.851 -0.455 18522
1649 1 3 . 1 1 96 96 PRO CB C 108 32.181 32.181 31.876 0.305 18522
1650 1 3 . 1 1 97 97 LYS N N 109 117.942 117.942 115.847 2.095 18522
1651 1 3 . 1 1 97 97 LYS HA H 109 4.143 4.143 3.988 0.155 18522
1652 1 3 . 1 1 97 97 LYS C C 109 178.099 178.099 179.203 -1.104 18522
1653 1 3 . 1 1 97 97 LYS CA C 109 58.167 58.167 59.243 -1.076 18522
1654 1 3 . 1 1 97 97 LYS CB C 109 31.649 31.649 31.493 0.156 18522
1655 1 3 . 1 1 97 97 LYS H H 109 8.335 8.335 7.890 0.445 18522
1656 1 3 . 1 1 98 98 GLN N N 110 119.159 119.159 118.103 1.056 18522
1657 1 3 . 1 1 98 98 GLN HA H 110 4.130 4.130 4.290 -0.160 18522
1658 1 3 . 1 1 98 98 GLN C C 110 178.298 178.298 178.369 -0.071 18522
1659 1 3 . 1 1 98 98 GLN CA C 110 57.660 57.660 57.016 0.644 18522
1660 1 3 . 1 1 98 98 GLN CB C 110 28.720 28.720 28.523 0.197 18522
1661 1 3 . 1 1 98 98 GLN H H 110 7.985 7.985 8.120 -0.135 18522
1662 1 3 . 1 1 99 99 LEU N N 111 120.490 120.490 122.688 -2.198 18522
1663 1 3 . 1 1 99 99 LEU HA H 111 3.877 3.877 4.257 -0.380 18522
1664 1 3 . 1 1 99 99 LEU C C 111 177.729 177.729 178.298 -0.569 18522
1665 1 3 . 1 1 99 99 LEU CA C 111 57.049 57.049 57.793 -0.744 18522
1666 1 3 . 1 1 99 99 LEU CB C 111 41.466 41.466 41.896 -0.430 18522
1667 1 3 . 1 1 99 99 LEU H H 111 7.994 7.994 8.396 -0.402 18522
1668 1 3 . 1 1 100 100 GLU N N 112 118.251 118.251 118.085 0.166 18522
1669 1 3 . 1 1 100 100 GLU HA H 112 3.972 3.972 4.230 -0.258 18522
1670 1 3 . 1 1 100 100 GLU C C 112 178.402 178.402 178.398 0.004 18522
1671 1 3 . 1 1 100 100 GLU CA C 112 59.056 59.056 58.962 0.094 18522
1672 1 3 . 1 1 100 100 GLU CB C 112 29.732 29.732 29.103 0.629 18522
1673 1 3 . 1 1 100 100 GLU H H 112 7.760 7.760 8.165 -0.405 18522
1674 1 3 . 1 1 101 101 VAL N N 113 117.229 117.229 118.796 -1.567 18522
1675 1 3 . 1 1 101 101 VAL HA H 113 3.762 3.762 3.815 -0.053 18522
1676 1 3 . 1 1 101 101 VAL C C 113 178.107 178.107 178.139 -0.032 18522
1677 1 3 . 1 1 101 101 VAL CA C 113 64.791 64.791 65.454 -0.662 18522
1678 1 3 . 1 1 101 101 VAL CB C 113 32.149 32.149 31.539 0.610 18522
1679 1 3 . 1 1 101 101 VAL H H 113 7.437 7.437 7.473 -0.036 18522
1680 1 3 . 1 1 102 102 LEU N N 114 122.124 122.124 118.960 3.164 18522
1681 1 3 . 1 1 102 102 LEU HA H 114 4.033 4.033 4.201 -0.168 18522
1682 1 3 . 1 1 102 102 LEU C C 114 178.506 178.506 178.229 0.277 18522
1683 1 3 . 1 1 102 102 LEU CA C 114 57.243 57.243 56.955 0.288 18522
1684 1 3 . 1 1 102 102 LEU CB C 114 42.028 42.028 42.044 -0.016 18522
1685 1 3 . 1 1 102 102 LEU H H 114 7.765 7.765 7.208 0.557 18522
1686 1 3 . 1 1 103 103 PHE N N 115 115.346 115.346 119.653 -4.307 18522
1687 1 3 . 1 1 103 103 PHE HA H 115 4.224 4.224 4.682 -0.458 18522
1688 1 3 . 1 1 103 103 PHE C C 115 175.621 175.621 174.569 1.052 18522
1689 1 3 . 1 1 103 103 PHE CA C 115 57.537 57.537 54.958 2.579 18522
1690 1 3 . 1 1 103 103 PHE CB C 115 38.057 38.057 38.438 -0.381 18522
1691 1 3 . 1 1 103 103 PHE H H 115 7.805 7.805 7.607 0.198 18522
1692 1 3 . 1 1 104 104 GLN N N 116 119.021 119.021 119.931 -0.910 18522
1693 1 3 . 1 1 104 104 GLN HA H 116 4.407 4.407 4.191 0.216 18522
1694 1 3 . 1 1 104 104 GLN C C 116 176.402 176.402 176.078 0.324 18522
1695 1 3 . 1 1 104 104 GLN CA C 116 55.521 55.521 55.892 -0.370 18522
1696 1 3 . 1 1 104 104 GLN CB C 116 29.170 29.170 27.054 2.116 18522
1697 1 3 . 1 1 104 104 GLN H H 116 7.974 7.974 7.290 0.684 18522
1698 1 3 . 1 1 105 105 GLY N N 117 108.868 108.868 111.944 -3.076 18522
1699 1 3 . 1 1 105 105 GLY CA C 117 45.124 45.124 44.574 0.550 18522
1700 1 3 . 1 1 105 105 GLY H H 117 8.195 8.195 7.785 0.410 18522
1701 1 3 . 1 1 106 106 PRO HA H 118 4.490 4.490 2.814 1.676 18522
1702 1 3 . 1 1 106 106 PRO C C 118 176.001 176.001 175.213 0.788 18522
1703 1 3 . 1 1 106 106 PRO CA C 118 63.523 63.523 62.830 0.693 18522
1704 1 3 . 1 1 106 106 PRO CB C 118 32.078 32.078 31.892 0.186 18522
1705 1 3 . 1 1 107 107 GLN N N 119 126.950 126.950 121.575 5.375 18522
1706 1 3 . 1 1 107 107 GLN C C 119 181.211 181.211 173.925 7.286 18522
1707 1 3 . 1 1 107 107 GLN CA C 119 57.416 57.416 54.177 3.239 18522
1708 1 3 . 1 1 107 107 GLN H H 119 8.079 8.079 8.000 0.079 18522
1709 1 3 . 1 1 111 111 ARG C C 123 174.608 174.608 174.642 -0.034 18522
1710 1 3 . 1 1 111 111 ARG CA C 123 55.099 55.099 54.344 0.755 18522
1711 1 3 . 1 1 112 112 HIS N N 124 122.212 122.212 121.408 0.804 18522
1712 1 3 . 1 1 112 112 HIS HA H 124 4.718 4.718 4.113 0.605 18522
1713 1 3 . 1 1 112 112 HIS C C 124 176.040 176.040 175.532 0.508 18522
1714 1 3 . 1 1 112 112 HIS CA C 124 54.213 54.213 57.014 -2.801 18522
1715 1 3 . 1 1 112 112 HIS CB C 124 31.164 31.164 30.306 0.858 18522
1716 1 3 . 1 1 112 112 HIS H H 124 7.640 7.640 8.430 -0.790 18522
1717 1 3 . 1 1 113 113 TRP C C 125 176.168 176.168 176.453 -0.285 18522
1718 1 3 . 1 1 114 114 LEU N N 126 121.893 121.893 120.960 0.933 18522
1719 1 3 . 1 1 114 114 LEU HA H 126 4.869 4.869 5.028 -0.159 18522
1720 1 3 . 1 1 114 114 LEU CA C 126 54.151 54.151 54.194 -0.042 18522
1721 1 3 . 1 1 114 114 LEU CB C 126 45.144 45.144 43.616 1.528 18522
1722 1 3 . 1 1 114 114 LEU H H 126 8.606 8.606 8.491 0.115 18522
1723 1 3 . 1 1 115 115 LYS N N 127 125.850 125.850 118.818 7.032 18522
1724 1 3 . 1 1 115 115 LYS HA H 127 4.203 4.203 4.978 -0.775 18522
1725 1 3 . 1 1 115 115 LYS C C 127 175.564 175.564 174.605 0.959 18522
1726 1 3 . 1 1 115 115 LYS CA C 127 57.252 57.252 55.312 1.940 18522
1727 1 3 . 1 1 115 115 LYS CB C 127 33.406 33.406 34.369 -0.963 18522
1728 1 3 . 1 1 115 115 LYS H H 127 8.647 8.647 8.413 0.234 18522
1729 1 4 . 1 1 3 3 PRO C C 15 177.225 177.225 176.116 1.109 18522
1730 1 4 . 1 1 3 3 PRO CA C 15 63.508 63.508 62.786 0.722 18522
1731 1 4 . 1 1 3 3 PRO CB C 15 32.090 32.090 29.993 2.097 18522
1732 1 4 . 1 1 4 4 GLY N N 16 108.829 108.829 111.593 -2.764 18522
1733 1 4 . 1 1 4 4 GLY C C 16 173.398 173.398 174.021 -0.623 18522
1734 1 4 . 1 1 4 4 GLY CA C 16 45.128 45.128 44.441 0.687 18522
1735 1 4 . 1 1 4 4 GLY H H 16 8.489 8.489 8.173 0.316 18522
1736 1 4 . 1 1 5 5 ILE N N 17 121.763 121.763 121.822 -0.059 18522
1737 1 4 . 1 1 5 5 ILE HA H 17 4.554 4.554 4.615 -0.061 18522
1738 1 4 . 1 1 5 5 ILE C C 17 174.332 174.332 175.083 -0.751 18522
1739 1 4 . 1 1 5 5 ILE CA C 17 58.245 58.245 57.165 1.080 18522
1740 1 4 . 1 1 5 5 ILE CB C 17 38.762 38.762 37.213 1.549 18522
1741 1 4 . 1 1 5 5 ILE H H 17 8.014 8.014 7.627 0.387 18522
1742 1 4 . 1 1 6 6 PRO C C 18 176.437 176.437 176.169 0.268 18522
1743 1 4 . 1 1 6 6 PRO CA C 18 62.667 62.667 64.005 -1.338 18522
1744 1 4 . 1 1 6 6 PRO CB C 18 32.469 32.469 32.105 0.364 18522
1745 1 4 . 1 1 7 7 VAL N N 19 123.849 123.849 119.771 4.078 18522
1746 1 4 . 1 1 7 7 VAL HA H 19 4.550 4.550 4.397 0.153 18522
1747 1 4 . 1 1 7 7 VAL C C 19 174.453 174.453 173.838 0.615 18522
1748 1 4 . 1 1 7 7 VAL CA C 19 59.846 59.846 59.826 0.020 18522
1749 1 4 . 1 1 7 7 VAL CB C 19 33.510 33.510 32.182 1.328 18522
1750 1 4 . 1 1 7 7 VAL H H 19 8.754 8.754 8.021 0.733 18522
1751 1 4 . 1 1 8 8 PRO HA H 20 5.338 5.338 4.960 0.378 18522
1752 1 4 . 1 1 8 8 PRO C C 20 177.585 177.585 178.294 -0.709 18522
1753 1 4 . 1 1 8 8 PRO CA C 20 62.406 62.406 62.221 0.185 18522
1754 1 4 . 1 1 8 8 PRO CB C 20 32.891 32.891 32.628 0.263 18522
1755 1 4 . 1 1 9 9 GLY N N 21 108.426 108.426 108.393 0.033 18522
1756 1 4 . 1 1 9 9 GLY C C 21 171.443 171.443 173.783 -2.340 18522
1757 1 4 . 1 1 9 9 GLY CA C 21 44.581 44.581 45.343 -0.762 18522
1758 1 4 . 1 1 9 9 GLY H H 21 8.258 8.258 8.493 -0.235 18522
1759 1 4 . 1 1 10 10 LYS N N 22 117.372 117.372 118.148 -0.776 18522
1760 1 4 . 1 1 10 10 LYS HA H 22 4.039 4.039 3.848 0.191 18522
1761 1 4 . 1 1 10 10 LYS C C 22 174.463 174.463 174.898 -0.435 18522
1762 1 4 . 1 1 10 10 LYS CA C 22 55.263 55.263 57.603 -2.340 18522
1763 1 4 . 1 1 10 10 LYS CB C 22 35.227 35.227 31.943 3.284 18522
1764 1 4 . 1 1 10 10 LYS H H 22 8.175 8.175 8.073 0.102 18522
1765 1 4 . 1 1 11 11 VAL N N 23 120.387 120.387 116.640 3.747 18522
1766 1 4 . 1 1 11 11 VAL HA H 23 4.708 4.708 4.495 0.213 18522
1767 1 4 . 1 1 11 11 VAL C C 23 171.873 171.873 174.137 -2.264 18522
1768 1 4 . 1 1 11 11 VAL CA C 23 59.866 59.866 60.296 -0.430 18522
1769 1 4 . 1 1 11 11 VAL CB C 23 35.269 35.269 35.424 -0.155 18522
1770 1 4 . 1 1 11 11 VAL H H 23 8.862 8.862 8.109 0.753 18522
1771 1 4 . 1 1 12 12 THR N N 24 125.797 125.797 118.013 7.784 18522
1772 1 4 . 1 1 12 12 THR HA H 24 5.121 5.121 4.687 0.434 18522
1773 1 4 . 1 1 12 12 THR C C 24 173.407 173.407 173.464 -0.057 18522
1774 1 4 . 1 1 12 12 THR CA C 24 62.115 62.115 60.627 1.488 18522
1775 1 4 . 1 1 12 12 THR CB C 24 69.606 69.606 69.464 0.142 18522
1776 1 4 . 1 1 12 12 THR H H 24 8.859 8.859 8.226 0.633 18522
1777 1 4 . 1 1 13 13 LEU N N 25 127.960 127.960 126.921 1.039 18522
1778 1 4 . 1 1 13 13 LEU HA H 25 4.809 4.809 4.828 -0.019 18522
1779 1 4 . 1 1 13 13 LEU C C 25 175.029 175.029 175.501 -0.472 18522
1780 1 4 . 1 1 13 13 LEU CA C 25 52.623 52.623 52.364 0.259 18522
1781 1 4 . 1 1 13 13 LEU CB C 25 46.242 46.242 44.633 1.609 18522
1782 1 4 . 1 1 13 13 LEU H H 25 9.258 9.258 8.129 1.129 18522
1783 1 4 . 1 1 14 14 GLN N N 26 120.858 120.858 117.408 3.450 18522
1784 1 4 . 1 1 14 14 GLN HA H 26 4.482 4.482 4.563 -0.081 18522
1785 1 4 . 1 1 14 14 GLN C C 26 174.515 174.515 175.437 -0.922 18522
1786 1 4 . 1 1 14 14 GLN CA C 26 54.576 54.576 54.234 0.342 18522
1787 1 4 . 1 1 14 14 GLN CB C 26 29.516 29.516 31.619 -2.103 18522
1788 1 4 . 1 1 14 14 GLN H H 26 8.530 8.530 8.330 0.200 18522
1789 1 4 . 1 1 15 15 LYS N N 27 119.583 119.583 122.125 -2.542 18522
1790 1 4 . 1 1 15 15 LYS HA H 27 4.180 4.180 4.278 -0.098 18522
1791 1 4 . 1 1 15 15 LYS C C 27 177.468 177.468 176.796 0.672 18522
1792 1 4 . 1 1 15 15 LYS CA C 27 55.956 55.956 56.520 -0.564 18522
1793 1 4 . 1 1 15 15 LYS CB C 27 34.099 34.099 32.343 1.756 18522
1794 1 4 . 1 1 15 15 LYS H H 27 8.099 8.099 7.986 0.114 18522
1795 1 4 . 1 1 16 16 ASP N N 28 121.439 121.439 122.526 -1.087 18522
1796 1 4 . 1 1 16 16 ASP HA H 28 4.590 4.590 4.639 -0.049 18522
1797 1 4 . 1 1 16 16 ASP C C 28 178.392 178.392 177.820 0.572 18522
1798 1 4 . 1 1 16 16 ASP CA C 28 52.426 52.426 53.512 -1.086 18522
1799 1 4 . 1 1 16 16 ASP CB C 28 41.377 41.377 42.730 -1.353 18522
1800 1 4 . 1 1 16 16 ASP H H 28 8.888 8.888 8.659 0.229 18522
1801 1 4 . 1 1 17 17 ALA N N 29 119.578 119.578 123.979 -4.401 18522
1802 1 4 . 1 1 17 17 ALA HA H 29 4.188 4.188 4.101 0.087 18522
1803 1 4 . 1 1 17 17 ALA C C 29 178.763 178.763 178.280 0.483 18522
1804 1 4 . 1 1 17 17 ALA CA C 29 54.434 54.434 54.631 -0.197 18522
1805 1 4 . 1 1 17 17 ALA CB C 29 18.293 18.293 18.717 -0.424 18522
1806 1 4 . 1 1 17 17 ALA H H 29 8.392 8.392 8.709 -0.317 18522
1807 1 4 . 1 1 18 18 GLN N N 30 117.564 117.564 117.007 0.557 18522
1808 1 4 . 1 1 18 18 GLN HA H 30 4.399 4.399 4.381 0.018 18522
1809 1 4 . 1 1 18 18 GLN C C 30 175.168 175.168 175.646 -0.478 18522
1810 1 4 . 1 1 18 18 GLN CA C 30 55.339 55.339 55.000 0.339 18522
1811 1 4 . 1 1 18 18 GLN CB C 30 28.589 28.589 29.057 -0.468 18522
1812 1 4 . 1 1 18 18 GLN H H 30 8.353 8.353 7.845 0.508 18522
1813 1 4 . 1 1 19 19 ASN N N 31 115.365 115.365 115.651 -0.286 18522
1814 1 4 . 1 1 19 19 ASN HA H 31 4.315 4.315 4.393 -0.078 18522
1815 1 4 . 1 1 19 19 ASN C C 31 174.043 174.043 172.866 1.177 18522
1816 1 4 . 1 1 19 19 ASN CA C 31 54.303 54.303 54.700 -0.397 18522
1817 1 4 . 1 1 19 19 ASN CB C 31 37.610 37.610 37.967 -0.357 18522
1818 1 4 . 1 1 19 19 ASN H H 31 8.521 8.521 8.375 0.146 18522
1819 1 4 . 1 1 20 20 LEU N N 32 118.660 118.660 111.560 7.100 18522
1820 1 4 . 1 1 20 20 LEU HA H 32 4.900 4.900 5.196 -0.296 18522
1821 1 4 . 1 1 20 20 LEU C C 32 178.117 178.117 177.649 0.468 18522
1822 1 4 . 1 1 20 20 LEU CA C 32 53.957 53.957 53.292 0.665 18522
1823 1 4 . 1 1 20 20 LEU CB C 32 44.774 44.774 43.641 1.133 18522
1824 1 4 . 1 1 20 20 LEU H H 32 8.155 8.155 7.344 0.811 18522
1825 1 4 . 1 1 21 21 ILE N N 33 116.785 116.785 114.828 1.957 18522
1826 1 4 . 1 1 21 21 ILE HA H 33 4.674 4.674 4.606 0.068 18522
1827 1 4 . 1 1 21 21 ILE C C 33 176.185 176.185 176.703 -0.518 18522
1828 1 4 . 1 1 21 21 ILE CA C 33 62.602 62.602 61.282 1.320 18522
1829 1 4 . 1 1 21 21 ILE CB C 33 39.016 39.016 39.129 -0.113 18522
1830 1 4 . 1 1 21 21 ILE H H 33 11.488 11.488 8.566 2.922 18522
1831 1 4 . 1 1 22 22 GLY N N 34 111.234 111.234 108.653 2.581 18522
1832 1 4 . 1 1 22 22 GLY C C 34 173.993 173.993 173.254 0.739 18522
1833 1 4 . 1 1 22 22 GLY CA C 34 45.980 45.980 45.125 0.855 18522
1834 1 4 . 1 1 22 22 GLY H H 34 9.854 9.854 8.757 1.097 18522
1835 1 4 . 1 1 23 23 ILE N N 35 111.117 111.117 114.151 -3.034 18522
1836 1 4 . 1 1 23 23 ILE HA H 35 5.535 5.535 5.230 0.305 18522
1837 1 4 . 1 1 23 23 ILE C C 35 175.033 175.033 174.121 0.912 18522
1838 1 4 . 1 1 23 23 ILE CA C 35 58.415 58.415 57.753 0.662 18522
1839 1 4 . 1 1 23 23 ILE CB C 35 41.577 41.577 41.526 0.051 18522
1840 1 4 . 1 1 23 23 ILE H H 35 7.835 7.835 7.432 0.403 18522
1841 1 4 . 1 1 24 24 SER N N 36 114.908 114.908 115.192 -0.284 18522
1842 1 4 . 1 1 24 24 SER HA H 36 4.232 4.232 5.214 -0.982 18522
1843 1 4 . 1 1 24 24 SER C C 36 174.735 174.735 173.029 1.706 18522
1844 1 4 . 1 1 24 24 SER CA C 36 56.121 56.121 57.511 -1.390 18522
1845 1 4 . 1 1 24 24 SER CB C 36 66.097 66.097 65.918 0.179 18522
1846 1 4 . 1 1 24 24 SER H H 36 8.623 8.623 8.659 -0.036 18522
1847 1 4 . 1 1 25 25 ILE N N 37 117.739 117.739 126.072 -8.333 18522
1848 1 4 . 1 1 25 25 ILE C C 37 174.340 174.340 175.446 -1.106 18522
1849 1 4 . 1 1 25 25 ILE CA C 37 59.123 59.123 59.938 -0.815 18522
1850 1 4 . 1 1 25 25 ILE CB C 37 41.637 41.637 39.728 1.909 18522
1851 1 4 . 1 1 25 25 ILE H H 37 9.130 9.130 8.998 0.132 18522
1852 1 4 . 1 1 26 26 GLY N N 38 108.069 108.069 114.812 -6.743 18522
1853 1 4 . 1 1 26 26 GLY CA C 38 44.112 44.112 44.153 -0.041 18522
1854 1 4 . 1 1 26 26 GLY H H 38 8.841 8.841 8.808 0.033 18522
1855 1 4 . 1 1 27 27 GLY N N 39 109.016 109.016 106.161 2.855 18522
1856 1 4 . 1 1 27 27 GLY C C 39 173.956 173.956 174.785 -0.829 18522
1857 1 4 . 1 1 27 27 GLY H H 39 8.187 8.187 8.246 -0.059 18522
1858 1 4 . 1 1 28 28 GLY N N 40 111.783 111.783 109.346 2.437 18522
1859 1 4 . 1 1 28 28 GLY C C 40 174.255 174.255 175.192 -0.937 18522
1860 1 4 . 1 1 28 28 GLY CA C 40 47.098 47.098 45.383 1.715 18522
1861 1 4 . 1 1 28 28 GLY H H 40 8.275 8.275 8.048 0.227 18522
1862 1 4 . 1 1 29 29 ALA N N 41 123.128 123.128 119.121 4.007 18522
1863 1 4 . 1 1 29 29 ALA HA H 41 4.559 4.559 3.856 0.703 18522
1864 1 4 . 1 1 29 29 ALA CA C 41 51.073 51.073 53.461 -2.388 18522
1865 1 4 . 1 1 29 29 ALA CB C 41 21.926 21.926 17.370 4.556 18522
1866 1 4 . 1 1 29 29 ALA H H 41 8.012 8.012 8.325 -0.313 18522
1867 1 4 . 1 1 31 31 TYR HA H 43 4.549 4.549 4.299 0.250 18522
1868 1 4 . 1 1 31 31 TYR CA C 43 57.147 57.147 60.147 -3.000 18522
1869 1 4 . 1 1 31 31 TYR CB C 43 37.495 37.495 36.560 0.935 18522
1870 1 4 . 1 1 32 32 CYS N N 44 119.332 119.332 117.948 1.384 18522
1871 1 4 . 1 1 32 32 CYS HA H 44 4.859 4.859 4.808 0.051 18522
1872 1 4 . 1 1 32 32 CYS CA C 44 57.406 57.406 56.078 1.328 18522
1873 1 4 . 1 1 32 32 CYS CB C 44 27.673 27.673 27.943 -0.270 18522
1874 1 4 . 1 1 32 32 CYS H H 44 7.504 7.504 7.870 -0.366 18522
1875 1 4 . 1 1 33 33 PRO HA H 45 4.413 4.413 4.377 0.036 18522
1876 1 4 . 1 1 33 33 PRO CA C 45 64.885 64.885 63.221 1.664 18522
1877 1 4 . 1 1 33 33 PRO CB C 45 32.318 32.318 32.528 -0.210 18522
1878 1 4 . 1 1 34 34 CYS N N 46 117.327 117.327 114.572 2.755 18522
1879 1 4 . 1 1 34 34 CYS C C 46 172.064 172.064 174.506 -2.442 18522
1880 1 4 . 1 1 34 34 CYS CA C 46 60.066 60.066 59.954 0.112 18522
1881 1 4 . 1 1 34 34 CYS CB C 46 28.715 28.715 26.592 2.123 18522
1882 1 4 . 1 1 34 34 CYS H H 46 7.973 7.973 8.501 -0.528 18522
1883 1 4 . 1 1 35 35 LEU N N 47 124.270 124.270 118.837 5.433 18522
1884 1 4 . 1 1 35 35 LEU HA H 47 4.928 4.928 4.718 0.210 18522
1885 1 4 . 1 1 35 35 LEU C C 47 175.076 175.076 177.258 -2.182 18522
1886 1 4 . 1 1 35 35 LEU CA C 47 53.278 53.278 53.390 -0.112 18522
1887 1 4 . 1 1 35 35 LEU CB C 47 44.321 44.321 43.606 0.715 18522
1888 1 4 . 1 1 35 35 LEU H H 47 8.629 8.629 8.178 0.451 18522
1889 1 4 . 1 1 36 36 TYR N N 48 119.326 119.326 115.572 3.754 18522
1890 1 4 . 1 1 36 36 TYR HA H 48 5.255 5.255 4.103 1.152 18522
1891 1 4 . 1 1 36 36 TYR C C 48 175.766 175.766 175.922 -0.156 18522
1892 1 4 . 1 1 36 36 TYR CA C 48 56.696 56.696 61.734 -5.038 18522
1893 1 4 . 1 1 36 36 TYR CB C 48 42.590 42.590 37.201 5.389 18522
1894 1 4 . 1 1 36 36 TYR H H 48 8.761 8.761 8.071 0.690 18522
1895 1 4 . 1 1 37 37 ILE N N 49 120.259 120.259 121.571 -1.312 18522
1896 1 4 . 1 1 37 37 ILE HA H 49 4.215 4.215 4.387 -0.172 18522
1897 1 4 . 1 1 37 37 ILE C C 49 177.429 177.429 176.469 0.960 18522
1898 1 4 . 1 1 37 37 ILE CA C 49 62.456 62.456 61.024 1.432 18522
1899 1 4 . 1 1 37 37 ILE CB C 49 37.352 37.352 37.460 -0.108 18522
1900 1 4 . 1 1 37 37 ILE H H 49 8.959 8.959 7.778 1.181 18522
1901 1 4 . 1 1 38 38 VAL HA H 50 3.937 3.937 4.169 -0.232 18522
1902 1 4 . 1 1 38 38 VAL C C 50 174.408 174.408 175.590 -1.182 18522
1903 1 4 . 1 1 38 38 VAL CA C 50 62.259 62.259 62.552 -0.293 18522
1904 1 4 . 1 1 38 38 VAL CB C 50 31.584 31.584 32.955 -1.371 18522
1905 1 4 . 1 1 39 39 GLN N N 51 116.821 116.821 117.913 -1.092 18522
1906 1 4 . 1 1 39 39 GLN HA H 51 4.103 4.103 4.493 -0.390 18522
1907 1 4 . 1 1 39 39 GLN C C 51 172.856 172.856 173.233 -0.377 18522
1908 1 4 . 1 1 39 39 GLN CA C 51 55.127 55.127 54.989 0.138 18522
1909 1 4 . 1 1 39 39 GLN CB C 51 32.376 32.376 33.054 -0.678 18522
1910 1 4 . 1 1 39 39 GLN H H 51 6.967 6.967 7.520 -0.553 18522
1911 1 4 . 1 1 40 40 VAL N N 52 123.482 123.482 119.863 3.619 18522
1912 1 4 . 1 1 40 40 VAL HA H 52 4.277 4.277 4.706 -0.429 18522
1913 1 4 . 1 1 40 40 VAL C C 52 176.198 176.198 174.163 2.035 18522
1914 1 4 . 1 1 40 40 VAL CA C 52 61.574 61.574 59.468 2.106 18522
1915 1 4 . 1 1 40 40 VAL CB C 52 32.875 32.875 35.792 -2.917 18522
1916 1 4 . 1 1 40 40 VAL H H 52 8.447 8.447 8.198 0.249 18522
1917 1 4 . 1 1 41 41 PHE N N 53 128.296 128.296 122.785 5.511 18522
1918 1 4 . 1 1 41 41 PHE HA H 53 4.400 4.400 4.855 -0.455 18522
1919 1 4 . 1 1 41 41 PHE C C 53 175.299 175.299 176.159 -0.860 18522
1920 1 4 . 1 1 41 41 PHE CA C 53 58.494 58.494 56.197 2.297 18522
1921 1 4 . 1 1 41 41 PHE CB C 53 39.561 39.561 40.489 -0.928 18522
1922 1 4 . 1 1 41 41 PHE H H 53 8.707 8.707 8.303 0.404 18522
1923 1 4 . 1 1 42 42 ASP N N 54 122.696 122.696 123.227 -0.531 18522
1924 1 4 . 1 1 42 42 ASP HA H 54 4.272 4.272 4.337 -0.065 18522
1925 1 4 . 1 1 42 42 ASP C C 54 176.837 176.837 176.414 0.423 18522
1926 1 4 . 1 1 42 42 ASP CA C 54 55.291 55.291 56.838 -1.547 18522
1927 1 4 . 1 1 42 42 ASP CB C 54 41.093 41.093 41.027 0.066 18522
1928 1 4 . 1 1 42 42 ASP H H 54 8.901 8.901 9.051 -0.150 18522
1929 1 4 . 1 1 43 43 ASN N N 55 113.923 113.923 112.815 1.108 18522
1930 1 4 . 1 1 43 43 ASN HA H 55 4.258 4.258 4.778 -0.520 18522
1931 1 4 . 1 1 43 43 ASN C C 55 173.714 173.714 175.441 -1.727 18522
1932 1 4 . 1 1 43 43 ASN CA C 55 54.958 54.958 53.039 1.919 18522
1933 1 4 . 1 1 43 43 ASN CB C 55 37.150 37.150 39.460 -2.310 18522
1934 1 4 . 1 1 43 43 ASN H H 55 9.319 9.319 8.117 1.202 18522
1935 1 4 . 1 1 44 44 THR N N 56 108.020 108.020 112.967 -4.947 18522
1936 1 4 . 1 1 44 44 THR HA H 56 5.377 5.377 4.978 0.399 18522
1937 1 4 . 1 1 44 44 THR CA C 56 59.712 59.712 59.314 0.398 18522
1938 1 4 . 1 1 44 44 THR CB C 56 69.529 69.529 70.570 -1.041 18522
1939 1 4 . 1 1 44 44 THR H H 56 7.149 7.149 7.953 -0.804 18522
1940 1 4 . 1 1 45 45 PRO HA H 57 4.304 4.304 4.088 0.216 18522
1941 1 4 . 1 1 45 45 PRO C C 57 180.141 180.141 178.081 2.060 18522
1942 1 4 . 1 1 45 45 PRO CA C 57 66.090 66.090 65.649 0.441 18522
1943 1 4 . 1 1 45 45 PRO CB C 57 33.194 33.194 31.432 1.762 18522
1944 1 4 . 1 1 46 46 ALA N N 58 116.854 116.854 120.016 -3.162 18522
1945 1 4 . 1 1 46 46 ALA HA H 58 4.035 4.035 4.013 0.022 18522
1946 1 4 . 1 1 46 46 ALA C C 58 180.647 180.647 179.524 1.123 18522
1947 1 4 . 1 1 46 46 ALA CA C 58 55.195 55.195 55.227 -0.032 18522
1948 1 4 . 1 1 46 46 ALA CB C 58 18.880 18.880 18.134 0.746 18522
1949 1 4 . 1 1 46 46 ALA H H 58 8.938 8.938 7.843 1.095 18522
1950 1 4 . 1 1 47 47 ALA N N 59 123.250 123.250 121.069 2.181 18522
1951 1 4 . 1 1 47 47 ALA HA H 59 4.030 4.030 4.175 -0.145 18522
1952 1 4 . 1 1 47 47 ALA C C 59 179.852 179.852 179.933 -0.081 18522
1953 1 4 . 1 1 47 47 ALA CA C 59 54.939 54.939 54.466 0.473 18522
1954 1 4 . 1 1 47 47 ALA CB C 59 19.688 19.688 18.461 1.227 18522
1955 1 4 . 1 1 47 47 ALA H H 59 7.658 7.658 7.430 0.228 18522
1956 1 4 . 1 1 48 48 LEU N N 60 118.654 118.654 120.507 -1.853 18522
1957 1 4 . 1 1 48 48 LEU HA H 60 4.026 4.026 4.099 -0.073 18522
1958 1 4 . 1 1 48 48 LEU C C 60 179.238 179.238 178.423 0.815 18522
1959 1 4 . 1 1 48 48 LEU CA C 60 57.261 57.261 58.202 -0.941 18522
1960 1 4 . 1 1 48 48 LEU CB C 60 41.445 41.445 40.679 0.766 18522
1961 1 4 . 1 1 48 48 LEU H H 60 8.636 8.636 8.523 0.113 18522
1962 1 4 . 1 1 49 49 ASP N N 61 117.382 117.382 116.968 0.414 18522
1963 1 4 . 1 1 49 49 ASP HA H 61 4.421 4.421 4.604 -0.183 18522
1964 1 4 . 1 1 49 49 ASP C C 61 177.668 177.668 178.614 -0.946 18522
1965 1 4 . 1 1 49 49 ASP CA C 61 57.087 57.087 55.700 1.387 18522
1966 1 4 . 1 1 49 49 ASP CB C 61 44.478 44.478 42.243 2.235 18522
1967 1 4 . 1 1 49 49 ASP H H 61 7.665 7.665 8.017 -0.352 18522
1968 1 4 . 1 1 50 50 GLY N N 62 103.228 103.228 108.075 -4.847 18522
1969 1 4 . 1 1 50 50 GLY C C 62 174.776 174.776 174.564 0.212 18522
1970 1 4 . 1 1 50 50 GLY CA C 62 46.533 46.533 46.384 0.149 18522
1971 1 4 . 1 1 50 50 GLY H H 62 7.216 7.216 8.324 -1.108 18522
1972 1 4 . 1 1 51 51 THR N N 63 117.230 117.230 112.833 4.397 18522
1973 1 4 . 1 1 51 51 THR HA H 63 3.907 3.907 3.932 -0.025 18522
1974 1 4 . 1 1 51 51 THR C C 63 175.961 175.961 173.205 2.756 18522
1975 1 4 . 1 1 51 51 THR CA C 63 66.478 66.478 62.492 3.986 18522
1976 1 4 . 1 1 51 51 THR CB C 63 68.268 68.268 66.868 1.400 18522
1977 1 4 . 1 1 51 51 THR H H 63 8.319 8.319 7.762 0.557 18522
1978 1 4 . 1 1 52 52 VAL N N 64 113.826 113.826 114.361 -0.535 18522
1979 1 4 . 1 1 52 52 VAL HA H 64 3.950 3.950 4.549 -0.599 18522
1980 1 4 . 1 1 52 52 VAL C C 64 173.883 173.883 174.668 -0.785 18522
1981 1 4 . 1 1 52 52 VAL CA C 64 60.708 60.708 59.328 1.380 18522
1982 1 4 . 1 1 52 52 VAL CB C 64 33.079 33.079 30.995 2.084 18522
1983 1 4 . 1 1 52 52 VAL H H 64 8.147 8.147 7.386 0.761 18522
1984 1 4 . 1 1 53 53 ALA N N 65 123.521 123.521 123.439 0.082 18522
1985 1 4 . 1 1 53 53 ALA HA H 65 4.414 4.414 4.337 0.077 18522
1986 1 4 . 1 1 53 53 ALA C C 65 175.247 175.247 176.459 -1.212 18522
1987 1 4 . 1 1 53 53 ALA CA C 65 50.440 50.440 51.113 -0.673 18522
1988 1 4 . 1 1 53 53 ALA CB C 65 23.266 23.266 19.968 3.298 18522
1989 1 4 . 1 1 53 53 ALA H H 65 8.633 8.633 7.682 0.951 18522
1990 1 4 . 1 1 54 54 ALA N N 66 120.818 120.818 121.675 -0.857 18522
1991 1 4 . 1 1 54 54 ALA HA H 66 3.720 3.720 3.939 -0.219 18522
1992 1 4 . 1 1 54 54 ALA C C 66 178.411 178.411 178.171 0.240 18522
1993 1 4 . 1 1 54 54 ALA CA C 66 53.016 53.016 53.806 -0.790 18522
1994 1 4 . 1 1 54 54 ALA CB C 66 17.840 17.840 17.872 -0.032 18522
1995 1 4 . 1 1 54 54 ALA H H 66 8.451 8.451 8.217 0.234 18522
1996 1 4 . 1 1 55 55 GLY N N 67 112.260 112.260 111.836 0.424 18522
1997 1 4 . 1 1 55 55 GLY C C 67 173.296 173.296 173.051 0.245 18522
1998 1 4 . 1 1 55 55 GLY CA C 67 45.025 45.025 44.687 0.339 18522
1999 1 4 . 1 1 55 55 GLY H H 67 9.600 9.600 8.453 1.147 18522
2000 1 4 . 1 1 56 56 ASP N N 68 121.293 121.293 120.118 1.175 18522
2001 1 4 . 1 1 56 56 ASP HA H 68 4.861 4.861 4.845 0.016 18522
2002 1 4 . 1 1 56 56 ASP C C 68 174.937 174.937 174.478 0.459 18522
2003 1 4 . 1 1 56 56 ASP CA C 68 55.641 55.641 52.867 2.774 18522
2004 1 4 . 1 1 56 56 ASP CB C 68 40.696 40.696 43.762 -3.066 18522
2005 1 4 . 1 1 56 56 ASP H H 68 8.043 8.043 7.675 0.368 18522
2006 1 4 . 1 1 57 57 GLU N N 69 122.814 122.814 120.875 1.939 18522
2007 1 4 . 1 1 57 57 GLU C C 69 177.202 177.202 176.074 1.128 18522
2008 1 4 . 1 1 57 57 GLU CA C 69 54.472 54.472 54.926 -0.454 18522
2009 1 4 . 1 1 57 57 GLU CB C 69 32.800 32.800 30.902 1.898 18522
2010 1 4 . 1 1 57 57 GLU H H 69 8.455 8.455 8.072 0.383 18522
2011 1 4 . 1 1 58 58 ILE N N 70 125.862 125.862 124.988 0.874 18522
2012 1 4 . 1 1 58 58 ILE HA H 70 4.526 4.526 4.449 0.077 18522
2013 1 4 . 1 1 58 58 ILE C C 70 175.035 175.035 175.252 -0.217 18522
2014 1 4 . 1 1 58 58 ILE CA C 70 60.918 60.918 59.060 1.858 18522
2015 1 4 . 1 1 58 58 ILE CB C 70 39.236 39.236 38.950 0.286 18522
2016 1 4 . 1 1 58 58 ILE H H 70 8.619 8.619 8.143 0.476 18522
2017 1 4 . 1 1 59 59 THR N N 71 115.507 115.507 119.816 -4.309 18522
2018 1 4 . 1 1 59 59 THR HA H 71 4.513 4.513 4.049 0.464 18522
2019 1 4 . 1 1 59 59 THR C C 71 176.425 176.425 173.197 3.228 18522
2020 1 4 . 1 1 59 59 THR CA C 71 61.158 61.158 61.466 -0.308 18522
2021 1 4 . 1 1 59 59 THR CB C 71 69.604 69.604 70.066 -0.462 18522
2022 1 4 . 1 1 59 59 THR H H 71 9.242 9.242 8.868 0.374 18522
2023 1 4 . 1 1 60 60 GLY N N 72 111.789 111.789 109.353 2.436 18522
2024 1 4 . 1 1 60 60 GLY C C 72 170.981 170.981 171.517 -0.536 18522
2025 1 4 . 1 1 60 60 GLY CA C 72 46.554 46.554 44.416 2.138 18522
2026 1 4 . 1 1 60 60 GLY H H 72 7.883 7.883 7.990 -0.107 18522
2027 1 4 . 1 1 61 61 VAL N N 73 119.277 119.277 122.753 -3.476 18522
2028 1 4 . 1 1 61 61 VAL C C 73 175.951 175.951 175.750 0.201 18522
2029 1 4 . 1 1 61 61 VAL CA C 73 60.982 60.982 60.346 0.636 18522
2030 1 4 . 1 1 61 61 VAL CB C 73 36.197 36.197 34.033 2.164 18522
2031 1 4 . 1 1 61 61 VAL H H 73 8.424 8.424 8.865 -0.441 18522
2032 1 4 . 1 1 62 62 ASN N N 74 127.731 127.731 128.009 -0.278 18522
2033 1 4 . 1 1 62 62 ASN HA H 74 4.520 4.520 4.412 0.108 18522
2034 1 4 . 1 1 62 62 ASN C C 74 174.878 174.878 174.877 0.001 18522
2035 1 4 . 1 1 62 62 ASN CA C 74 54.418 54.418 54.294 0.124 18522
2036 1 4 . 1 1 62 62 ASN CB C 74 36.655 36.655 37.661 -1.006 18522
2037 1 4 . 1 1 62 62 ASN H H 74 10.384 10.384 9.267 1.117 18522
2038 1 4 . 1 1 63 63 GLY N N 75 104.633 104.633 103.597 1.036 18522
2039 1 4 . 1 1 63 63 GLY C C 75 173.610 173.610 172.946 0.664 18522
2040 1 4 . 1 1 63 63 GLY CA C 75 45.261 45.261 44.771 0.490 18522
2041 1 4 . 1 1 63 63 GLY H H 75 8.926 8.926 8.291 0.635 18522
2042 1 4 . 1 1 64 64 ARG N N 76 120.451 120.451 120.303 0.148 18522
2043 1 4 . 1 1 64 64 ARG HA H 76 4.501 4.501 4.648 -0.147 18522
2044 1 4 . 1 1 64 64 ARG C C 76 175.085 175.085 175.619 -0.534 18522
2045 1 4 . 1 1 64 64 ARG CA C 76 54.252 54.252 54.062 0.190 18522
2046 1 4 . 1 1 64 64 ARG CB C 76 31.482 31.482 31.864 -0.382 18522
2047 1 4 . 1 1 64 64 ARG H H 76 7.753 7.753 7.810 -0.057 18522
2048 1 4 . 1 1 65 65 SER N N 77 116.586 116.586 117.699 -1.113 18522
2049 1 4 . 1 1 65 65 SER HA H 77 4.483 4.483 4.572 -0.090 18522
2050 1 4 . 1 1 65 65 SER C C 77 176.953 176.953 176.569 0.384 18522
2051 1 4 . 1 1 65 65 SER CA C 77 58.292 58.292 58.651 -0.359 18522
2052 1 4 . 1 1 65 65 SER CB C 77 63.643 63.643 63.750 -0.107 18522
2053 1 4 . 1 1 65 65 SER H H 77 8.555 8.555 8.758 -0.203 18522
2054 1 4 . 1 1 66 66 ILE N N 78 116.618 116.618 124.626 -8.008 18522
2055 1 4 . 1 1 66 66 ILE HA H 78 4.420 4.420 4.248 0.172 18522
2056 1 4 . 1 1 66 66 ILE C C 78 175.072 175.072 176.828 -1.756 18522
2057 1 4 . 1 1 66 66 ILE CA C 78 59.122 59.122 62.073 -2.951 18522
2058 1 4 . 1 1 66 66 ILE CB C 78 36.758 36.758 37.199 -0.441 18522
2059 1 4 . 1 1 66 66 ILE H H 78 7.599 7.599 8.762 -1.163 18522
2060 1 4 . 1 1 67 67 LYS N N 79 123.287 123.287 122.234 1.053 18522
2061 1 4 . 1 1 67 67 LYS HA H 79 4.049 4.049 4.160 -0.111 18522
2062 1 4 . 1 1 67 67 LYS C C 79 178.333 178.333 177.957 0.376 18522
2063 1 4 . 1 1 67 67 LYS CA C 79 58.321 58.321 58.225 0.096 18522
2064 1 4 . 1 1 67 67 LYS CB C 79 31.635 31.635 32.035 -0.400 18522
2065 1 4 . 1 1 67 67 LYS H H 79 7.898 7.898 7.619 0.279 18522
2066 1 4 . 1 1 68 68 GLY N N 80 114.933 114.933 107.389 7.544 18522
2067 1 4 . 1 1 68 68 GLY C C 80 174.385 174.385 174.620 -0.235 18522
2068 1 4 . 1 1 68 68 GLY CA C 80 45.518 45.518 45.681 -0.163 18522
2069 1 4 . 1 1 68 68 GLY H H 80 8.999 8.999 8.002 0.997 18522
2070 1 4 . 1 1 69 69 LYS N N 81 119.403 119.403 118.900 0.503 18522
2071 1 4 . 1 1 69 69 LYS HA H 81 4.043 4.043 4.617 -0.574 18522
2072 1 4 . 1 1 69 69 LYS C C 81 177.064 177.064 175.113 1.951 18522
2073 1 4 . 1 1 69 69 LYS CA C 81 54.722 54.722 55.138 -0.416 18522
2074 1 4 . 1 1 69 69 LYS CB C 81 33.560 33.560 32.883 0.677 18522
2075 1 4 . 1 1 69 69 LYS H H 81 7.845 7.845 7.930 -0.085 18522
2076 1 4 . 1 1 70 70 THR N N 82 112.066 112.066 115.340 -3.274 18522
2077 1 4 . 1 1 70 70 THR HA H 82 4.666 4.666 4.612 0.054 18522
2078 1 4 . 1 1 70 70 THR C C 82 175.955 175.955 175.287 0.668 18522
2079 1 4 . 1 1 70 70 THR CA C 82 60.438 60.438 60.940 -0.502 18522
2080 1 4 . 1 1 70 70 THR CB C 82 71.629 71.629 72.614 -0.985 18522
2081 1 4 . 1 1 70 70 THR H H 82 9.153 9.153 8.018 1.135 18522
2082 1 4 . 1 1 71 71 LYS N N 83 118.730 118.730 124.580 -5.850 18522
2083 1 4 . 1 1 71 71 LYS HA H 83 3.870 3.870 3.977 -0.107 18522
2084 1 4 . 1 1 71 71 LYS C C 83 177.464 177.464 178.311 -0.847 18522
2085 1 4 . 1 1 71 71 LYS CA C 83 60.357 60.357 59.936 0.421 18522
2086 1 4 . 1 1 71 71 LYS CB C 83 31.350 31.350 31.478 -0.128 18522
2087 1 4 . 1 1 71 71 LYS H H 83 8.969 8.969 8.812 0.157 18522
2088 1 4 . 1 1 72 72 VAL N N 84 117.444 117.444 118.766 -1.322 18522
2089 1 4 . 1 1 72 72 VAL HA H 84 3.633 3.633 3.693 -0.061 18522
2090 1 4 . 1 1 72 72 VAL C C 84 178.315 178.315 177.932 0.383 18522
2091 1 4 . 1 1 72 72 VAL CA C 84 66.079 66.079 65.672 0.407 18522
2092 1 4 . 1 1 72 72 VAL CB C 84 32.091 32.091 30.754 1.337 18522
2093 1 4 . 1 1 72 72 VAL H H 84 7.631 7.631 7.870 -0.239 18522
2094 1 4 . 1 1 73 73 GLU N N 85 120.890 120.890 119.472 1.418 18522
2095 1 4 . 1 1 73 73 GLU HA H 85 3.964 3.964 4.061 -0.097 18522
2096 1 4 . 1 1 73 73 GLU C C 85 179.971 179.971 179.114 0.857 18522
2097 1 4 . 1 1 73 73 GLU CA C 85 59.316 59.316 59.332 -0.016 18522
2098 1 4 . 1 1 73 73 GLU CB C 85 30.355 30.355 29.127 1.228 18522
2099 1 4 . 1 1 73 73 GLU H H 85 7.617 7.617 8.363 -0.746 18522
2100 1 4 . 1 1 74 74 VAL N N 86 121.246 121.246 117.642 3.604 18522
2101 1 4 . 1 1 74 74 VAL HA H 86 3.630 3.630 3.776 -0.146 18522
2102 1 4 . 1 1 74 74 VAL C C 86 177.217 177.217 177.388 -0.171 18522
2103 1 4 . 1 1 74 74 VAL CA C 86 66.678 66.678 65.896 0.782 18522
2104 1 4 . 1 1 74 74 VAL CB C 86 31.307 31.307 30.684 0.623 18522
2105 1 4 . 1 1 74 74 VAL H H 86 8.368 8.368 8.307 0.061 18522
2106 1 4 . 1 1 75 75 ALA N N 87 122.148 122.148 123.183 -1.035 18522
2107 1 4 . 1 1 75 75 ALA HA H 87 3.947 3.947 3.891 0.056 18522
2108 1 4 . 1 1 75 75 ALA C C 87 179.545 179.545 178.984 0.561 18522
2109 1 4 . 1 1 75 75 ALA CA C 87 55.851 55.851 55.626 0.225 18522
2110 1 4 . 1 1 75 75 ALA CB C 87 18.491 18.491 17.974 0.517 18522
2111 1 4 . 1 1 75 75 ALA H H 87 8.577 8.577 7.627 0.950 18522
2112 1 4 . 1 1 76 76 LYS N N 88 117.733 117.733 119.083 -1.350 18522
2113 1 4 . 1 1 76 76 LYS HA H 88 4.051 4.051 3.936 0.115 18522
2114 1 4 . 1 1 76 76 LYS CA C 88 59.393 59.393 59.480 -0.087 18522
2115 1 4 . 1 1 76 76 LYS CB C 88 32.058 32.058 32.304 -0.246 18522
2116 1 4 . 1 1 76 76 LYS H H 88 7.854 7.854 7.605 0.249 18522
2117 1 4 . 1 1 77 77 MET N N 89 117.676 117.676 118.094 -0.418 18522
2118 1 4 . 1 1 77 77 MET HA H 89 4.048 4.048 4.047 0.001 18522
2119 1 4 . 1 1 77 77 MET C C 89 178.791 178.791 178.878 -0.087 18522
2120 1 4 . 1 1 77 77 MET CA C 89 59.128 59.128 59.373 -0.246 18522
2121 1 4 . 1 1 77 77 MET CB C 89 33.801 33.801 32.581 1.220 18522
2122 1 4 . 1 1 77 77 MET H H 89 7.759 7.759 8.018 -0.259 18522
2123 1 4 . 1 1 78 78 ILE N N 90 117.305 117.305 119.335 -2.030 18522
2124 1 4 . 1 1 78 78 ILE HA H 90 3.590 3.590 3.645 -0.055 18522
2125 1 4 . 1 1 78 78 ILE C C 90 178.658 178.658 178.091 0.567 18522
2126 1 4 . 1 1 78 78 ILE CA C 90 65.482 65.482 64.988 0.494 18522
2127 1 4 . 1 1 78 78 ILE CB C 90 38.845 38.845 37.753 1.092 18522
2128 1 4 . 1 1 78 78 ILE H H 90 7.972 7.972 7.922 0.050 18522
2129 1 4 . 1 1 79 79 GLN N N 91 120.935 120.935 117.978 2.957 18522
2130 1 4 . 1 1 79 79 GLN HA H 91 3.998 3.998 4.204 -0.206 18522
2131 1 4 . 1 1 79 79 GLN C C 91 178.274 178.274 178.309 -0.035 18522
2132 1 4 . 1 1 79 79 GLN CA C 91 59.151 59.151 57.169 1.982 18522
2133 1 4 . 1 1 79 79 GLN CB C 91 28.934 28.934 28.396 0.538 18522
2134 1 4 . 1 1 79 79 GLN H H 91 8.826 8.826 8.104 0.722 18522
2135 1 4 . 1 1 80 80 GLU N N 92 115.213 115.213 119.913 -4.700 18522
2136 1 4 . 1 1 80 80 GLU HA H 92 4.061 4.061 4.154 -0.093 18522
2137 1 4 . 1 1 80 80 GLU C C 92 176.824 176.824 177.351 -0.527 18522
2138 1 4 . 1 1 80 80 GLU CA C 92 58.006 58.006 57.757 0.249 18522
2139 1 4 . 1 1 80 80 GLU CB C 92 29.890 29.890 30.085 -0.195 18522
2140 1 4 . 1 1 80 80 GLU H H 92 8.020 8.020 8.260 -0.240 18522
2141 1 4 . 1 1 81 81 VAL N N 93 119.047 119.047 118.042 1.005 18522
2142 1 4 . 1 1 81 81 VAL HA H 93 3.930 3.930 4.111 -0.181 18522
2143 1 4 . 1 1 81 81 VAL C C 93 176.016 176.016 174.693 1.323 18522
2144 1 4 . 1 1 81 81 VAL CA C 93 63.153 63.153 62.210 0.943 18522
2145 1 4 . 1 1 81 81 VAL CB C 93 32.154 32.154 32.565 -0.411 18522
2146 1 4 . 1 1 81 81 VAL H H 93 7.073 7.073 7.515 -0.442 18522
2147 1 4 . 1 1 82 82 LYS N N 94 128.366 128.366 124.604 3.762 18522
2148 1 4 . 1 1 82 82 LYS C C 94 177.460 177.460 176.796 0.664 18522
2149 1 4 . 1 1 82 82 LYS CA C 94 55.753 55.753 55.209 0.544 18522
2150 1 4 . 1 1 82 82 LYS CB C 94 32.332 32.332 35.276 -2.944 18522
2151 1 4 . 1 1 82 82 LYS H H 94 8.762 8.762 7.973 0.789 18522
2152 1 4 . 1 1 83 83 GLY N N 95 112.528 112.528 112.765 -0.237 18522
2153 1 4 . 1 1 83 83 GLY C C 95 173.468 173.468 172.735 0.733 18522
2154 1 4 . 1 1 83 83 GLY CA C 95 46.243 46.243 45.581 0.662 18522
2155 1 4 . 1 1 83 83 GLY H H 95 8.673 8.673 9.148 -0.475 18522
2156 1 4 . 1 1 84 84 GLU N N 96 121.485 121.485 118.590 2.895 18522
2157 1 4 . 1 1 84 84 GLU HA H 96 4.749 4.749 4.936 -0.187 18522
2158 1 4 . 1 1 84 84 GLU C C 96 174.583 174.583 173.799 0.784 18522
2159 1 4 . 1 1 84 84 GLU CA C 96 55.821 55.821 54.498 1.323 18522
2160 1 4 . 1 1 84 84 GLU CB C 96 31.410 31.410 34.087 -2.677 18522
2161 1 4 . 1 1 84 84 GLU H H 96 8.297 8.297 7.608 0.689 18522
2162 1 4 . 1 1 85 85 VAL N N 97 120.501 120.501 112.292 8.209 18522
2163 1 4 . 1 1 85 85 VAL HA H 97 4.665 4.665 4.675 -0.010 18522
2164 1 4 . 1 1 85 85 VAL C C 97 173.047 173.047 173.579 -0.532 18522
2165 1 4 . 1 1 85 85 VAL CA C 97 60.114 60.114 59.972 0.141 18522
2166 1 4 . 1 1 85 85 VAL CB C 97 35.184 35.184 35.518 -0.334 18522
2167 1 4 . 1 1 85 85 VAL H H 97 9.096 9.096 8.723 0.373 18522
2168 1 4 . 1 1 86 86 THR N N 98 125.019 125.019 118.854 6.165 18522
2169 1 4 . 1 1 86 86 THR HA H 98 4.076 4.076 4.993 -0.917 18522
2170 1 4 . 1 1 86 86 THR C C 98 173.807 173.807 173.283 0.524 18522
2171 1 4 . 1 1 86 86 THR CA C 98 61.735 61.735 61.968 -0.233 18522
2172 1 4 . 1 1 86 86 THR CB C 98 69.531 69.531 70.882 -1.351 18522
2173 1 4 . 1 1 86 86 THR H H 98 9.352 9.352 8.321 1.031 18522
2174 1 4 . 1 1 87 87 ILE N N 99 128.383 128.383 122.410 5.973 18522
2175 1 4 . 1 1 87 87 ILE HA H 99 4.661 4.661 4.813 -0.152 18522
2176 1 4 . 1 1 87 87 ILE C C 99 174.614 174.614 174.707 -0.093 18522
2177 1 4 . 1 1 87 87 ILE CA C 99 58.258 58.258 59.136 -0.878 18522
2178 1 4 . 1 1 87 87 ILE CB C 99 38.528 38.528 39.391 -0.863 18522
2179 1 4 . 1 1 87 87 ILE H H 99 9.329 9.329 8.898 0.431 18522
2180 1 4 . 1 1 88 88 HIS N N 100 128.279 128.279 125.905 2.374 18522
2181 1 4 . 1 1 88 88 HIS HA H 100 4.948 4.948 5.646 -0.698 18522
2182 1 4 . 1 1 88 88 HIS C C 100 174.787 174.787 174.216 0.571 18522
2183 1 4 . 1 1 88 88 HIS CA C 100 54.620 54.620 54.331 0.289 18522
2184 1 4 . 1 1 88 88 HIS H H 100 8.647 8.647 8.258 0.389 18522
2185 1 4 . 1 1 89 89 TYR N N 101 121.320 121.320 123.540 -2.220 18522
2186 1 4 . 1 1 89 89 TYR HA H 101 5.947 5.947 4.452 1.495 18522
2187 1 4 . 1 1 89 89 TYR C C 101 173.769 173.769 172.713 1.056 18522
2188 1 4 . 1 1 89 89 TYR CA C 101 55.669 55.669 58.238 -2.569 18522
2189 1 4 . 1 1 89 89 TYR CB C 101 42.195 42.195 40.176 2.019 18522
2190 1 4 . 1 1 89 89 TYR H H 101 8.414 8.414 8.497 -0.083 18522
2191 1 4 . 1 1 90 90 ASN N N 102 116.679 116.679 114.970 1.709 18522
2192 1 4 . 1 1 90 90 ASN HA H 102 5.335 5.335 5.112 0.223 18522
2193 1 4 . 1 1 90 90 ASN C C 102 175.406 175.406 172.623 2.783 18522
2194 1 4 . 1 1 90 90 ASN CA C 102 51.961 51.961 53.074 -1.113 18522
2195 1 4 . 1 1 90 90 ASN CB C 102 41.800 41.800 42.068 -0.268 18522
2196 1 4 . 1 1 90 90 ASN H H 102 9.282 9.282 7.666 1.616 18522
2197 1 4 . 1 1 91 91 LYS N N 103 124.129 124.129 117.283 6.846 18522
2198 1 4 . 1 1 91 91 LYS C C 103 176.678 176.678 175.828 0.850 18522
2199 1 4 . 1 1 91 91 LYS CA C 103 55.006 55.006 54.417 0.589 18522
2200 1 4 . 1 1 91 91 LYS H H 103 8.949 8.949 8.113 0.836 18522
2201 1 4 . 1 1 92 92 LEU N N 104 127.043 127.043 117.070 9.973 18522
2202 1 4 . 1 1 92 92 LEU HA H 104 4.425 4.425 3.835 0.590 18522
2203 1 4 . 1 1 92 92 LEU CA C 104 55.060 55.060 56.067 -1.007 18522
2204 1 4 . 1 1 92 92 LEU CB C 104 42.559 42.559 40.978 1.581 18522
2205 1 4 . 1 1 92 92 LEU H H 104 9.150 9.150 8.293 0.857 18522
2206 1 4 . 1 1 93 93 GLN HA H 105 4.315 4.315 3.981 0.334 18522
2207 1 4 . 1 1 93 93 GLN C C 105 175.070 175.070 173.958 1.112 18522
2208 1 4 . 1 1 93 93 GLN CA C 105 55.490 55.490 55.705 -0.215 18522
2209 1 4 . 1 1 93 93 GLN CB C 105 28.909 28.909 28.259 0.650 18522
2210 1 4 . 1 1 94 94 ALA N N 106 125.133 125.133 125.327 -0.194 18522
2211 1 4 . 1 1 94 94 ALA HA H 106 4.366 4.366 4.712 -0.346 18522
2212 1 4 . 1 1 94 94 ALA C C 106 176.392 176.392 175.529 0.863 18522
2213 1 4 . 1 1 94 94 ALA CA C 106 51.723 51.723 51.655 0.068 18522
2214 1 4 . 1 1 94 94 ALA CB C 106 20.185 20.185 20.706 -0.520 18522
2215 1 4 . 1 1 94 94 ALA H H 106 8.226 8.226 8.001 0.225 18522
2216 1 4 . 1 1 95 95 ASP N N 107 122.013 122.013 119.490 2.523 18522
2217 1 4 . 1 1 95 95 ASP HA H 107 4.413 4.413 4.973 -0.560 18522
2218 1 4 . 1 1 95 95 ASP C C 107 175.019 175.019 174.685 0.334 18522
2219 1 4 . 1 1 95 95 ASP CA C 107 55.642 55.642 52.651 2.991 18522
2220 1 4 . 1 1 95 95 ASP CB C 107 41.266 41.266 42.543 -1.277 18522
2221 1 4 . 1 1 95 95 ASP H H 107 8.429 8.429 8.186 0.243 18522
2222 1 4 . 1 1 96 96 PRO HA H 108 4.207 4.207 4.066 0.141 18522
2223 1 4 . 1 1 96 96 PRO C C 108 178.840 178.840 178.325 0.515 18522
2224 1 4 . 1 1 96 96 PRO CA C 108 65.396 65.396 66.220 -0.824 18522
2225 1 4 . 1 1 96 96 PRO CB C 108 32.181 32.181 31.666 0.515 18522
2226 1 4 . 1 1 97 97 LYS N N 109 117.942 117.942 114.909 3.033 18522
2227 1 4 . 1 1 97 97 LYS HA H 109 4.143 4.143 4.050 0.093 18522
2228 1 4 . 1 1 97 97 LYS C C 109 178.099 178.099 178.918 -0.819 18522
2229 1 4 . 1 1 97 97 LYS CA C 109 58.167 58.167 59.086 -0.919 18522
2230 1 4 . 1 1 97 97 LYS CB C 109 31.649 31.649 31.423 0.226 18522
2231 1 4 . 1 1 97 97 LYS H H 109 8.335 8.335 8.343 -0.008 18522
2232 1 4 . 1 1 98 98 GLN N N 110 119.159 119.159 117.793 1.366 18522
2233 1 4 . 1 1 98 98 GLN HA H 110 4.130 4.130 4.425 -0.295 18522
2234 1 4 . 1 1 98 98 GLN C C 110 178.298 178.298 177.843 0.455 18522
2235 1 4 . 1 1 98 98 GLN CA C 110 57.660 57.660 56.671 0.989 18522
2236 1 4 . 1 1 98 98 GLN CB C 110 28.720 28.720 29.138 -0.418 18522
2237 1 4 . 1 1 98 98 GLN H H 110 7.985 7.985 8.014 -0.029 18522
2238 1 4 . 1 1 99 99 LEU N N 111 120.490 120.490 122.459 -1.969 18522
2239 1 4 . 1 1 99 99 LEU HA H 111 3.877 3.877 4.196 -0.319 18522
2240 1 4 . 1 1 99 99 LEU C C 111 177.729 177.729 178.402 -0.673 18522
2241 1 4 . 1 1 99 99 LEU CA C 111 57.049 57.049 57.880 -0.831 18522
2242 1 4 . 1 1 99 99 LEU CB C 111 41.466 41.466 41.801 -0.335 18522
2243 1 4 . 1 1 99 99 LEU H H 111 7.994 7.994 8.484 -0.490 18522
2244 1 4 . 1 1 100 100 GLU N N 112 118.251 118.251 118.858 -0.607 18522
2245 1 4 . 1 1 100 100 GLU HA H 112 3.972 3.972 4.168 -0.196 18522
2246 1 4 . 1 1 100 100 GLU C C 112 178.402 178.402 179.007 -0.605 18522
2247 1 4 . 1 1 100 100 GLU CA C 112 59.056 59.056 59.300 -0.244 18522
2248 1 4 . 1 1 100 100 GLU CB C 112 29.732 29.732 28.954 0.778 18522
2249 1 4 . 1 1 100 100 GLU H H 112 7.760 7.760 8.188 -0.428 18522
2250 1 4 . 1 1 101 101 VAL N N 113 117.229 117.229 120.672 -3.443 18522
2251 1 4 . 1 1 101 101 VAL HA H 113 3.762 3.762 3.629 0.133 18522
2252 1 4 . 1 1 101 101 VAL C C 113 178.107 178.107 177.559 0.548 18522
2253 1 4 . 1 1 101 101 VAL CA C 113 64.791 64.791 66.354 -1.563 18522
2254 1 4 . 1 1 101 101 VAL CB C 113 32.149 32.149 31.665 0.484 18522
2255 1 4 . 1 1 101 101 VAL H H 113 7.437 7.437 7.388 0.049 18522
2256 1 4 . 1 1 102 102 LEU N N 114 122.124 122.124 117.646 4.478 18522
2257 1 4 . 1 1 102 102 LEU HA H 114 4.033 4.033 4.114 -0.081 18522
2258 1 4 . 1 1 102 102 LEU C C 114 178.506 178.506 178.209 0.297 18522
2259 1 4 . 1 1 102 102 LEU CA C 114 57.243 57.243 56.329 0.914 18522
2260 1 4 . 1 1 102 102 LEU CB C 114 42.028 42.028 40.847 1.181 18522
2261 1 4 . 1 1 102 102 LEU H H 114 7.765 7.765 7.873 -0.108 18522
2262 1 4 . 1 1 103 103 PHE N N 115 115.346 115.346 118.220 -2.874 18522
2263 1 4 . 1 1 103 103 PHE HA H 115 4.224 4.224 4.304 -0.080 18522
2264 1 4 . 1 1 103 103 PHE C C 115 175.621 175.621 176.479 -0.858 18522
2265 1 4 . 1 1 103 103 PHE CA C 115 57.537 57.537 60.516 -2.979 18522
2266 1 4 . 1 1 103 103 PHE CB C 115 38.057 38.057 40.375 -2.318 18522
2267 1 4 . 1 1 103 103 PHE H H 115 7.805 7.805 8.009 -0.204 18522
2268 1 4 . 1 1 104 104 GLN N N 116 119.021 119.021 115.883 3.138 18522
2269 1 4 . 1 1 104 104 GLN HA H 116 4.407 4.407 4.374 0.033 18522
2270 1 4 . 1 1 104 104 GLN C C 116 176.402 176.402 175.601 0.801 18522
2271 1 4 . 1 1 104 104 GLN CA C 116 55.521 55.521 56.515 -0.994 18522
2272 1 4 . 1 1 104 104 GLN CB C 116 29.170 29.170 31.725 -2.555 18522
2273 1 4 . 1 1 104 104 GLN H H 116 7.974 7.974 8.159 -0.185 18522
2274 1 4 . 1 1 105 105 GLY N N 117 108.868 108.868 105.446 3.422 18522
2275 1 4 . 1 1 105 105 GLY CA C 117 45.124 45.124 46.197 -1.073 18522
2276 1 4 . 1 1 105 105 GLY H H 117 8.195 8.195 7.625 0.570 18522
2277 1 4 . 1 1 106 106 PRO HA H 118 4.490 4.490 4.292 0.198 18522
2278 1 4 . 1 1 106 106 PRO C C 118 176.001 176.001 175.376 0.625 18522
2279 1 4 . 1 1 106 106 PRO CA C 118 63.523 63.523 64.704 -1.181 18522
2280 1 4 . 1 1 106 106 PRO CB C 118 32.078 32.078 30.496 1.582 18522
2281 1 4 . 1 1 107 107 GLN N N 119 126.950 126.950 118.860 8.090 18522
2282 1 4 . 1 1 107 107 GLN C C 119 181.211 181.211 174.513 6.698 18522
2283 1 4 . 1 1 107 107 GLN CA C 119 57.416 57.416 55.600 1.816 18522
2284 1 4 . 1 1 107 107 GLN H H 119 8.079 8.079 8.041 0.038 18522
2285 1 4 . 1 1 111 111 ARG C C 123 174.608 174.608 175.809 -1.201 18522
2286 1 4 . 1 1 111 111 ARG CA C 123 55.099 55.099 54.254 0.845 18522
2287 1 4 . 1 1 112 112 HIS N N 124 122.212 122.212 120.636 1.576 18522
2288 1 4 . 1 1 112 112 HIS HA H 124 4.718 4.718 4.843 -0.125 18522
2289 1 4 . 1 1 112 112 HIS C C 124 176.040 176.040 175.110 0.930 18522
2290 1 4 . 1 1 112 112 HIS CA C 124 54.213 54.213 55.952 -1.739 18522
2291 1 4 . 1 1 112 112 HIS CB C 124 31.164 31.164 31.125 0.039 18522
2292 1 4 . 1 1 112 112 HIS H H 124 7.640 7.640 8.680 -1.040 18522
2293 1 4 . 1 1 113 113 TRP C C 125 176.168 176.168 174.678 1.490 18522
2294 1 4 . 1 1 114 114 LEU N N 126 121.893 121.893 119.679 2.214 18522
2295 1 4 . 1 1 114 114 LEU HA H 126 4.869 4.869 4.889 -0.020 18522
2296 1 4 . 1 1 114 114 LEU CA C 126 54.151 54.151 53.035 1.116 18522
2297 1 4 . 1 1 114 114 LEU CB C 126 45.144 45.144 45.305 -0.161 18522
2298 1 4 . 1 1 114 114 LEU H H 126 8.606 8.606 8.915 -0.309 18522
2299 1 4 . 1 1 115 115 LYS N N 127 125.850 125.850 118.674 7.176 18522
2300 1 4 . 1 1 115 115 LYS HA H 127 4.203 4.203 4.949 -0.746 18522
2301 1 4 . 1 1 115 115 LYS C C 127 175.564 175.564 174.809 0.755 18522
2302 1 4 . 1 1 115 115 LYS CA C 127 57.252 57.252 55.412 1.840 18522
2303 1 4 . 1 1 115 115 LYS CB C 127 33.406 33.406 34.749 -1.343 18522
2304 1 4 . 1 1 115 115 LYS H H 127 8.647 8.647 8.206 0.441 18522
2305 1 5 . 1 1 3 3 PRO C C 15 177.225 177.225 177.290 -0.065 18522
2306 1 5 . 1 1 3 3 PRO CA C 15 63.508 63.508 63.672 -0.164 18522
2307 1 5 . 1 1 3 3 PRO CB C 15 32.090 32.090 32.182 -0.092 18522
2308 1 5 . 1 1 4 4 GLY N N 16 108.829 108.829 108.014 0.815 18522
2309 1 5 . 1 1 4 4 GLY C C 16 173.398 173.398 174.731 -1.333 18522
2310 1 5 . 1 1 4 4 GLY CA C 16 45.128 45.128 44.885 0.243 18522
2311 1 5 . 1 1 4 4 GLY H H 16 8.489 8.489 8.434 0.055 18522
2312 1 5 . 1 1 5 5 ILE N N 17 121.763 121.763 119.661 2.102 18522
2313 1 5 . 1 1 5 5 ILE HA H 17 4.554 4.554 4.498 0.056 18522
2314 1 5 . 1 1 5 5 ILE C C 17 174.332 174.332 175.624 -1.292 18522
2315 1 5 . 1 1 5 5 ILE CA C 17 58.245 58.245 58.869 -0.624 18522
2316 1 5 . 1 1 5 5 ILE CB C 17 38.762 38.762 37.226 1.536 18522
2317 1 5 . 1 1 5 5 ILE H H 17 8.014 8.014 8.039 -0.025 18522
2318 1 5 . 1 1 6 6 PRO C C 18 176.437 176.437 176.858 -0.421 18522
2319 1 5 . 1 1 6 6 PRO CA C 18 62.667 62.667 64.543 -1.875 18522
2320 1 5 . 1 1 6 6 PRO CB C 18 32.469 32.469 31.635 0.834 18522
2321 1 5 . 1 1 7 7 VAL N N 19 123.849 123.849 119.260 4.589 18522
2322 1 5 . 1 1 7 7 VAL HA H 19 4.550 4.550 4.300 0.250 18522
2323 1 5 . 1 1 7 7 VAL C C 19 174.453 174.453 174.013 0.440 18522
2324 1 5 . 1 1 7 7 VAL CA C 19 59.846 59.846 58.502 1.344 18522
2325 1 5 . 1 1 7 7 VAL CB C 19 33.510 33.510 31.975 1.535 18522
2326 1 5 . 1 1 7 7 VAL H H 19 8.754 8.754 7.840 0.914 18522
2327 1 5 . 1 1 8 8 PRO HA H 20 5.338 5.338 4.470 0.868 18522
2328 1 5 . 1 1 8 8 PRO C C 20 177.585 177.585 176.797 0.788 18522
2329 1 5 . 1 1 8 8 PRO CA C 20 62.406 62.406 62.526 -0.121 18522
2330 1 5 . 1 1 8 8 PRO CB C 20 32.891 32.891 31.862 1.029 18522
2331 1 5 . 1 1 9 9 GLY N N 21 108.426 108.426 112.950 -4.524 18522
2332 1 5 . 1 1 9 9 GLY C C 21 171.443 171.443 172.791 -1.348 18522
2333 1 5 . 1 1 9 9 GLY CA C 21 44.581 44.581 44.586 -0.005 18522
2334 1 5 . 1 1 9 9 GLY H H 21 8.258 8.258 8.860 -0.602 18522
2335 1 5 . 1 1 10 10 LYS N N 22 117.372 117.372 126.443 -9.071 18522
2336 1 5 . 1 1 10 10 LYS HA H 22 4.039 4.039 5.225 -1.186 18522
2337 1 5 . 1 1 10 10 LYS C C 22 174.463 174.463 174.854 -0.391 18522
2338 1 5 . 1 1 10 10 LYS CA C 22 55.263 55.263 54.451 0.812 18522
2339 1 5 . 1 1 10 10 LYS CB C 22 35.227 35.227 32.817 2.410 18522
2340 1 5 . 1 1 10 10 LYS H H 22 8.175 8.175 7.854 0.321 18522
2341 1 5 . 1 1 11 11 VAL N N 23 120.387 120.387 117.930 2.457 18522
2342 1 5 . 1 1 11 11 VAL HA H 23 4.708 4.708 4.571 0.137 18522
2343 1 5 . 1 1 11 11 VAL C C 23 171.873 171.873 174.506 -2.633 18522
2344 1 5 . 1 1 11 11 VAL CA C 23 59.866 59.866 60.066 -0.201 18522
2345 1 5 . 1 1 11 11 VAL CB C 23 35.269 35.269 34.788 0.481 18522
2346 1 5 . 1 1 11 11 VAL H H 23 8.862 8.862 7.783 1.079 18522
2347 1 5 . 1 1 12 12 THR N N 24 125.797 125.797 120.418 5.379 18522
2348 1 5 . 1 1 12 12 THR HA H 24 5.121 5.121 4.907 0.214 18522
2349 1 5 . 1 1 12 12 THR C C 24 173.407 173.407 173.674 -0.267 18522
2350 1 5 . 1 1 12 12 THR CA C 24 62.115 62.115 60.508 1.607 18522
2351 1 5 . 1 1 12 12 THR CB C 24 69.606 69.606 69.148 0.458 18522
2352 1 5 . 1 1 12 12 THR H H 24 8.859 8.859 8.367 0.492 18522
2353 1 5 . 1 1 13 13 LEU N N 25 127.960 127.960 127.876 0.084 18522
2354 1 5 . 1 1 13 13 LEU HA H 25 4.809 4.809 4.888 -0.079 18522
2355 1 5 . 1 1 13 13 LEU C C 25 175.029 175.029 175.904 -0.875 18522
2356 1 5 . 1 1 13 13 LEU CA C 25 52.623 52.623 52.470 0.153 18522
2357 1 5 . 1 1 13 13 LEU CB C 25 46.242 46.242 44.436 1.806 18522
2358 1 5 . 1 1 13 13 LEU H H 25 9.258 9.258 8.248 1.010 18522
2359 1 5 . 1 1 14 14 GLN N N 26 120.858 120.858 117.270 3.588 18522
2360 1 5 . 1 1 14 14 GLN HA H 26 4.482 4.482 4.583 -0.101 18522
2361 1 5 . 1 1 14 14 GLN C C 26 174.515 174.515 175.106 -0.591 18522
2362 1 5 . 1 1 14 14 GLN CA C 26 54.576 54.576 54.343 0.233 18522
2363 1 5 . 1 1 14 14 GLN CB C 26 29.516 29.516 31.982 -2.466 18522
2364 1 5 . 1 1 14 14 GLN H H 26 8.530 8.530 8.277 0.253 18522
2365 1 5 . 1 1 15 15 LYS N N 27 119.583 119.583 122.275 -2.692 18522
2366 1 5 . 1 1 15 15 LYS HA H 27 4.180 4.180 4.269 -0.089 18522
2367 1 5 . 1 1 15 15 LYS C C 27 177.468 177.468 176.997 0.471 18522
2368 1 5 . 1 1 15 15 LYS CA C 27 55.956 55.956 56.636 -0.680 18522
2369 1 5 . 1 1 15 15 LYS CB C 27 34.099 34.099 32.525 1.574 18522
2370 1 5 . 1 1 15 15 LYS H H 27 8.099 8.099 8.264 -0.165 18522
2371 1 5 . 1 1 16 16 ASP N N 28 121.439 121.439 121.988 -0.549 18522
2372 1 5 . 1 1 16 16 ASP HA H 28 4.590 4.590 4.627 -0.037 18522
2373 1 5 . 1 1 16 16 ASP C C 28 178.392 178.392 177.785 0.607 18522
2374 1 5 . 1 1 16 16 ASP CA C 28 52.426 52.426 53.611 -1.185 18522
2375 1 5 . 1 1 16 16 ASP CB C 28 41.377 41.377 42.630 -1.253 18522
2376 1 5 . 1 1 16 16 ASP H H 28 8.888 8.888 8.560 0.328 18522
2377 1 5 . 1 1 17 17 ALA N N 29 119.578 119.578 123.272 -3.694 18522
2378 1 5 . 1 1 17 17 ALA HA H 29 4.188 4.188 4.087 0.101 18522
2379 1 5 . 1 1 17 17 ALA C C 29 178.763 178.763 178.178 0.585 18522
2380 1 5 . 1 1 17 17 ALA CA C 29 54.434 54.434 54.536 -0.102 18522
2381 1 5 . 1 1 17 17 ALA CB C 29 18.293 18.293 18.690 -0.397 18522
2382 1 5 . 1 1 17 17 ALA H H 29 8.392 8.392 8.698 -0.306 18522
2383 1 5 . 1 1 18 18 GLN N N 30 117.564 117.564 117.633 -0.069 18522
2384 1 5 . 1 1 18 18 GLN HA H 30 4.399 4.399 4.367 0.032 18522
2385 1 5 . 1 1 18 18 GLN C C 30 175.168 175.168 175.293 -0.125 18522
2386 1 5 . 1 1 18 18 GLN CA C 30 55.339 55.339 55.042 0.297 18522
2387 1 5 . 1 1 18 18 GLN CB C 30 28.589 28.589 29.196 -0.607 18522
2388 1 5 . 1 1 18 18 GLN H H 30 8.353 8.353 7.791 0.562 18522
2389 1 5 . 1 1 19 19 ASN N N 31 115.365 115.365 114.696 0.669 18522
2390 1 5 . 1 1 19 19 ASN HA H 31 4.315 4.315 4.355 -0.040 18522
2391 1 5 . 1 1 19 19 ASN C C 31 174.043 174.043 172.664 1.379 18522
2392 1 5 . 1 1 19 19 ASN CA C 31 54.303 54.303 54.626 -0.323 18522
2393 1 5 . 1 1 19 19 ASN CB C 31 37.610 37.610 37.279 0.331 18522
2394 1 5 . 1 1 19 19 ASN H H 31 8.521 8.521 8.363 0.158 18522
2395 1 5 . 1 1 20 20 LEU N N 32 118.660 118.660 112.089 6.571 18522
2396 1 5 . 1 1 20 20 LEU HA H 32 4.900 4.900 4.891 0.009 18522
2397 1 5 . 1 1 20 20 LEU C C 32 178.117 178.117 176.727 1.390 18522
2398 1 5 . 1 1 20 20 LEU CA C 32 53.957 53.957 53.514 0.443 18522
2399 1 5 . 1 1 20 20 LEU CB C 32 44.774 44.774 43.267 1.507 18522
2400 1 5 . 1 1 20 20 LEU H H 32 8.155 8.155 7.321 0.834 18522
2401 1 5 . 1 1 21 21 ILE N N 33 116.785 116.785 115.117 1.668 18522
2402 1 5 . 1 1 21 21 ILE HA H 33 4.674 4.674 4.553 0.121 18522
2403 1 5 . 1 1 21 21 ILE C C 33 176.185 176.185 176.627 -0.442 18522
2404 1 5 . 1 1 21 21 ILE CA C 33 62.602 62.602 61.474 1.128 18522
2405 1 5 . 1 1 21 21 ILE CB C 33 39.016 39.016 39.101 -0.085 18522
2406 1 5 . 1 1 21 21 ILE H H 33 11.488 11.488 8.610 2.878 18522
2407 1 5 . 1 1 22 22 GLY N N 34 111.234 111.234 108.371 2.863 18522
2408 1 5 . 1 1 22 22 GLY C C 34 173.993 173.993 173.547 0.446 18522
2409 1 5 . 1 1 22 22 GLY CA C 34 45.980 45.980 45.141 0.839 18522
2410 1 5 . 1 1 22 22 GLY H H 34 9.854 9.854 8.741 1.113 18522
2411 1 5 . 1 1 23 23 ILE N N 35 111.117 111.117 114.252 -3.135 18522
2412 1 5 . 1 1 23 23 ILE HA H 35 5.535 5.535 5.456 0.079 18522
2413 1 5 . 1 1 23 23 ILE C C 35 175.033 175.033 174.387 0.646 18522
2414 1 5 . 1 1 23 23 ILE CA C 35 58.415 58.415 57.885 0.530 18522
2415 1 5 . 1 1 23 23 ILE CB C 35 41.577 41.577 41.422 0.154 18522
2416 1 5 . 1 1 23 23 ILE H H 35 7.835 7.835 7.525 0.310 18522
2417 1 5 . 1 1 24 24 SER N N 36 114.908 114.908 115.469 -0.561 18522
2418 1 5 . 1 1 24 24 SER HA H 36 4.232 4.232 5.052 -0.820 18522
2419 1 5 . 1 1 24 24 SER C C 36 174.735 174.735 172.939 1.796 18522
2420 1 5 . 1 1 24 24 SER CA C 36 56.121 56.121 57.266 -1.145 18522
2421 1 5 . 1 1 24 24 SER CB C 36 66.097 66.097 65.784 0.313 18522
2422 1 5 . 1 1 24 24 SER H H 36 8.623 8.623 8.177 0.446 18522
2423 1 5 . 1 1 25 25 ILE N N 37 117.739 117.739 124.732 -6.993 18522
2424 1 5 . 1 1 25 25 ILE C C 37 174.340 174.340 175.765 -1.425 18522
2425 1 5 . 1 1 25 25 ILE CA C 37 59.123 59.123 60.210 -1.087 18522
2426 1 5 . 1 1 25 25 ILE CB C 37 41.637 41.637 40.429 1.208 18522
2427 1 5 . 1 1 25 25 ILE H H 37 9.130 9.130 8.556 0.574 18522
2428 1 5 . 1 1 26 26 GLY N N 38 108.069 108.069 112.271 -4.202 18522
2429 1 5 . 1 1 26 26 GLY CA C 38 44.112 44.112 45.189 -1.077 18522
2430 1 5 . 1 1 26 26 GLY H H 38 8.841 8.841 8.111 0.730 18522
2431 1 5 . 1 1 27 27 GLY N N 39 109.016 109.016 107.109 1.907 18522
2432 1 5 . 1 1 27 27 GLY C C 39 173.956 173.956 174.186 -0.230 18522
2433 1 5 . 1 1 27 27 GLY H H 39 8.187 8.187 8.558 -0.371 18522
2434 1 5 . 1 1 28 28 GLY N N 40 111.783 111.783 112.617 -0.834 18522
2435 1 5 . 1 1 28 28 GLY C C 40 174.255 174.255 173.689 0.566 18522
2436 1 5 . 1 1 28 28 GLY CA C 40 47.098 47.098 44.682 2.416 18522
2437 1 5 . 1 1 28 28 GLY H H 40 8.275 8.275 7.668 0.607 18522
2438 1 5 . 1 1 29 29 ALA N N 41 123.128 123.128 126.442 -3.314 18522
2439 1 5 . 1 1 29 29 ALA HA H 41 4.559 4.559 4.104 0.455 18522
2440 1 5 . 1 1 29 29 ALA CA C 41 51.073 51.073 54.202 -3.129 18522
2441 1 5 . 1 1 29 29 ALA CB C 41 21.926 21.926 19.411 2.515 18522
2442 1 5 . 1 1 29 29 ALA H H 41 8.012 8.012 8.407 -0.395 18522
2443 1 5 . 1 1 31 31 TYR HA H 43 4.549 4.549 4.511 0.038 18522
2444 1 5 . 1 1 31 31 TYR CA C 43 57.147 57.147 59.771 -2.624 18522
2445 1 5 . 1 1 31 31 TYR CB C 43 37.495 37.495 40.478 -2.983 18522
2446 1 5 . 1 1 32 32 CYS N N 44 119.332 119.332 116.069 3.263 18522
2447 1 5 . 1 1 32 32 CYS HA H 44 4.859 4.859 4.797 0.062 18522
2448 1 5 . 1 1 32 32 CYS CA C 44 57.406 57.406 56.532 0.874 18522
2449 1 5 . 1 1 32 32 CYS CB C 44 27.673 27.673 27.015 0.658 18522
2450 1 5 . 1 1 32 32 CYS H H 44 7.504 7.504 8.323 -0.819 18522
2451 1 5 . 1 1 33 33 PRO HA H 45 4.413 4.413 4.488 -0.075 18522
2452 1 5 . 1 1 33 33 PRO CA C 45 64.885 64.885 64.090 0.795 18522
2453 1 5 . 1 1 33 33 PRO CB C 45 32.318 32.318 32.363 -0.045 18522
2454 1 5 . 1 1 34 34 CYS N N 46 117.327 117.327 113.925 3.402 18522
2455 1 5 . 1 1 34 34 CYS C C 46 172.064 172.064 173.622 -1.558 18522
2456 1 5 . 1 1 34 34 CYS CA C 46 60.066 60.066 56.677 3.389 18522
2457 1 5 . 1 1 34 34 CYS CB C 46 28.715 28.715 31.686 -2.971 18522
2458 1 5 . 1 1 34 34 CYS H H 46 7.973 7.973 7.653 0.320 18522
2459 1 5 . 1 1 35 35 LEU N N 47 124.270 124.270 115.733 8.537 18522
2460 1 5 . 1 1 35 35 LEU HA H 47 4.928 4.928 4.756 0.172 18522
2461 1 5 . 1 1 35 35 LEU C C 47 175.076 175.076 176.513 -1.437 18522
2462 1 5 . 1 1 35 35 LEU CA C 47 53.278 53.278 54.132 -0.854 18522
2463 1 5 . 1 1 35 35 LEU CB C 47 44.321 44.321 43.259 1.062 18522
2464 1 5 . 1 1 35 35 LEU H H 47 8.629 8.629 8.553 0.076 18522
2465 1 5 . 1 1 36 36 TYR N N 48 119.326 119.326 115.193 4.133 18522
2466 1 5 . 1 1 36 36 TYR HA H 48 5.255 5.255 4.225 1.030 18522
2467 1 5 . 1 1 36 36 TYR C C 48 175.766 175.766 175.241 0.525 18522
2468 1 5 . 1 1 36 36 TYR CA C 48 56.696 56.696 62.175 -5.479 18522
2469 1 5 . 1 1 36 36 TYR CB C 48 42.590 42.590 38.008 4.582 18522
2470 1 5 . 1 1 36 36 TYR H H 48 8.761 8.761 9.155 -0.394 18522
2471 1 5 . 1 1 37 37 ILE N N 49 120.259 120.259 120.267 -0.008 18522
2472 1 5 . 1 1 37 37 ILE HA H 49 4.215 4.215 4.869 -0.654 18522
2473 1 5 . 1 1 37 37 ILE C C 49 177.429 177.429 175.968 1.461 18522
2474 1 5 . 1 1 37 37 ILE CA C 49 62.456 62.456 59.714 2.742 18522
2475 1 5 . 1 1 37 37 ILE CB C 49 37.352 37.352 38.720 -1.368 18522
2476 1 5 . 1 1 37 37 ILE H H 49 8.959 8.959 7.786 1.173 18522
2477 1 5 . 1 1 38 38 VAL HA H 50 3.937 3.937 4.171 -0.234 18522
2478 1 5 . 1 1 38 38 VAL C C 50 174.408 174.408 175.364 -0.956 18522
2479 1 5 . 1 1 38 38 VAL CA C 50 62.259 62.259 62.664 -0.405 18522
2480 1 5 . 1 1 38 38 VAL CB C 50 31.584 31.584 32.819 -1.235 18522
2481 1 5 . 1 1 39 39 GLN N N 51 116.821 116.821 116.448 0.373 18522
2482 1 5 . 1 1 39 39 GLN HA H 51 4.103 4.103 4.438 -0.335 18522
2483 1 5 . 1 1 39 39 GLN C C 51 172.856 172.856 172.948 -0.092 18522
2484 1 5 . 1 1 39 39 GLN CA C 51 55.127 55.127 55.077 0.050 18522
2485 1 5 . 1 1 39 39 GLN CB C 51 32.376 32.376 32.685 -0.309 18522
2486 1 5 . 1 1 39 39 GLN H H 51 6.967 6.967 7.481 -0.514 18522
2487 1 5 . 1 1 40 40 VAL N N 52 123.482 123.482 119.386 4.096 18522
2488 1 5 . 1 1 40 40 VAL HA H 52 4.277 4.277 4.916 -0.639 18522
2489 1 5 . 1 1 40 40 VAL C C 52 176.198 176.198 174.094 2.104 18522
2490 1 5 . 1 1 40 40 VAL CA C 52 61.574 61.574 59.977 1.597 18522
2491 1 5 . 1 1 40 40 VAL CB C 52 32.875 32.875 35.873 -2.998 18522
2492 1 5 . 1 1 40 40 VAL H H 52 8.447 8.447 8.185 0.262 18522
2493 1 5 . 1 1 41 41 PHE N N 53 128.296 128.296 122.876 5.420 18522
2494 1 5 . 1 1 41 41 PHE HA H 53 4.400 4.400 4.816 -0.416 18522
2495 1 5 . 1 1 41 41 PHE C C 53 175.299 175.299 176.179 -0.880 18522
2496 1 5 . 1 1 41 41 PHE CA C 53 58.494 58.494 57.093 1.401 18522
2497 1 5 . 1 1 41 41 PHE CB C 53 39.561 39.561 41.068 -1.506 18522
2498 1 5 . 1 1 41 41 PHE H H 53 8.707 8.707 8.574 0.133 18522
2499 1 5 . 1 1 42 42 ASP N N 54 122.696 122.696 123.740 -1.044 18522
2500 1 5 . 1 1 42 42 ASP HA H 54 4.272 4.272 4.282 -0.010 18522
2501 1 5 . 1 1 42 42 ASP C C 54 176.837 176.837 176.679 0.158 18522
2502 1 5 . 1 1 42 42 ASP CA C 54 55.291 55.291 57.154 -1.863 18522
2503 1 5 . 1 1 42 42 ASP CB C 54 41.093 41.093 41.045 0.048 18522
2504 1 5 . 1 1 42 42 ASP H H 54 8.901 8.901 9.040 -0.139 18522
2505 1 5 . 1 1 43 43 ASN N N 55 113.923 113.923 112.985 0.938 18522
2506 1 5 . 1 1 43 43 ASN HA H 55 4.258 4.258 4.750 -0.492 18522
2507 1 5 . 1 1 43 43 ASN C C 55 173.714 173.714 175.034 -1.320 18522
2508 1 5 . 1 1 43 43 ASN CA C 55 54.958 54.958 52.953 2.005 18522
2509 1 5 . 1 1 43 43 ASN CB C 55 37.150 37.150 39.419 -2.269 18522
2510 1 5 . 1 1 43 43 ASN H H 55 9.319 9.319 8.067 1.252 18522
2511 1 5 . 1 1 44 44 THR N N 56 108.020 108.020 113.145 -5.125 18522
2512 1 5 . 1 1 44 44 THR HA H 56 5.377 5.377 4.883 0.494 18522
2513 1 5 . 1 1 44 44 THR CA C 56 59.712 59.712 59.533 0.179 18522
2514 1 5 . 1 1 44 44 THR CB C 56 69.529 69.529 69.998 -0.469 18522
2515 1 5 . 1 1 44 44 THR H H 56 7.149 7.149 7.826 -0.677 18522
2516 1 5 . 1 1 45 45 PRO HA H 57 4.304 4.304 4.062 0.242 18522
2517 1 5 . 1 1 45 45 PRO C C 57 180.141 180.141 178.080 2.061 18522
2518 1 5 . 1 1 45 45 PRO CA C 57 66.090 66.090 65.671 0.419 18522
2519 1 5 . 1 1 45 45 PRO CB C 57 33.194 33.194 31.382 1.812 18522
2520 1 5 . 1 1 46 46 ALA N N 58 116.854 116.854 120.118 -3.264 18522
2521 1 5 . 1 1 46 46 ALA HA H 58 4.035 4.035 4.038 -0.003 18522
2522 1 5 . 1 1 46 46 ALA C C 58 180.647 180.647 179.518 1.129 18522
2523 1 5 . 1 1 46 46 ALA CA C 58 55.195 55.195 55.297 -0.102 18522
2524 1 5 . 1 1 46 46 ALA CB C 58 18.880 18.880 18.162 0.718 18522
2525 1 5 . 1 1 46 46 ALA H H 58 8.938 8.938 7.837 1.101 18522
2526 1 5 . 1 1 47 47 ALA N N 59 123.250 123.250 121.184 2.066 18522
2527 1 5 . 1 1 47 47 ALA HA H 59 4.030 4.030 4.215 -0.185 18522
2528 1 5 . 1 1 47 47 ALA C C 59 179.852 179.852 179.986 -0.134 18522
2529 1 5 . 1 1 47 47 ALA CA C 59 54.939 54.939 54.448 0.491 18522
2530 1 5 . 1 1 47 47 ALA CB C 59 19.688 19.688 18.486 1.202 18522
2531 1 5 . 1 1 47 47 ALA H H 59 7.658 7.658 7.525 0.133 18522
2532 1 5 . 1 1 48 48 LEU N N 60 118.654 118.654 120.267 -1.613 18522
2533 1 5 . 1 1 48 48 LEU HA H 60 4.026 4.026 4.104 -0.078 18522
2534 1 5 . 1 1 48 48 LEU C C 60 179.238 179.238 178.368 0.870 18522
2535 1 5 . 1 1 48 48 LEU CA C 60 57.261 57.261 58.197 -0.936 18522
2536 1 5 . 1 1 48 48 LEU CB C 60 41.445 41.445 40.727 0.718 18522
2537 1 5 . 1 1 48 48 LEU H H 60 8.636 8.636 8.519 0.117 18522
2538 1 5 . 1 1 49 49 ASP N N 61 117.382 117.382 117.191 0.191 18522
2539 1 5 . 1 1 49 49 ASP HA H 61 4.421 4.421 4.612 -0.191 18522
2540 1 5 . 1 1 49 49 ASP C C 61 177.668 177.668 178.602 -0.934 18522
2541 1 5 . 1 1 49 49 ASP CA C 61 57.087 57.087 55.760 1.327 18522
2542 1 5 . 1 1 49 49 ASP CB C 61 44.478 44.478 42.297 2.182 18522
2543 1 5 . 1 1 49 49 ASP H H 61 7.665 7.665 7.969 -0.304 18522
2544 1 5 . 1 1 50 50 GLY N N 62 103.228 103.228 107.476 -4.248 18522
2545 1 5 . 1 1 50 50 GLY C C 62 174.776 174.776 174.311 0.465 18522
2546 1 5 . 1 1 50 50 GLY CA C 62 46.533 46.533 46.605 -0.072 18522
2547 1 5 . 1 1 50 50 GLY H H 62 7.216 7.216 8.432 -1.216 18522
2548 1 5 . 1 1 51 51 THR N N 63 117.230 117.230 112.538 4.692 18522
2549 1 5 . 1 1 51 51 THR HA H 63 3.907 3.907 3.853 0.054 18522
2550 1 5 . 1 1 51 51 THR C C 63 175.961 175.961 173.447 2.514 18522
2551 1 5 . 1 1 51 51 THR CA C 63 66.478 66.478 62.610 3.868 18522
2552 1 5 . 1 1 51 51 THR CB C 63 68.268 68.268 66.275 1.993 18522
2553 1 5 . 1 1 51 51 THR H H 63 8.319 8.319 7.578 0.741 18522
2554 1 5 . 1 1 52 52 VAL N N 64 113.826 113.826 113.491 0.335 18522
2555 1 5 . 1 1 52 52 VAL HA H 64 3.950 3.950 4.853 -0.903 18522
2556 1 5 . 1 1 52 52 VAL C C 64 173.883 173.883 174.734 -0.851 18522
2557 1 5 . 1 1 52 52 VAL CA C 64 60.708 60.708 59.907 0.800 18522
2558 1 5 . 1 1 52 52 VAL CB C 64 33.079 33.079 31.685 1.394 18522
2559 1 5 . 1 1 52 52 VAL H H 64 8.147 8.147 7.437 0.710 18522
2560 1 5 . 1 1 53 53 ALA N N 65 123.521 123.521 123.925 -0.404 18522
2561 1 5 . 1 1 53 53 ALA HA H 65 4.414 4.414 4.412 0.002 18522
2562 1 5 . 1 1 53 53 ALA C C 65 175.247 175.247 176.590 -1.343 18522
2563 1 5 . 1 1 53 53 ALA CA C 65 50.440 50.440 51.007 -0.567 18522
2564 1 5 . 1 1 53 53 ALA CB C 65 23.266 23.266 20.285 2.981 18522
2565 1 5 . 1 1 53 53 ALA H H 65 8.633 8.633 7.737 0.896 18522
2566 1 5 . 1 1 54 54 ALA N N 66 120.818 120.818 121.965 -1.147 18522
2567 1 5 . 1 1 54 54 ALA HA H 66 3.720 3.720 3.956 -0.236 18522
2568 1 5 . 1 1 54 54 ALA C C 66 178.411 178.411 178.026 0.385 18522
2569 1 5 . 1 1 54 54 ALA CA C 66 53.016 53.016 53.918 -0.902 18522
2570 1 5 . 1 1 54 54 ALA CB C 66 17.840 17.840 17.711 0.129 18522
2571 1 5 . 1 1 54 54 ALA H H 66 8.451 8.451 8.323 0.128 18522
2572 1 5 . 1 1 55 55 GLY N N 67 112.260 112.260 113.141 -0.881 18522
2573 1 5 . 1 1 55 55 GLY C C 67 173.296 173.296 173.759 -0.463 18522
2574 1 5 . 1 1 55 55 GLY CA C 67 45.025 45.025 44.737 0.288 18522
2575 1 5 . 1 1 55 55 GLY H H 67 9.600 9.600 8.487 1.113 18522
2576 1 5 . 1 1 56 56 ASP N N 68 121.293 121.293 120.219 1.074 18522
2577 1 5 . 1 1 56 56 ASP HA H 68 4.861 4.861 4.841 0.020 18522
2578 1 5 . 1 1 56 56 ASP C C 68 174.937 174.937 174.330 0.607 18522
2579 1 5 . 1 1 56 56 ASP CA C 68 55.641 55.641 53.415 2.226 18522
2580 1 5 . 1 1 56 56 ASP CB C 68 40.696 40.696 42.986 -2.290 18522
2581 1 5 . 1 1 56 56 ASP H H 68 8.043 8.043 7.694 0.349 18522
2582 1 5 . 1 1 57 57 GLU N N 69 122.814 122.814 118.943 3.871 18522
2583 1 5 . 1 1 57 57 GLU C C 69 177.202 177.202 175.436 1.766 18522
2584 1 5 . 1 1 57 57 GLU CA C 69 54.472 54.472 54.674 -0.202 18522
2585 1 5 . 1 1 57 57 GLU CB C 69 32.800 32.800 34.156 -1.356 18522
2586 1 5 . 1 1 57 57 GLU H H 69 8.455 8.455 7.852 0.603 18522
2587 1 5 . 1 1 58 58 ILE N N 70 125.862 125.862 124.467 1.395 18522
2588 1 5 . 1 1 58 58 ILE HA H 70 4.526 4.526 4.477 0.049 18522
2589 1 5 . 1 1 58 58 ILE C C 70 175.035 175.035 175.193 -0.158 18522
2590 1 5 . 1 1 58 58 ILE CA C 70 60.918 60.918 60.743 0.175 18522
2591 1 5 . 1 1 58 58 ILE CB C 70 39.236 39.236 39.407 -0.171 18522
2592 1 5 . 1 1 58 58 ILE H H 70 8.619 8.619 8.305 0.314 18522
2593 1 5 . 1 1 59 59 THR N N 71 115.507 115.507 119.689 -4.182 18522
2594 1 5 . 1 1 59 59 THR HA H 71 4.513 4.513 4.181 0.332 18522
2595 1 5 . 1 1 59 59 THR C C 71 176.425 176.425 174.085 2.340 18522
2596 1 5 . 1 1 59 59 THR CA C 71 61.158 61.158 61.121 0.037 18522
2597 1 5 . 1 1 59 59 THR CB C 71 69.604 69.604 69.463 0.141 18522
2598 1 5 . 1 1 59 59 THR H H 71 9.242 9.242 8.915 0.327 18522
2599 1 5 . 1 1 60 60 GLY N N 72 111.789 111.789 109.020 2.769 18522
2600 1 5 . 1 1 60 60 GLY C C 72 170.981 170.981 171.393 -0.412 18522
2601 1 5 . 1 1 60 60 GLY CA C 72 46.554 46.554 45.417 1.137 18522
2602 1 5 . 1 1 60 60 GLY H H 72 7.883 7.883 7.562 0.321 18522
2603 1 5 . 1 1 61 61 VAL N N 73 119.277 119.277 122.365 -3.088 18522
2604 1 5 . 1 1 61 61 VAL C C 73 175.951 175.951 175.620 0.331 18522
2605 1 5 . 1 1 61 61 VAL CA C 73 60.982 60.982 59.532 1.450 18522
2606 1 5 . 1 1 61 61 VAL CB C 73 36.197 36.197 33.725 2.472 18522
2607 1 5 . 1 1 61 61 VAL H H 73 8.424 8.424 8.870 -0.446 18522
2608 1 5 . 1 1 62 62 ASN N N 74 127.731 127.731 128.106 -0.375 18522
2609 1 5 . 1 1 62 62 ASN HA H 74 4.520 4.520 4.460 0.060 18522
2610 1 5 . 1 1 62 62 ASN C C 74 174.878 174.878 175.123 -0.245 18522
2611 1 5 . 1 1 62 62 ASN CA C 74 54.418 54.418 54.492 -0.074 18522
2612 1 5 . 1 1 62 62 ASN CB C 74 36.655 36.655 36.888 -0.233 18522
2613 1 5 . 1 1 62 62 ASN H H 74 10.384 10.384 9.547 0.837 18522
2614 1 5 . 1 1 63 63 GLY N N 75 104.633 104.633 103.782 0.851 18522
2615 1 5 . 1 1 63 63 GLY C C 75 173.610 173.610 173.503 0.107 18522
2616 1 5 . 1 1 63 63 GLY CA C 75 45.261 45.261 44.945 0.316 18522
2617 1 5 . 1 1 63 63 GLY H H 75 8.926 8.926 8.717 0.209 18522
2618 1 5 . 1 1 64 64 ARG N N 76 120.451 120.451 121.576 -1.125 18522
2619 1 5 . 1 1 64 64 ARG HA H 76 4.501 4.501 4.636 -0.135 18522
2620 1 5 . 1 1 64 64 ARG C C 76 175.085 175.085 175.539 -0.454 18522
2621 1 5 . 1 1 64 64 ARG CA C 76 54.252 54.252 54.559 -0.307 18522
2622 1 5 . 1 1 64 64 ARG CB C 76 31.482 31.482 31.466 0.016 18522
2623 1 5 . 1 1 64 64 ARG H H 76 7.753 7.753 7.972 -0.219 18522
2624 1 5 . 1 1 65 65 SER N N 77 116.586 116.586 117.888 -1.302 18522
2625 1 5 . 1 1 65 65 SER HA H 77 4.483 4.483 4.531 -0.048 18522
2626 1 5 . 1 1 65 65 SER C C 77 176.953 176.953 175.346 1.607 18522
2627 1 5 . 1 1 65 65 SER CA C 77 58.292 58.292 59.399 -1.107 18522
2628 1 5 . 1 1 65 65 SER CB C 77 63.643 63.643 63.673 -0.030 18522
2629 1 5 . 1 1 65 65 SER H H 77 8.555 8.555 8.667 -0.112 18522
2630 1 5 . 1 1 66 66 ILE N N 78 116.618 116.618 116.455 0.163 18522
2631 1 5 . 1 1 66 66 ILE HA H 78 4.420 4.420 4.344 0.076 18522
2632 1 5 . 1 1 66 66 ILE C C 78 175.072 175.072 175.762 -0.690 18522
2633 1 5 . 1 1 66 66 ILE CA C 78 59.122 59.122 59.627 -0.505 18522
2634 1 5 . 1 1 66 66 ILE CB C 78 36.758 36.758 37.722 -0.964 18522
2635 1 5 . 1 1 66 66 ILE H H 78 7.599 7.599 7.696 -0.097 18522
2636 1 5 . 1 1 67 67 LYS N N 79 123.287 123.287 122.332 0.955 18522
2637 1 5 . 1 1 67 67 LYS HA H 79 4.049 4.049 4.089 -0.040 18522
2638 1 5 . 1 1 67 67 LYS C C 79 178.333 178.333 176.455 1.878 18522
2639 1 5 . 1 1 67 67 LYS CA C 79 58.321 58.321 56.616 1.705 18522
2640 1 5 . 1 1 67 67 LYS CB C 79 31.635 31.635 30.015 1.620 18522
2641 1 5 . 1 1 67 67 LYS H H 79 7.898 7.898 8.041 -0.143 18522
2642 1 5 . 1 1 68 68 GLY N N 80 114.933 114.933 113.624 1.309 18522
2643 1 5 . 1 1 68 68 GLY C C 80 174.385 174.385 174.234 0.151 18522
2644 1 5 . 1 1 68 68 GLY CA C 80 45.518 45.518 45.403 0.115 18522
2645 1 5 . 1 1 68 68 GLY H H 80 8.999 8.999 8.139 0.860 18522
2646 1 5 . 1 1 69 69 LYS N N 81 119.403 119.403 122.282 -2.879 18522
2647 1 5 . 1 1 69 69 LYS HA H 81 4.043 4.043 4.651 -0.608 18522
2648 1 5 . 1 1 69 69 LYS C C 81 177.064 177.064 175.730 1.334 18522
2649 1 5 . 1 1 69 69 LYS CA C 81 54.722 54.722 55.204 -0.482 18522
2650 1 5 . 1 1 69 69 LYS CB C 81 33.560 33.560 33.708 -0.148 18522
2651 1 5 . 1 1 69 69 LYS H H 81 7.845 7.845 7.738 0.107 18522
2652 1 5 . 1 1 70 70 THR N N 82 112.066 112.066 115.517 -3.451 18522
2653 1 5 . 1 1 70 70 THR HA H 82 4.666 4.666 4.610 0.056 18522
2654 1 5 . 1 1 70 70 THR C C 82 175.955 175.955 175.078 0.877 18522
2655 1 5 . 1 1 70 70 THR CA C 82 60.438 60.438 61.020 -0.583 18522
2656 1 5 . 1 1 70 70 THR CB C 82 71.629 71.629 72.638 -1.009 18522
2657 1 5 . 1 1 70 70 THR H H 82 9.153 9.153 7.747 1.406 18522
2658 1 5 . 1 1 71 71 LYS N N 83 118.730 118.730 125.402 -6.672 18522
2659 1 5 . 1 1 71 71 LYS HA H 83 3.870 3.870 3.825 0.045 18522
2660 1 5 . 1 1 71 71 LYS C C 83 177.464 177.464 177.816 -0.352 18522
2661 1 5 . 1 1 71 71 LYS CA C 83 60.357 60.357 60.174 0.183 18522
2662 1 5 . 1 1 71 71 LYS CB C 83 31.350 31.350 31.377 -0.026 18522
2663 1 5 . 1 1 71 71 LYS H H 83 8.969 8.969 8.845 0.124 18522
2664 1 5 . 1 1 72 72 VAL N N 84 117.444 117.444 118.552 -1.108 18522
2665 1 5 . 1 1 72 72 VAL HA H 84 3.633 3.633 3.639 -0.006 18522
2666 1 5 . 1 1 72 72 VAL C C 84 178.315 178.315 177.690 0.625 18522
2667 1 5 . 1 1 72 72 VAL CA C 84 66.079 66.079 65.610 0.469 18522
2668 1 5 . 1 1 72 72 VAL CB C 84 32.091 32.091 31.546 0.545 18522
2669 1 5 . 1 1 72 72 VAL H H 84 7.631 7.631 8.141 -0.510 18522
2670 1 5 . 1 1 73 73 GLU N N 85 120.890 120.890 119.102 1.788 18522
2671 1 5 . 1 1 73 73 GLU HA H 85 3.964 3.964 4.115 -0.151 18522
2672 1 5 . 1 1 73 73 GLU C C 85 179.971 179.971 178.748 1.223 18522
2673 1 5 . 1 1 73 73 GLU CA C 85 59.316 59.316 59.159 0.157 18522
2674 1 5 . 1 1 73 73 GLU CB C 85 30.355 30.355 29.816 0.539 18522
2675 1 5 . 1 1 73 73 GLU H H 85 7.617 7.617 7.630 -0.013 18522
2676 1 5 . 1 1 74 74 VAL N N 86 121.246 121.246 117.704 3.542 18522
2677 1 5 . 1 1 74 74 VAL HA H 86 3.630 3.630 3.861 -0.231 18522
2678 1 5 . 1 1 74 74 VAL C C 86 177.217 177.217 177.854 -0.637 18522
2679 1 5 . 1 1 74 74 VAL CA C 86 66.678 66.678 65.771 0.907 18522
2680 1 5 . 1 1 74 74 VAL CB C 86 31.307 31.307 31.415 -0.108 18522
2681 1 5 . 1 1 74 74 VAL H H 86 8.368 8.368 8.130 0.238 18522
2682 1 5 . 1 1 75 75 ALA N N 87 122.148 122.148 122.835 -0.687 18522
2683 1 5 . 1 1 75 75 ALA HA H 87 3.947 3.947 3.934 0.013 18522
2684 1 5 . 1 1 75 75 ALA C C 87 179.545 179.545 179.052 0.493 18522
2685 1 5 . 1 1 75 75 ALA CA C 87 55.851 55.851 55.599 0.252 18522
2686 1 5 . 1 1 75 75 ALA CB C 87 18.491 18.491 17.943 0.548 18522
2687 1 5 . 1 1 75 75 ALA H H 87 8.577 8.577 8.713 -0.136 18522
2688 1 5 . 1 1 76 76 LYS N N 88 117.733 117.733 119.012 -1.279 18522
2689 1 5 . 1 1 76 76 LYS HA H 88 4.051 4.051 3.993 0.058 18522
2690 1 5 . 1 1 76 76 LYS CA C 88 59.393 59.393 59.287 0.106 18522
2691 1 5 . 1 1 76 76 LYS CB C 88 32.058 32.058 32.307 -0.249 18522
2692 1 5 . 1 1 76 76 LYS H H 88 7.854 7.854 7.369 0.485 18522
2693 1 5 . 1 1 77 77 MET N N 89 117.676 117.676 118.442 -0.766 18522
2694 1 5 . 1 1 77 77 MET HA H 89 4.048 4.048 4.025 0.023 18522
2695 1 5 . 1 1 77 77 MET C C 89 178.791 178.791 178.941 -0.150 18522
2696 1 5 . 1 1 77 77 MET CA C 89 59.128 59.128 59.364 -0.236 18522
2697 1 5 . 1 1 77 77 MET CB C 89 33.801 33.801 32.591 1.210 18522
2698 1 5 . 1 1 77 77 MET H H 89 7.759 7.759 8.293 -0.534 18522
2699 1 5 . 1 1 78 78 ILE N N 90 117.305 117.305 119.548 -2.243 18522
2700 1 5 . 1 1 78 78 ILE HA H 90 3.590 3.590 3.595 -0.005 18522
2701 1 5 . 1 1 78 78 ILE C C 90 178.658 178.658 177.746 0.912 18522
2702 1 5 . 1 1 78 78 ILE CA C 90 65.482 65.482 65.694 -0.212 18522
2703 1 5 . 1 1 78 78 ILE CB C 90 38.845 38.845 37.858 0.987 18522
2704 1 5 . 1 1 78 78 ILE H H 90 7.972 7.972 8.451 -0.479 18522
2705 1 5 . 1 1 79 79 GLN N N 91 120.935 120.935 118.942 1.993 18522
2706 1 5 . 1 1 79 79 GLN HA H 91 3.998 3.998 4.185 -0.187 18522
2707 1 5 . 1 1 79 79 GLN C C 91 178.274 178.274 178.142 0.132 18522
2708 1 5 . 1 1 79 79 GLN CA C 91 59.151 59.151 58.094 1.057 18522
2709 1 5 . 1 1 79 79 GLN CB C 91 28.934 28.934 28.634 0.300 18522
2710 1 5 . 1 1 79 79 GLN H H 91 8.826 8.826 8.119 0.707 18522
2711 1 5 . 1 1 80 80 GLU N N 92 115.213 115.213 121.185 -5.972 18522
2712 1 5 . 1 1 80 80 GLU HA H 92 4.061 4.061 4.044 0.017 18522
2713 1 5 . 1 1 80 80 GLU C C 92 176.824 176.824 179.129 -2.305 18522
2714 1 5 . 1 1 80 80 GLU CA C 92 58.006 58.006 59.470 -1.464 18522
2715 1 5 . 1 1 80 80 GLU CB C 92 29.890 29.890 29.759 0.132 18522
2716 1 5 . 1 1 80 80 GLU H H 92 8.020 8.020 8.522 -0.502 18522
2717 1 5 . 1 1 81 81 VAL N N 93 119.047 119.047 113.998 5.049 18522
2718 1 5 . 1 1 81 81 VAL HA H 93 3.930 3.930 3.809 0.121 18522
2719 1 5 . 1 1 81 81 VAL C C 93 176.016 176.016 176.058 -0.042 18522
2720 1 5 . 1 1 81 81 VAL CA C 93 63.153 63.153 64.529 -1.376 18522
2721 1 5 . 1 1 81 81 VAL CB C 93 32.154 32.154 31.562 0.591 18522
2722 1 5 . 1 1 81 81 VAL H H 93 7.073 7.073 7.473 -0.400 18522
2723 1 5 . 1 1 82 82 LYS N N 94 128.366 128.366 117.911 10.455 18522
2724 1 5 . 1 1 82 82 LYS C C 94 177.460 177.460 177.618 -0.158 18522
2725 1 5 . 1 1 82 82 LYS CA C 94 55.753 55.753 57.122 -1.369 18522
2726 1 5 . 1 1 82 82 LYS CB C 94 32.332 32.332 31.933 0.399 18522
2727 1 5 . 1 1 82 82 LYS H H 94 8.762 8.762 7.272 1.490 18522
2728 1 5 . 1 1 83 83 GLY N N 95 112.528 112.528 109.200 3.328 18522
2729 1 5 . 1 1 83 83 GLY C C 95 173.468 173.468 173.739 -0.271 18522
2730 1 5 . 1 1 83 83 GLY CA C 95 46.243 46.243 45.562 0.680 18522
2731 1 5 . 1 1 83 83 GLY H H 95 8.673 8.673 8.954 -0.281 18522
2732 1 5 . 1 1 84 84 GLU N N 96 121.485 121.485 121.853 -0.368 18522
2733 1 5 . 1 1 84 84 GLU HA H 96 4.749 4.749 5.159 -0.410 18522
2734 1 5 . 1 1 84 84 GLU C C 96 174.583 174.583 174.771 -0.188 18522
2735 1 5 . 1 1 84 84 GLU CA C 96 55.821 55.821 54.442 1.379 18522
2736 1 5 . 1 1 84 84 GLU CB C 96 31.410 31.410 33.783 -2.373 18522
2737 1 5 . 1 1 84 84 GLU H H 96 8.297 8.297 8.025 0.272 18522
2738 1 5 . 1 1 85 85 VAL N N 97 120.501 120.501 113.962 6.539 18522
2739 1 5 . 1 1 85 85 VAL HA H 97 4.665 4.665 5.084 -0.419 18522
2740 1 5 . 1 1 85 85 VAL C C 97 173.047 173.047 174.252 -1.205 18522
2741 1 5 . 1 1 85 85 VAL CA C 97 60.114 60.114 60.192 -0.078 18522
2742 1 5 . 1 1 85 85 VAL CB C 97 35.184 35.184 35.571 -0.387 18522
2743 1 5 . 1 1 85 85 VAL H H 97 9.096 9.096 8.655 0.441 18522
2744 1 5 . 1 1 86 86 THR N N 98 125.019 125.019 120.294 4.725 18522
2745 1 5 . 1 1 86 86 THR HA H 98 4.076 4.076 5.193 -1.117 18522
2746 1 5 . 1 1 86 86 THR C C 98 173.807 173.807 173.850 -0.043 18522
2747 1 5 . 1 1 86 86 THR CA C 98 61.735 61.735 61.951 -0.216 18522
2748 1 5 . 1 1 86 86 THR CB C 98 69.531 69.531 70.972 -1.441 18522
2749 1 5 . 1 1 86 86 THR H H 98 9.352 9.352 9.150 0.202 18522
2750 1 5 . 1 1 87 87 ILE N N 99 128.383 128.383 122.854 5.529 18522
2751 1 5 . 1 1 87 87 ILE HA H 99 4.661 4.661 4.816 -0.155 18522
2752 1 5 . 1 1 87 87 ILE C C 99 174.614 174.614 174.692 -0.078 18522
2753 1 5 . 1 1 87 87 ILE CA C 99 58.258 58.258 59.096 -0.838 18522
2754 1 5 . 1 1 87 87 ILE CB C 99 38.528 38.528 39.710 -1.182 18522
2755 1 5 . 1 1 87 87 ILE H H 99 9.329 9.329 8.882 0.447 18522
2756 1 5 . 1 1 88 88 HIS N N 100 128.279 128.279 124.256 4.023 18522
2757 1 5 . 1 1 88 88 HIS HA H 100 4.948 4.948 5.330 -0.382 18522
2758 1 5 . 1 1 88 88 HIS C C 100 174.787 174.787 173.889 0.898 18522
2759 1 5 . 1 1 88 88 HIS CA C 100 54.620 54.620 55.580 -0.960 18522
2760 1 5 . 1 1 88 88 HIS H H 100 8.647 8.647 8.356 0.291 18522
2761 1 5 . 1 1 89 89 TYR N N 101 121.320 121.320 125.848 -4.528 18522
2762 1 5 . 1 1 89 89 TYR HA H 101 5.947 5.947 4.685 1.262 18522
2763 1 5 . 1 1 89 89 TYR C C 101 173.769 173.769 172.863 0.906 18522
2764 1 5 . 1 1 89 89 TYR CA C 101 55.669 55.669 58.475 -2.806 18522
2765 1 5 . 1 1 89 89 TYR CB C 101 42.195 42.195 40.721 1.474 18522
2766 1 5 . 1 1 89 89 TYR H H 101 8.414 8.414 9.386 -0.972 18522
2767 1 5 . 1 1 90 90 ASN N N 102 116.679 116.679 117.014 -0.335 18522
2768 1 5 . 1 1 90 90 ASN HA H 102 5.335 5.335 5.000 0.335 18522
2769 1 5 . 1 1 90 90 ASN C C 102 175.406 175.406 173.686 1.720 18522
2770 1 5 . 1 1 90 90 ASN CA C 102 51.961 51.961 52.501 -0.540 18522
2771 1 5 . 1 1 90 90 ASN CB C 102 41.800 41.800 40.818 0.982 18522
2772 1 5 . 1 1 90 90 ASN H H 102 9.282 9.282 7.773 1.509 18522
2773 1 5 . 1 1 91 91 LYS N N 103 124.129 124.129 119.291 4.838 18522
2774 1 5 . 1 1 91 91 LYS C C 103 176.678 176.678 175.083 1.595 18522
2775 1 5 . 1 1 91 91 LYS CA C 103 55.006 55.006 54.589 0.417 18522
2776 1 5 . 1 1 91 91 LYS H H 103 8.949 8.949 8.416 0.533 18522
2777 1 5 . 1 1 92 92 LEU N N 104 127.043 127.043 113.436 13.607 18522
2778 1 5 . 1 1 92 92 LEU HA H 104 4.425 4.425 4.521 -0.096 18522
2779 1 5 . 1 1 92 92 LEU CA C 104 55.060 55.060 55.091 -0.031 18522
2780 1 5 . 1 1 92 92 LEU CB C 104 42.559 42.559 43.934 -1.375 18522
2781 1 5 . 1 1 92 92 LEU H H 104 9.150 9.150 7.383 1.767 18522
2782 1 5 . 1 1 93 93 GLN HA H 105 4.315 4.315 4.544 -0.229 18522
2783 1 5 . 1 1 93 93 GLN C C 105 175.070 175.070 176.384 -1.314 18522
2784 1 5 . 1 1 93 93 GLN CA C 105 55.490 55.490 54.703 0.787 18522
2785 1 5 . 1 1 93 93 GLN CB C 105 28.909 28.909 29.803 -0.894 18522
2786 1 5 . 1 1 94 94 ALA N N 106 125.133 125.133 122.726 2.407 18522
2787 1 5 . 1 1 94 94 ALA HA H 106 4.366 4.366 3.936 0.430 18522
2788 1 5 . 1 1 94 94 ALA C C 106 176.392 176.392 176.494 -0.102 18522
2789 1 5 . 1 1 94 94 ALA CA C 106 51.723 51.723 53.239 -1.516 18522
2790 1 5 . 1 1 94 94 ALA CB C 106 20.185 20.185 17.436 2.749 18522
2791 1 5 . 1 1 94 94 ALA H H 106 8.226 8.226 8.244 -0.018 18522
2792 1 5 . 1 1 95 95 ASP N N 107 122.013 122.013 120.543 1.470 18522
2793 1 5 . 1 1 95 95 ASP HA H 107 4.413 4.413 5.005 -0.592 18522
2794 1 5 . 1 1 95 95 ASP C C 107 175.019 175.019 174.296 0.723 18522
2795 1 5 . 1 1 95 95 ASP CA C 107 55.642 55.642 51.810 3.832 18522
2796 1 5 . 1 1 95 95 ASP CB C 107 41.266 41.266 42.418 -1.152 18522
2797 1 5 . 1 1 95 95 ASP H H 107 8.429 8.429 7.965 0.464 18522
2798 1 5 . 1 1 96 96 PRO HA H 108 4.207 4.207 3.970 0.237 18522
2799 1 5 . 1 1 96 96 PRO C C 108 178.840 178.840 178.227 0.613 18522
2800 1 5 . 1 1 96 96 PRO CA C 108 65.396 65.396 65.749 -0.353 18522
2801 1 5 . 1 1 96 96 PRO CB C 108 32.181 32.181 32.096 0.084 18522
2802 1 5 . 1 1 97 97 LYS N N 109 117.942 117.942 115.604 2.338 18522
2803 1 5 . 1 1 97 97 LYS HA H 109 4.143 4.143 3.969 0.174 18522
2804 1 5 . 1 1 97 97 LYS C C 109 178.099 178.099 179.296 -1.197 18522
2805 1 5 . 1 1 97 97 LYS CA C 109 58.167 58.167 59.127 -0.960 18522
2806 1 5 . 1 1 97 97 LYS CB C 109 31.649 31.649 31.393 0.256 18522
2807 1 5 . 1 1 97 97 LYS H H 109 8.335 8.335 7.711 0.624 18522
2808 1 5 . 1 1 98 98 GLN N N 110 119.159 119.159 118.472 0.687 18522
2809 1 5 . 1 1 98 98 GLN HA H 110 4.130 4.130 4.286 -0.156 18522
2810 1 5 . 1 1 98 98 GLN C C 110 178.298 178.298 178.223 0.075 18522
2811 1 5 . 1 1 98 98 GLN CA C 110 57.660 57.660 57.088 0.572 18522
2812 1 5 . 1 1 98 98 GLN CB C 110 28.720 28.720 28.449 0.271 18522
2813 1 5 . 1 1 98 98 GLN H H 110 7.985 7.985 8.153 -0.168 18522
2814 1 5 . 1 1 99 99 LEU N N 111 120.490 120.490 123.342 -2.852 18522
2815 1 5 . 1 1 99 99 LEU HA H 111 3.877 3.877 4.450 -0.573 18522
2816 1 5 . 1 1 99 99 LEU C C 111 177.729 177.729 178.822 -1.093 18522
2817 1 5 . 1 1 99 99 LEU CA C 111 57.049 57.049 58.347 -1.298 18522
2818 1 5 . 1 1 99 99 LEU CB C 111 41.466 41.466 41.737 -0.271 18522
2819 1 5 . 1 1 99 99 LEU H H 111 7.994 7.994 8.502 -0.508 18522
2820 1 5 . 1 1 100 100 GLU N N 112 118.251 118.251 117.117 1.134 18522
2821 1 5 . 1 1 100 100 GLU HA H 112 3.972 3.972 4.214 -0.242 18522
2822 1 5 . 1 1 100 100 GLU C C 112 178.402 178.402 177.914 0.488 18522
2823 1 5 . 1 1 100 100 GLU CA C 112 59.056 59.056 58.873 0.183 18522
2824 1 5 . 1 1 100 100 GLU CB C 112 29.732 29.732 29.233 0.499 18522
2825 1 5 . 1 1 100 100 GLU H H 112 7.760 7.760 7.733 0.027 18522
2826 1 5 . 1 1 101 101 VAL N N 113 117.229 117.229 117.834 -0.605 18522
2827 1 5 . 1 1 101 101 VAL HA H 113 3.762 3.762 3.837 -0.075 18522
2828 1 5 . 1 1 101 101 VAL C C 113 178.107 178.107 178.482 -0.375 18522
2829 1 5 . 1 1 101 101 VAL CA C 113 64.791 64.791 65.290 -0.499 18522
2830 1 5 . 1 1 101 101 VAL CB C 113 32.149 32.149 32.073 0.076 18522
2831 1 5 . 1 1 101 101 VAL H H 113 7.437 7.437 7.328 0.109 18522
2832 1 5 . 1 1 102 102 LEU N N 114 122.124 122.124 119.897 2.227 18522
2833 1 5 . 1 1 102 102 LEU HA H 114 4.033 4.033 4.219 -0.186 18522
2834 1 5 . 1 1 102 102 LEU C C 114 178.506 178.506 178.225 0.281 18522
2835 1 5 . 1 1 102 102 LEU CA C 114 57.243 57.243 57.255 -0.012 18522
2836 1 5 . 1 1 102 102 LEU CB C 114 42.028 42.028 41.973 0.055 18522
2837 1 5 . 1 1 102 102 LEU H H 114 7.765 7.765 8.378 -0.613 18522
2838 1 5 . 1 1 103 103 PHE N N 115 115.346 115.346 117.174 -1.828 18522
2839 1 5 . 1 1 103 103 PHE HA H 115 4.224 4.224 4.551 -0.327 18522
2840 1 5 . 1 1 103 103 PHE C C 115 175.621 175.621 175.448 0.173 18522
2841 1 5 . 1 1 103 103 PHE CA C 115 57.537 57.537 56.984 0.553 18522
2842 1 5 . 1 1 103 103 PHE CB C 115 38.057 38.057 39.282 -1.225 18522
2843 1 5 . 1 1 103 103 PHE H H 115 7.805 7.805 7.815 -0.010 18522
2844 1 5 . 1 1 104 104 GLN N N 116 119.021 119.021 119.540 -0.519 18522
2845 1 5 . 1 1 104 104 GLN HA H 116 4.407 4.407 4.269 0.138 18522
2846 1 5 . 1 1 104 104 GLN C C 116 176.402 176.402 175.813 0.589 18522
2847 1 5 . 1 1 104 104 GLN CA C 116 55.521 55.521 56.182 -0.661 18522
2848 1 5 . 1 1 104 104 GLN CB C 116 29.170 29.170 28.566 0.604 18522
2849 1 5 . 1 1 104 104 GLN H H 116 7.974 7.974 7.473 0.501 18522
2850 1 5 . 1 1 105 105 GLY N N 117 108.868 108.868 106.519 2.349 18522
2851 1 5 . 1 1 105 105 GLY CA C 117 45.124 45.124 44.967 0.157 18522
2852 1 5 . 1 1 105 105 GLY H H 117 8.195 8.195 7.436 0.759 18522
2853 1 5 . 1 1 106 106 PRO HA H 118 4.490 4.490 4.096 0.394 18522
2854 1 5 . 1 1 106 106 PRO C C 118 176.001 176.001 175.569 0.432 18522
2855 1 5 . 1 1 106 106 PRO CA C 118 63.523 63.523 63.535 -0.012 18522
2856 1 5 . 1 1 106 106 PRO CB C 118 32.078 32.078 31.657 0.421 18522
2857 1 5 . 1 1 107 107 GLN N N 119 126.950 126.950 124.324 2.626 18522
2858 1 5 . 1 1 107 107 GLN C C 119 181.211 181.211 175.437 5.774 18522
2859 1 5 . 1 1 107 107 GLN CA C 119 57.416 57.416 54.383 3.034 18522
2860 1 5 . 1 1 107 107 GLN H H 119 8.079 8.079 8.194 -0.115 18522
2861 1 5 . 1 1 111 111 ARG C C 123 174.608 174.608 174.679 -0.071 18522
2862 1 5 . 1 1 111 111 ARG CA C 123 55.099 55.099 55.017 0.082 18522
2863 1 5 . 1 1 112 112 HIS N N 124 122.212 122.212 119.721 2.491 18522
2864 1 5 . 1 1 112 112 HIS HA H 124 4.718 4.718 4.311 0.407 18522
2865 1 5 . 1 1 112 112 HIS C C 124 176.040 176.040 174.302 1.738 18522
2866 1 5 . 1 1 112 112 HIS CA C 124 54.213 54.213 56.564 -2.351 18522
2867 1 5 . 1 1 112 112 HIS CB C 124 31.164 31.164 29.651 1.514 18522
2868 1 5 . 1 1 112 112 HIS H H 124 7.640 7.640 8.804 -1.164 18522
2869 1 5 . 1 1 113 113 TRP C C 125 176.168 176.168 174.843 1.325 18522
2870 1 5 . 1 1 114 114 LEU N N 126 121.893 121.893 124.536 -2.643 18522
2871 1 5 . 1 1 114 114 LEU HA H 126 4.869 4.869 4.844 0.025 18522
2872 1 5 . 1 1 114 114 LEU CA C 126 54.151 54.151 53.382 0.769 18522
2873 1 5 . 1 1 114 114 LEU CB C 126 45.144 45.144 45.271 -0.127 18522
2874 1 5 . 1 1 114 114 LEU H H 126 8.606 8.606 8.335 0.271 18522
2875 1 5 . 1 1 115 115 LYS N N 127 125.850 125.850 120.376 5.474 18522
2876 1 5 . 1 1 115 115 LYS HA H 127 4.203 4.203 4.928 -0.725 18522
2877 1 5 . 1 1 115 115 LYS C C 127 175.564 175.564 174.312 1.252 18522
2878 1 5 . 1 1 115 115 LYS CA C 127 57.252 57.252 55.498 1.754 18522
2879 1 5 . 1 1 115 115 LYS CB C 127 33.406 33.406 34.733 -1.327 18522
2880 1 5 . 1 1 115 115 LYS H H 127 8.647 8.647 8.166 0.481 18522
2881 1 6 . 1 1 3 3 PRO C C 15 177.225 177.225 177.698 -0.473 18522
2882 1 6 . 1 1 3 3 PRO CA C 15 63.508 63.508 62.467 1.041 18522
2883 1 6 . 1 1 3 3 PRO CB C 15 32.090 32.090 30.593 1.497 18522
2884 1 6 . 1 1 4 4 GLY N N 16 108.829 108.829 110.607 -1.778 18522
2885 1 6 . 1 1 4 4 GLY C C 16 173.398 173.398 174.333 -0.935 18522
2886 1 6 . 1 1 4 4 GLY CA C 16 45.128 45.128 45.779 -0.651 18522
2887 1 6 . 1 1 4 4 GLY H H 16 8.489 8.489 8.289 0.200 18522
2888 1 6 . 1 1 5 5 ILE N N 17 121.763 121.763 118.662 3.101 18522
2889 1 6 . 1 1 5 5 ILE HA H 17 4.554 4.554 4.718 -0.164 18522
2890 1 6 . 1 1 5 5 ILE C C 17 174.332 174.332 174.076 0.256 18522
2891 1 6 . 1 1 5 5 ILE CA C 17 58.245 58.245 58.035 0.209 18522
2892 1 6 . 1 1 5 5 ILE CB C 17 38.762 38.762 38.535 0.227 18522
2893 1 6 . 1 1 5 5 ILE H H 17 8.014 8.014 7.874 0.140 18522
2894 1 6 . 1 1 6 6 PRO C C 18 176.437 176.437 176.469 -0.032 18522
2895 1 6 . 1 1 6 6 PRO CA C 18 62.667 62.667 64.760 -2.092 18522
2896 1 6 . 1 1 6 6 PRO CB C 18 32.469 32.469 32.059 0.410 18522
2897 1 6 . 1 1 7 7 VAL N N 19 123.849 123.849 114.501 9.348 18522
2898 1 6 . 1 1 7 7 VAL HA H 19 4.550 4.550 4.545 0.005 18522
2899 1 6 . 1 1 7 7 VAL C C 19 174.453 174.453 174.094 0.359 18522
2900 1 6 . 1 1 7 7 VAL CA C 19 59.846 59.846 57.840 2.006 18522
2901 1 6 . 1 1 7 7 VAL CB C 19 33.510 33.510 31.448 2.062 18522
2902 1 6 . 1 1 7 7 VAL H H 19 8.754 8.754 7.743 1.011 18522
2903 1 6 . 1 1 8 8 PRO HA H 20 5.338 5.338 4.443 0.895 18522
2904 1 6 . 1 1 8 8 PRO C C 20 177.585 177.585 176.708 0.877 18522
2905 1 6 . 1 1 8 8 PRO CA C 20 62.406 62.406 62.464 -0.058 18522
2906 1 6 . 1 1 8 8 PRO CB C 20 32.891 32.891 32.360 0.531 18522
2907 1 6 . 1 1 9 9 GLY N N 21 108.426 108.426 109.731 -1.305 18522
2908 1 6 . 1 1 9 9 GLY C C 21 171.443 171.443 171.447 -0.004 18522
2909 1 6 . 1 1 9 9 GLY CA C 21 44.581 44.581 44.736 -0.155 18522
2910 1 6 . 1 1 9 9 GLY H H 21 8.258 8.258 8.044 0.214 18522
2911 1 6 . 1 1 10 10 LYS N N 22 117.372 117.372 121.023 -3.651 18522
2912 1 6 . 1 1 10 10 LYS HA H 22 4.039 4.039 5.090 -1.051 18522
2913 1 6 . 1 1 10 10 LYS C C 22 174.463 174.463 174.635 -0.172 18522
2914 1 6 . 1 1 10 10 LYS CA C 22 55.263 55.263 55.226 0.037 18522
2915 1 6 . 1 1 10 10 LYS CB C 22 35.227 35.227 35.560 -0.333 18522
2916 1 6 . 1 1 10 10 LYS H H 22 8.175 8.175 8.016 0.159 18522
2917 1 6 . 1 1 11 11 VAL N N 23 120.387 120.387 118.857 1.530 18522
2918 1 6 . 1 1 11 11 VAL HA H 23 4.708 4.708 4.604 0.104 18522
2919 1 6 . 1 1 11 11 VAL C C 23 171.873 171.873 174.482 -2.609 18522
2920 1 6 . 1 1 11 11 VAL CA C 23 59.866 59.866 60.477 -0.611 18522
2921 1 6 . 1 1 11 11 VAL CB C 23 35.269 35.269 35.656 -0.387 18522
2922 1 6 . 1 1 11 11 VAL H H 23 8.862 8.862 8.375 0.487 18522
2923 1 6 . 1 1 12 12 THR N N 24 125.797 125.797 119.705 6.092 18522
2924 1 6 . 1 1 12 12 THR HA H 24 5.121 5.121 4.790 0.331 18522
2925 1 6 . 1 1 12 12 THR C C 24 173.407 173.407 174.006 -0.599 18522
2926 1 6 . 1 1 12 12 THR CA C 24 62.115 62.115 60.944 1.171 18522
2927 1 6 . 1 1 12 12 THR CB C 24 69.606 69.606 68.875 0.731 18522
2928 1 6 . 1 1 12 12 THR H H 24 8.859 8.859 8.344 0.515 18522
2929 1 6 . 1 1 13 13 LEU N N 25 127.960 127.960 127.366 0.594 18522
2930 1 6 . 1 1 13 13 LEU HA H 25 4.809 4.809 4.861 -0.052 18522
2931 1 6 . 1 1 13 13 LEU C C 25 175.029 175.029 174.882 0.147 18522
2932 1 6 . 1 1 13 13 LEU CA C 25 52.623 52.623 52.959 -0.336 18522
2933 1 6 . 1 1 13 13 LEU CB C 25 46.242 46.242 45.503 0.739 18522
2934 1 6 . 1 1 13 13 LEU H H 25 9.258 9.258 7.931 1.327 18522
2935 1 6 . 1 1 14 14 GLN N N 26 120.858 120.858 117.679 3.179 18522
2936 1 6 . 1 1 14 14 GLN HA H 26 4.482 4.482 4.484 -0.002 18522
2937 1 6 . 1 1 14 14 GLN C C 26 174.515 174.515 174.806 -0.291 18522
2938 1 6 . 1 1 14 14 GLN CA C 26 54.576 54.576 54.003 0.573 18522
2939 1 6 . 1 1 14 14 GLN CB C 26 29.516 29.516 32.025 -2.509 18522
2940 1 6 . 1 1 14 14 GLN H H 26 8.530 8.530 8.299 0.231 18522
2941 1 6 . 1 1 15 15 LYS N N 27 119.583 119.583 122.928 -3.345 18522
2942 1 6 . 1 1 15 15 LYS HA H 27 4.180 4.180 4.222 -0.042 18522
2943 1 6 . 1 1 15 15 LYS C C 27 177.468 177.468 176.956 0.512 18522
2944 1 6 . 1 1 15 15 LYS CA C 27 55.956 55.956 57.549 -1.593 18522
2945 1 6 . 1 1 15 15 LYS CB C 27 34.099 34.099 32.395 1.704 18522
2946 1 6 . 1 1 15 15 LYS H H 27 8.099 8.099 8.534 -0.435 18522
2947 1 6 . 1 1 16 16 ASP N N 28 121.439 121.439 122.305 -0.866 18522
2948 1 6 . 1 1 16 16 ASP HA H 28 4.590 4.590 4.656 -0.066 18522
2949 1 6 . 1 1 16 16 ASP C C 28 178.392 178.392 177.991 0.401 18522
2950 1 6 . 1 1 16 16 ASP CA C 28 52.426 52.426 53.853 -1.427 18522
2951 1 6 . 1 1 16 16 ASP CB C 28 41.377 41.377 42.490 -1.113 18522
2952 1 6 . 1 1 16 16 ASP H H 28 8.888 8.888 8.567 0.321 18522
2953 1 6 . 1 1 17 17 ALA N N 29 119.578 119.578 123.614 -4.036 18522
2954 1 6 . 1 1 17 17 ALA HA H 29 4.188 4.188 4.111 0.077 18522
2955 1 6 . 1 1 17 17 ALA C C 29 178.763 178.763 178.632 0.131 18522
2956 1 6 . 1 1 17 17 ALA CA C 29 54.434 54.434 54.490 -0.056 18522
2957 1 6 . 1 1 17 17 ALA CB C 29 18.293 18.293 18.631 -0.338 18522
2958 1 6 . 1 1 17 17 ALA H H 29 8.392 8.392 8.607 -0.215 18522
2959 1 6 . 1 1 18 18 GLN N N 30 117.564 117.564 116.545 1.019 18522
2960 1 6 . 1 1 18 18 GLN HA H 30 4.399 4.399 4.290 0.109 18522
2961 1 6 . 1 1 18 18 GLN C C 30 175.168 175.168 175.419 -0.251 18522
2962 1 6 . 1 1 18 18 GLN CA C 30 55.339 55.339 55.265 0.074 18522
2963 1 6 . 1 1 18 18 GLN CB C 30 28.589 28.589 29.291 -0.702 18522
2964 1 6 . 1 1 18 18 GLN H H 30 8.353 8.353 7.787 0.566 18522
2965 1 6 . 1 1 19 19 ASN N N 31 115.365 115.365 116.125 -0.760 18522
2966 1 6 . 1 1 19 19 ASN HA H 31 4.315 4.315 4.437 -0.122 18522
2967 1 6 . 1 1 19 19 ASN C C 31 174.043 174.043 173.053 0.990 18522
2968 1 6 . 1 1 19 19 ASN CA C 31 54.303 54.303 54.365 -0.062 18522
2969 1 6 . 1 1 19 19 ASN CB C 31 37.610 37.610 37.532 0.078 18522
2970 1 6 . 1 1 19 19 ASN H H 31 8.521 8.521 8.233 0.288 18522
2971 1 6 . 1 1 20 20 LEU N N 32 118.660 118.660 111.104 7.556 18522
2972 1 6 . 1 1 20 20 LEU HA H 32 4.900 4.900 4.848 0.052 18522
2973 1 6 . 1 1 20 20 LEU C C 32 178.117 178.117 176.384 1.733 18522
2974 1 6 . 1 1 20 20 LEU CA C 32 53.957 53.957 52.328 1.629 18522
2975 1 6 . 1 1 20 20 LEU CB C 32 44.774 44.774 44.661 0.113 18522
2976 1 6 . 1 1 20 20 LEU H H 32 8.155 8.155 7.356 0.799 18522
2977 1 6 . 1 1 21 21 ILE N N 33 116.785 116.785 116.449 0.336 18522
2978 1 6 . 1 1 21 21 ILE HA H 33 4.674 4.674 4.366 0.308 18522
2979 1 6 . 1 1 21 21 ILE C C 33 176.185 176.185 176.295 -0.110 18522
2980 1 6 . 1 1 21 21 ILE CA C 33 62.602 62.602 61.201 1.401 18522
2981 1 6 . 1 1 21 21 ILE CB C 33 39.016 39.016 39.265 -0.249 18522
2982 1 6 . 1 1 21 21 ILE H H 33 11.488 11.488 8.336 3.152 18522
2983 1 6 . 1 1 22 22 GLY N N 34 111.234 111.234 108.563 2.671 18522
2984 1 6 . 1 1 22 22 GLY C C 34 173.993 173.993 173.671 0.322 18522
2985 1 6 . 1 1 22 22 GLY CA C 34 45.980 45.980 45.199 0.781 18522
2986 1 6 . 1 1 22 22 GLY H H 34 9.854 9.854 8.047 1.807 18522
2987 1 6 . 1 1 23 23 ILE N N 35 111.117 111.117 113.481 -2.364 18522
2988 1 6 . 1 1 23 23 ILE HA H 35 5.535 5.535 5.595 -0.060 18522
2989 1 6 . 1 1 23 23 ILE C C 35 175.033 175.033 174.057 0.976 18522
2990 1 6 . 1 1 23 23 ILE CA C 35 58.415 58.415 58.088 0.327 18522
2991 1 6 . 1 1 23 23 ILE CB C 35 41.577 41.577 41.801 -0.224 18522
2992 1 6 . 1 1 23 23 ILE H H 35 7.835 7.835 8.409 -0.574 18522
2993 1 6 . 1 1 24 24 SER N N 36 114.908 114.908 115.191 -0.283 18522
2994 1 6 . 1 1 24 24 SER HA H 36 4.232 4.232 5.201 -0.969 18522
2995 1 6 . 1 1 24 24 SER C C 36 174.735 174.735 173.042 1.693 18522
2996 1 6 . 1 1 24 24 SER CA C 36 56.121 56.121 57.602 -1.481 18522
2997 1 6 . 1 1 24 24 SER CB C 36 66.097 66.097 65.773 0.324 18522
2998 1 6 . 1 1 24 24 SER H H 36 8.623 8.623 8.424 0.199 18522
2999 1 6 . 1 1 25 25 ILE N N 37 117.739 117.739 125.563 -7.824 18522
3000 1 6 . 1 1 25 25 ILE C C 37 174.340 174.340 175.020 -0.680 18522
3001 1 6 . 1 1 25 25 ILE CA C 37 59.123 59.123 60.383 -1.260 18522
3002 1 6 . 1 1 25 25 ILE CB C 37 41.637 41.637 39.651 1.986 18522
3003 1 6 . 1 1 25 25 ILE H H 37 9.130 9.130 8.703 0.427 18522
3004 1 6 . 1 1 26 26 GLY N N 38 108.069 108.069 115.309 -7.240 18522
3005 1 6 . 1 1 26 26 GLY CA C 38 44.112 44.112 43.783 0.329 18522
3006 1 6 . 1 1 26 26 GLY H H 38 8.841 8.841 8.908 -0.067 18522
3007 1 6 . 1 1 27 27 GLY N N 39 109.016 109.016 109.396 -0.380 18522
3008 1 6 . 1 1 27 27 GLY C C 39 173.956 173.956 173.429 0.527 18522
3009 1 6 . 1 1 27 27 GLY H H 39 8.187 8.187 7.651 0.536 18522
3010 1 6 . 1 1 28 28 GLY N N 40 111.783 111.783 106.417 5.366 18522
3011 1 6 . 1 1 28 28 GLY C C 40 174.255 174.255 172.970 1.285 18522
3012 1 6 . 1 1 28 28 GLY CA C 40 47.098 47.098 44.825 2.273 18522
3013 1 6 . 1 1 28 28 GLY H H 40 8.275 8.275 7.825 0.450 18522
3014 1 6 . 1 1 29 29 ALA N N 41 123.128 123.128 118.818 4.310 18522
3015 1 6 . 1 1 29 29 ALA HA H 41 4.559 4.559 4.924 -0.365 18522
3016 1 6 . 1 1 29 29 ALA CA C 41 51.073 51.073 52.976 -1.903 18522
3017 1 6 . 1 1 29 29 ALA CB C 41 21.926 21.926 19.091 2.835 18522
3018 1 6 . 1 1 29 29 ALA H H 41 8.012 8.012 8.020 -0.008 18522
3019 1 6 . 1 1 31 31 TYR HA H 43 4.549 4.549 4.679 -0.130 18522
3020 1 6 . 1 1 31 31 TYR CA C 43 57.147 57.147 59.868 -2.721 18522
3021 1 6 . 1 1 31 31 TYR CB C 43 37.495 37.495 39.369 -1.874 18522
3022 1 6 . 1 1 32 32 CYS N N 44 119.332 119.332 112.956 6.376 18522
3023 1 6 . 1 1 32 32 CYS HA H 44 4.859 4.859 4.814 0.045 18522
3024 1 6 . 1 1 32 32 CYS CA C 44 57.406 57.406 55.780 1.626 18522
3025 1 6 . 1 1 32 32 CYS CB C 44 27.673 27.673 29.182 -1.509 18522
3026 1 6 . 1 1 32 32 CYS H H 44 7.504 7.504 8.042 -0.538 18522
3027 1 6 . 1 1 33 33 PRO HA H 45 4.413 4.413 4.500 -0.087 18522
3028 1 6 . 1 1 33 33 PRO CA C 45 64.885 64.885 64.395 0.490 18522
3029 1 6 . 1 1 33 33 PRO CB C 45 32.318 32.318 32.035 0.283 18522
3030 1 6 . 1 1 34 34 CYS N N 46 117.327 117.327 117.198 0.129 18522
3031 1 6 . 1 1 34 34 CYS C C 46 172.064 172.064 174.097 -2.033 18522
3032 1 6 . 1 1 34 34 CYS CA C 46 60.066 60.066 60.292 -0.226 18522
3033 1 6 . 1 1 34 34 CYS CB C 46 28.715 28.715 27.981 0.734 18522
3034 1 6 . 1 1 34 34 CYS H H 46 7.973 7.973 8.498 -0.525 18522
3035 1 6 . 1 1 35 35 LEU N N 47 124.270 124.270 122.278 1.992 18522
3036 1 6 . 1 1 35 35 LEU HA H 47 4.928 4.928 4.604 0.324 18522
3037 1 6 . 1 1 35 35 LEU C C 47 175.076 175.076 175.555 -0.479 18522
3038 1 6 . 1 1 35 35 LEU CA C 47 53.278 53.278 55.081 -1.803 18522
3039 1 6 . 1 1 35 35 LEU CB C 47 44.321 44.321 43.557 0.764 18522
3040 1 6 . 1 1 35 35 LEU H H 47 8.629 8.629 8.198 0.431 18522
3041 1 6 . 1 1 36 36 TYR N N 48 119.326 119.326 112.528 6.798 18522
3042 1 6 . 1 1 36 36 TYR HA H 48 5.255 5.255 4.948 0.307 18522
3043 1 6 . 1 1 36 36 TYR C C 48 175.766 175.766 173.635 2.131 18522
3044 1 6 . 1 1 36 36 TYR CA C 48 56.696 56.696 55.942 0.754 18522
3045 1 6 . 1 1 36 36 TYR CB C 48 42.590 42.590 40.524 2.066 18522
3046 1 6 . 1 1 36 36 TYR H H 48 8.761 8.761 7.593 1.168 18522
3047 1 6 . 1 1 37 37 ILE N N 49 120.259 120.259 122.362 -2.103 18522
3048 1 6 . 1 1 37 37 ILE HA H 49 4.215 4.215 4.476 -0.261 18522
3049 1 6 . 1 1 37 37 ILE C C 49 177.429 177.429 176.280 1.149 18522
3050 1 6 . 1 1 37 37 ILE CA C 49 62.456 62.456 60.651 1.805 18522
3051 1 6 . 1 1 37 37 ILE CB C 49 37.352 37.352 38.877 -1.525 18522
3052 1 6 . 1 1 37 37 ILE H H 49 8.959 8.959 9.000 -0.041 18522
3053 1 6 . 1 1 38 38 VAL HA H 50 3.937 3.937 4.289 -0.352 18522
3054 1 6 . 1 1 38 38 VAL C C 50 174.408 174.408 175.121 -0.713 18522
3055 1 6 . 1 1 38 38 VAL CA C 50 62.259 62.259 62.289 -0.030 18522
3056 1 6 . 1 1 38 38 VAL CB C 50 31.584 31.584 32.259 -0.675 18522
3057 1 6 . 1 1 39 39 GLN N N 51 116.821 116.821 118.916 -2.095 18522
3058 1 6 . 1 1 39 39 GLN HA H 51 4.103 4.103 4.424 -0.321 18522
3059 1 6 . 1 1 39 39 GLN C C 51 172.856 172.856 173.049 -0.193 18522
3060 1 6 . 1 1 39 39 GLN CA C 51 55.127 55.127 55.248 -0.121 18522
3061 1 6 . 1 1 39 39 GLN CB C 51 32.376 32.376 32.460 -0.084 18522
3062 1 6 . 1 1 39 39 GLN H H 51 6.967 6.967 7.494 -0.527 18522
3063 1 6 . 1 1 40 40 VAL N N 52 123.482 123.482 122.253 1.229 18522
3064 1 6 . 1 1 40 40 VAL HA H 52 4.277 4.277 4.986 -0.709 18522
3065 1 6 . 1 1 40 40 VAL C C 52 176.198 176.198 174.525 1.673 18522
3066 1 6 . 1 1 40 40 VAL CA C 52 61.574 61.574 59.635 1.939 18522
3067 1 6 . 1 1 40 40 VAL CB C 52 32.875 32.875 34.749 -1.874 18522
3068 1 6 . 1 1 40 40 VAL H H 52 8.447 8.447 8.130 0.317 18522
3069 1 6 . 1 1 41 41 PHE N N 53 128.296 128.296 124.054 4.242 18522
3070 1 6 . 1 1 41 41 PHE HA H 53 4.400 4.400 4.706 -0.306 18522
3071 1 6 . 1 1 41 41 PHE C C 53 175.299 175.299 175.020 0.279 18522
3072 1 6 . 1 1 41 41 PHE CA C 53 58.494 58.494 58.431 0.063 18522
3073 1 6 . 1 1 41 41 PHE CB C 53 39.561 39.561 39.730 -0.169 18522
3074 1 6 . 1 1 41 41 PHE H H 53 8.707 8.707 8.564 0.143 18522
3075 1 6 . 1 1 42 42 ASP N N 54 122.696 122.696 116.414 6.282 18522
3076 1 6 . 1 1 42 42 ASP HA H 54 4.272 4.272 4.677 -0.405 18522
3077 1 6 . 1 1 42 42 ASP C C 54 176.837 176.837 175.744 1.093 18522
3078 1 6 . 1 1 42 42 ASP CA C 54 55.291 55.291 55.065 0.226 18522
3079 1 6 . 1 1 42 42 ASP CB C 54 41.093 41.093 42.465 -1.372 18522
3080 1 6 . 1 1 42 42 ASP H H 54 8.901 8.901 8.447 0.454 18522
3081 1 6 . 1 1 43 43 ASN N N 55 113.923 113.923 117.597 -3.674 18522
3082 1 6 . 1 1 43 43 ASN HA H 55 4.258 4.258 4.813 -0.555 18522
3083 1 6 . 1 1 43 43 ASN C C 55 173.714 173.714 174.722 -1.008 18522
3084 1 6 . 1 1 43 43 ASN CA C 55 54.958 54.958 53.439 1.519 18522
3085 1 6 . 1 1 43 43 ASN CB C 55 37.150 37.150 39.360 -2.210 18522
3086 1 6 . 1 1 43 43 ASN H H 55 9.319 9.319 8.311 1.008 18522
3087 1 6 . 1 1 44 44 THR N N 56 108.020 108.020 111.403 -3.383 18522
3088 1 6 . 1 1 44 44 THR HA H 56 5.377 5.377 4.709 0.668 18522
3089 1 6 . 1 1 44 44 THR CA C 56 59.712 59.712 59.648 0.064 18522
3090 1 6 . 1 1 44 44 THR CB C 56 69.529 69.529 69.686 -0.157 18522
3091 1 6 . 1 1 44 44 THR H H 56 7.149 7.149 7.532 -0.383 18522
3092 1 6 . 1 1 45 45 PRO HA H 57 4.304 4.304 4.092 0.212 18522
3093 1 6 . 1 1 45 45 PRO C C 57 180.141 180.141 177.946 2.195 18522
3094 1 6 . 1 1 45 45 PRO CA C 57 66.090 66.090 65.738 0.352 18522
3095 1 6 . 1 1 45 45 PRO CB C 57 33.194 33.194 31.503 1.691 18522
3096 1 6 . 1 1 46 46 ALA N N 58 116.854 116.854 119.252 -2.398 18522
3097 1 6 . 1 1 46 46 ALA HA H 58 4.035 4.035 4.011 0.024 18522
3098 1 6 . 1 1 46 46 ALA C C 58 180.647 180.647 179.385 1.262 18522
3099 1 6 . 1 1 46 46 ALA CA C 58 55.195 55.195 55.156 0.039 18522
3100 1 6 . 1 1 46 46 ALA CB C 58 18.880 18.880 18.141 0.739 18522
3101 1 6 . 1 1 46 46 ALA H H 58 8.938 8.938 7.776 1.162 18522
3102 1 6 . 1 1 47 47 ALA N N 59 123.250 123.250 120.848 2.402 18522
3103 1 6 . 1 1 47 47 ALA HA H 59 4.030 4.030 4.079 -0.049 18522
3104 1 6 . 1 1 47 47 ALA C C 59 179.852 179.852 179.750 0.102 18522
3105 1 6 . 1 1 47 47 ALA CA C 59 54.939 54.939 54.665 0.274 18522
3106 1 6 . 1 1 47 47 ALA CB C 59 19.688 19.688 18.780 0.908 18522
3107 1 6 . 1 1 47 47 ALA H H 59 7.658 7.658 7.349 0.309 18522
3108 1 6 . 1 1 48 48 LEU N N 60 118.654 118.654 118.620 0.034 18522
3109 1 6 . 1 1 48 48 LEU HA H 60 4.026 4.026 4.150 -0.124 18522
3110 1 6 . 1 1 48 48 LEU C C 60 179.238 179.238 178.133 1.105 18522
3111 1 6 . 1 1 48 48 LEU CA C 60 57.261 57.261 57.871 -0.610 18522
3112 1 6 . 1 1 48 48 LEU CB C 60 41.445 41.445 41.602 -0.157 18522
3113 1 6 . 1 1 48 48 LEU H H 60 8.636 8.636 8.423 0.213 18522
3114 1 6 . 1 1 49 49 ASP N N 61 117.382 117.382 118.947 -1.565 18522
3115 1 6 . 1 1 49 49 ASP HA H 61 4.421 4.421 4.606 -0.185 18522
3116 1 6 . 1 1 49 49 ASP C C 61 177.668 177.668 177.553 0.115 18522
3117 1 6 . 1 1 49 49 ASP CA C 61 57.087 57.087 54.705 2.382 18522
3118 1 6 . 1 1 49 49 ASP CB C 61 44.478 44.478 41.792 2.686 18522
3119 1 6 . 1 1 49 49 ASP H H 61 7.665 7.665 7.694 -0.029 18522
3120 1 6 . 1 1 50 50 GLY N N 62 103.228 103.228 107.974 -4.746 18522
3121 1 6 . 1 1 50 50 GLY C C 62 174.776 174.776 175.044 -0.268 18522
3122 1 6 . 1 1 50 50 GLY CA C 62 46.533 46.533 45.933 0.600 18522
3123 1 6 . 1 1 50 50 GLY H H 62 7.216 7.216 7.941 -0.725 18522
3124 1 6 . 1 1 51 51 THR N N 63 117.230 117.230 110.248 6.982 18522
3125 1 6 . 1 1 51 51 THR HA H 63 3.907 3.907 3.791 0.116 18522
3126 1 6 . 1 1 51 51 THR C C 63 175.961 175.961 174.814 1.147 18522
3127 1 6 . 1 1 51 51 THR CA C 63 66.478 66.478 63.120 3.358 18522
3128 1 6 . 1 1 51 51 THR CB C 63 68.268 68.268 67.612 0.655 18522
3129 1 6 . 1 1 51 51 THR H H 63 8.319 8.319 7.749 0.570 18522
3130 1 6 . 1 1 52 52 VAL N N 64 113.826 113.826 116.505 -2.679 18522
3131 1 6 . 1 1 52 52 VAL HA H 64 3.950 3.950 4.082 -0.132 18522
3132 1 6 . 1 1 52 52 VAL C C 64 173.883 173.883 174.711 -0.828 18522
3133 1 6 . 1 1 52 52 VAL CA C 64 60.708 60.708 60.719 -0.012 18522
3134 1 6 . 1 1 52 52 VAL CB C 64 33.079 33.079 30.496 2.583 18522
3135 1 6 . 1 1 52 52 VAL H H 64 8.147 8.147 7.226 0.921 18522
3136 1 6 . 1 1 53 53 ALA N N 65 123.521 123.521 123.705 -0.184 18522
3137 1 6 . 1 1 53 53 ALA HA H 65 4.414 4.414 4.521 -0.107 18522
3138 1 6 . 1 1 53 53 ALA C C 65 175.247 175.247 176.692 -1.445 18522
3139 1 6 . 1 1 53 53 ALA CA C 65 50.440 50.440 50.352 0.088 18522
3140 1 6 . 1 1 53 53 ALA CB C 65 23.266 23.266 20.613 2.653 18522
3141 1 6 . 1 1 53 53 ALA H H 65 8.633 8.633 7.213 1.420 18522
3142 1 6 . 1 1 54 54 ALA N N 66 120.818 120.818 123.002 -2.184 18522
3143 1 6 . 1 1 54 54 ALA HA H 66 3.720 3.720 4.116 -0.396 18522
3144 1 6 . 1 1 54 54 ALA C C 66 178.411 178.411 178.586 -0.175 18522
3145 1 6 . 1 1 54 54 ALA CA C 66 53.016 53.016 53.279 -0.263 18522
3146 1 6 . 1 1 54 54 ALA CB C 66 17.840 17.840 18.000 -0.160 18522
3147 1 6 . 1 1 54 54 ALA H H 66 8.451 8.451 8.415 0.036 18522
3148 1 6 . 1 1 55 55 GLY N N 67 112.260 112.260 113.742 -1.482 18522
3149 1 6 . 1 1 55 55 GLY C C 67 173.296 173.296 174.063 -0.767 18522
3150 1 6 . 1 1 55 55 GLY CA C 67 45.025 45.025 44.642 0.383 18522
3151 1 6 . 1 1 55 55 GLY H H 67 9.600 9.600 9.283 0.317 18522
3152 1 6 . 1 1 56 56 ASP N N 68 121.293 121.293 122.247 -0.954 18522
3153 1 6 . 1 1 56 56 ASP HA H 68 4.861 4.861 4.839 0.022 18522
3154 1 6 . 1 1 56 56 ASP C C 68 174.937 174.937 174.386 0.551 18522
3155 1 6 . 1 1 56 56 ASP CA C 68 55.641 55.641 54.360 1.281 18522
3156 1 6 . 1 1 56 56 ASP CB C 68 40.696 40.696 42.477 -1.781 18522
3157 1 6 . 1 1 56 56 ASP H H 68 8.043 8.043 7.727 0.316 18522
3158 1 6 . 1 1 57 57 GLU N N 69 122.814 122.814 122.738 0.076 18522
3159 1 6 . 1 1 57 57 GLU C C 69 177.202 177.202 175.480 1.722 18522
3160 1 6 . 1 1 57 57 GLU CA C 69 54.472 54.472 55.657 -1.185 18522
3161 1 6 . 1 1 57 57 GLU CB C 69 32.800 32.800 31.057 1.743 18522
3162 1 6 . 1 1 57 57 GLU H H 69 8.455 8.455 8.499 -0.044 18522
3163 1 6 . 1 1 58 58 ILE N N 70 125.862 125.862 127.355 -1.493 18522
3164 1 6 . 1 1 58 58 ILE HA H 70 4.526 4.526 4.570 -0.044 18522
3165 1 6 . 1 1 58 58 ILE C C 70 175.035 175.035 176.220 -1.185 18522
3166 1 6 . 1 1 58 58 ILE CA C 70 60.918 60.918 60.100 0.818 18522
3167 1 6 . 1 1 58 58 ILE CB C 70 39.236 39.236 36.757 2.479 18522
3168 1 6 . 1 1 58 58 ILE H H 70 8.619 8.619 8.413 0.206 18522
3169 1 6 . 1 1 59 59 THR N N 71 115.507 115.507 122.789 -7.282 18522
3170 1 6 . 1 1 59 59 THR HA H 71 4.513 4.513 4.609 -0.096 18522
3171 1 6 . 1 1 59 59 THR C C 71 176.425 176.425 174.234 2.191 18522
3172 1 6 . 1 1 59 59 THR CA C 71 61.158 61.158 61.800 -0.642 18522
3173 1 6 . 1 1 59 59 THR CB C 71 69.604 69.604 70.548 -0.944 18522
3174 1 6 . 1 1 59 59 THR H H 71 9.242 9.242 9.226 0.016 18522
3175 1 6 . 1 1 60 60 GLY N N 72 111.789 111.789 108.181 3.608 18522
3176 1 6 . 1 1 60 60 GLY C C 72 170.981 170.981 171.266 -0.285 18522
3177 1 6 . 1 1 60 60 GLY CA C 72 46.554 46.554 45.541 1.013 18522
3178 1 6 . 1 1 60 60 GLY H H 72 7.883 7.883 7.725 0.158 18522
3179 1 6 . 1 1 61 61 VAL N N 73 119.277 119.277 120.415 -1.138 18522
3180 1 6 . 1 1 61 61 VAL C C 73 175.951 175.951 175.586 0.365 18522
3181 1 6 . 1 1 61 61 VAL CA C 73 60.982 60.982 59.036 1.946 18522
3182 1 6 . 1 1 61 61 VAL CB C 73 36.197 36.197 34.678 1.519 18522
3183 1 6 . 1 1 61 61 VAL H H 73 8.424 8.424 8.734 -0.310 18522
3184 1 6 . 1 1 62 62 ASN N N 74 127.731 127.731 126.858 0.873 18522
3185 1 6 . 1 1 62 62 ASN HA H 74 4.520 4.520 4.338 0.182 18522
3186 1 6 . 1 1 62 62 ASN C C 74 174.878 174.878 175.005 -0.127 18522
3187 1 6 . 1 1 62 62 ASN CA C 74 54.418 54.418 54.684 -0.266 18522
3188 1 6 . 1 1 62 62 ASN CB C 74 36.655 36.655 38.188 -1.533 18522
3189 1 6 . 1 1 62 62 ASN H H 74 10.384 10.384 9.552 0.832 18522
3190 1 6 . 1 1 63 63 GLY N N 75 104.633 104.633 103.406 1.227 18522
3191 1 6 . 1 1 63 63 GLY C C 75 173.610 173.610 173.412 0.198 18522
3192 1 6 . 1 1 63 63 GLY CA C 75 45.261 45.261 44.841 0.420 18522
3193 1 6 . 1 1 63 63 GLY H H 75 8.926 8.926 8.277 0.649 18522
3194 1 6 . 1 1 64 64 ARG N N 76 120.451 120.451 121.921 -1.470 18522
3195 1 6 . 1 1 64 64 ARG HA H 76 4.501 4.501 4.664 -0.163 18522
3196 1 6 . 1 1 64 64 ARG C C 76 175.085 175.085 175.665 -0.580 18522
3197 1 6 . 1 1 64 64 ARG CA C 76 54.252 54.252 54.428 -0.176 18522
3198 1 6 . 1 1 64 64 ARG CB C 76 31.482 31.482 31.261 0.221 18522
3199 1 6 . 1 1 64 64 ARG H H 76 7.753 7.753 7.987 -0.234 18522
3200 1 6 . 1 1 65 65 SER N N 77 116.586 116.586 119.865 -3.279 18522
3201 1 6 . 1 1 65 65 SER HA H 77 4.483 4.483 4.567 -0.084 18522
3202 1 6 . 1 1 65 65 SER C C 77 176.953 176.953 175.075 1.878 18522
3203 1 6 . 1 1 65 65 SER CA C 77 58.292 58.292 58.578 -0.286 18522
3204 1 6 . 1 1 65 65 SER CB C 77 63.643 63.643 63.659 -0.016 18522
3205 1 6 . 1 1 65 65 SER H H 77 8.555 8.555 8.850 -0.295 18522
3206 1 6 . 1 1 66 66 ILE N N 78 116.618 116.618 116.832 -0.214 18522
3207 1 6 . 1 1 66 66 ILE HA H 78 4.420 4.420 4.320 0.100 18522
3208 1 6 . 1 1 66 66 ILE C C 78 175.072 175.072 176.230 -1.158 18522
3209 1 6 . 1 1 66 66 ILE CA C 78 59.122 59.122 61.119 -1.997 18522
3210 1 6 . 1 1 66 66 ILE CB C 78 36.758 36.758 38.159 -1.401 18522
3211 1 6 . 1 1 66 66 ILE H H 78 7.599 7.599 7.813 -0.214 18522
3212 1 6 . 1 1 67 67 LYS N N 79 123.287 123.287 122.915 0.372 18522
3213 1 6 . 1 1 67 67 LYS HA H 79 4.049 4.049 4.108 -0.059 18522
3214 1 6 . 1 1 67 67 LYS C C 79 178.333 178.333 176.653 1.680 18522
3215 1 6 . 1 1 67 67 LYS CA C 79 58.321 58.321 57.453 0.868 18522
3216 1 6 . 1 1 67 67 LYS CB C 79 31.635 31.635 31.194 0.441 18522
3217 1 6 . 1 1 67 67 LYS H H 79 7.898 7.898 8.184 -0.286 18522
3218 1 6 . 1 1 68 68 GLY N N 80 114.933 114.933 114.801 0.132 18522
3219 1 6 . 1 1 68 68 GLY C C 80 174.385 174.385 173.983 0.402 18522
3220 1 6 . 1 1 68 68 GLY CA C 80 45.518 45.518 45.160 0.358 18522
3221 1 6 . 1 1 68 68 GLY H H 80 8.999 8.999 8.387 0.612 18522
3222 1 6 . 1 1 69 69 LYS N N 81 119.403 119.403 121.785 -2.382 18522
3223 1 6 . 1 1 69 69 LYS HA H 81 4.043 4.043 4.653 -0.610 18522
3224 1 6 . 1 1 69 69 LYS C C 81 177.064 177.064 175.213 1.851 18522
3225 1 6 . 1 1 69 69 LYS CA C 81 54.722 54.722 55.319 -0.597 18522
3226 1 6 . 1 1 69 69 LYS CB C 81 33.560 33.560 33.468 0.092 18522
3227 1 6 . 1 1 69 69 LYS H H 81 7.845 7.845 8.130 -0.285 18522
3228 1 6 . 1 1 70 70 THR N N 82 112.066 112.066 116.753 -4.687 18522
3229 1 6 . 1 1 70 70 THR HA H 82 4.666 4.666 4.629 0.037 18522
3230 1 6 . 1 1 70 70 THR C C 82 175.955 175.955 175.233 0.722 18522
3231 1 6 . 1 1 70 70 THR CA C 82 60.438 60.438 60.492 -0.054 18522
3232 1 6 . 1 1 70 70 THR CB C 82 71.629 71.629 72.246 -0.617 18522
3233 1 6 . 1 1 70 70 THR H H 82 9.153 9.153 7.985 1.168 18522
3234 1 6 . 1 1 71 71 LYS N N 83 118.730 118.730 125.778 -7.048 18522
3235 1 6 . 1 1 71 71 LYS HA H 83 3.870 3.870 3.935 -0.065 18522
3236 1 6 . 1 1 71 71 LYS C C 83 177.464 177.464 178.538 -1.074 18522
3237 1 6 . 1 1 71 71 LYS CA C 83 60.357 60.357 59.425 0.931 18522
3238 1 6 . 1 1 71 71 LYS CB C 83 31.350 31.350 31.626 -0.276 18522
3239 1 6 . 1 1 71 71 LYS H H 83 8.969 8.969 8.864 0.105 18522
3240 1 6 . 1 1 72 72 VAL N N 84 117.444 117.444 119.267 -1.823 18522
3241 1 6 . 1 1 72 72 VAL HA H 84 3.633 3.633 3.695 -0.062 18522
3242 1 6 . 1 1 72 72 VAL C C 84 178.315 178.315 177.294 1.021 18522
3243 1 6 . 1 1 72 72 VAL CA C 84 66.079 66.079 65.953 0.126 18522
3244 1 6 . 1 1 72 72 VAL CB C 84 32.091 32.091 31.683 0.408 18522
3245 1 6 . 1 1 72 72 VAL H H 84 7.631 7.631 8.275 -0.644 18522
3246 1 6 . 1 1 73 73 GLU N N 85 120.890 120.890 119.238 1.652 18522
3247 1 6 . 1 1 73 73 GLU HA H 85 3.964 3.964 4.086 -0.122 18522
3248 1 6 . 1 1 73 73 GLU C C 85 179.971 179.971 178.928 1.043 18522
3249 1 6 . 1 1 73 73 GLU CA C 85 59.316 59.316 59.545 -0.229 18522
3250 1 6 . 1 1 73 73 GLU CB C 85 30.355 30.355 29.456 0.899 18522
3251 1 6 . 1 1 73 73 GLU H H 85 7.617 7.617 7.495 0.122 18522
3252 1 6 . 1 1 74 74 VAL N N 86 121.246 121.246 118.104 3.142 18522
3253 1 6 . 1 1 74 74 VAL HA H 86 3.630 3.630 3.725 -0.095 18522
3254 1 6 . 1 1 74 74 VAL C C 86 177.217 177.217 177.889 -0.672 18522
3255 1 6 . 1 1 74 74 VAL CA C 86 66.678 66.678 65.888 0.791 18522
3256 1 6 . 1 1 74 74 VAL CB C 86 31.307 31.307 30.634 0.673 18522
3257 1 6 . 1 1 74 74 VAL H H 86 8.368 8.368 8.420 -0.052 18522
3258 1 6 . 1 1 75 75 ALA N N 87 122.148 122.148 122.442 -0.294 18522
3259 1 6 . 1 1 75 75 ALA HA H 87 3.947 3.947 3.986 -0.039 18522
3260 1 6 . 1 1 75 75 ALA C C 87 179.545 179.545 179.333 0.212 18522
3261 1 6 . 1 1 75 75 ALA CA C 87 55.851 55.851 55.209 0.642 18522
3262 1 6 . 1 1 75 75 ALA CB C 87 18.491 18.491 18.153 0.338 18522
3263 1 6 . 1 1 75 75 ALA H H 87 8.577 8.577 8.303 0.274 18522
3264 1 6 . 1 1 76 76 LYS N N 88 117.733 117.733 119.709 -1.976 18522
3265 1 6 . 1 1 76 76 LYS HA H 88 4.051 4.051 4.003 0.048 18522
3266 1 6 . 1 1 76 76 LYS CA C 88 59.393 59.393 59.395 -0.002 18522
3267 1 6 . 1 1 76 76 LYS CB C 88 32.058 32.058 32.379 -0.321 18522
3268 1 6 . 1 1 76 76 LYS H H 88 7.854 7.854 7.551 0.303 18522
3269 1 6 . 1 1 77 77 MET N N 89 117.676 117.676 117.698 -0.022 18522
3270 1 6 . 1 1 77 77 MET HA H 89 4.048 4.048 4.153 -0.105 18522
3271 1 6 . 1 1 77 77 MET C C 89 178.791 178.791 179.033 -0.242 18522
3272 1 6 . 1 1 77 77 MET CA C 89 59.128 59.128 58.213 0.915 18522
3273 1 6 . 1 1 77 77 MET CB C 89 33.801 33.801 31.897 1.904 18522
3274 1 6 . 1 1 77 77 MET H H 89 7.759 7.759 8.319 -0.560 18522
3275 1 6 . 1 1 78 78 ILE N N 90 117.305 117.305 118.733 -1.428 18522
3276 1 6 . 1 1 78 78 ILE HA H 90 3.590 3.590 3.690 -0.100 18522
3277 1 6 . 1 1 78 78 ILE C C 90 178.658 178.658 178.295 0.363 18522
3278 1 6 . 1 1 78 78 ILE CA C 90 65.482 65.482 65.124 0.358 18522
3279 1 6 . 1 1 78 78 ILE CB C 90 38.845 38.845 37.555 1.290 18522
3280 1 6 . 1 1 78 78 ILE H H 90 7.972 7.972 7.776 0.196 18522
3281 1 6 . 1 1 79 79 GLN N N 91 120.935 120.935 118.899 2.036 18522
3282 1 6 . 1 1 79 79 GLN HA H 91 3.998 3.998 4.151 -0.153 18522
3283 1 6 . 1 1 79 79 GLN C C 91 178.274 178.274 178.100 0.174 18522
3284 1 6 . 1 1 79 79 GLN CA C 91 59.151 59.151 58.054 1.097 18522
3285 1 6 . 1 1 79 79 GLN CB C 91 28.934 28.934 28.908 0.026 18522
3286 1 6 . 1 1 79 79 GLN H H 91 8.826 8.826 8.054 0.772 18522
3287 1 6 . 1 1 80 80 GLU N N 92 115.213 115.213 121.110 -5.897 18522
3288 1 6 . 1 1 80 80 GLU HA H 92 4.061 4.061 4.107 -0.046 18522
3289 1 6 . 1 1 80 80 GLU C C 92 176.824 176.824 178.643 -1.819 18522
3290 1 6 . 1 1 80 80 GLU CA C 92 58.006 58.006 59.208 -1.202 18522
3291 1 6 . 1 1 80 80 GLU CB C 92 29.890 29.890 29.502 0.388 18522
3292 1 6 . 1 1 80 80 GLU H H 92 8.020 8.020 8.324 -0.304 18522
3293 1 6 . 1 1 81 81 VAL N N 93 119.047 119.047 114.928 4.119 18522
3294 1 6 . 1 1 81 81 VAL HA H 93 3.930 3.930 3.851 0.079 18522
3295 1 6 . 1 1 81 81 VAL C C 93 176.016 176.016 176.020 -0.004 18522
3296 1 6 . 1 1 81 81 VAL CA C 93 63.153 63.153 64.000 -0.847 18522
3297 1 6 . 1 1 81 81 VAL CB C 93 32.154 32.154 31.905 0.249 18522
3298 1 6 . 1 1 81 81 VAL H H 93 7.073 7.073 7.531 -0.458 18522
3299 1 6 . 1 1 82 82 LYS N N 94 128.366 128.366 118.931 9.435 18522
3300 1 6 . 1 1 82 82 LYS C C 94 177.460 177.460 177.048 0.412 18522
3301 1 6 . 1 1 82 82 LYS CA C 94 55.753 55.753 57.302 -1.549 18522
3302 1 6 . 1 1 82 82 LYS CB C 94 32.332 32.332 31.845 0.487 18522
3303 1 6 . 1 1 82 82 LYS H H 94 8.762 8.762 7.486 1.276 18522
3304 1 6 . 1 1 83 83 GLY N N 95 112.528 112.528 111.204 1.324 18522
3305 1 6 . 1 1 83 83 GLY C C 95 173.468 173.468 173.137 0.331 18522
3306 1 6 . 1 1 83 83 GLY CA C 95 46.243 46.243 45.508 0.735 18522
3307 1 6 . 1 1 83 83 GLY H H 95 8.673 8.673 8.704 -0.031 18522
3308 1 6 . 1 1 84 84 GLU N N 96 121.485 121.485 119.242 2.243 18522
3309 1 6 . 1 1 84 84 GLU HA H 96 4.749 4.749 4.575 0.174 18522
3310 1 6 . 1 1 84 84 GLU C C 96 174.583 174.583 174.198 0.385 18522
3311 1 6 . 1 1 84 84 GLU CA C 96 55.821 55.821 54.148 1.673 18522
3312 1 6 . 1 1 84 84 GLU CB C 96 31.410 31.410 33.343 -1.933 18522
3313 1 6 . 1 1 84 84 GLU H H 96 8.297 8.297 7.524 0.773 18522
3314 1 6 . 1 1 85 85 VAL N N 97 120.501 120.501 115.505 4.996 18522
3315 1 6 . 1 1 85 85 VAL HA H 97 4.665 4.665 4.537 0.128 18522
3316 1 6 . 1 1 85 85 VAL C C 97 173.047 173.047 173.979 -0.932 18522
3317 1 6 . 1 1 85 85 VAL CA C 97 60.114 60.114 60.225 -0.111 18522
3318 1 6 . 1 1 85 85 VAL CB C 97 35.184 35.184 36.144 -0.960 18522
3319 1 6 . 1 1 85 85 VAL H H 97 9.096 9.096 8.480 0.616 18522
3320 1 6 . 1 1 86 86 THR N N 98 125.019 125.019 117.831 7.188 18522
3321 1 6 . 1 1 86 86 THR HA H 98 4.076 4.076 4.899 -0.823 18522
3322 1 6 . 1 1 86 86 THR C C 98 173.807 173.807 174.114 -0.307 18522
3323 1 6 . 1 1 86 86 THR CA C 98 61.735 61.735 61.266 0.469 18522
3324 1 6 . 1 1 86 86 THR CB C 98 69.531 69.531 69.687 -0.156 18522
3325 1 6 . 1 1 86 86 THR H H 98 9.352 9.352 8.193 1.159 18522
3326 1 6 . 1 1 87 87 ILE N N 99 128.383 128.383 122.459 5.924 18522
3327 1 6 . 1 1 87 87 ILE HA H 99 4.661 4.661 4.831 -0.170 18522
3328 1 6 . 1 1 87 87 ILE C C 99 174.614 174.614 174.475 0.139 18522
3329 1 6 . 1 1 87 87 ILE CA C 99 58.258 58.258 59.105 -0.847 18522
3330 1 6 . 1 1 87 87 ILE CB C 99 38.528 38.528 39.425 -0.897 18522
3331 1 6 . 1 1 87 87 ILE H H 99 9.329 9.329 8.472 0.857 18522
3332 1 6 . 1 1 88 88 HIS N N 100 128.279 128.279 124.067 4.212 18522
3333 1 6 . 1 1 88 88 HIS HA H 100 4.948 4.948 5.392 -0.444 18522
3334 1 6 . 1 1 88 88 HIS C C 100 174.787 174.787 175.019 -0.232 18522
3335 1 6 . 1 1 88 88 HIS CA C 100 54.620 54.620 54.177 0.443 18522
3336 1 6 . 1 1 88 88 HIS H H 100 8.647 8.647 8.789 -0.142 18522
3337 1 6 . 1 1 89 89 TYR N N 101 121.320 121.320 122.024 -0.704 18522
3338 1 6 . 1 1 89 89 TYR HA H 101 5.947 5.947 5.727 0.220 18522
3339 1 6 . 1 1 89 89 TYR C C 101 173.769 173.769 173.130 0.639 18522
3340 1 6 . 1 1 89 89 TYR CA C 101 55.669 55.669 55.478 0.191 18522
3341 1 6 . 1 1 89 89 TYR CB C 101 42.195 42.195 41.425 0.770 18522
3342 1 6 . 1 1 89 89 TYR H H 101 8.414 8.414 8.913 -0.499 18522
3343 1 6 . 1 1 90 90 ASN N N 102 116.679 116.679 114.980 1.699 18522
3344 1 6 . 1 1 90 90 ASN HA H 102 5.335 5.335 5.286 0.049 18522
3345 1 6 . 1 1 90 90 ASN C C 102 175.406 175.406 173.236 2.170 18522
3346 1 6 . 1 1 90 90 ASN CA C 102 51.961 51.961 53.079 -1.118 18522
3347 1 6 . 1 1 90 90 ASN CB C 102 41.800 41.800 41.512 0.288 18522
3348 1 6 . 1 1 90 90 ASN H H 102 9.282 9.282 9.002 0.280 18522
3349 1 6 . 1 1 91 91 LYS N N 103 124.129 124.129 119.236 4.893 18522
3350 1 6 . 1 1 91 91 LYS C C 103 176.678 176.678 174.799 1.879 18522
3351 1 6 . 1 1 91 91 LYS CA C 103 55.006 55.006 55.893 -0.887 18522
3352 1 6 . 1 1 91 91 LYS H H 103 8.949 8.949 8.423 0.526 18522
3353 1 6 . 1 1 92 92 LEU N N 104 127.043 127.043 122.837 4.206 18522
3354 1 6 . 1 1 92 92 LEU HA H 104 4.425 4.425 4.662 -0.237 18522
3355 1 6 . 1 1 92 92 LEU CA C 104 55.060 55.060 54.409 0.651 18522
3356 1 6 . 1 1 92 92 LEU CB C 104 42.559 42.559 44.341 -1.782 18522
3357 1 6 . 1 1 92 92 LEU H H 104 9.150 9.150 8.477 0.673 18522
3358 1 6 . 1 1 93 93 GLN HA H 105 4.315 4.315 4.526 -0.211 18522
3359 1 6 . 1 1 93 93 GLN C C 105 175.070 175.070 174.897 0.173 18522
3360 1 6 . 1 1 93 93 GLN CA C 105 55.490 55.490 54.958 0.532 18522
3361 1 6 . 1 1 93 93 GLN CB C 105 28.909 28.909 29.126 -0.217 18522
3362 1 6 . 1 1 94 94 ALA N N 106 125.133 125.133 128.036 -2.903 18522
3363 1 6 . 1 1 94 94 ALA HA H 106 4.366 4.366 4.333 0.033 18522
3364 1 6 . 1 1 94 94 ALA C C 106 176.392 176.392 176.326 0.066 18522
3365 1 6 . 1 1 94 94 ALA CA C 106 51.723 51.723 52.275 -0.552 18522
3366 1 6 . 1 1 94 94 ALA CB C 106 20.185 20.185 19.531 0.654 18522
3367 1 6 . 1 1 94 94 ALA H H 106 8.226 8.226 8.366 -0.140 18522
3368 1 6 . 1 1 95 95 ASP N N 107 122.013 122.013 119.457 2.556 18522
3369 1 6 . 1 1 95 95 ASP HA H 107 4.413 4.413 4.813 -0.400 18522
3370 1 6 . 1 1 95 95 ASP C C 107 175.019 175.019 175.014 0.005 18522
3371 1 6 . 1 1 95 95 ASP CA C 107 55.642 55.642 52.479 3.163 18522
3372 1 6 . 1 1 95 95 ASP CB C 107 41.266 41.266 42.630 -1.364 18522
3373 1 6 . 1 1 95 95 ASP H H 107 8.429 8.429 8.333 0.096 18522
3374 1 6 . 1 1 96 96 PRO HA H 108 4.207 4.207 4.066 0.141 18522
3375 1 6 . 1 1 96 96 PRO C C 108 178.840 178.840 178.387 0.453 18522
3376 1 6 . 1 1 96 96 PRO CA C 108 65.396 65.396 66.429 -1.033 18522
3377 1 6 . 1 1 96 96 PRO CB C 108 32.181 32.181 31.558 0.622 18522
3378 1 6 . 1 1 97 97 LYS N N 109 117.942 117.942 115.440 2.502 18522
3379 1 6 . 1 1 97 97 LYS HA H 109 4.143 4.143 4.055 0.088 18522
3380 1 6 . 1 1 97 97 LYS C C 109 178.099 178.099 179.172 -1.073 18522
3381 1 6 . 1 1 97 97 LYS CA C 109 58.167 58.167 59.103 -0.936 18522
3382 1 6 . 1 1 97 97 LYS CB C 109 31.649 31.649 31.483 0.166 18522
3383 1 6 . 1 1 97 97 LYS H H 109 8.335 8.335 8.355 -0.020 18522
3384 1 6 . 1 1 98 98 GLN N N 110 119.159 119.159 118.043 1.116 18522
3385 1 6 . 1 1 98 98 GLN HA H 110 4.130 4.130 4.298 -0.168 18522
3386 1 6 . 1 1 98 98 GLN C C 110 178.298 178.298 178.376 -0.078 18522
3387 1 6 . 1 1 98 98 GLN CA C 110 57.660 57.660 57.137 0.523 18522
3388 1 6 . 1 1 98 98 GLN CB C 110 28.720 28.720 28.715 0.005 18522
3389 1 6 . 1 1 98 98 GLN H H 110 7.985 7.985 8.140 -0.155 18522
3390 1 6 . 1 1 99 99 LEU N N 111 120.490 120.490 122.209 -1.719 18522
3391 1 6 . 1 1 99 99 LEU HA H 111 3.877 3.877 4.226 -0.349 18522
3392 1 6 . 1 1 99 99 LEU C C 111 177.729 177.729 178.367 -0.638 18522
3393 1 6 . 1 1 99 99 LEU CA C 111 57.049 57.049 57.844 -0.796 18522
3394 1 6 . 1 1 99 99 LEU CB C 111 41.466 41.466 41.813 -0.347 18522
3395 1 6 . 1 1 99 99 LEU H H 111 7.994 7.994 8.416 -0.422 18522
3396 1 6 . 1 1 100 100 GLU N N 112 118.251 118.251 118.051 0.200 18522
3397 1 6 . 1 1 100 100 GLU HA H 112 3.972 3.972 4.130 -0.158 18522
3398 1 6 . 1 1 100 100 GLU C C 112 178.402 178.402 177.863 0.539 18522
3399 1 6 . 1 1 100 100 GLU CA C 112 59.056 59.056 59.057 -0.001 18522
3400 1 6 . 1 1 100 100 GLU CB C 112 29.732 29.732 28.970 0.763 18522
3401 1 6 . 1 1 100 100 GLU H H 112 7.760 7.760 8.224 -0.464 18522
3402 1 6 . 1 1 101 101 VAL N N 113 117.229 117.229 118.035 -0.806 18522
3403 1 6 . 1 1 101 101 VAL HA H 113 3.762 3.762 3.770 -0.008 18522
3404 1 6 . 1 1 101 101 VAL C C 113 178.107 178.107 178.328 -0.221 18522
3405 1 6 . 1 1 101 101 VAL CA C 113 64.791 64.791 65.202 -0.411 18522
3406 1 6 . 1 1 101 101 VAL CB C 113 32.149 32.149 31.927 0.222 18522
3407 1 6 . 1 1 101 101 VAL H H 113 7.437 7.437 7.410 0.027 18522
3408 1 6 . 1 1 102 102 LEU N N 114 122.124 122.124 118.010 4.114 18522
3409 1 6 . 1 1 102 102 LEU HA H 114 4.033 4.033 4.151 -0.118 18522
3410 1 6 . 1 1 102 102 LEU C C 114 178.506 178.506 177.488 1.018 18522
3411 1 6 . 1 1 102 102 LEU CA C 114 57.243 57.243 56.158 1.085 18522
3412 1 6 . 1 1 102 102 LEU CB C 114 42.028 42.028 42.163 -0.135 18522
3413 1 6 . 1 1 102 102 LEU H H 114 7.765 7.765 7.273 0.492 18522
3414 1 6 . 1 1 103 103 PHE N N 115 115.346 115.346 117.351 -2.005 18522
3415 1 6 . 1 1 103 103 PHE HA H 115 4.224 4.224 4.572 -0.348 18522
3416 1 6 . 1 1 103 103 PHE C C 115 175.621 175.621 175.754 -0.133 18522
3417 1 6 . 1 1 103 103 PHE CA C 115 57.537 57.537 56.856 0.681 18522
3418 1 6 . 1 1 103 103 PHE CB C 115 38.057 38.057 38.862 -0.805 18522
3419 1 6 . 1 1 103 103 PHE H H 115 7.805 7.805 7.947 -0.142 18522
3420 1 6 . 1 1 104 104 GLN N N 116 119.021 119.021 119.433 -0.412 18522
3421 1 6 . 1 1 104 104 GLN HA H 116 4.407 4.407 4.352 0.055 18522
3422 1 6 . 1 1 104 104 GLN C C 116 176.402 176.402 175.738 0.664 18522
3423 1 6 . 1 1 104 104 GLN CA C 116 55.521 55.521 56.059 -0.538 18522
3424 1 6 . 1 1 104 104 GLN CB C 116 29.170 29.170 29.261 -0.091 18522
3425 1 6 . 1 1 104 104 GLN H H 116 7.974 7.974 7.924 0.050 18522
3426 1 6 . 1 1 105 105 GLY N N 117 108.868 108.868 107.920 0.948 18522
3427 1 6 . 1 1 105 105 GLY CA C 117 45.124 45.124 44.714 0.410 18522
3428 1 6 . 1 1 105 105 GLY H H 117 8.195 8.195 7.532 0.663 18522
3429 1 6 . 1 1 106 106 PRO HA H 118 4.490 4.490 4.148 0.342 18522
3430 1 6 . 1 1 106 106 PRO C C 118 176.001 176.001 176.623 -0.622 18522
3431 1 6 . 1 1 106 106 PRO CA C 118 63.523 63.523 63.069 0.454 18522
3432 1 6 . 1 1 106 106 PRO CB C 118 32.078 32.078 32.096 -0.018 18522
3433 1 6 . 1 1 107 107 GLN N N 119 126.950 126.950 116.240 10.710 18522
3434 1 6 . 1 1 107 107 GLN C C 119 181.211 181.211 174.338 6.873 18522
3435 1 6 . 1 1 107 107 GLN CA C 119 57.416 57.416 55.435 1.981 18522
3436 1 6 . 1 1 107 107 GLN H H 119 8.079 8.079 7.715 0.364 18522
3437 1 6 . 1 1 111 111 ARG C C 123 174.608 174.608 175.523 -0.915 18522
3438 1 6 . 1 1 111 111 ARG CA C 123 55.099 55.099 54.176 0.923 18522
3439 1 6 . 1 1 112 112 HIS N N 124 122.212 122.212 122.644 -0.432 18522
3440 1 6 . 1 1 112 112 HIS HA H 124 4.718 4.718 4.095 0.623 18522
3441 1 6 . 1 1 112 112 HIS C C 124 176.040 176.040 175.004 1.036 18522
3442 1 6 . 1 1 112 112 HIS CA C 124 54.213 54.213 56.563 -2.350 18522
3443 1 6 . 1 1 112 112 HIS CB C 124 31.164 31.164 31.087 0.077 18522
3444 1 6 . 1 1 112 112 HIS H H 124 7.640 7.640 8.476 -0.836 18522
3445 1 6 . 1 1 113 113 TRP C C 125 176.168 176.168 177.092 -0.924 18522
3446 1 6 . 1 1 114 114 LEU N N 126 121.893 121.893 123.969 -2.076 18522
3447 1 6 . 1 1 114 114 LEU HA H 126 4.869 4.869 5.008 -0.139 18522
3448 1 6 . 1 1 114 114 LEU CA C 126 54.151 54.151 53.974 0.177 18522
3449 1 6 . 1 1 114 114 LEU CB C 126 45.144 45.144 43.586 1.558 18522
3450 1 6 . 1 1 114 114 LEU H H 126 8.606 8.606 8.550 0.056 18522
3451 1 6 . 1 1 115 115 LYS N N 127 125.850 125.850 117.745 8.105 18522
3452 1 6 . 1 1 115 115 LYS HA H 127 4.203 4.203 5.111 -0.908 18522
3453 1 6 . 1 1 115 115 LYS C C 127 175.564 175.564 175.015 0.549 18522
3454 1 6 . 1 1 115 115 LYS CA C 127 57.252 57.252 55.180 2.072 18522
3455 1 6 . 1 1 115 115 LYS CB C 127 33.406 33.406 35.442 -2.036 18522
3456 1 6 . 1 1 115 115 LYS H H 127 8.647 8.647 8.150 0.497 18522
3457 1 7 . 1 1 3 3 PRO C C 15 177.225 177.225 177.407 -0.182 18522
3458 1 7 . 1 1 3 3 PRO CA C 15 63.508 63.508 62.731 0.777 18522
3459 1 7 . 1 1 3 3 PRO CB C 15 32.090 32.090 32.099 -0.009 18522
3460 1 7 . 1 1 4 4 GLY N N 16 108.829 108.829 109.843 -1.014 18522
3461 1 7 . 1 1 4 4 GLY C C 16 173.398 173.398 174.238 -0.840 18522
3462 1 7 . 1 1 4 4 GLY CA C 16 45.128 45.128 45.855 -0.727 18522
3463 1 7 . 1 1 4 4 GLY H H 16 8.489 8.489 7.826 0.663 18522
3464 1 7 . 1 1 5 5 ILE N N 17 121.763 121.763 119.029 2.734 18522
3465 1 7 . 1 1 5 5 ILE HA H 17 4.554 4.554 4.808 -0.254 18522
3466 1 7 . 1 1 5 5 ILE C C 17 174.332 174.332 174.505 -0.173 18522
3467 1 7 . 1 1 5 5 ILE CA C 17 58.245 58.245 57.787 0.458 18522
3468 1 7 . 1 1 5 5 ILE CB C 17 38.762 38.762 38.613 0.149 18522
3469 1 7 . 1 1 5 5 ILE H H 17 8.014 8.014 7.757 0.257 18522
3470 1 7 . 1 1 6 6 PRO C C 18 176.437 176.437 175.647 0.790 18522
3471 1 7 . 1 1 6 6 PRO CA C 18 62.667 62.667 62.024 0.643 18522
3472 1 7 . 1 1 6 6 PRO CB C 18 32.469 32.469 32.213 0.256 18522
3473 1 7 . 1 1 7 7 VAL N N 19 123.849 123.849 118.628 5.221 18522
3474 1 7 . 1 1 7 7 VAL HA H 19 4.550 4.550 3.857 0.693 18522
3475 1 7 . 1 1 7 7 VAL C C 19 174.453 174.453 174.881 -0.428 18522
3476 1 7 . 1 1 7 7 VAL CA C 19 59.846 59.846 62.213 -2.367 18522
3477 1 7 . 1 1 7 7 VAL CB C 19 33.510 33.510 31.080 2.430 18522
3478 1 7 . 1 1 7 7 VAL H H 19 8.754 8.754 8.164 0.590 18522
3479 1 7 . 1 1 8 8 PRO HA H 20 5.338 5.338 4.778 0.560 18522
3480 1 7 . 1 1 8 8 PRO C C 20 177.585 177.585 176.049 1.536 18522
3481 1 7 . 1 1 8 8 PRO CA C 20 62.406 62.406 61.738 0.668 18522
3482 1 7 . 1 1 8 8 PRO CB C 20 32.891 32.891 32.436 0.455 18522
3483 1 7 . 1 1 9 9 GLY N N 21 108.426 108.426 112.003 -3.577 18522
3484 1 7 . 1 1 9 9 GLY C C 21 171.443 171.443 171.860 -0.417 18522
3485 1 7 . 1 1 9 9 GLY CA C 21 44.581 44.581 43.477 1.104 18522
3486 1 7 . 1 1 9 9 GLY H H 21 8.258 8.258 8.807 -0.549 18522
3487 1 7 . 1 1 10 10 LYS N N 22 117.372 117.372 121.672 -4.300 18522
3488 1 7 . 1 1 10 10 LYS HA H 22 4.039 4.039 5.131 -1.092 18522
3489 1 7 . 1 1 10 10 LYS C C 22 174.463 174.463 174.494 -0.031 18522
3490 1 7 . 1 1 10 10 LYS CA C 22 55.263 55.263 54.432 0.831 18522
3491 1 7 . 1 1 10 10 LYS CB C 22 35.227 35.227 34.186 1.041 18522
3492 1 7 . 1 1 10 10 LYS H H 22 8.175 8.175 7.951 0.224 18522
3493 1 7 . 1 1 11 11 VAL N N 23 120.387 120.387 117.041 3.346 18522
3494 1 7 . 1 1 11 11 VAL HA H 23 4.708 4.708 4.681 0.027 18522
3495 1 7 . 1 1 11 11 VAL C C 23 171.873 171.873 173.961 -2.088 18522
3496 1 7 . 1 1 11 11 VAL CA C 23 59.866 59.866 59.612 0.254 18522
3497 1 7 . 1 1 11 11 VAL CB C 23 35.269 35.269 35.149 0.120 18522
3498 1 7 . 1 1 11 11 VAL H H 23 8.862 8.862 8.273 0.589 18522
3499 1 7 . 1 1 12 12 THR N N 24 125.797 125.797 118.694 7.103 18522
3500 1 7 . 1 1 12 12 THR HA H 24 5.121 5.121 5.169 -0.048 18522
3501 1 7 . 1 1 12 12 THR C C 24 173.407 173.407 173.384 0.023 18522
3502 1 7 . 1 1 12 12 THR CA C 24 62.115 62.115 60.469 1.646 18522
3503 1 7 . 1 1 12 12 THR CB C 24 69.606 69.606 69.521 0.085 18522
3504 1 7 . 1 1 12 12 THR H H 24 8.859 8.859 8.355 0.504 18522
3505 1 7 . 1 1 13 13 LEU N N 25 127.960 127.960 126.594 1.366 18522
3506 1 7 . 1 1 13 13 LEU HA H 25 4.809 4.809 4.920 -0.111 18522
3507 1 7 . 1 1 13 13 LEU C C 25 175.029 175.029 175.311 -0.282 18522
3508 1 7 . 1 1 13 13 LEU CA C 25 52.623 52.623 52.377 0.246 18522
3509 1 7 . 1 1 13 13 LEU CB C 25 46.242 46.242 45.377 0.865 18522
3510 1 7 . 1 1 13 13 LEU H H 25 9.258 9.258 8.721 0.537 18522
3511 1 7 . 1 1 14 14 GLN N N 26 120.858 120.858 116.702 4.156 18522
3512 1 7 . 1 1 14 14 GLN HA H 26 4.482 4.482 4.637 -0.155 18522
3513 1 7 . 1 1 14 14 GLN C C 26 174.515 174.515 175.950 -1.435 18522
3514 1 7 . 1 1 14 14 GLN CA C 26 54.576 54.576 53.603 0.973 18522
3515 1 7 . 1 1 14 14 GLN CB C 26 29.516 29.516 30.998 -1.482 18522
3516 1 7 . 1 1 14 14 GLN H H 26 8.530 8.530 8.178 0.352 18522
3517 1 7 . 1 1 15 15 LYS N N 27 119.583 119.583 120.940 -1.357 18522
3518 1 7 . 1 1 15 15 LYS HA H 27 4.180 4.180 4.250 -0.070 18522
3519 1 7 . 1 1 15 15 LYS C C 27 177.468 177.468 176.882 0.586 18522
3520 1 7 . 1 1 15 15 LYS CA C 27 55.956 55.956 56.548 -0.592 18522
3521 1 7 . 1 1 15 15 LYS CB C 27 34.099 34.099 32.574 1.526 18522
3522 1 7 . 1 1 15 15 LYS H H 27 8.099 8.099 8.405 -0.306 18522
3523 1 7 . 1 1 16 16 ASP N N 28 121.439 121.439 121.137 0.302 18522
3524 1 7 . 1 1 16 16 ASP HA H 28 4.590 4.590 4.674 -0.084 18522
3525 1 7 . 1 1 16 16 ASP C C 28 178.392 178.392 177.727 0.665 18522
3526 1 7 . 1 1 16 16 ASP CA C 28 52.426 52.426 53.226 -0.800 18522
3527 1 7 . 1 1 16 16 ASP CB C 28 41.377 41.377 42.953 -1.576 18522
3528 1 7 . 1 1 16 16 ASP H H 28 8.888 8.888 8.649 0.239 18522
3529 1 7 . 1 1 17 17 ALA N N 29 119.578 119.578 123.889 -4.311 18522
3530 1 7 . 1 1 17 17 ALA HA H 29 4.188 4.188 4.106 0.082 18522
3531 1 7 . 1 1 17 17 ALA C C 29 178.763 178.763 178.213 0.550 18522
3532 1 7 . 1 1 17 17 ALA CA C 29 54.434 54.434 54.534 -0.100 18522
3533 1 7 . 1 1 17 17 ALA CB C 29 18.293 18.293 18.634 -0.341 18522
3534 1 7 . 1 1 17 17 ALA H H 29 8.392 8.392 8.755 -0.363 18522
3535 1 7 . 1 1 18 18 GLN N N 30 117.564 117.564 116.951 0.613 18522
3536 1 7 . 1 1 18 18 GLN HA H 30 4.399 4.399 4.344 0.055 18522
3537 1 7 . 1 1 18 18 GLN C C 30 175.168 175.168 175.493 -0.325 18522
3538 1 7 . 1 1 18 18 GLN CA C 30 55.339 55.339 55.323 0.016 18522
3539 1 7 . 1 1 18 18 GLN CB C 30 28.589 28.589 29.520 -0.931 18522
3540 1 7 . 1 1 18 18 GLN H H 30 8.353 8.353 7.837 0.516 18522
3541 1 7 . 1 1 19 19 ASN N N 31 115.365 115.365 116.954 -1.589 18522
3542 1 7 . 1 1 19 19 ASN HA H 31 4.315 4.315 4.377 -0.062 18522
3543 1 7 . 1 1 19 19 ASN C C 31 174.043 174.043 173.267 0.776 18522
3544 1 7 . 1 1 19 19 ASN CA C 31 54.303 54.303 54.275 0.028 18522
3545 1 7 . 1 1 19 19 ASN CB C 31 37.610 37.610 37.845 -0.235 18522
3546 1 7 . 1 1 19 19 ASN H H 31 8.521 8.521 8.195 0.326 18522
3547 1 7 . 1 1 20 20 LEU N N 32 118.660 118.660 110.174 8.486 18522
3548 1 7 . 1 1 20 20 LEU HA H 32 4.900 4.900 4.787 0.113 18522
3549 1 7 . 1 1 20 20 LEU C C 32 178.117 178.117 176.023 2.094 18522
3550 1 7 . 1 1 20 20 LEU CA C 32 53.957 53.957 53.845 0.112 18522
3551 1 7 . 1 1 20 20 LEU CB C 32 44.774 44.774 43.827 0.947 18522
3552 1 7 . 1 1 20 20 LEU H H 32 8.155 8.155 7.299 0.856 18522
3553 1 7 . 1 1 21 21 ILE N N 33 116.785 116.785 117.185 -0.400 18522
3554 1 7 . 1 1 21 21 ILE HA H 33 4.674 4.674 4.388 0.286 18522
3555 1 7 . 1 1 21 21 ILE C C 33 176.185 176.185 176.722 -0.537 18522
3556 1 7 . 1 1 21 21 ILE CA C 33 62.602 62.602 61.546 1.056 18522
3557 1 7 . 1 1 21 21 ILE CB C 33 39.016 39.016 39.330 -0.314 18522
3558 1 7 . 1 1 21 21 ILE H H 33 11.488 11.488 8.371 3.117 18522
3559 1 7 . 1 1 22 22 GLY N N 34 111.234 111.234 107.831 3.403 18522
3560 1 7 . 1 1 22 22 GLY C C 34 173.993 173.993 173.901 0.092 18522
3561 1 7 . 1 1 22 22 GLY CA C 34 45.980 45.980 44.792 1.188 18522
3562 1 7 . 1 1 22 22 GLY H H 34 9.854 9.854 8.543 1.311 18522
3563 1 7 . 1 1 23 23 ILE N N 35 111.117 111.117 113.481 -2.364 18522
3564 1 7 . 1 1 23 23 ILE HA H 35 5.535 5.535 5.004 0.531 18522
3565 1 7 . 1 1 23 23 ILE C C 35 175.033 175.033 173.862 1.171 18522
3566 1 7 . 1 1 23 23 ILE CA C 35 58.415 58.415 57.716 0.699 18522
3567 1 7 . 1 1 23 23 ILE CB C 35 41.577 41.577 42.110 -0.533 18522
3568 1 7 . 1 1 23 23 ILE H H 35 7.835 7.835 6.928 0.907 18522
3569 1 7 . 1 1 24 24 SER N N 36 114.908 114.908 115.349 -0.441 18522
3570 1 7 . 1 1 24 24 SER HA H 36 4.232 4.232 4.854 -0.622 18522
3571 1 7 . 1 1 24 24 SER C C 36 174.735 174.735 172.745 1.990 18522
3572 1 7 . 1 1 24 24 SER CA C 36 56.121 56.121 57.075 -0.954 18522
3573 1 7 . 1 1 24 24 SER CB C 36 66.097 66.097 65.374 0.724 18522
3574 1 7 . 1 1 24 24 SER H H 36 8.623 8.623 8.030 0.593 18522
3575 1 7 . 1 1 25 25 ILE N N 37 117.739 117.739 125.485 -7.746 18522
3576 1 7 . 1 1 25 25 ILE C C 37 174.340 174.340 175.908 -1.568 18522
3577 1 7 . 1 1 25 25 ILE CA C 37 59.123 59.123 59.669 -0.546 18522
3578 1 7 . 1 1 25 25 ILE CB C 37 41.637 41.637 41.442 0.195 18522
3579 1 7 . 1 1 25 25 ILE H H 37 9.130 9.130 8.632 0.498 18522
3580 1 7 . 1 1 26 26 GLY N N 38 108.069 108.069 112.735 -4.666 18522
3581 1 7 . 1 1 26 26 GLY CA C 38 44.112 44.112 45.497 -1.385 18522
3582 1 7 . 1 1 26 26 GLY H H 38 8.841 8.841 7.768 1.073 18522
3583 1 7 . 1 1 27 27 GLY N N 39 109.016 109.016 106.568 2.448 18522
3584 1 7 . 1 1 27 27 GLY C C 39 173.956 173.956 174.483 -0.527 18522
3585 1 7 . 1 1 27 27 GLY H H 39 8.187 8.187 7.928 0.259 18522
3586 1 7 . 1 1 28 28 GLY N N 40 111.783 111.783 108.681 3.102 18522
3587 1 7 . 1 1 28 28 GLY C C 40 174.255 174.255 174.962 -0.707 18522
3588 1 7 . 1 1 28 28 GLY CA C 40 47.098 47.098 46.747 0.351 18522
3589 1 7 . 1 1 28 28 GLY H H 40 8.275 8.275 7.971 0.304 18522
3590 1 7 . 1 1 29 29 ALA N N 41 123.128 123.128 124.422 -1.294 18522
3591 1 7 . 1 1 29 29 ALA HA H 41 4.559 4.559 4.380 0.179 18522
3592 1 7 . 1 1 29 29 ALA CA C 41 51.073 51.073 50.952 0.121 18522
3593 1 7 . 1 1 29 29 ALA CB C 41 21.926 21.926 17.290 4.636 18522
3594 1 7 . 1 1 29 29 ALA H H 41 8.012 8.012 7.909 0.103 18522
3595 1 7 . 1 1 31 31 TYR HA H 43 4.549 4.549 4.993 -0.444 18522
3596 1 7 . 1 1 31 31 TYR CA C 43 57.147 57.147 56.859 0.288 18522
3597 1 7 . 1 1 31 31 TYR CB C 43 37.495 37.495 39.724 -2.229 18522
3598 1 7 . 1 1 32 32 CYS N N 44 119.332 119.332 120.433 -1.101 18522
3599 1 7 . 1 1 32 32 CYS HA H 44 4.859 4.859 4.565 0.294 18522
3600 1 7 . 1 1 32 32 CYS CA C 44 57.406 57.406 60.496 -3.090 18522
3601 1 7 . 1 1 32 32 CYS CB C 44 27.673 27.673 25.778 1.895 18522
3602 1 7 . 1 1 32 32 CYS H H 44 7.504 7.504 8.280 -0.776 18522
3603 1 7 . 1 1 33 33 PRO HA H 45 4.413 4.413 4.834 -0.421 18522
3604 1 7 . 1 1 33 33 PRO CA C 45 64.885 64.885 62.017 2.868 18522
3605 1 7 . 1 1 33 33 PRO CB C 45 32.318 32.318 32.593 -0.275 18522
3606 1 7 . 1 1 34 34 CYS N N 46 117.327 117.327 116.723 0.604 18522
3607 1 7 . 1 1 34 34 CYS C C 46 172.064 172.064 175.114 -3.050 18522
3608 1 7 . 1 1 34 34 CYS CA C 46 60.066 60.066 57.666 2.400 18522
3609 1 7 . 1 1 34 34 CYS CB C 46 28.715 28.715 31.253 -2.538 18522
3610 1 7 . 1 1 34 34 CYS H H 46 7.973 7.973 8.612 -0.639 18522
3611 1 7 . 1 1 35 35 LEU N N 47 124.270 124.270 115.705 8.565 18522
3612 1 7 . 1 1 35 35 LEU HA H 47 4.928 4.928 4.482 0.446 18522
3613 1 7 . 1 1 35 35 LEU C C 47 175.076 175.076 176.602 -1.526 18522
3614 1 7 . 1 1 35 35 LEU CA C 47 53.278 53.278 56.231 -2.953 18522
3615 1 7 . 1 1 35 35 LEU CB C 47 44.321 44.321 41.211 3.110 18522
3616 1 7 . 1 1 35 35 LEU H H 47 8.629 8.629 8.664 -0.035 18522
3617 1 7 . 1 1 36 36 TYR N N 48 119.326 119.326 115.791 3.535 18522
3618 1 7 . 1 1 36 36 TYR HA H 48 5.255 5.255 4.353 0.902 18522
3619 1 7 . 1 1 36 36 TYR C C 48 175.766 175.766 175.222 0.544 18522
3620 1 7 . 1 1 36 36 TYR CA C 48 56.696 56.696 61.239 -4.543 18522
3621 1 7 . 1 1 36 36 TYR CB C 48 42.590 42.590 37.071 5.519 18522
3622 1 7 . 1 1 36 36 TYR H H 48 8.761 8.761 7.737 1.024 18522
3623 1 7 . 1 1 37 37 ILE N N 49 120.259 120.259 120.459 -0.200 18522
3624 1 7 . 1 1 37 37 ILE HA H 49 4.215 4.215 4.753 -0.538 18522
3625 1 7 . 1 1 37 37 ILE C C 49 177.429 177.429 175.740 1.689 18522
3626 1 7 . 1 1 37 37 ILE CA C 49 62.456 62.456 59.285 3.171 18522
3627 1 7 . 1 1 37 37 ILE CB C 49 37.352 37.352 38.270 -0.918 18522
3628 1 7 . 1 1 37 37 ILE H H 49 8.959 8.959 7.764 1.195 18522
3629 1 7 . 1 1 38 38 VAL HA H 50 3.937 3.937 3.956 -0.019 18522
3630 1 7 . 1 1 38 38 VAL C C 50 174.408 174.408 175.118 -0.710 18522
3631 1 7 . 1 1 38 38 VAL CA C 50 62.259 62.259 63.170 -0.911 18522
3632 1 7 . 1 1 38 38 VAL CB C 50 31.584 31.584 31.816 -0.232 18522
3633 1 7 . 1 1 39 39 GLN N N 51 116.821 116.821 117.733 -0.912 18522
3634 1 7 . 1 1 39 39 GLN HA H 51 4.103 4.103 4.372 -0.269 18522
3635 1 7 . 1 1 39 39 GLN C C 51 172.856 172.856 173.001 -0.145 18522
3636 1 7 . 1 1 39 39 GLN CA C 51 55.127 55.127 55.077 0.050 18522
3637 1 7 . 1 1 39 39 GLN CB C 51 32.376 32.376 32.216 0.160 18522
3638 1 7 . 1 1 39 39 GLN H H 51 6.967 6.967 7.333 -0.366 18522
3639 1 7 . 1 1 40 40 VAL N N 52 123.482 123.482 122.141 1.341 18522
3640 1 7 . 1 1 40 40 VAL HA H 52 4.277 4.277 4.427 -0.150 18522
3641 1 7 . 1 1 40 40 VAL C C 52 176.198 176.198 174.417 1.781 18522
3642 1 7 . 1 1 40 40 VAL CA C 52 61.574 61.574 59.542 2.032 18522
3643 1 7 . 1 1 40 40 VAL CB C 52 32.875 32.875 34.658 -1.783 18522
3644 1 7 . 1 1 40 40 VAL H H 52 8.447 8.447 8.174 0.273 18522
3645 1 7 . 1 1 41 41 PHE N N 53 128.296 128.296 124.504 3.792 18522
3646 1 7 . 1 1 41 41 PHE HA H 53 4.400 4.400 4.766 -0.366 18522
3647 1 7 . 1 1 41 41 PHE C C 53 175.299 175.299 175.318 -0.019 18522
3648 1 7 . 1 1 41 41 PHE CA C 53 58.494 58.494 56.964 1.530 18522
3649 1 7 . 1 1 41 41 PHE CB C 53 39.561 39.561 39.205 0.356 18522
3650 1 7 . 1 1 41 41 PHE H H 53 8.707 8.707 7.881 0.826 18522
3651 1 7 . 1 1 42 42 ASP N N 54 122.696 122.696 115.826 6.870 18522
3652 1 7 . 1 1 42 42 ASP HA H 54 4.272 4.272 4.652 -0.380 18522
3653 1 7 . 1 1 42 42 ASP C C 54 176.837 176.837 176.049 0.788 18522
3654 1 7 . 1 1 42 42 ASP CA C 54 55.291 55.291 54.929 0.362 18522
3655 1 7 . 1 1 42 42 ASP CB C 54 41.093 41.093 42.601 -1.508 18522
3656 1 7 . 1 1 42 42 ASP H H 54 8.901 8.901 8.434 0.467 18522
3657 1 7 . 1 1 43 43 ASN N N 55 113.923 113.923 116.705 -2.782 18522
3658 1 7 . 1 1 43 43 ASN HA H 55 4.258 4.258 4.824 -0.566 18522
3659 1 7 . 1 1 43 43 ASN C C 55 173.714 173.714 174.660 -0.946 18522
3660 1 7 . 1 1 43 43 ASN CA C 55 54.958 54.958 53.615 1.343 18522
3661 1 7 . 1 1 43 43 ASN CB C 55 37.150 37.150 39.445 -2.295 18522
3662 1 7 . 1 1 43 43 ASN H H 55 9.319 9.319 8.278 1.041 18522
3663 1 7 . 1 1 44 44 THR N N 56 108.020 108.020 110.482 -2.462 18522
3664 1 7 . 1 1 44 44 THR HA H 56 5.377 5.377 4.799 0.578 18522
3665 1 7 . 1 1 44 44 THR CA C 56 59.712 59.712 59.349 0.363 18522
3666 1 7 . 1 1 44 44 THR CB C 56 69.529 69.529 69.781 -0.252 18522
3667 1 7 . 1 1 44 44 THR H H 56 7.149 7.149 7.458 -0.309 18522
3668 1 7 . 1 1 45 45 PRO HA H 57 4.304 4.304 4.067 0.237 18522
3669 1 7 . 1 1 45 45 PRO C C 57 180.141 180.141 177.894 2.247 18522
3670 1 7 . 1 1 45 45 PRO CA C 57 66.090 66.090 65.632 0.458 18522
3671 1 7 . 1 1 45 45 PRO CB C 57 33.194 33.194 31.465 1.728 18522
3672 1 7 . 1 1 46 46 ALA N N 58 116.854 116.854 119.393 -2.539 18522
3673 1 7 . 1 1 46 46 ALA HA H 58 4.035 4.035 3.984 0.051 18522
3674 1 7 . 1 1 46 46 ALA C C 58 180.647 180.647 179.349 1.298 18522
3675 1 7 . 1 1 46 46 ALA CA C 58 55.195 55.195 55.149 0.046 18522
3676 1 7 . 1 1 46 46 ALA CB C 58 18.880 18.880 18.033 0.847 18522
3677 1 7 . 1 1 46 46 ALA H H 58 8.938 8.938 7.930 1.008 18522
3678 1 7 . 1 1 47 47 ALA N N 59 123.250 123.250 120.987 2.263 18522
3679 1 7 . 1 1 47 47 ALA HA H 59 4.030 4.030 4.024 0.006 18522
3680 1 7 . 1 1 47 47 ALA C C 59 179.852 179.852 179.768 0.084 18522
3681 1 7 . 1 1 47 47 ALA CA C 59 54.939 54.939 54.592 0.347 18522
3682 1 7 . 1 1 47 47 ALA CB C 59 19.688 19.688 18.737 0.951 18522
3683 1 7 . 1 1 47 47 ALA H H 59 7.658 7.658 7.312 0.346 18522
3684 1 7 . 1 1 48 48 LEU N N 60 118.654 118.654 118.337 0.317 18522
3685 1 7 . 1 1 48 48 LEU HA H 60 4.026 4.026 4.167 -0.141 18522
3686 1 7 . 1 1 48 48 LEU C C 60 179.238 179.238 178.158 1.080 18522
3687 1 7 . 1 1 48 48 LEU CA C 60 57.261 57.261 57.808 -0.547 18522
3688 1 7 . 1 1 48 48 LEU CB C 60 41.445 41.445 41.621 -0.176 18522
3689 1 7 . 1 1 48 48 LEU H H 60 8.636 8.636 8.464 0.172 18522
3690 1 7 . 1 1 49 49 ASP N N 61 117.382 117.382 119.074 -1.692 18522
3691 1 7 . 1 1 49 49 ASP HA H 61 4.421 4.421 4.617 -0.196 18522
3692 1 7 . 1 1 49 49 ASP C C 61 177.668 177.668 177.702 -0.034 18522
3693 1 7 . 1 1 49 49 ASP CA C 61 57.087 57.087 54.591 2.496 18522
3694 1 7 . 1 1 49 49 ASP CB C 61 44.478 44.478 41.698 2.780 18522
3695 1 7 . 1 1 49 49 ASP H H 61 7.665 7.665 7.728 -0.063 18522
3696 1 7 . 1 1 50 50 GLY N N 62 103.228 103.228 109.215 -5.987 18522
3697 1 7 . 1 1 50 50 GLY C C 62 174.776 174.776 174.846 -0.070 18522
3698 1 7 . 1 1 50 50 GLY CA C 62 46.533 46.533 46.040 0.493 18522
3699 1 7 . 1 1 50 50 GLY H H 62 7.216 7.216 8.123 -0.907 18522
3700 1 7 . 1 1 51 51 THR N N 63 117.230 117.230 110.950 6.280 18522
3701 1 7 . 1 1 51 51 THR HA H 63 3.907 3.907 3.722 0.185 18522
3702 1 7 . 1 1 51 51 THR C C 63 175.961 175.961 174.059 1.902 18522
3703 1 7 . 1 1 51 51 THR CA C 63 66.478 66.478 63.229 3.249 18522
3704 1 7 . 1 1 51 51 THR CB C 63 68.268 68.268 66.333 1.935 18522
3705 1 7 . 1 1 51 51 THR H H 63 8.319 8.319 7.671 0.648 18522
3706 1 7 . 1 1 52 52 VAL N N 64 113.826 113.826 112.603 1.223 18522
3707 1 7 . 1 1 52 52 VAL HA H 64 3.950 3.950 4.041 -0.091 18522
3708 1 7 . 1 1 52 52 VAL C C 64 173.883 173.883 174.741 -0.858 18522
3709 1 7 . 1 1 52 52 VAL CA C 64 60.708 60.708 59.966 0.742 18522
3710 1 7 . 1 1 52 52 VAL CB C 64 33.079 33.079 31.530 1.549 18522
3711 1 7 . 1 1 52 52 VAL H H 64 8.147 8.147 7.224 0.923 18522
3712 1 7 . 1 1 53 53 ALA N N 65 123.521 123.521 123.753 -0.232 18522
3713 1 7 . 1 1 53 53 ALA HA H 65 4.414 4.414 4.371 0.043 18522
3714 1 7 . 1 1 53 53 ALA C C 65 175.247 175.247 176.656 -1.409 18522
3715 1 7 . 1 1 53 53 ALA CA C 65 50.440 50.440 50.711 -0.271 18522
3716 1 7 . 1 1 53 53 ALA CB C 65 23.266 23.266 20.204 3.062 18522
3717 1 7 . 1 1 53 53 ALA H H 65 8.633 8.633 7.508 1.125 18522
3718 1 7 . 1 1 54 54 ALA N N 66 120.818 120.818 122.428 -1.610 18522
3719 1 7 . 1 1 54 54 ALA HA H 66 3.720 3.720 3.745 -0.025 18522
3720 1 7 . 1 1 54 54 ALA C C 66 178.411 178.411 178.509 -0.098 18522
3721 1 7 . 1 1 54 54 ALA CA C 66 53.016 53.016 53.141 -0.125 18522
3722 1 7 . 1 1 54 54 ALA CB C 66 17.840 17.840 18.382 -0.542 18522
3723 1 7 . 1 1 54 54 ALA H H 66 8.451 8.451 8.269 0.182 18522
3724 1 7 . 1 1 55 55 GLY N N 67 112.260 112.260 112.634 -0.374 18522
3725 1 7 . 1 1 55 55 GLY C C 67 173.296 173.296 173.908 -0.612 18522
3726 1 7 . 1 1 55 55 GLY CA C 67 45.025 45.025 44.633 0.392 18522
3727 1 7 . 1 1 55 55 GLY H H 67 9.600 9.600 8.641 0.959 18522
3728 1 7 . 1 1 56 56 ASP N N 68 121.293 121.293 120.615 0.678 18522
3729 1 7 . 1 1 56 56 ASP HA H 68 4.861 4.861 4.720 0.141 18522
3730 1 7 . 1 1 56 56 ASP C C 68 174.937 174.937 174.469 0.468 18522
3731 1 7 . 1 1 56 56 ASP CA C 68 55.641 55.641 53.713 1.928 18522
3732 1 7 . 1 1 56 56 ASP CB C 68 40.696 40.696 43.060 -2.364 18522
3733 1 7 . 1 1 56 56 ASP H H 68 8.043 8.043 7.562 0.481 18522
3734 1 7 . 1 1 57 57 GLU N N 69 122.814 122.814 121.246 1.568 18522
3735 1 7 . 1 1 57 57 GLU C C 69 177.202 177.202 176.139 1.063 18522
3736 1 7 . 1 1 57 57 GLU CA C 69 54.472 54.472 54.405 0.067 18522
3737 1 7 . 1 1 57 57 GLU CB C 69 32.800 32.800 30.024 2.776 18522
3738 1 7 . 1 1 57 57 GLU H H 69 8.455 8.455 8.155 0.300 18522
3739 1 7 . 1 1 58 58 ILE N N 70 125.862 125.862 127.400 -1.538 18522
3740 1 7 . 1 1 58 58 ILE HA H 70 4.526 4.526 4.461 0.065 18522
3741 1 7 . 1 1 58 58 ILE C C 70 175.035 175.035 176.206 -1.171 18522
3742 1 7 . 1 1 58 58 ILE CA C 70 60.918 60.918 60.656 0.263 18522
3743 1 7 . 1 1 58 58 ILE CB C 70 39.236 39.236 35.529 3.707 18522
3744 1 7 . 1 1 58 58 ILE H H 70 8.619 8.619 9.121 -0.502 18522
3745 1 7 . 1 1 59 59 THR N N 71 115.507 115.507 121.255 -5.748 18522
3746 1 7 . 1 1 59 59 THR HA H 71 4.513 4.513 4.340 0.173 18522
3747 1 7 . 1 1 59 59 THR C C 71 176.425 176.425 173.580 2.845 18522
3748 1 7 . 1 1 59 59 THR CA C 71 61.158 61.158 62.117 -0.959 18522
3749 1 7 . 1 1 59 59 THR CB C 71 69.604 69.604 70.294 -0.690 18522
3750 1 7 . 1 1 59 59 THR H H 71 9.242 9.242 8.805 0.437 18522
3751 1 7 . 1 1 60 60 GLY N N 72 111.789 111.789 108.290 3.499 18522
3752 1 7 . 1 1 60 60 GLY C C 72 170.981 170.981 171.369 -0.388 18522
3753 1 7 . 1 1 60 60 GLY CA C 72 46.554 46.554 45.191 1.363 18522
3754 1 7 . 1 1 60 60 GLY H H 72 7.883 7.883 7.527 0.356 18522
3755 1 7 . 1 1 61 61 VAL N N 73 119.277 119.277 123.070 -3.793 18522
3756 1 7 . 1 1 61 61 VAL C C 73 175.951 175.951 175.396 0.555 18522
3757 1 7 . 1 1 61 61 VAL CA C 73 60.982 60.982 60.154 0.828 18522
3758 1 7 . 1 1 61 61 VAL CB C 73 36.197 36.197 34.244 1.953 18522
3759 1 7 . 1 1 61 61 VAL H H 73 8.424 8.424 8.773 -0.349 18522
3760 1 7 . 1 1 62 62 ASN N N 74 127.731 127.731 127.506 0.225 18522
3761 1 7 . 1 1 62 62 ASN HA H 74 4.520 4.520 4.413 0.107 18522
3762 1 7 . 1 1 62 62 ASN C C 74 174.878 174.878 174.640 0.238 18522
3763 1 7 . 1 1 62 62 ASN CA C 74 54.418 54.418 54.098 0.320 18522
3764 1 7 . 1 1 62 62 ASN CB C 74 36.655 36.655 37.412 -0.757 18522
3765 1 7 . 1 1 62 62 ASN H H 74 10.384 10.384 8.929 1.455 18522
3766 1 7 . 1 1 63 63 GLY N N 75 104.633 104.633 102.034 2.599 18522
3767 1 7 . 1 1 63 63 GLY C C 75 173.610 173.610 173.314 0.296 18522
3768 1 7 . 1 1 63 63 GLY CA C 75 45.261 45.261 44.901 0.360 18522
3769 1 7 . 1 1 63 63 GLY H H 75 8.926 8.926 7.966 0.960 18522
3770 1 7 . 1 1 64 64 ARG N N 76 120.451 120.451 120.074 0.377 18522
3771 1 7 . 1 1 64 64 ARG HA H 76 4.501 4.501 4.663 -0.162 18522
3772 1 7 . 1 1 64 64 ARG C C 76 175.085 175.085 175.550 -0.465 18522
3773 1 7 . 1 1 64 64 ARG CA C 76 54.252 54.252 54.006 0.246 18522
3774 1 7 . 1 1 64 64 ARG CB C 76 31.482 31.482 31.926 -0.444 18522
3775 1 7 . 1 1 64 64 ARG H H 76 7.753 7.753 7.726 0.027 18522
3776 1 7 . 1 1 65 65 SER N N 77 116.586 116.586 117.080 -0.494 18522
3777 1 7 . 1 1 65 65 SER HA H 77 4.483 4.483 4.465 0.018 18522
3778 1 7 . 1 1 65 65 SER C C 77 176.953 176.953 175.822 1.131 18522
3779 1 7 . 1 1 65 65 SER CA C 77 58.292 58.292 58.561 -0.269 18522
3780 1 7 . 1 1 65 65 SER CB C 77 63.643 63.643 63.727 -0.084 18522
3781 1 7 . 1 1 65 65 SER H H 77 8.555 8.555 8.711 -0.157 18522
3782 1 7 . 1 1 66 66 ILE N N 78 116.618 116.618 120.111 -3.493 18522
3783 1 7 . 1 1 66 66 ILE HA H 78 4.420 4.420 4.075 0.345 18522
3784 1 7 . 1 1 66 66 ILE C C 78 175.072 175.072 176.134 -1.062 18522
3785 1 7 . 1 1 66 66 ILE CA C 78 59.122 59.122 61.508 -2.386 18522
3786 1 7 . 1 1 66 66 ILE CB C 78 36.758 36.758 37.571 -0.813 18522
3787 1 7 . 1 1 66 66 ILE H H 78 7.599 7.599 7.659 -0.060 18522
3788 1 7 . 1 1 67 67 LYS N N 79 123.287 123.287 122.972 0.315 18522
3789 1 7 . 1 1 67 67 LYS HA H 79 4.049 4.049 3.952 0.097 18522
3790 1 7 . 1 1 67 67 LYS C C 79 178.333 178.333 176.740 1.593 18522
3791 1 7 . 1 1 67 67 LYS CA C 79 58.321 58.321 57.898 0.423 18522
3792 1 7 . 1 1 67 67 LYS CB C 79 31.635 31.635 31.299 0.336 18522
3793 1 7 . 1 1 67 67 LYS H H 79 7.898 7.898 7.478 0.420 18522
3794 1 7 . 1 1 68 68 GLY N N 80 114.933 114.933 113.498 1.435 18522
3795 1 7 . 1 1 68 68 GLY C C 80 174.385 174.385 174.115 0.270 18522
3796 1 7 . 1 1 68 68 GLY CA C 80 45.518 45.518 45.105 0.414 18522
3797 1 7 . 1 1 68 68 GLY H H 80 8.999 8.999 8.068 0.931 18522
3798 1 7 . 1 1 69 69 LYS N N 81 119.403 119.403 120.242 -0.839 18522
3799 1 7 . 1 1 69 69 LYS HA H 81 4.043 4.043 4.764 -0.721 18522
3800 1 7 . 1 1 69 69 LYS C C 81 177.064 177.064 175.172 1.892 18522
3801 1 7 . 1 1 69 69 LYS CA C 81 54.722 54.722 55.227 -0.505 18522
3802 1 7 . 1 1 69 69 LYS CB C 81 33.560 33.560 34.474 -0.914 18522
3803 1 7 . 1 1 69 69 LYS H H 81 7.845 7.845 8.183 -0.338 18522
3804 1 7 . 1 1 70 70 THR N N 82 112.066 112.066 114.207 -2.141 18522
3805 1 7 . 1 1 70 70 THR HA H 82 4.666 4.666 4.769 -0.103 18522
3806 1 7 . 1 1 70 70 THR C C 82 175.955 175.955 174.891 1.064 18522
3807 1 7 . 1 1 70 70 THR CA C 82 60.438 60.438 60.208 0.230 18522
3808 1 7 . 1 1 70 70 THR CB C 82 71.629 71.629 72.786 -1.157 18522
3809 1 7 . 1 1 70 70 THR H H 82 9.153 9.153 8.103 1.050 18522
3810 1 7 . 1 1 71 71 LYS N N 83 118.730 118.730 122.857 -4.127 18522
3811 1 7 . 1 1 71 71 LYS HA H 83 3.870 3.870 4.017 -0.147 18522
3812 1 7 . 1 1 71 71 LYS C C 83 177.464 177.464 178.641 -1.177 18522
3813 1 7 . 1 1 71 71 LYS CA C 83 60.357 60.357 59.533 0.824 18522
3814 1 7 . 1 1 71 71 LYS CB C 83 31.350 31.350 32.129 -0.779 18522
3815 1 7 . 1 1 71 71 LYS H H 83 8.969 8.969 8.771 0.198 18522
3816 1 7 . 1 1 72 72 VAL N N 84 117.444 117.444 118.736 -1.292 18522
3817 1 7 . 1 1 72 72 VAL HA H 84 3.633 3.633 3.760 -0.127 18522
3818 1 7 . 1 1 72 72 VAL C C 84 178.315 178.315 177.431 0.884 18522
3819 1 7 . 1 1 72 72 VAL CA C 84 66.079 66.079 65.650 0.429 18522
3820 1 7 . 1 1 72 72 VAL CB C 84 32.091 32.091 31.469 0.622 18522
3821 1 7 . 1 1 72 72 VAL H H 84 7.631 7.631 8.200 -0.569 18522
3822 1 7 . 1 1 73 73 GLU N N 85 120.890 120.890 118.895 1.995 18522
3823 1 7 . 1 1 73 73 GLU HA H 85 3.964 3.964 4.136 -0.172 18522
3824 1 7 . 1 1 73 73 GLU C C 85 179.971 179.971 178.954 1.017 18522
3825 1 7 . 1 1 73 73 GLU CA C 85 59.316 59.316 59.435 -0.119 18522
3826 1 7 . 1 1 73 73 GLU CB C 85 30.355 30.355 29.519 0.836 18522
3827 1 7 . 1 1 73 73 GLU H H 85 7.617 7.617 7.490 0.127 18522
3828 1 7 . 1 1 74 74 VAL N N 86 121.246 121.246 118.410 2.836 18522
3829 1 7 . 1 1 74 74 VAL HA H 86 3.630 3.630 3.967 -0.337 18522
3830 1 7 . 1 1 74 74 VAL C C 86 177.217 177.217 178.047 -0.830 18522
3831 1 7 . 1 1 74 74 VAL CA C 86 66.678 66.678 64.851 1.827 18522
3832 1 7 . 1 1 74 74 VAL CB C 86 31.307 31.307 30.618 0.689 18522
3833 1 7 . 1 1 74 74 VAL H H 86 8.368 8.368 8.379 -0.011 18522
3834 1 7 . 1 1 75 75 ALA N N 87 122.148 122.148 123.398 -1.250 18522
3835 1 7 . 1 1 75 75 ALA HA H 87 3.947 3.947 3.902 0.045 18522
3836 1 7 . 1 1 75 75 ALA C C 87 179.545 179.545 179.327 0.218 18522
3837 1 7 . 1 1 75 75 ALA CA C 87 55.851 55.851 55.525 0.326 18522
3838 1 7 . 1 1 75 75 ALA CB C 87 18.491 18.491 18.021 0.470 18522
3839 1 7 . 1 1 75 75 ALA H H 87 8.577 8.577 8.485 0.092 18522
3840 1 7 . 1 1 76 76 LYS N N 88 117.733 117.733 119.462 -1.729 18522
3841 1 7 . 1 1 76 76 LYS HA H 88 4.051 4.051 4.008 0.043 18522
3842 1 7 . 1 1 76 76 LYS CA C 88 59.393 59.393 59.128 0.265 18522
3843 1 7 . 1 1 76 76 LYS CB C 88 32.058 32.058 32.362 -0.304 18522
3844 1 7 . 1 1 76 76 LYS H H 88 7.854 7.854 7.440 0.414 18522
3845 1 7 . 1 1 77 77 MET N N 89 117.676 117.676 118.067 -0.391 18522
3846 1 7 . 1 1 77 77 MET HA H 89 4.048 4.048 4.088 -0.040 18522
3847 1 7 . 1 1 77 77 MET C C 89 178.791 178.791 178.741 0.050 18522
3848 1 7 . 1 1 77 77 MET CA C 89 59.128 59.128 59.352 -0.224 18522
3849 1 7 . 1 1 77 77 MET CB C 89 33.801 33.801 32.592 1.209 18522
3850 1 7 . 1 1 77 77 MET H H 89 7.759 7.759 8.132 -0.373 18522
3851 1 7 . 1 1 78 78 ILE N N 90 117.305 117.305 118.732 -1.427 18522
3852 1 7 . 1 1 78 78 ILE HA H 90 3.590 3.590 3.799 -0.209 18522
3853 1 7 . 1 1 78 78 ILE C C 90 178.658 178.658 178.294 0.364 18522
3854 1 7 . 1 1 78 78 ILE CA C 90 65.482 65.482 63.156 2.326 18522
3855 1 7 . 1 1 78 78 ILE CB C 90 38.845 38.845 36.825 2.020 18522
3856 1 7 . 1 1 78 78 ILE H H 90 7.972 7.972 8.210 -0.238 18522
3857 1 7 . 1 1 79 79 GLN N N 91 120.935 120.935 119.154 1.781 18522
3858 1 7 . 1 1 79 79 GLN HA H 91 3.998 3.998 4.165 -0.167 18522
3859 1 7 . 1 1 79 79 GLN C C 91 178.274 178.274 178.738 -0.464 18522
3860 1 7 . 1 1 79 79 GLN CA C 91 59.151 59.151 58.445 0.706 18522
3861 1 7 . 1 1 79 79 GLN CB C 91 28.934 28.934 28.925 0.009 18522
3862 1 7 . 1 1 79 79 GLN H H 91 8.826 8.826 8.237 0.589 18522
3863 1 7 . 1 1 80 80 GLU N N 92 115.213 115.213 121.876 -6.663 18522
3864 1 7 . 1 1 80 80 GLU HA H 92 4.061 4.061 4.052 0.009 18522
3865 1 7 . 1 1 80 80 GLU C C 92 176.824 176.824 178.127 -1.303 18522
3866 1 7 . 1 1 80 80 GLU CA C 92 58.006 58.006 59.513 -1.507 18522
3867 1 7 . 1 1 80 80 GLU CB C 92 29.890 29.890 29.561 0.329 18522
3868 1 7 . 1 1 80 80 GLU H H 92 8.020 8.020 8.194 -0.174 18522
3869 1 7 . 1 1 81 81 VAL N N 93 119.047 119.047 115.852 3.195 18522
3870 1 7 . 1 1 81 81 VAL HA H 93 3.930 3.930 3.714 0.216 18522
3871 1 7 . 1 1 81 81 VAL C C 93 176.016 176.016 176.508 -0.492 18522
3872 1 7 . 1 1 81 81 VAL CA C 93 63.153 63.153 64.475 -1.322 18522
3873 1 7 . 1 1 81 81 VAL CB C 93 32.154 32.154 32.008 0.146 18522
3874 1 7 . 1 1 81 81 VAL H H 93 7.073 7.073 7.526 -0.453 18522
3875 1 7 . 1 1 82 82 LYS N N 94 128.366 128.366 119.219 9.147 18522
3876 1 7 . 1 1 82 82 LYS C C 94 177.460 177.460 176.219 1.241 18522
3877 1 7 . 1 1 82 82 LYS CA C 94 55.753 55.753 56.593 -0.840 18522
3878 1 7 . 1 1 82 82 LYS CB C 94 32.332 32.332 30.491 1.841 18522
3879 1 7 . 1 1 82 82 LYS H H 94 8.762 8.762 7.804 0.958 18522
3880 1 7 . 1 1 83 83 GLY N N 95 112.528 112.528 107.838 4.690 18522
3881 1 7 . 1 1 83 83 GLY C C 95 173.468 173.468 173.641 -0.173 18522
3882 1 7 . 1 1 83 83 GLY CA C 95 46.243 46.243 45.005 1.238 18522
3883 1 7 . 1 1 83 83 GLY H H 95 8.673 8.673 8.569 0.104 18522
3884 1 7 . 1 1 84 84 GLU N N 96 121.485 121.485 120.176 1.309 18522
3885 1 7 . 1 1 84 84 GLU HA H 96 4.749 4.749 4.844 -0.095 18522
3886 1 7 . 1 1 84 84 GLU C C 96 174.583 174.583 174.519 0.064 18522
3887 1 7 . 1 1 84 84 GLU CA C 96 55.821 55.821 54.948 0.873 18522
3888 1 7 . 1 1 84 84 GLU CB C 96 31.410 31.410 32.886 -1.476 18522
3889 1 7 . 1 1 84 84 GLU H H 96 8.297 8.297 7.937 0.360 18522
3890 1 7 . 1 1 85 85 VAL N N 97 120.501 120.501 117.860 2.641 18522
3891 1 7 . 1 1 85 85 VAL HA H 97 4.665 4.665 4.359 0.306 18522
3892 1 7 . 1 1 85 85 VAL C C 97 173.047 173.047 174.054 -1.007 18522
3893 1 7 . 1 1 85 85 VAL CA C 97 60.114 60.114 61.257 -1.143 18522
3894 1 7 . 1 1 85 85 VAL CB C 97 35.184 35.184 36.244 -1.060 18522
3895 1 7 . 1 1 85 85 VAL H H 97 9.096 9.096 8.209 0.887 18522
3896 1 7 . 1 1 86 86 THR N N 98 125.019 125.019 123.392 1.627 18522
3897 1 7 . 1 1 86 86 THR HA H 98 4.076 4.076 5.216 -1.140 18522
3898 1 7 . 1 1 86 86 THR C C 98 173.807 173.807 172.912 0.895 18522
3899 1 7 . 1 1 86 86 THR CA C 98 61.735 61.735 61.322 0.413 18522
3900 1 7 . 1 1 86 86 THR CB C 98 69.531 69.531 71.243 -1.712 18522
3901 1 7 . 1 1 86 86 THR H H 98 9.352 9.352 8.193 1.159 18522
3902 1 7 . 1 1 87 87 ILE N N 99 128.383 128.383 120.619 7.764 18522
3903 1 7 . 1 1 87 87 ILE HA H 99 4.661 4.661 4.941 -0.280 18522
3904 1 7 . 1 1 87 87 ILE C C 99 174.614 174.614 174.018 0.596 18522
3905 1 7 . 1 1 87 87 ILE CA C 99 58.258 58.258 58.960 -0.702 18522
3906 1 7 . 1 1 87 87 ILE CB C 99 38.528 38.528 40.652 -2.124 18522
3907 1 7 . 1 1 87 87 ILE H H 99 9.329 9.329 8.969 0.360 18522
3908 1 7 . 1 1 88 88 HIS N N 100 128.279 128.279 123.710 4.569 18522
3909 1 7 . 1 1 88 88 HIS HA H 100 4.948 4.948 5.283 -0.335 18522
3910 1 7 . 1 1 88 88 HIS C C 100 174.787 174.787 174.803 -0.016 18522
3911 1 7 . 1 1 88 88 HIS CA C 100 54.620 54.620 53.823 0.797 18522
3912 1 7 . 1 1 88 88 HIS H H 100 8.647 8.647 8.476 0.171 18522
3913 1 7 . 1 1 89 89 TYR N N 101 121.320 121.320 121.435 -0.115 18522
3914 1 7 . 1 1 89 89 TYR HA H 101 5.947 5.947 5.671 0.276 18522
3915 1 7 . 1 1 89 89 TYR C C 101 173.769 173.769 173.228 0.541 18522
3916 1 7 . 1 1 89 89 TYR CA C 101 55.669 55.669 55.116 0.553 18522
3917 1 7 . 1 1 89 89 TYR CB C 101 42.195 42.195 41.008 1.187 18522
3918 1 7 . 1 1 89 89 TYR H H 101 8.414 8.414 9.161 -0.747 18522
3919 1 7 . 1 1 90 90 ASN N N 102 116.679 116.679 116.947 -0.268 18522
3920 1 7 . 1 1 90 90 ASN HA H 102 5.335 5.335 5.450 -0.115 18522
3921 1 7 . 1 1 90 90 ASN C C 102 175.406 175.406 174.286 1.120 18522
3922 1 7 . 1 1 90 90 ASN CA C 102 51.961 51.961 52.390 -0.429 18522
3923 1 7 . 1 1 90 90 ASN CB C 102 41.800 41.800 43.150 -1.350 18522
3924 1 7 . 1 1 90 90 ASN H H 102 9.282 9.282 8.808 0.474 18522
3925 1 7 . 1 1 91 91 LYS N N 103 124.129 124.129 119.524 4.605 18522
3926 1 7 . 1 1 91 91 LYS C C 103 176.678 176.678 175.558 1.120 18522
3927 1 7 . 1 1 91 91 LYS CA C 103 55.006 55.006 54.411 0.595 18522
3928 1 7 . 1 1 91 91 LYS H H 103 8.949 8.949 8.579 0.370 18522
3929 1 7 . 1 1 92 92 LEU N N 104 127.043 127.043 116.629 10.414 18522
3930 1 7 . 1 1 92 92 LEU HA H 104 4.425 4.425 4.150 0.275 18522
3931 1 7 . 1 1 92 92 LEU CA C 104 55.060 55.060 55.704 -0.644 18522
3932 1 7 . 1 1 92 92 LEU CB C 104 42.559 42.559 41.237 1.322 18522
3933 1 7 . 1 1 92 92 LEU H H 104 9.150 9.150 8.495 0.655 18522
3934 1 7 . 1 1 93 93 GLN HA H 105 4.315 4.315 4.503 -0.188 18522
3935 1 7 . 1 1 93 93 GLN C C 105 175.070 175.070 174.125 0.945 18522
3936 1 7 . 1 1 93 93 GLN CA C 105 55.490 55.490 55.580 -0.090 18522
3937 1 7 . 1 1 93 93 GLN CB C 105 28.909 28.909 29.771 -0.862 18522
3938 1 7 . 1 1 94 94 ALA N N 106 125.133 125.133 122.356 2.777 18522
3939 1 7 . 1 1 94 94 ALA HA H 106 4.366 4.366 4.483 -0.117 18522
3940 1 7 . 1 1 94 94 ALA C C 106 176.392 176.392 176.068 0.324 18522
3941 1 7 . 1 1 94 94 ALA CA C 106 51.723 51.723 51.508 0.215 18522
3942 1 7 . 1 1 94 94 ALA CB C 106 20.185 20.185 20.316 -0.131 18522
3943 1 7 . 1 1 94 94 ALA H H 106 8.226 8.226 7.858 0.368 18522
3944 1 7 . 1 1 95 95 ASP N N 107 122.013 122.013 119.920 2.093 18522
3945 1 7 . 1 1 95 95 ASP HA H 107 4.413 4.413 4.895 -0.482 18522
3946 1 7 . 1 1 95 95 ASP C C 107 175.019 175.019 174.448 0.571 18522
3947 1 7 . 1 1 95 95 ASP CA C 107 55.642 55.642 52.392 3.250 18522
3948 1 7 . 1 1 95 95 ASP CB C 107 41.266 41.266 42.495 -1.229 18522
3949 1 7 . 1 1 95 95 ASP H H 107 8.429 8.429 7.947 0.482 18522
3950 1 7 . 1 1 96 96 PRO HA H 108 4.207 4.207 4.093 0.114 18522
3951 1 7 . 1 1 96 96 PRO C C 108 178.840 178.840 178.237 0.603 18522
3952 1 7 . 1 1 96 96 PRO CA C 108 65.396 65.396 66.274 -0.878 18522
3953 1 7 . 1 1 96 96 PRO CB C 108 32.181 32.181 31.699 0.482 18522
3954 1 7 . 1 1 97 97 LYS N N 109 117.942 117.942 114.305 3.637 18522
3955 1 7 . 1 1 97 97 LYS HA H 109 4.143 4.143 4.066 0.077 18522
3956 1 7 . 1 1 97 97 LYS C C 109 178.099 178.099 178.749 -0.650 18522
3957 1 7 . 1 1 97 97 LYS CA C 109 58.167 58.167 59.041 -0.874 18522
3958 1 7 . 1 1 97 97 LYS CB C 109 31.649 31.649 31.475 0.174 18522
3959 1 7 . 1 1 97 97 LYS H H 109 8.335 8.335 8.286 0.049 18522
3960 1 7 . 1 1 98 98 GLN N N 110 119.159 119.159 118.892 0.267 18522
3961 1 7 . 1 1 98 98 GLN HA H 110 4.130 4.130 4.338 -0.208 18522
3962 1 7 . 1 1 98 98 GLN C C 110 178.298 178.298 178.386 -0.088 18522
3963 1 7 . 1 1 98 98 GLN CA C 110 57.660 57.660 57.102 0.558 18522
3964 1 7 . 1 1 98 98 GLN CB C 110 28.720 28.720 28.608 0.112 18522
3965 1 7 . 1 1 98 98 GLN H H 110 7.985 7.985 7.861 0.124 18522
3966 1 7 . 1 1 99 99 LEU N N 111 120.490 120.490 122.048 -1.558 18522
3967 1 7 . 1 1 99 99 LEU HA H 111 3.877 3.877 4.146 -0.269 18522
3968 1 7 . 1 1 99 99 LEU C C 111 177.729 177.729 178.277 -0.548 18522
3969 1 7 . 1 1 99 99 LEU CA C 111 57.049 57.049 58.386 -1.337 18522
3970 1 7 . 1 1 99 99 LEU CB C 111 41.466 41.466 41.746 -0.280 18522
3971 1 7 . 1 1 99 99 LEU H H 111 7.994 7.994 8.597 -0.603 18522
3972 1 7 . 1 1 100 100 GLU N N 112 118.251 118.251 118.499 -0.248 18522
3973 1 7 . 1 1 100 100 GLU HA H 112 3.972 3.972 4.166 -0.194 18522
3974 1 7 . 1 1 100 100 GLU C C 112 178.402 178.402 179.178 -0.776 18522
3975 1 7 . 1 1 100 100 GLU CA C 112 59.056 59.056 59.087 -0.030 18522
3976 1 7 . 1 1 100 100 GLU CB C 112 29.732 29.732 28.986 0.746 18522
3977 1 7 . 1 1 100 100 GLU H H 112 7.760 7.760 7.729 0.031 18522
3978 1 7 . 1 1 101 101 VAL N N 113 117.229 117.229 120.356 -3.127 18522
3979 1 7 . 1 1 101 101 VAL HA H 113 3.762 3.762 3.838 -0.076 18522
3980 1 7 . 1 1 101 101 VAL C C 113 178.107 178.107 177.908 0.199 18522
3981 1 7 . 1 1 101 101 VAL CA C 113 64.791 64.791 65.891 -1.100 18522
3982 1 7 . 1 1 101 101 VAL CB C 113 32.149 32.149 31.751 0.398 18522
3983 1 7 . 1 1 101 101 VAL H H 113 7.437 7.437 7.295 0.142 18522
3984 1 7 . 1 1 102 102 LEU N N 114 122.124 122.124 119.644 2.480 18522
3985 1 7 . 1 1 102 102 LEU HA H 114 4.033 4.033 4.148 -0.115 18522
3986 1 7 . 1 1 102 102 LEU C C 114 178.506 178.506 178.266 0.240 18522
3987 1 7 . 1 1 102 102 LEU CA C 114 57.243 57.243 56.715 0.528 18522
3988 1 7 . 1 1 102 102 LEU CB C 114 42.028 42.028 41.874 0.153 18522
3989 1 7 . 1 1 102 102 LEU H H 114 7.765 7.765 7.760 0.005 18522
3990 1 7 . 1 1 103 103 PHE N N 115 115.346 115.346 118.603 -3.257 18522
3991 1 7 . 1 1 103 103 PHE HA H 115 4.224 4.224 4.145 0.079 18522
3992 1 7 . 1 1 103 103 PHE C C 115 175.621 175.621 176.685 -1.064 18522
3993 1 7 . 1 1 103 103 PHE CA C 115 57.537 57.537 60.393 -2.856 18522
3994 1 7 . 1 1 103 103 PHE CB C 115 38.057 38.057 39.695 -1.638 18522
3995 1 7 . 1 1 103 103 PHE H H 115 7.805 7.805 7.809 -0.004 18522
3996 1 7 . 1 1 104 104 GLN N N 116 119.021 119.021 116.095 2.926 18522
3997 1 7 . 1 1 104 104 GLN HA H 116 4.407 4.407 4.325 0.082 18522
3998 1 7 . 1 1 104 104 GLN C C 116 176.402 176.402 175.641 0.761 18522
3999 1 7 . 1 1 104 104 GLN CA C 116 55.521 55.521 55.981 -0.460 18522
4000 1 7 . 1 1 104 104 GLN CB C 116 29.170 29.170 31.851 -2.681 18522
4001 1 7 . 1 1 104 104 GLN H H 116 7.974 7.974 7.650 0.324 18522
4002 1 7 . 1 1 105 105 GLY N N 117 108.868 108.868 109.450 -0.582 18522
4003 1 7 . 1 1 105 105 GLY CA C 117 45.124 45.124 44.926 0.198 18522
4004 1 7 . 1 1 105 105 GLY H H 117 8.195 8.195 8.082 0.113 18522
4005 1 7 . 1 1 106 106 PRO HA H 118 4.490 4.490 4.491 -0.001 18522
4006 1 7 . 1 1 106 106 PRO C C 118 176.001 176.001 176.585 -0.584 18522
4007 1 7 . 1 1 106 106 PRO CA C 118 63.523 63.523 63.002 0.521 18522
4008 1 7 . 1 1 106 106 PRO CB C 118 32.078 32.078 32.511 -0.433 18522
4009 1 7 . 1 1 107 107 GLN N N 119 126.950 126.950 124.198 2.752 18522
4010 1 7 . 1 1 107 107 GLN C C 119 181.211 181.211 175.805 5.406 18522
4011 1 7 . 1 1 107 107 GLN CA C 119 57.416 57.416 55.124 2.292 18522
4012 1 7 . 1 1 107 107 GLN H H 119 8.079 8.079 8.804 -0.725 18522
4013 1 7 . 1 1 111 111 ARG C C 123 174.608 174.608 174.405 0.203 18522
4014 1 7 . 1 1 111 111 ARG CA C 123 55.099 55.099 56.520 -1.421 18522
4015 1 7 . 1 1 112 112 HIS N N 124 122.212 122.212 119.922 2.290 18522
4016 1 7 . 1 1 112 112 HIS HA H 124 4.718 4.718 4.627 0.091 18522
4017 1 7 . 1 1 112 112 HIS C C 124 176.040 176.040 174.326 1.714 18522
4018 1 7 . 1 1 112 112 HIS CA C 124 54.213 54.213 54.969 -0.756 18522
4019 1 7 . 1 1 112 112 HIS CB C 124 31.164 31.164 29.664 1.500 18522
4020 1 7 . 1 1 112 112 HIS H H 124 7.640 7.640 8.296 -0.656 18522
4021 1 7 . 1 1 113 113 TRP C C 125 176.168 176.168 175.943 0.225 18522
4022 1 7 . 1 1 114 114 LEU N N 126 121.893 121.893 119.968 1.925 18522
4023 1 7 . 1 1 114 114 LEU HA H 126 4.869 4.869 4.517 0.352 18522
4024 1 7 . 1 1 114 114 LEU CA C 126 54.151 54.151 53.996 0.155 18522
4025 1 7 . 1 1 114 114 LEU CB C 126 45.144 45.144 44.417 0.727 18522
4026 1 7 . 1 1 114 114 LEU H H 126 8.606 8.606 8.699 -0.093 18522
4027 1 7 . 1 1 115 115 LYS N N 127 125.850 125.850 119.240 6.610 18522
4028 1 7 . 1 1 115 115 LYS HA H 127 4.203 4.203 4.929 -0.726 18522
4029 1 7 . 1 1 115 115 LYS C C 127 175.564 175.564 174.752 0.812 18522
4030 1 7 . 1 1 115 115 LYS CA C 127 57.252 57.252 55.421 1.831 18522
4031 1 7 . 1 1 115 115 LYS CB C 127 33.406 33.406 33.303 0.103 18522
4032 1 7 . 1 1 115 115 LYS H H 127 8.647 8.647 8.422 0.225 18522
4033 1 8 . 1 1 3 3 PRO C C 15 177.225 177.225 176.671 0.554 18522
4034 1 8 . 1 1 3 3 PRO CA C 15 63.508 63.508 63.261 0.246 18522
4035 1 8 . 1 1 3 3 PRO CB C 15 32.090 32.090 30.750 1.340 18522
4036 1 8 . 1 1 4 4 GLY N N 16 108.829 108.829 112.598 -3.769 18522
4037 1 8 . 1 1 4 4 GLY C C 16 173.398 173.398 173.851 -0.453 18522
4038 1 8 . 1 1 4 4 GLY CA C 16 45.128 45.128 45.129 -0.001 18522
4039 1 8 . 1 1 4 4 GLY H H 16 8.489 8.489 8.207 0.282 18522
4040 1 8 . 1 1 5 5 ILE N N 17 121.763 121.763 119.791 1.972 18522
4041 1 8 . 1 1 5 5 ILE HA H 17 4.554 4.554 4.670 -0.116 18522
4042 1 8 . 1 1 5 5 ILE C C 17 174.332 174.332 174.054 0.278 18522
4043 1 8 . 1 1 5 5 ILE CA C 17 58.245 58.245 58.937 -0.692 18522
4044 1 8 . 1 1 5 5 ILE CB C 17 38.762 38.762 38.249 0.513 18522
4045 1 8 . 1 1 5 5 ILE H H 17 8.014 8.014 7.455 0.559 18522
4046 1 8 . 1 1 6 6 PRO C C 18 176.437 176.437 176.221 0.216 18522
4047 1 8 . 1 1 6 6 PRO CA C 18 62.667 62.667 64.524 -1.857 18522
4048 1 8 . 1 1 6 6 PRO CB C 18 32.469 32.469 31.918 0.551 18522
4049 1 8 . 1 1 7 7 VAL N N 19 123.849 123.849 116.814 7.035 18522
4050 1 8 . 1 1 7 7 VAL HA H 19 4.550 4.550 4.584 -0.034 18522
4051 1 8 . 1 1 7 7 VAL C C 19 174.453 174.453 173.589 0.864 18522
4052 1 8 . 1 1 7 7 VAL CA C 19 59.846 59.846 59.050 0.797 18522
4053 1 8 . 1 1 7 7 VAL CB C 19 33.510 33.510 32.012 1.498 18522
4054 1 8 . 1 1 7 7 VAL H H 19 8.754 8.754 7.862 0.892 18522
4055 1 8 . 1 1 8 8 PRO HA H 20 5.338 5.338 5.501 -0.163 18522
4056 1 8 . 1 1 8 8 PRO C C 20 177.585 177.585 176.503 1.082 18522
4057 1 8 . 1 1 8 8 PRO CA C 20 62.406 62.406 61.606 0.800 18522
4058 1 8 . 1 1 8 8 PRO CB C 20 32.891 32.891 32.259 0.632 18522
4059 1 8 . 1 1 9 9 GLY N N 21 108.426 108.426 111.339 -2.913 18522
4060 1 8 . 1 1 9 9 GLY C C 21 171.443 171.443 171.807 -0.364 18522
4061 1 8 . 1 1 9 9 GLY CA C 21 44.581 44.581 44.294 0.287 18522
4062 1 8 . 1 1 9 9 GLY H H 21 8.258 8.258 8.667 -0.409 18522
4063 1 8 . 1 1 10 10 LYS N N 22 117.372 117.372 120.916 -3.544 18522
4064 1 8 . 1 1 10 10 LYS HA H 22 4.039 4.039 4.786 -0.747 18522
4065 1 8 . 1 1 10 10 LYS C C 22 174.463 174.463 174.357 0.106 18522
4066 1 8 . 1 1 10 10 LYS CA C 22 55.263 55.263 54.939 0.324 18522
4067 1 8 . 1 1 10 10 LYS CB C 22 35.227 35.227 34.997 0.230 18522
4068 1 8 . 1 1 10 10 LYS H H 22 8.175 8.175 8.120 0.055 18522
4069 1 8 . 1 1 11 11 VAL N N 23 120.387 120.387 116.544 3.843 18522
4070 1 8 . 1 1 11 11 VAL HA H 23 4.708 4.708 4.569 0.139 18522
4071 1 8 . 1 1 11 11 VAL C C 23 171.873 171.873 174.039 -2.166 18522
4072 1 8 . 1 1 11 11 VAL CA C 23 59.866 59.866 59.826 0.040 18522
4073 1 8 . 1 1 11 11 VAL CB C 23 35.269 35.269 35.081 0.188 18522
4074 1 8 . 1 1 11 11 VAL H H 23 8.862 8.862 8.122 0.740 18522
4075 1 8 . 1 1 12 12 THR N N 24 125.797 125.797 119.516 6.281 18522
4076 1 8 . 1 1 12 12 THR HA H 24 5.121 5.121 4.993 0.128 18522
4077 1 8 . 1 1 12 12 THR C C 24 173.407 173.407 173.380 0.027 18522
4078 1 8 . 1 1 12 12 THR CA C 24 62.115 62.115 59.926 2.189 18522
4079 1 8 . 1 1 12 12 THR CB C 24 69.606 69.606 69.515 0.091 18522
4080 1 8 . 1 1 12 12 THR H H 24 8.859 8.859 8.373 0.486 18522
4081 1 8 . 1 1 13 13 LEU N N 25 127.960 127.960 127.618 0.342 18522
4082 1 8 . 1 1 13 13 LEU HA H 25 4.809 4.809 4.856 -0.047 18522
4083 1 8 . 1 1 13 13 LEU C C 25 175.029 175.029 174.666 0.363 18522
4084 1 8 . 1 1 13 13 LEU CA C 25 52.623 52.623 52.436 0.187 18522
4085 1 8 . 1 1 13 13 LEU CB C 25 46.242 46.242 45.566 0.677 18522
4086 1 8 . 1 1 13 13 LEU H H 25 9.258 9.258 8.391 0.867 18522
4087 1 8 . 1 1 14 14 GLN N N 26 120.858 120.858 117.619 3.239 18522
4088 1 8 . 1 1 14 14 GLN HA H 26 4.482 4.482 4.462 0.020 18522
4089 1 8 . 1 1 14 14 GLN C C 26 174.515 174.515 174.981 -0.466 18522
4090 1 8 . 1 1 14 14 GLN CA C 26 54.576 54.576 53.958 0.618 18522
4091 1 8 . 1 1 14 14 GLN CB C 26 29.516 29.516 32.210 -2.694 18522
4092 1 8 . 1 1 14 14 GLN H H 26 8.530 8.530 8.285 0.245 18522
4093 1 8 . 1 1 15 15 LYS N N 27 119.583 119.583 122.200 -2.617 18522
4094 1 8 . 1 1 15 15 LYS HA H 27 4.180 4.180 4.218 -0.038 18522
4095 1 8 . 1 1 15 15 LYS C C 27 177.468 177.468 177.151 0.317 18522
4096 1 8 . 1 1 15 15 LYS CA C 27 55.956 55.956 57.339 -1.383 18522
4097 1 8 . 1 1 15 15 LYS CB C 27 34.099 34.099 32.619 1.480 18522
4098 1 8 . 1 1 15 15 LYS H H 27 8.099 8.099 8.251 -0.152 18522
4099 1 8 . 1 1 16 16 ASP N N 28 121.439 121.439 122.626 -1.187 18522
4100 1 8 . 1 1 16 16 ASP HA H 28 4.590 4.590 4.665 -0.075 18522
4101 1 8 . 1 1 16 16 ASP C C 28 178.392 178.392 177.945 0.447 18522
4102 1 8 . 1 1 16 16 ASP CA C 28 52.426 52.426 53.713 -1.287 18522
4103 1 8 . 1 1 16 16 ASP CB C 28 41.377 41.377 42.640 -1.263 18522
4104 1 8 . 1 1 16 16 ASP H H 28 8.888 8.888 8.627 0.261 18522
4105 1 8 . 1 1 17 17 ALA N N 29 119.578 119.578 123.673 -4.095 18522
4106 1 8 . 1 1 17 17 ALA HA H 29 4.188 4.188 4.137 0.051 18522
4107 1 8 . 1 1 17 17 ALA C C 29 178.763 178.763 178.346 0.417 18522
4108 1 8 . 1 1 17 17 ALA CA C 29 54.434 54.434 54.400 0.034 18522
4109 1 8 . 1 1 17 17 ALA CB C 29 18.293 18.293 18.586 -0.293 18522
4110 1 8 . 1 1 17 17 ALA H H 29 8.392 8.392 8.608 -0.216 18522
4111 1 8 . 1 1 18 18 GLN N N 30 117.564 117.564 118.300 -0.736 18522
4112 1 8 . 1 1 18 18 GLN HA H 30 4.399 4.399 4.341 0.058 18522
4113 1 8 . 1 1 18 18 GLN C C 30 175.168 175.168 175.398 -0.230 18522
4114 1 8 . 1 1 18 18 GLN CA C 30 55.339 55.339 54.841 0.498 18522
4115 1 8 . 1 1 18 18 GLN CB C 30 28.589 28.589 29.021 -0.432 18522
4116 1 8 . 1 1 18 18 GLN H H 30 8.353 8.353 7.790 0.563 18522
4117 1 8 . 1 1 19 19 ASN N N 31 115.365 115.365 114.969 0.396 18522
4118 1 8 . 1 1 19 19 ASN HA H 31 4.315 4.315 4.363 -0.048 18522
4119 1 8 . 1 1 19 19 ASN C C 31 174.043 174.043 172.688 1.355 18522
4120 1 8 . 1 1 19 19 ASN CA C 31 54.303 54.303 54.564 -0.261 18522
4121 1 8 . 1 1 19 19 ASN CB C 31 37.610 37.610 37.139 0.471 18522
4122 1 8 . 1 1 19 19 ASN H H 31 8.521 8.521 8.307 0.214 18522
4123 1 8 . 1 1 20 20 LEU N N 32 118.660 118.660 111.428 7.232 18522
4124 1 8 . 1 1 20 20 LEU HA H 32 4.900 4.900 4.895 0.005 18522
4125 1 8 . 1 1 20 20 LEU C C 32 178.117 178.117 176.505 1.612 18522
4126 1 8 . 1 1 20 20 LEU CA C 32 53.957 53.957 53.284 0.673 18522
4127 1 8 . 1 1 20 20 LEU CB C 32 44.774 44.774 43.539 1.235 18522
4128 1 8 . 1 1 20 20 LEU H H 32 8.155 8.155 7.316 0.839 18522
4129 1 8 . 1 1 21 21 ILE N N 33 116.785 116.785 117.214 -0.429 18522
4130 1 8 . 1 1 21 21 ILE HA H 33 4.674 4.674 4.332 0.342 18522
4131 1 8 . 1 1 21 21 ILE C C 33 176.185 176.185 176.653 -0.468 18522
4132 1 8 . 1 1 21 21 ILE CA C 33 62.602 62.602 61.862 0.740 18522
4133 1 8 . 1 1 21 21 ILE CB C 33 39.016 39.016 39.048 -0.033 18522
4134 1 8 . 1 1 21 21 ILE H H 33 11.488 11.488 8.423 3.065 18522
4135 1 8 . 1 1 22 22 GLY N N 34 111.234 111.234 108.294 2.940 18522
4136 1 8 . 1 1 22 22 GLY C C 34 173.993 173.993 173.552 0.441 18522
4137 1 8 . 1 1 22 22 GLY CA C 34 45.980 45.980 45.242 0.738 18522
4138 1 8 . 1 1 22 22 GLY H H 34 9.854 9.854 8.346 1.508 18522
4139 1 8 . 1 1 23 23 ILE N N 35 111.117 111.117 113.514 -2.397 18522
4140 1 8 . 1 1 23 23 ILE HA H 35 5.535 5.535 5.384 0.151 18522
4141 1 8 . 1 1 23 23 ILE C C 35 175.033 175.033 173.857 1.176 18522
4142 1 8 . 1 1 23 23 ILE CA C 35 58.415 58.415 58.025 0.390 18522
4143 1 8 . 1 1 23 23 ILE CB C 35 41.577 41.577 41.694 -0.117 18522
4144 1 8 . 1 1 23 23 ILE H H 35 7.835 7.835 8.383 -0.548 18522
4145 1 8 . 1 1 24 24 SER N N 36 114.908 114.908 116.751 -1.843 18522
4146 1 8 . 1 1 24 24 SER HA H 36 4.232 4.232 4.893 -0.661 18522
4147 1 8 . 1 1 24 24 SER C C 36 174.735 174.735 172.528 2.207 18522
4148 1 8 . 1 1 24 24 SER CA C 36 56.121 56.121 57.135 -1.014 18522
4149 1 8 . 1 1 24 24 SER CB C 36 66.097 66.097 65.705 0.392 18522
4150 1 8 . 1 1 24 24 SER H H 36 8.623 8.623 8.439 0.184 18522
4151 1 8 . 1 1 25 25 ILE N N 37 117.739 117.739 125.015 -7.276 18522
4152 1 8 . 1 1 25 25 ILE C C 37 174.340 174.340 175.281 -0.941 18522
4153 1 8 . 1 1 25 25 ILE CA C 37 59.123 59.123 59.163 -0.040 18522
4154 1 8 . 1 1 25 25 ILE CB C 37 41.637 41.637 40.284 1.353 18522
4155 1 8 . 1 1 25 25 ILE H H 37 9.130 9.130 8.673 0.457 18522
4156 1 8 . 1 1 26 26 GLY N N 38 108.069 108.069 113.494 -5.425 18522
4157 1 8 . 1 1 26 26 GLY CA C 38 44.112 44.112 44.123 -0.011 18522
4158 1 8 . 1 1 26 26 GLY H H 38 8.841 8.841 7.897 0.944 18522
4159 1 8 . 1 1 27 27 GLY N N 39 109.016 109.016 106.464 2.552 18522
4160 1 8 . 1 1 27 27 GLY C C 39 173.956 173.956 175.507 -1.551 18522
4161 1 8 . 1 1 27 27 GLY H H 39 8.187 8.187 8.356 -0.169 18522
4162 1 8 . 1 1 28 28 GLY N N 40 111.783 111.783 109.538 2.245 18522
4163 1 8 . 1 1 28 28 GLY C C 40 174.255 174.255 173.946 0.309 18522
4164 1 8 . 1 1 28 28 GLY CA C 40 47.098 47.098 46.626 0.472 18522
4165 1 8 . 1 1 28 28 GLY H H 40 8.275 8.275 8.446 -0.171 18522
4166 1 8 . 1 1 29 29 ALA N N 41 123.128 123.128 120.582 2.546 18522
4167 1 8 . 1 1 29 29 ALA HA H 41 4.559 4.559 4.768 -0.209 18522
4168 1 8 . 1 1 29 29 ALA CA C 41 51.073 51.073 51.025 0.048 18522
4169 1 8 . 1 1 29 29 ALA CB C 41 21.926 21.926 19.941 1.985 18522
4170 1 8 . 1 1 29 29 ALA H H 41 8.012 8.012 7.969 0.043 18522
4171 1 8 . 1 1 31 31 TYR HA H 43 4.549 4.549 5.362 -0.813 18522
4172 1 8 . 1 1 31 31 TYR CA C 43 57.147 57.147 56.332 0.815 18522
4173 1 8 . 1 1 31 31 TYR CB C 43 37.495 37.495 37.982 -0.487 18522
4174 1 8 . 1 1 32 32 CYS N N 44 119.332 119.332 119.301 0.031 18522
4175 1 8 . 1 1 32 32 CYS HA H 44 4.859 4.859 5.089 -0.230 18522
4176 1 8 . 1 1 32 32 CYS CA C 44 57.406 57.406 57.683 -0.277 18522
4177 1 8 . 1 1 32 32 CYS CB C 44 27.673 27.673 28.367 -0.694 18522
4178 1 8 . 1 1 32 32 CYS H H 44 7.504 7.504 8.468 -0.964 18522
4179 1 8 . 1 1 33 33 PRO HA H 45 4.413 4.413 4.430 -0.017 18522
4180 1 8 . 1 1 33 33 PRO CA C 45 64.885 64.885 61.873 3.013 18522
4181 1 8 . 1 1 33 33 PRO CB C 45 32.318 32.318 32.381 -0.063 18522
4182 1 8 . 1 1 34 34 CYS N N 46 117.327 117.327 116.950 0.377 18522
4183 1 8 . 1 1 34 34 CYS C C 46 172.064 172.064 174.390 -2.326 18522
4184 1 8 . 1 1 34 34 CYS CA C 46 60.066 60.066 59.382 0.684 18522
4185 1 8 . 1 1 34 34 CYS CB C 46 28.715 28.715 29.114 -0.399 18522
4186 1 8 . 1 1 34 34 CYS H H 46 7.973 7.973 8.231 -0.258 18522
4187 1 8 . 1 1 35 35 LEU N N 47 124.270 124.270 115.550 8.720 18522
4188 1 8 . 1 1 35 35 LEU HA H 47 4.928 4.928 4.933 -0.005 18522
4189 1 8 . 1 1 35 35 LEU C C 47 175.076 175.076 174.815 0.261 18522
4190 1 8 . 1 1 35 35 LEU CA C 47 53.278 53.278 54.220 -0.942 18522
4191 1 8 . 1 1 35 35 LEU CB C 47 44.321 44.321 43.595 0.726 18522
4192 1 8 . 1 1 35 35 LEU H H 47 8.629 8.629 8.229 0.400 18522
4193 1 8 . 1 1 36 36 TYR N N 48 119.326 119.326 113.614 5.712 18522
4194 1 8 . 1 1 36 36 TYR HA H 48 5.255 5.255 5.301 -0.046 18522
4195 1 8 . 1 1 36 36 TYR C C 48 175.766 175.766 173.463 2.303 18522
4196 1 8 . 1 1 36 36 TYR CA C 48 56.696 56.696 55.737 0.959 18522
4197 1 8 . 1 1 36 36 TYR CB C 48 42.590 42.590 40.794 1.796 18522
4198 1 8 . 1 1 36 36 TYR H H 48 8.761 8.761 7.720 1.041 18522
4199 1 8 . 1 1 37 37 ILE N N 49 120.259 120.259 121.402 -1.143 18522
4200 1 8 . 1 1 37 37 ILE HA H 49 4.215 4.215 4.411 -0.196 18522
4201 1 8 . 1 1 37 37 ILE C C 49 177.429 177.429 175.508 1.921 18522
4202 1 8 . 1 1 37 37 ILE CA C 49 62.456 62.456 59.885 2.571 18522
4203 1 8 . 1 1 37 37 ILE CB C 49 37.352 37.352 38.749 -1.397 18522
4204 1 8 . 1 1 37 37 ILE H H 49 8.959 8.959 8.656 0.303 18522
4205 1 8 . 1 1 38 38 VAL HA H 50 3.937 3.937 4.100 -0.163 18522
4206 1 8 . 1 1 38 38 VAL C C 50 174.408 174.408 175.196 -0.788 18522
4207 1 8 . 1 1 38 38 VAL CA C 50 62.259 62.259 64.612 -2.353 18522
4208 1 8 . 1 1 38 38 VAL CB C 50 31.584 31.584 32.157 -0.573 18522
4209 1 8 . 1 1 39 39 GLN N N 51 116.821 116.821 117.534 -0.713 18522
4210 1 8 . 1 1 39 39 GLN HA H 51 4.103 4.103 4.424 -0.321 18522
4211 1 8 . 1 1 39 39 GLN C C 51 172.856 172.856 173.040 -0.184 18522
4212 1 8 . 1 1 39 39 GLN CA C 51 55.127 55.127 54.883 0.244 18522
4213 1 8 . 1 1 39 39 GLN CB C 51 32.376 32.376 32.380 -0.004 18522
4214 1 8 . 1 1 39 39 GLN H H 51 6.967 6.967 7.422 -0.455 18522
4215 1 8 . 1 1 40 40 VAL N N 52 123.482 123.482 121.556 1.926 18522
4216 1 8 . 1 1 40 40 VAL HA H 52 4.277 4.277 4.611 -0.334 18522
4217 1 8 . 1 1 40 40 VAL C C 52 176.198 176.198 174.477 1.721 18522
4218 1 8 . 1 1 40 40 VAL CA C 52 61.574 61.574 59.537 2.037 18522
4219 1 8 . 1 1 40 40 VAL CB C 52 32.875 32.875 34.625 -1.750 18522
4220 1 8 . 1 1 40 40 VAL H H 52 8.447 8.447 8.110 0.337 18522
4221 1 8 . 1 1 41 41 PHE N N 53 128.296 128.296 124.120 4.176 18522
4222 1 8 . 1 1 41 41 PHE HA H 53 4.400 4.400 4.632 -0.232 18522
4223 1 8 . 1 1 41 41 PHE C C 53 175.299 175.299 175.142 0.157 18522
4224 1 8 . 1 1 41 41 PHE CA C 53 58.494 58.494 58.593 -0.099 18522
4225 1 8 . 1 1 41 41 PHE CB C 53 39.561 39.561 39.584 -0.023 18522
4226 1 8 . 1 1 41 41 PHE H H 53 8.707 8.707 8.232 0.475 18522
4227 1 8 . 1 1 42 42 ASP N N 54 122.696 122.696 115.481 7.215 18522
4228 1 8 . 1 1 42 42 ASP HA H 54 4.272 4.272 4.668 -0.396 18522
4229 1 8 . 1 1 42 42 ASP C C 54 176.837 176.837 175.915 0.922 18522
4230 1 8 . 1 1 42 42 ASP CA C 54 55.291 55.291 54.956 0.335 18522
4231 1 8 . 1 1 42 42 ASP CB C 54 41.093 41.093 42.636 -1.543 18522
4232 1 8 . 1 1 42 42 ASP H H 54 8.901 8.901 8.444 0.457 18522
4233 1 8 . 1 1 43 43 ASN N N 55 113.923 113.923 116.617 -2.694 18522
4234 1 8 . 1 1 43 43 ASN HA H 55 4.258 4.258 4.852 -0.594 18522
4235 1 8 . 1 1 43 43 ASN C C 55 173.714 173.714 174.798 -1.084 18522
4236 1 8 . 1 1 43 43 ASN CA C 55 54.958 54.958 53.502 1.456 18522
4237 1 8 . 1 1 43 43 ASN CB C 55 37.150 37.150 39.499 -2.349 18522
4238 1 8 . 1 1 43 43 ASN H H 55 9.319 9.319 8.302 1.017 18522
4239 1 8 . 1 1 44 44 THR N N 56 108.020 108.020 110.941 -2.921 18522
4240 1 8 . 1 1 44 44 THR HA H 56 5.377 5.377 4.750 0.627 18522
4241 1 8 . 1 1 44 44 THR CA C 56 59.712 59.712 58.984 0.728 18522
4242 1 8 . 1 1 44 44 THR CB C 56 69.529 69.529 69.858 -0.329 18522
4243 1 8 . 1 1 44 44 THR H H 56 7.149 7.149 7.457 -0.308 18522
4244 1 8 . 1 1 45 45 PRO HA H 57 4.304 4.304 4.094 0.210 18522
4245 1 8 . 1 1 45 45 PRO C C 57 180.141 180.141 177.854 2.287 18522
4246 1 8 . 1 1 45 45 PRO CA C 57 66.090 66.090 65.594 0.496 18522
4247 1 8 . 1 1 45 45 PRO CB C 57 33.194 33.194 31.491 1.703 18522
4248 1 8 . 1 1 46 46 ALA N N 58 116.854 116.854 119.281 -2.427 18522
4249 1 8 . 1 1 46 46 ALA HA H 58 4.035 4.035 4.036 -0.001 18522
4250 1 8 . 1 1 46 46 ALA C C 58 180.647 180.647 179.347 1.300 18522
4251 1 8 . 1 1 46 46 ALA CA C 58 55.195 55.195 55.144 0.051 18522
4252 1 8 . 1 1 46 46 ALA CB C 58 18.880 18.880 18.174 0.706 18522
4253 1 8 . 1 1 46 46 ALA H H 58 8.938 8.938 7.814 1.124 18522
4254 1 8 . 1 1 47 47 ALA N N 59 123.250 123.250 120.692 2.558 18522
4255 1 8 . 1 1 47 47 ALA HA H 59 4.030 4.030 4.096 -0.066 18522
4256 1 8 . 1 1 47 47 ALA C C 59 179.852 179.852 179.815 0.037 18522
4257 1 8 . 1 1 47 47 ALA CA C 59 54.939 54.939 54.573 0.366 18522
4258 1 8 . 1 1 47 47 ALA CB C 59 19.688 19.688 18.850 0.838 18522
4259 1 8 . 1 1 47 47 ALA H H 59 7.658 7.658 7.395 0.263 18522
4260 1 8 . 1 1 48 48 LEU N N 60 118.654 118.654 118.763 -0.109 18522
4261 1 8 . 1 1 48 48 LEU HA H 60 4.026 4.026 4.186 -0.160 18522
4262 1 8 . 1 1 48 48 LEU C C 60 179.238 179.238 178.153 1.085 18522
4263 1 8 . 1 1 48 48 LEU CA C 60 57.261 57.261 57.870 -0.609 18522
4264 1 8 . 1 1 48 48 LEU CB C 60 41.445 41.445 41.625 -0.180 18522
4265 1 8 . 1 1 48 48 LEU H H 60 8.636 8.636 8.480 0.156 18522
4266 1 8 . 1 1 49 49 ASP N N 61 117.382 117.382 118.645 -1.263 18522
4267 1 8 . 1 1 49 49 ASP HA H 61 4.421 4.421 4.621 -0.200 18522
4268 1 8 . 1 1 49 49 ASP C C 61 177.668 177.668 177.470 0.198 18522
4269 1 8 . 1 1 49 49 ASP CA C 61 57.087 57.087 54.465 2.623 18522
4270 1 8 . 1 1 49 49 ASP CB C 61 44.478 44.478 41.755 2.723 18522
4271 1 8 . 1 1 49 49 ASP H H 61 7.665 7.665 7.713 -0.048 18522
4272 1 8 . 1 1 50 50 GLY N N 62 103.228 103.228 107.926 -4.698 18522
4273 1 8 . 1 1 50 50 GLY C C 62 174.776 174.776 175.092 -0.316 18522
4274 1 8 . 1 1 50 50 GLY CA C 62 46.533 46.533 46.075 0.458 18522
4275 1 8 . 1 1 50 50 GLY H H 62 7.216 7.216 7.989 -0.773 18522
4276 1 8 . 1 1 51 51 THR N N 63 117.230 117.230 110.537 6.693 18522
4277 1 8 . 1 1 51 51 THR HA H 63 3.907 3.907 3.783 0.124 18522
4278 1 8 . 1 1 51 51 THR C C 63 175.961 175.961 175.062 0.899 18522
4279 1 8 . 1 1 51 51 THR CA C 63 66.478 66.478 63.546 2.932 18522
4280 1 8 . 1 1 51 51 THR CB C 63 68.268 68.268 67.103 1.165 18522
4281 1 8 . 1 1 51 51 THR H H 63 8.319 8.319 7.788 0.531 18522
4282 1 8 . 1 1 52 52 VAL N N 64 113.826 113.826 116.533 -2.707 18522
4283 1 8 . 1 1 52 52 VAL HA H 64 3.950 3.950 3.966 -0.016 18522
4284 1 8 . 1 1 52 52 VAL C C 64 173.883 173.883 174.765 -0.882 18522
4285 1 8 . 1 1 52 52 VAL CA C 64 60.708 60.708 60.415 0.293 18522
4286 1 8 . 1 1 52 52 VAL CB C 64 33.079 33.079 30.030 3.049 18522
4287 1 8 . 1 1 52 52 VAL H H 64 8.147 8.147 7.297 0.850 18522
4288 1 8 . 1 1 53 53 ALA N N 65 123.521 123.521 124.213 -0.692 18522
4289 1 8 . 1 1 53 53 ALA HA H 65 4.414 4.414 4.452 -0.038 18522
4290 1 8 . 1 1 53 53 ALA C C 65 175.247 175.247 177.002 -1.755 18522
4291 1 8 . 1 1 53 53 ALA CA C 65 50.440 50.440 50.518 -0.078 18522
4292 1 8 . 1 1 53 53 ALA CB C 65 23.266 23.266 20.452 2.814 18522
4293 1 8 . 1 1 53 53 ALA H H 65 8.633 8.633 7.327 1.306 18522
4294 1 8 . 1 1 54 54 ALA N N 66 120.818 120.818 122.811 -1.993 18522
4295 1 8 . 1 1 54 54 ALA HA H 66 3.720 3.720 4.014 -0.294 18522
4296 1 8 . 1 1 54 54 ALA C C 66 178.411 178.411 178.536 -0.125 18522
4297 1 8 . 1 1 54 54 ALA CA C 66 53.016 53.016 53.285 -0.270 18522
4298 1 8 . 1 1 54 54 ALA CB C 66 17.840 17.840 18.309 -0.469 18522
4299 1 8 . 1 1 54 54 ALA H H 66 8.451 8.451 8.399 0.052 18522
4300 1 8 . 1 1 55 55 GLY N N 67 112.260 112.260 113.677 -1.417 18522
4301 1 8 . 1 1 55 55 GLY C C 67 173.296 173.296 174.508 -1.212 18522
4302 1 8 . 1 1 55 55 GLY CA C 67 45.025 45.025 44.645 0.380 18522
4303 1 8 . 1 1 55 55 GLY H H 67 9.600 9.600 8.937 0.663 18522
4304 1 8 . 1 1 56 56 ASP N N 68 121.293 121.293 122.649 -1.356 18522
4305 1 8 . 1 1 56 56 ASP HA H 68 4.861 4.861 4.777 0.084 18522
4306 1 8 . 1 1 56 56 ASP C C 68 174.937 174.937 174.325 0.612 18522
4307 1 8 . 1 1 56 56 ASP CA C 68 55.641 55.641 54.859 0.782 18522
4308 1 8 . 1 1 56 56 ASP CB C 68 40.696 40.696 42.878 -2.182 18522
4309 1 8 . 1 1 56 56 ASP H H 68 8.043 8.043 7.664 0.379 18522
4310 1 8 . 1 1 57 57 GLU N N 69 122.814 122.814 121.442 1.372 18522
4311 1 8 . 1 1 57 57 GLU C C 69 177.202 177.202 174.891 2.311 18522
4312 1 8 . 1 1 57 57 GLU CA C 69 54.472 54.472 55.016 -0.544 18522
4313 1 8 . 1 1 57 57 GLU CB C 69 32.800 32.800 31.685 1.115 18522
4314 1 8 . 1 1 57 57 GLU H H 69 8.455 8.455 8.232 0.223 18522
4315 1 8 . 1 1 58 58 ILE N N 70 125.862 125.862 127.972 -2.110 18522
4316 1 8 . 1 1 58 58 ILE HA H 70 4.526 4.526 4.634 -0.108 18522
4317 1 8 . 1 1 58 58 ILE C C 70 175.035 175.035 175.690 -0.655 18522
4318 1 8 . 1 1 58 58 ILE CA C 70 60.918 60.918 60.095 0.823 18522
4319 1 8 . 1 1 58 58 ILE CB C 70 39.236 39.236 36.692 2.544 18522
4320 1 8 . 1 1 58 58 ILE H H 70 8.619 8.619 8.295 0.324 18522
4321 1 8 . 1 1 59 59 THR N N 71 115.507 115.507 119.561 -4.054 18522
4322 1 8 . 1 1 59 59 THR HA H 71 4.513 4.513 4.859 -0.346 18522
4323 1 8 . 1 1 59 59 THR C C 71 176.425 176.425 174.566 1.859 18522
4324 1 8 . 1 1 59 59 THR CA C 71 61.158 61.158 62.171 -1.013 18522
4325 1 8 . 1 1 59 59 THR CB C 71 69.604 69.604 70.101 -0.497 18522
4326 1 8 . 1 1 59 59 THR H H 71 9.242 9.242 8.732 0.510 18522
4327 1 8 . 1 1 60 60 GLY N N 72 111.789 111.789 108.504 3.285 18522
4328 1 8 . 1 1 60 60 GLY C C 72 170.981 170.981 171.709 -0.728 18522
4329 1 8 . 1 1 60 60 GLY CA C 72 46.554 46.554 45.335 1.219 18522
4330 1 8 . 1 1 60 60 GLY H H 72 7.883 7.883 7.499 0.384 18522
4331 1 8 . 1 1 61 61 VAL N N 73 119.277 119.277 120.040 -0.763 18522
4332 1 8 . 1 1 61 61 VAL C C 73 175.951 175.951 175.705 0.246 18522
4333 1 8 . 1 1 61 61 VAL CA C 73 60.982 60.982 59.636 1.346 18522
4334 1 8 . 1 1 61 61 VAL CB C 73 36.197 36.197 34.094 2.103 18522
4335 1 8 . 1 1 61 61 VAL H H 73 8.424 8.424 8.742 -0.318 18522
4336 1 8 . 1 1 62 62 ASN N N 74 127.731 127.731 126.689 1.042 18522
4337 1 8 . 1 1 62 62 ASN HA H 74 4.520 4.520 4.522 -0.002 18522
4338 1 8 . 1 1 62 62 ASN C C 74 174.878 174.878 175.393 -0.515 18522
4339 1 8 . 1 1 62 62 ASN CA C 74 54.418 54.418 54.965 -0.547 18522
4340 1 8 . 1 1 62 62 ASN CB C 74 36.655 36.655 37.562 -0.907 18522
4341 1 8 . 1 1 62 62 ASN H H 74 10.384 10.384 9.228 1.156 18522
4342 1 8 . 1 1 63 63 GLY N N 75 104.633 104.633 101.918 2.715 18522
4343 1 8 . 1 1 63 63 GLY C C 75 173.610 173.610 173.579 0.031 18522
4344 1 8 . 1 1 63 63 GLY CA C 75 45.261 45.261 44.917 0.344 18522
4345 1 8 . 1 1 63 63 GLY H H 75 8.926 8.926 7.709 1.217 18522
4346 1 8 . 1 1 64 64 ARG N N 76 120.451 120.451 122.243 -1.792 18522
4347 1 8 . 1 1 64 64 ARG HA H 76 4.501 4.501 4.644 -0.143 18522
4348 1 8 . 1 1 64 64 ARG C C 76 175.085 175.085 175.619 -0.534 18522
4349 1 8 . 1 1 64 64 ARG CA C 76 54.252 54.252 54.424 -0.172 18522
4350 1 8 . 1 1 64 64 ARG CB C 76 31.482 31.482 31.166 0.316 18522
4351 1 8 . 1 1 64 64 ARG H H 76 7.753 7.753 8.014 -0.261 18522
4352 1 8 . 1 1 65 65 SER N N 77 116.586 116.586 120.931 -4.345 18522
4353 1 8 . 1 1 65 65 SER HA H 77 4.483 4.483 4.612 -0.129 18522
4354 1 8 . 1 1 65 65 SER C C 77 176.953 176.953 175.893 1.060 18522
4355 1 8 . 1 1 65 65 SER CA C 77 58.292 58.292 58.935 -0.643 18522
4356 1 8 . 1 1 65 65 SER CB C 77 63.643 63.643 63.878 -0.235 18522
4357 1 8 . 1 1 65 65 SER H H 77 8.555 8.555 9.021 -0.466 18522
4358 1 8 . 1 1 66 66 ILE N N 78 116.618 116.618 121.123 -4.505 18522
4359 1 8 . 1 1 66 66 ILE HA H 78 4.420 4.420 4.209 0.211 18522
4360 1 8 . 1 1 66 66 ILE C C 78 175.072 175.072 177.333 -2.261 18522
4361 1 8 . 1 1 66 66 ILE CA C 78 59.122 59.122 61.394 -2.272 18522
4362 1 8 . 1 1 66 66 ILE CB C 78 36.758 36.758 36.748 0.010 18522
4363 1 8 . 1 1 66 66 ILE H H 78 7.599 7.599 8.315 -0.716 18522
4364 1 8 . 1 1 67 67 LYS N N 79 123.287 123.287 122.140 1.147 18522
4365 1 8 . 1 1 67 67 LYS HA H 79 4.049 4.049 4.069 -0.020 18522
4366 1 8 . 1 1 67 67 LYS C C 79 178.333 178.333 177.809 0.524 18522
4367 1 8 . 1 1 67 67 LYS CA C 79 58.321 58.321 58.549 -0.228 18522
4368 1 8 . 1 1 67 67 LYS CB C 79 31.635 31.635 32.061 -0.426 18522
4369 1 8 . 1 1 67 67 LYS H H 79 7.898 7.898 8.346 -0.448 18522
4370 1 8 . 1 1 68 68 GLY N N 80 114.933 114.933 106.494 8.439 18522
4371 1 8 . 1 1 68 68 GLY C C 80 174.385 174.385 174.455 -0.070 18522
4372 1 8 . 1 1 68 68 GLY CA C 80 45.518 45.518 45.309 0.209 18522
4373 1 8 . 1 1 68 68 GLY H H 80 8.999 8.999 8.223 0.776 18522
4374 1 8 . 1 1 69 69 LYS N N 81 119.403 119.403 119.316 0.087 18522
4375 1 8 . 1 1 69 69 LYS HA H 81 4.043 4.043 4.621 -0.578 18522
4376 1 8 . 1 1 69 69 LYS C C 81 177.064 177.064 174.756 2.308 18522
4377 1 8 . 1 1 69 69 LYS CA C 81 54.722 54.722 55.199 -0.477 18522
4378 1 8 . 1 1 69 69 LYS CB C 81 33.560 33.560 33.522 0.038 18522
4379 1 8 . 1 1 69 69 LYS H H 81 7.845 7.845 7.896 -0.051 18522
4380 1 8 . 1 1 70 70 THR N N 82 112.066 112.066 109.582 2.484 18522
4381 1 8 . 1 1 70 70 THR HA H 82 4.666 4.666 4.717 -0.051 18522
4382 1 8 . 1 1 70 70 THR C C 82 175.955 175.955 175.375 0.580 18522
4383 1 8 . 1 1 70 70 THR CA C 82 60.438 60.438 60.196 0.242 18522
4384 1 8 . 1 1 70 70 THR CB C 82 71.629 71.629 72.480 -0.851 18522
4385 1 8 . 1 1 70 70 THR H H 82 9.153 9.153 7.822 1.331 18522
4386 1 8 . 1 1 71 71 LYS N N 83 118.730 118.730 123.181 -4.451 18522
4387 1 8 . 1 1 71 71 LYS HA H 83 3.870 3.870 3.946 -0.076 18522
4388 1 8 . 1 1 71 71 LYS C C 83 177.464 177.464 178.382 -0.918 18522
4389 1 8 . 1 1 71 71 LYS CA C 83 60.357 60.357 60.089 0.268 18522
4390 1 8 . 1 1 71 71 LYS CB C 83 31.350 31.350 31.606 -0.256 18522
4391 1 8 . 1 1 71 71 LYS H H 83 8.969 8.969 8.793 0.176 18522
4392 1 8 . 1 1 72 72 VAL N N 84 117.444 117.444 118.752 -1.308 18522
4393 1 8 . 1 1 72 72 VAL HA H 84 3.633 3.633 3.670 -0.037 18522
4394 1 8 . 1 1 72 72 VAL C C 84 178.315 178.315 177.557 0.758 18522
4395 1 8 . 1 1 72 72 VAL CA C 84 66.079 66.079 65.979 0.100 18522
4396 1 8 . 1 1 72 72 VAL CB C 84 32.091 32.091 31.678 0.413 18522
4397 1 8 . 1 1 72 72 VAL H H 84 7.631 7.631 8.358 -0.727 18522
4398 1 8 . 1 1 73 73 GLU N N 85 120.890 120.890 119.058 1.832 18522
4399 1 8 . 1 1 73 73 GLU HA H 85 3.964 3.964 4.082 -0.118 18522
4400 1 8 . 1 1 73 73 GLU C C 85 179.971 179.971 178.886 1.085 18522
4401 1 8 . 1 1 73 73 GLU CA C 85 59.316 59.316 59.454 -0.138 18522
4402 1 8 . 1 1 73 73 GLU CB C 85 30.355 30.355 29.664 0.691 18522
4403 1 8 . 1 1 73 73 GLU H H 85 7.617 7.617 7.802 -0.185 18522
4404 1 8 . 1 1 74 74 VAL N N 86 121.246 121.246 117.539 3.707 18522
4405 1 8 . 1 1 74 74 VAL HA H 86 3.630 3.630 3.794 -0.164 18522
4406 1 8 . 1 1 74 74 VAL C C 86 177.217 177.217 177.739 -0.522 18522
4407 1 8 . 1 1 74 74 VAL CA C 86 66.678 66.678 66.168 0.510 18522
4408 1 8 . 1 1 74 74 VAL CB C 86 31.307 31.307 31.384 -0.077 18522
4409 1 8 . 1 1 74 74 VAL H H 86 8.368 8.368 8.345 0.023 18522
4410 1 8 . 1 1 75 75 ALA N N 87 122.148 122.148 122.776 -0.628 18522
4411 1 8 . 1 1 75 75 ALA HA H 87 3.947 3.947 3.942 0.005 18522
4412 1 8 . 1 1 75 75 ALA C C 87 179.545 179.545 179.192 0.353 18522
4413 1 8 . 1 1 75 75 ALA CA C 87 55.851 55.851 55.532 0.319 18522
4414 1 8 . 1 1 75 75 ALA CB C 87 18.491 18.491 17.963 0.527 18522
4415 1 8 . 1 1 75 75 ALA H H 87 8.577 8.577 8.720 -0.143 18522
4416 1 8 . 1 1 76 76 LYS N N 88 117.733 117.733 119.275 -1.542 18522
4417 1 8 . 1 1 76 76 LYS HA H 88 4.051 4.051 4.014 0.037 18522
4418 1 8 . 1 1 76 76 LYS CA C 88 59.393 59.393 59.428 -0.035 18522
4419 1 8 . 1 1 76 76 LYS CB C 88 32.058 32.058 32.363 -0.305 18522
4420 1 8 . 1 1 76 76 LYS H H 88 7.854 7.854 7.454 0.400 18522
4421 1 8 . 1 1 77 77 MET N N 89 117.676 117.676 118.691 -1.015 18522
4422 1 8 . 1 1 77 77 MET HA H 89 4.048 4.048 4.145 -0.097 18522
4423 1 8 . 1 1 77 77 MET C C 89 178.791 178.791 178.880 -0.089 18522
4424 1 8 . 1 1 77 77 MET CA C 89 59.128 59.128 58.359 0.769 18522
4425 1 8 . 1 1 77 77 MET CB C 89 33.801 33.801 32.016 1.785 18522
4426 1 8 . 1 1 77 77 MET H H 89 7.759 7.759 8.144 -0.385 18522
4427 1 8 . 1 1 78 78 ILE N N 90 117.305 117.305 120.079 -2.774 18522
4428 1 8 . 1 1 78 78 ILE HA H 90 3.590 3.590 3.584 0.006 18522
4429 1 8 . 1 1 78 78 ILE C C 90 178.658 178.658 178.165 0.493 18522
4430 1 8 . 1 1 78 78 ILE CA C 90 65.482 65.482 65.329 0.153 18522
4431 1 8 . 1 1 78 78 ILE CB C 90 38.845 38.845 37.514 1.331 18522
4432 1 8 . 1 1 78 78 ILE H H 90 7.972 7.972 8.606 -0.634 18522
4433 1 8 . 1 1 79 79 GLN N N 91 120.935 120.935 118.361 2.574 18522
4434 1 8 . 1 1 79 79 GLN HA H 91 3.998 3.998 4.143 -0.145 18522
4435 1 8 . 1 1 79 79 GLN C C 91 178.274 178.274 179.397 -1.123 18522
4436 1 8 . 1 1 79 79 GLN CA C 91 59.151 59.151 58.397 0.754 18522
4437 1 8 . 1 1 79 79 GLN CB C 91 28.934 28.934 28.875 0.059 18522
4438 1 8 . 1 1 79 79 GLN H H 91 8.826 8.826 8.212 0.614 18522
4439 1 8 . 1 1 80 80 GLU N N 92 115.213 115.213 123.022 -7.809 18522
4440 1 8 . 1 1 80 80 GLU HA H 92 4.061 4.061 4.145 -0.084 18522
4441 1 8 . 1 1 80 80 GLU C C 92 176.824 176.824 177.918 -1.094 18522
4442 1 8 . 1 1 80 80 GLU CA C 92 58.006 58.006 58.917 -0.911 18522
4443 1 8 . 1 1 80 80 GLU CB C 92 29.890 29.890 29.731 0.159 18522
4444 1 8 . 1 1 80 80 GLU H H 92 8.020 8.020 8.596 -0.576 18522
4445 1 8 . 1 1 81 81 VAL N N 93 119.047 119.047 116.599 2.448 18522
4446 1 8 . 1 1 81 81 VAL HA H 93 3.930 3.930 4.050 -0.120 18522
4447 1 8 . 1 1 81 81 VAL C C 93 176.016 176.016 175.086 0.930 18522
4448 1 8 . 1 1 81 81 VAL CA C 93 63.153 63.153 61.878 1.275 18522
4449 1 8 . 1 1 81 81 VAL CB C 93 32.154 32.154 29.512 2.642 18522
4450 1 8 . 1 1 81 81 VAL H H 93 7.073 7.073 7.904 -0.831 18522
4451 1 8 . 1 1 82 82 LYS N N 94 128.366 128.366 127.189 1.177 18522
4452 1 8 . 1 1 82 82 LYS C C 94 177.460 177.460 177.505 -0.045 18522
4453 1 8 . 1 1 82 82 LYS CA C 94 55.753 55.753 58.061 -2.308 18522
4454 1 8 . 1 1 82 82 LYS CB C 94 32.332 32.332 32.068 0.264 18522
4455 1 8 . 1 1 82 82 LYS H H 94 8.762 8.762 8.283 0.479 18522
4456 1 8 . 1 1 83 83 GLY N N 95 112.528 112.528 111.881 0.647 18522
4457 1 8 . 1 1 83 83 GLY C C 95 173.468 173.468 174.117 -0.649 18522
4458 1 8 . 1 1 83 83 GLY CA C 95 46.243 46.243 44.866 1.377 18522
4459 1 8 . 1 1 83 83 GLY H H 95 8.673 8.673 8.828 -0.155 18522
4460 1 8 . 1 1 84 84 GLU N N 96 121.485 121.485 119.873 1.612 18522
4461 1 8 . 1 1 84 84 GLU HA H 96 4.749 4.749 4.757 -0.008 18522
4462 1 8 . 1 1 84 84 GLU C C 96 174.583 174.583 174.212 0.371 18522
4463 1 8 . 1 1 84 84 GLU CA C 96 55.821 55.821 54.548 1.272 18522
4464 1 8 . 1 1 84 84 GLU CB C 96 31.410 31.410 33.678 -2.268 18522
4465 1 8 . 1 1 84 84 GLU H H 96 8.297 8.297 7.676 0.621 18522
4466 1 8 . 1 1 85 85 VAL N N 97 120.501 120.501 117.791 2.710 18522
4467 1 8 . 1 1 85 85 VAL HA H 97 4.665 4.665 4.293 0.372 18522
4468 1 8 . 1 1 85 85 VAL C C 97 173.047 173.047 174.354 -1.307 18522
4469 1 8 . 1 1 85 85 VAL CA C 97 60.114 60.114 62.489 -2.375 18522
4470 1 8 . 1 1 85 85 VAL CB C 97 35.184 35.184 36.035 -0.851 18522
4471 1 8 . 1 1 85 85 VAL H H 97 9.096 9.096 8.054 1.042 18522
4472 1 8 . 1 1 86 86 THR N N 98 125.019 125.019 124.731 0.288 18522
4473 1 8 . 1 1 86 86 THR HA H 98 4.076 4.076 5.015 -0.939 18522
4474 1 8 . 1 1 86 86 THR C C 98 173.807 173.807 173.428 0.379 18522
4475 1 8 . 1 1 86 86 THR CA C 98 61.735 61.735 61.686 0.049 18522
4476 1 8 . 1 1 86 86 THR CB C 98 69.531 69.531 69.926 -0.395 18522
4477 1 8 . 1 1 86 86 THR H H 98 9.352 9.352 8.390 0.962 18522
4478 1 8 . 1 1 87 87 ILE N N 99 128.383 128.383 123.734 4.649 18522
4479 1 8 . 1 1 87 87 ILE HA H 99 4.661 4.661 4.674 -0.013 18522
4480 1 8 . 1 1 87 87 ILE C C 99 174.614 174.614 174.396 0.218 18522
4481 1 8 . 1 1 87 87 ILE CA C 99 58.258 58.258 58.954 -0.696 18522
4482 1 8 . 1 1 87 87 ILE CB C 99 38.528 38.528 38.879 -0.351 18522
4483 1 8 . 1 1 87 87 ILE H H 99 9.329 9.329 8.382 0.947 18522
4484 1 8 . 1 1 88 88 HIS N N 100 128.279 128.279 121.918 6.361 18522
4485 1 8 . 1 1 88 88 HIS HA H 100 4.948 4.948 5.376 -0.428 18522
4486 1 8 . 1 1 88 88 HIS C C 100 174.787 174.787 174.666 0.121 18522
4487 1 8 . 1 1 88 88 HIS CA C 100 54.620 54.620 54.661 -0.041 18522
4488 1 8 . 1 1 88 88 HIS H H 100 8.647 8.647 8.325 0.322 18522
4489 1 8 . 1 1 89 89 TYR N N 101 121.320 121.320 122.331 -1.011 18522
4490 1 8 . 1 1 89 89 TYR HA H 101 5.947 5.947 5.733 0.214 18522
4491 1 8 . 1 1 89 89 TYR C C 101 173.769 173.769 173.445 0.324 18522
4492 1 8 . 1 1 89 89 TYR CA C 101 55.669 55.669 55.442 0.227 18522
4493 1 8 . 1 1 89 89 TYR CB C 101 42.195 42.195 41.127 1.068 18522
4494 1 8 . 1 1 89 89 TYR H H 101 8.414 8.414 9.115 -0.701 18522
4495 1 8 . 1 1 90 90 ASN N N 102 116.679 116.679 118.898 -2.219 18522
4496 1 8 . 1 1 90 90 ASN HA H 102 5.335 5.335 5.597 -0.262 18522
4497 1 8 . 1 1 90 90 ASN C C 102 175.406 175.406 175.652 -0.246 18522
4498 1 8 . 1 1 90 90 ASN CA C 102 51.961 51.961 51.310 0.651 18522
4499 1 8 . 1 1 90 90 ASN CB C 102 41.800 41.800 42.162 -0.362 18522
4500 1 8 . 1 1 90 90 ASN H H 102 9.282 9.282 8.896 0.386 18522
4501 1 8 . 1 1 91 91 LYS N N 103 124.129 124.129 118.474 5.655 18522
4502 1 8 . 1 1 91 91 LYS C C 103 176.678 176.678 175.273 1.405 18522
4503 1 8 . 1 1 91 91 LYS CA C 103 55.006 55.006 56.618 -1.612 18522
4504 1 8 . 1 1 91 91 LYS H H 103 8.949 8.949 8.696 0.253 18522
4505 1 8 . 1 1 92 92 LEU N N 104 127.043 127.043 113.046 13.997 18522
4506 1 8 . 1 1 92 92 LEU HA H 104 4.425 4.425 4.938 -0.513 18522
4507 1 8 . 1 1 92 92 LEU CA C 104 55.060 55.060 54.070 0.990 18522
4508 1 8 . 1 1 92 92 LEU CB C 104 42.559 42.559 44.989 -2.430 18522
4509 1 8 . 1 1 92 92 LEU H H 104 9.150 9.150 7.272 1.878 18522
4510 1 8 . 1 1 93 93 GLN HA H 105 4.315 4.315 4.544 -0.229 18522
4511 1 8 . 1 1 93 93 GLN C C 105 175.070 175.070 174.488 0.582 18522
4512 1 8 . 1 1 93 93 GLN CA C 105 55.490 55.490 55.062 0.428 18522
4513 1 8 . 1 1 93 93 GLN CB C 105 28.909 28.909 28.983 -0.074 18522
4514 1 8 . 1 1 94 94 ALA N N 106 125.133 125.133 123.843 1.290 18522
4515 1 8 . 1 1 94 94 ALA HA H 106 4.366 4.366 4.555 -0.189 18522
4516 1 8 . 1 1 94 94 ALA C C 106 176.392 176.392 174.901 1.491 18522
4517 1 8 . 1 1 94 94 ALA CA C 106 51.723 51.723 51.809 -0.086 18522
4518 1 8 . 1 1 94 94 ALA CB C 106 20.185 20.185 22.030 -1.845 18522
4519 1 8 . 1 1 94 94 ALA H H 106 8.226 8.226 8.088 0.138 18522
4520 1 8 . 1 1 95 95 ASP N N 107 122.013 122.013 119.659 2.354 18522
4521 1 8 . 1 1 95 95 ASP HA H 107 4.413 4.413 5.047 -0.634 18522
4522 1 8 . 1 1 95 95 ASP C C 107 175.019 175.019 175.130 -0.111 18522
4523 1 8 . 1 1 95 95 ASP CA C 107 55.642 55.642 52.673 2.969 18522
4524 1 8 . 1 1 95 95 ASP CB C 107 41.266 41.266 43.023 -1.757 18522
4525 1 8 . 1 1 95 95 ASP H H 107 8.429 8.429 8.380 0.049 18522
4526 1 8 . 1 1 96 96 PRO HA H 108 4.207 4.207 4.059 0.148 18522
4527 1 8 . 1 1 96 96 PRO C C 108 178.840 178.840 178.321 0.519 18522
4528 1 8 . 1 1 96 96 PRO CA C 108 65.396 65.396 66.394 -0.998 18522
4529 1 8 . 1 1 96 96 PRO CB C 108 32.181 32.181 31.595 0.586 18522
4530 1 8 . 1 1 97 97 LYS N N 109 117.942 117.942 115.467 2.475 18522
4531 1 8 . 1 1 97 97 LYS HA H 109 4.143 4.143 4.015 0.128 18522
4532 1 8 . 1 1 97 97 LYS C C 109 178.099 178.099 179.009 -0.910 18522
4533 1 8 . 1 1 97 97 LYS CA C 109 58.167 58.167 59.322 -1.155 18522
4534 1 8 . 1 1 97 97 LYS CB C 109 31.649 31.649 31.516 0.133 18522
4535 1 8 . 1 1 97 97 LYS H H 109 8.335 8.335 8.482 -0.147 18522
4536 1 8 . 1 1 98 98 GLN N N 110 119.159 119.159 118.675 0.484 18522
4537 1 8 . 1 1 98 98 GLN HA H 110 4.130 4.130 4.230 -0.100 18522
4538 1 8 . 1 1 98 98 GLN C C 110 178.298 178.298 178.594 -0.296 18522
4539 1 8 . 1 1 98 98 GLN CA C 110 57.660 57.660 57.489 0.171 18522
4540 1 8 . 1 1 98 98 GLN CB C 110 28.720 28.720 28.458 0.262 18522
4541 1 8 . 1 1 98 98 GLN H H 110 7.985 7.985 7.922 0.063 18522
4542 1 8 . 1 1 99 99 LEU N N 111 120.490 120.490 122.618 -2.128 18522
4543 1 8 . 1 1 99 99 LEU HA H 111 3.877 3.877 4.135 -0.258 18522
4544 1 8 . 1 1 99 99 LEU C C 111 177.729 177.729 178.262 -0.533 18522
4545 1 8 . 1 1 99 99 LEU CA C 111 57.049 57.049 58.048 -0.999 18522
4546 1 8 . 1 1 99 99 LEU CB C 111 41.466 41.466 41.695 -0.229 18522
4547 1 8 . 1 1 99 99 LEU H H 111 7.994 7.994 8.562 -0.568 18522
4548 1 8 . 1 1 100 100 GLU N N 112 118.251 118.251 118.651 -0.400 18522
4549 1 8 . 1 1 100 100 GLU HA H 112 3.972 3.972 4.060 -0.088 18522
4550 1 8 . 1 1 100 100 GLU C C 112 178.402 178.402 178.970 -0.568 18522
4551 1 8 . 1 1 100 100 GLU CA C 112 59.056 59.056 59.212 -0.156 18522
4552 1 8 . 1 1 100 100 GLU CB C 112 29.732 29.732 29.052 0.680 18522
4553 1 8 . 1 1 100 100 GLU H H 112 7.760 7.760 8.035 -0.275 18522
4554 1 8 . 1 1 101 101 VAL N N 113 117.229 117.229 120.561 -3.332 18522
4555 1 8 . 1 1 101 101 VAL HA H 113 3.762 3.762 3.839 -0.077 18522
4556 1 8 . 1 1 101 101 VAL C C 113 178.107 178.107 177.597 0.510 18522
4557 1 8 . 1 1 101 101 VAL CA C 113 64.791 64.791 65.420 -0.629 18522
4558 1 8 . 1 1 101 101 VAL CB C 113 32.149 32.149 31.699 0.450 18522
4559 1 8 . 1 1 101 101 VAL H H 113 7.437 7.437 7.579 -0.142 18522
4560 1 8 . 1 1 102 102 LEU N N 114 122.124 122.124 118.444 3.680 18522
4561 1 8 . 1 1 102 102 LEU HA H 114 4.033 4.033 4.118 -0.085 18522
4562 1 8 . 1 1 102 102 LEU C C 114 178.506 178.506 179.059 -0.553 18522
4563 1 8 . 1 1 102 102 LEU CA C 114 57.243 57.243 56.581 0.662 18522
4564 1 8 . 1 1 102 102 LEU CB C 114 42.028 42.028 41.783 0.245 18522
4565 1 8 . 1 1 102 102 LEU H H 114 7.765 7.765 7.493 0.272 18522
4566 1 8 . 1 1 103 103 PHE N N 115 115.346 115.346 120.204 -4.858 18522
4567 1 8 . 1 1 103 103 PHE HA H 115 4.224 4.224 4.044 0.180 18522
4568 1 8 . 1 1 103 103 PHE C C 115 175.621 175.621 177.284 -1.663 18522
4569 1 8 . 1 1 103 103 PHE CA C 115 57.537 57.537 61.248 -3.711 18522
4570 1 8 . 1 1 103 103 PHE CB C 115 38.057 38.057 39.278 -1.221 18522
4571 1 8 . 1 1 103 103 PHE H H 115 7.805 7.805 7.920 -0.115 18522
4572 1 8 . 1 1 104 104 GLN N N 116 119.021 119.021 117.429 1.592 18522
4573 1 8 . 1 1 104 104 GLN HA H 116 4.407 4.407 4.328 0.079 18522
4574 1 8 . 1 1 104 104 GLN C C 116 176.402 176.402 176.559 -0.157 18522
4575 1 8 . 1 1 104 104 GLN CA C 116 55.521 55.521 56.639 -1.118 18522
4576 1 8 . 1 1 104 104 GLN CB C 116 29.170 29.170 29.393 -0.223 18522
4577 1 8 . 1 1 104 104 GLN H H 116 7.974 7.974 7.939 0.035 18522
4578 1 8 . 1 1 105 105 GLY N N 117 108.868 108.868 107.819 1.049 18522
4579 1 8 . 1 1 105 105 GLY CA C 117 45.124 45.124 44.453 0.671 18522
4580 1 8 . 1 1 105 105 GLY H H 117 8.195 8.195 7.950 0.245 18522
4581 1 8 . 1 1 106 106 PRO HA H 118 4.490 4.490 4.339 0.151 18522
4582 1 8 . 1 1 106 106 PRO C C 118 176.001 176.001 176.967 -0.966 18522
4583 1 8 . 1 1 106 106 PRO CA C 118 63.523 63.523 64.820 -1.297 18522
4584 1 8 . 1 1 106 106 PRO CB C 118 32.078 32.078 32.292 -0.214 18522
4585 1 8 . 1 1 107 107 GLN N N 119 126.950 126.950 114.561 12.389 18522
4586 1 8 . 1 1 107 107 GLN C C 119 181.211 181.211 175.102 6.109 18522
4587 1 8 . 1 1 107 107 GLN CA C 119 57.416 57.416 55.684 1.732 18522
4588 1 8 . 1 1 107 107 GLN H H 119 8.079 8.079 8.086 -0.007 18522
4589 1 8 . 1 1 111 111 ARG C C 123 174.608 174.608 174.600 0.008 18522
4590 1 8 . 1 1 111 111 ARG CA C 123 55.099 55.099 55.723 -0.624 18522
4591 1 8 . 1 1 112 112 HIS N N 124 122.212 122.212 122.071 0.141 18522
4592 1 8 . 1 1 112 112 HIS HA H 124 4.718 4.718 4.172 0.546 18522
4593 1 8 . 1 1 112 112 HIS C C 124 176.040 176.040 174.182 1.858 18522
4594 1 8 . 1 1 112 112 HIS CA C 124 54.213 54.213 56.141 -1.927 18522
4595 1 8 . 1 1 112 112 HIS CB C 124 31.164 31.164 29.832 1.332 18522
4596 1 8 . 1 1 112 112 HIS H H 124 7.640 7.640 8.249 -0.609 18522
4597 1 8 . 1 1 113 113 TRP C C 125 176.168 176.168 176.154 0.014 18522
4598 1 8 . 1 1 114 114 LEU N N 126 121.893 121.893 122.845 -0.952 18522
4599 1 8 . 1 1 114 114 LEU HA H 126 4.869 4.869 4.469 0.400 18522
4600 1 8 . 1 1 114 114 LEU CA C 126 54.151 54.151 53.666 0.485 18522
4601 1 8 . 1 1 114 114 LEU CB C 126 45.144 45.144 43.762 1.382 18522
4602 1 8 . 1 1 114 114 LEU H H 126 8.606 8.606 8.340 0.266 18522
4603 1 8 . 1 1 115 115 LYS N N 127 125.850 125.850 117.952 7.898 18522
4604 1 8 . 1 1 115 115 LYS HA H 127 4.203 4.203 5.089 -0.886 18522
4605 1 8 . 1 1 115 115 LYS C C 127 175.564 175.564 174.758 0.806 18522
4606 1 8 . 1 1 115 115 LYS CA C 127 57.252 57.252 55.530 1.722 18522
4607 1 8 . 1 1 115 115 LYS CB C 127 33.406 33.406 33.427 -0.021 18522
4608 1 8 . 1 1 115 115 LYS H H 127 8.647 8.647 8.041 0.606 18522
4609 1 9 . 1 1 3 3 PRO C C 15 177.225 177.225 177.501 -0.276 18522
4610 1 9 . 1 1 3 3 PRO CA C 15 63.508 63.508 62.929 0.579 18522
4611 1 9 . 1 1 3 3 PRO CB C 15 32.090 32.090 32.384 -0.294 18522
4612 1 9 . 1 1 4 4 GLY N N 16 108.829 108.829 109.080 -0.251 18522
4613 1 9 . 1 1 4 4 GLY C C 16 173.398 173.398 174.523 -1.125 18522
4614 1 9 . 1 1 4 4 GLY CA C 16 45.128 45.128 45.458 -0.330 18522
4615 1 9 . 1 1 4 4 GLY H H 16 8.489 8.489 8.252 0.237 18522
4616 1 9 . 1 1 5 5 ILE N N 17 121.763 121.763 121.291 0.472 18522
4617 1 9 . 1 1 5 5 ILE HA H 17 4.554 4.554 4.557 -0.003 18522
4618 1 9 . 1 1 5 5 ILE C C 17 174.332 174.332 174.978 -0.646 18522
4619 1 9 . 1 1 5 5 ILE CA C 17 58.245 58.245 59.035 -0.791 18522
4620 1 9 . 1 1 5 5 ILE CB C 17 38.762 38.762 37.571 1.192 18522
4621 1 9 . 1 1 5 5 ILE H H 17 8.014 8.014 7.800 0.214 18522
4622 1 9 . 1 1 6 6 PRO C C 18 176.437 176.437 176.296 0.141 18522
4623 1 9 . 1 1 6 6 PRO CA C 18 62.667 62.667 63.535 -0.868 18522
4624 1 9 . 1 1 6 6 PRO CB C 18 32.469 32.469 31.963 0.506 18522
4625 1 9 . 1 1 7 7 VAL N N 19 123.849 123.849 119.556 4.293 18522
4626 1 9 . 1 1 7 7 VAL HA H 19 4.550 4.550 4.288 0.262 18522
4627 1 9 . 1 1 7 7 VAL C C 19 174.453 174.453 174.162 0.291 18522
4628 1 9 . 1 1 7 7 VAL CA C 19 59.846 59.846 59.614 0.232 18522
4629 1 9 . 1 1 7 7 VAL CB C 19 33.510 33.510 30.765 2.745 18522
4630 1 9 . 1 1 7 7 VAL H H 19 8.754 8.754 8.101 0.653 18522
4631 1 9 . 1 1 8 8 PRO HA H 20 5.338 5.338 4.499 0.839 18522
4632 1 9 . 1 1 8 8 PRO C C 20 177.585 177.585 176.689 0.896 18522
4633 1 9 . 1 1 8 8 PRO CA C 20 62.406 62.406 63.062 -0.656 18522
4634 1 9 . 1 1 8 8 PRO CB C 20 32.891 32.891 31.349 1.542 18522
4635 1 9 . 1 1 9 9 GLY N N 21 108.426 108.426 111.894 -3.468 18522
4636 1 9 . 1 1 9 9 GLY C C 21 171.443 171.443 172.127 -0.684 18522
4637 1 9 . 1 1 9 9 GLY CA C 21 44.581 44.581 44.401 0.180 18522
4638 1 9 . 1 1 9 9 GLY H H 21 8.258 8.258 8.305 -0.047 18522
4639 1 9 . 1 1 10 10 LYS N N 22 117.372 117.372 122.628 -5.256 18522
4640 1 9 . 1 1 10 10 LYS HA H 22 4.039 4.039 4.717 -0.678 18522
4641 1 9 . 1 1 10 10 LYS C C 22 174.463 174.463 174.435 0.028 18522
4642 1 9 . 1 1 10 10 LYS CA C 22 55.263 55.263 55.505 -0.242 18522
4643 1 9 . 1 1 10 10 LYS CB C 22 35.227 35.227 34.489 0.738 18522
4644 1 9 . 1 1 10 10 LYS H H 22 8.175 8.175 8.153 0.022 18522
4645 1 9 . 1 1 11 11 VAL N N 23 120.387 120.387 116.222 4.165 18522
4646 1 9 . 1 1 11 11 VAL HA H 23 4.708 4.708 4.544 0.164 18522
4647 1 9 . 1 1 11 11 VAL C C 23 171.873 171.873 173.955 -2.082 18522
4648 1 9 . 1 1 11 11 VAL CA C 23 59.866 59.866 59.943 -0.077 18522
4649 1 9 . 1 1 11 11 VAL CB C 23 35.269 35.269 35.204 0.065 18522
4650 1 9 . 1 1 11 11 VAL H H 23 8.862 8.862 8.277 0.585 18522
4651 1 9 . 1 1 12 12 THR N N 24 125.797 125.797 118.479 7.318 18522
4652 1 9 . 1 1 12 12 THR HA H 24 5.121 5.121 4.645 0.476 18522
4653 1 9 . 1 1 12 12 THR C C 24 173.407 173.407 173.176 0.231 18522
4654 1 9 . 1 1 12 12 THR CA C 24 62.115 62.115 60.564 1.551 18522
4655 1 9 . 1 1 12 12 THR CB C 24 69.606 69.606 69.204 0.402 18522
4656 1 9 . 1 1 12 12 THR H H 24 8.859 8.859 8.276 0.583 18522
4657 1 9 . 1 1 13 13 LEU N N 25 127.960 127.960 127.329 0.631 18522
4658 1 9 . 1 1 13 13 LEU HA H 25 4.809 4.809 4.874 -0.065 18522
4659 1 9 . 1 1 13 13 LEU C C 25 175.029 175.029 175.147 -0.118 18522
4660 1 9 . 1 1 13 13 LEU CA C 25 52.623 52.623 52.479 0.144 18522
4661 1 9 . 1 1 13 13 LEU CB C 25 46.242 46.242 45.071 1.171 18522
4662 1 9 . 1 1 13 13 LEU H H 25 9.258 9.258 8.049 1.209 18522
4663 1 9 . 1 1 14 14 GLN N N 26 120.858 120.858 117.618 3.240 18522
4664 1 9 . 1 1 14 14 GLN HA H 26 4.482 4.482 4.557 -0.075 18522
4665 1 9 . 1 1 14 14 GLN C C 26 174.515 174.515 175.364 -0.849 18522
4666 1 9 . 1 1 14 14 GLN CA C 26 54.576 54.576 54.254 0.322 18522
4667 1 9 . 1 1 14 14 GLN CB C 26 29.516 29.516 31.831 -2.315 18522
4668 1 9 . 1 1 14 14 GLN H H 26 8.530 8.530 8.341 0.189 18522
4669 1 9 . 1 1 15 15 LYS N N 27 119.583 119.583 122.256 -2.673 18522
4670 1 9 . 1 1 15 15 LYS HA H 27 4.180 4.180 4.235 -0.055 18522
4671 1 9 . 1 1 15 15 LYS C C 27 177.468 177.468 176.735 0.733 18522
4672 1 9 . 1 1 15 15 LYS CA C 27 55.956 55.956 56.933 -0.977 18522
4673 1 9 . 1 1 15 15 LYS CB C 27 34.099 34.099 32.386 1.712 18522
4674 1 9 . 1 1 15 15 LYS H H 27 8.099 8.099 8.057 0.042 18522
4675 1 9 . 1 1 16 16 ASP N N 28 121.439 121.439 122.436 -0.997 18522
4676 1 9 . 1 1 16 16 ASP HA H 28 4.590 4.590 4.641 -0.051 18522
4677 1 9 . 1 1 16 16 ASP C C 28 178.392 178.392 177.875 0.517 18522
4678 1 9 . 1 1 16 16 ASP CA C 28 52.426 52.426 53.618 -1.192 18522
4679 1 9 . 1 1 16 16 ASP CB C 28 41.377 41.377 42.679 -1.302 18522
4680 1 9 . 1 1 16 16 ASP H H 28 8.888 8.888 8.648 0.240 18522
4681 1 9 . 1 1 17 17 ALA N N 29 119.578 119.578 123.667 -4.089 18522
4682 1 9 . 1 1 17 17 ALA HA H 29 4.188 4.188 4.092 0.096 18522
4683 1 9 . 1 1 17 17 ALA C C 29 178.763 178.763 178.292 0.471 18522
4684 1 9 . 1 1 17 17 ALA CA C 29 54.434 54.434 54.507 -0.073 18522
4685 1 9 . 1 1 17 17 ALA CB C 29 18.293 18.293 18.688 -0.395 18522
4686 1 9 . 1 1 17 17 ALA H H 29 8.392 8.392 8.713 -0.321 18522
4687 1 9 . 1 1 18 18 GLN N N 30 117.564 117.564 117.345 0.219 18522
4688 1 9 . 1 1 18 18 GLN HA H 30 4.399 4.399 4.335 0.064 18522
4689 1 9 . 1 1 18 18 GLN C C 30 175.168 175.168 175.518 -0.350 18522
4690 1 9 . 1 1 18 18 GLN CA C 30 55.339 55.339 55.418 -0.079 18522
4691 1 9 . 1 1 18 18 GLN CB C 30 28.589 28.589 29.411 -0.822 18522
4692 1 9 . 1 1 18 18 GLN H H 30 8.353 8.353 7.983 0.370 18522
4693 1 9 . 1 1 19 19 ASN N N 31 115.365 115.365 116.059 -0.694 18522
4694 1 9 . 1 1 19 19 ASN HA H 31 4.315 4.315 4.419 -0.104 18522
4695 1 9 . 1 1 19 19 ASN C C 31 174.043 174.043 172.947 1.096 18522
4696 1 9 . 1 1 19 19 ASN CA C 31 54.303 54.303 54.711 -0.408 18522
4697 1 9 . 1 1 19 19 ASN CB C 31 37.610 37.610 37.654 -0.044 18522
4698 1 9 . 1 1 19 19 ASN H H 31 8.521 8.521 8.368 0.153 18522
4699 1 9 . 1 1 20 20 LEU N N 32 118.660 118.660 112.463 6.197 18522
4700 1 9 . 1 1 20 20 LEU HA H 32 4.900 4.900 4.827 0.073 18522
4701 1 9 . 1 1 20 20 LEU C C 32 178.117 178.117 176.378 1.739 18522
4702 1 9 . 1 1 20 20 LEU CA C 32 53.957 53.957 53.542 0.415 18522
4703 1 9 . 1 1 20 20 LEU CB C 32 44.774 44.774 43.345 1.429 18522
4704 1 9 . 1 1 20 20 LEU H H 32 8.155 8.155 7.398 0.757 18522
4705 1 9 . 1 1 21 21 ILE N N 33 116.785 116.785 116.308 0.477 18522
4706 1 9 . 1 1 21 21 ILE HA H 33 4.674 4.674 4.434 0.240 18522
4707 1 9 . 1 1 21 21 ILE C C 33 176.185 176.185 176.626 -0.441 18522
4708 1 9 . 1 1 21 21 ILE CA C 33 62.602 62.602 61.350 1.252 18522
4709 1 9 . 1 1 21 21 ILE CB C 33 39.016 39.016 39.380 -0.364 18522
4710 1 9 . 1 1 21 21 ILE H H 33 11.488 11.488 8.337 3.151 18522
4711 1 9 . 1 1 22 22 GLY N N 34 111.234 111.234 108.890 2.344 18522
4712 1 9 . 1 1 22 22 GLY C C 34 173.993 173.993 173.190 0.803 18522
4713 1 9 . 1 1 22 22 GLY CA C 34 45.980 45.980 45.188 0.792 18522
4714 1 9 . 1 1 22 22 GLY H H 34 9.854 9.854 8.704 1.150 18522
4715 1 9 . 1 1 23 23 ILE N N 35 111.117 111.117 114.173 -3.056 18522
4716 1 9 . 1 1 23 23 ILE HA H 35 5.535 5.535 5.148 0.387 18522
4717 1 9 . 1 1 23 23 ILE C C 35 175.033 175.033 173.955 1.078 18522
4718 1 9 . 1 1 23 23 ILE CA C 35 58.415 58.415 57.876 0.539 18522
4719 1 9 . 1 1 23 23 ILE CB C 35 41.577 41.577 41.545 0.031 18522
4720 1 9 . 1 1 23 23 ILE H H 35 7.835 7.835 7.331 0.504 18522
4721 1 9 . 1 1 24 24 SER N N 36 114.908 114.908 115.566 -0.658 18522
4722 1 9 . 1 1 24 24 SER HA H 36 4.232 4.232 4.897 -0.665 18522
4723 1 9 . 1 1 24 24 SER C C 36 174.735 174.735 172.891 1.844 18522
4724 1 9 . 1 1 24 24 SER CA C 36 56.121 56.121 57.211 -1.090 18522
4725 1 9 . 1 1 24 24 SER CB C 36 66.097 66.097 65.652 0.445 18522
4726 1 9 . 1 1 24 24 SER H H 36 8.623 8.623 8.742 -0.119 18522
4727 1 9 . 1 1 25 25 ILE N N 37 117.739 117.739 124.955 -7.216 18522
4728 1 9 . 1 1 25 25 ILE C C 37 174.340 174.340 174.625 -0.285 18522
4729 1 9 . 1 1 25 25 ILE CA C 37 59.123 59.123 59.740 -0.617 18522
4730 1 9 . 1 1 25 25 ILE CB C 37 41.637 41.637 41.601 0.036 18522
4731 1 9 . 1 1 25 25 ILE H H 37 9.130 9.130 8.718 0.412 18522
4732 1 9 . 1 1 26 26 GLY N N 38 108.069 108.069 114.200 -6.131 18522
4733 1 9 . 1 1 26 26 GLY CA C 38 44.112 44.112 44.321 -0.209 18522
4734 1 9 . 1 1 26 26 GLY H H 38 8.841 8.841 9.040 -0.199 18522
4735 1 9 . 1 1 27 27 GLY N N 39 109.016 109.016 110.470 -1.454 18522
4736 1 9 . 1 1 27 27 GLY C C 39 173.956 173.956 174.404 -0.448 18522
4737 1 9 . 1 1 27 27 GLY H H 39 8.187 8.187 8.352 -0.165 18522
4738 1 9 . 1 1 28 28 GLY N N 40 111.783 111.783 111.674 0.109 18522
4739 1 9 . 1 1 28 28 GLY C C 40 174.255 174.255 174.810 -0.555 18522
4740 1 9 . 1 1 28 28 GLY CA C 40 47.098 47.098 44.128 2.970 18522
4741 1 9 . 1 1 28 28 GLY H H 40 8.275 8.275 8.384 -0.109 18522
4742 1 9 . 1 1 29 29 ALA N N 41 123.128 123.128 120.744 2.384 18522
4743 1 9 . 1 1 29 29 ALA HA H 41 4.559 4.559 4.132 0.427 18522
4744 1 9 . 1 1 29 29 ALA CA C 41 51.073 51.073 54.225 -3.152 18522
4745 1 9 . 1 1 29 29 ALA CB C 41 21.926 21.926 18.889 3.038 18522
4746 1 9 . 1 1 29 29 ALA H H 41 8.012 8.012 8.358 -0.346 18522
4747 1 9 . 1 1 31 31 TYR HA H 43 4.549 4.549 3.930 0.619 18522
4748 1 9 . 1 1 31 31 TYR CA C 43 57.147 57.147 61.232 -4.085 18522
4749 1 9 . 1 1 31 31 TYR CB C 43 37.495 37.495 38.484 -0.989 18522
4750 1 9 . 1 1 32 32 CYS N N 44 119.332 119.332 114.297 5.035 18522
4751 1 9 . 1 1 32 32 CYS HA H 44 4.859 4.859 4.688 0.171 18522
4752 1 9 . 1 1 32 32 CYS CA C 44 57.406 57.406 58.788 -1.382 18522
4753 1 9 . 1 1 32 32 CYS CB C 44 27.673 27.673 27.605 0.069 18522
4754 1 9 . 1 1 32 32 CYS H H 44 7.504 7.504 8.019 -0.515 18522
4755 1 9 . 1 1 33 33 PRO HA H 45 4.413 4.413 4.752 -0.339 18522
4756 1 9 . 1 1 33 33 PRO CA C 45 64.885 64.885 64.826 0.059 18522
4757 1 9 . 1 1 33 33 PRO CB C 45 32.318 32.318 32.593 -0.275 18522
4758 1 9 . 1 1 34 34 CYS N N 46 117.327 117.327 113.695 3.632 18522
4759 1 9 . 1 1 34 34 CYS C C 46 172.064 172.064 176.569 -4.505 18522
4760 1 9 . 1 1 34 34 CYS CA C 46 60.066 60.066 61.773 -1.707 18522
4761 1 9 . 1 1 34 34 CYS CB C 46 28.715 28.715 26.338 2.377 18522
4762 1 9 . 1 1 34 34 CYS H H 46 7.973 7.973 8.321 -0.348 18522
4763 1 9 . 1 1 35 35 LEU N N 47 124.270 124.270 114.878 9.392 18522
4764 1 9 . 1 1 35 35 LEU HA H 47 4.928 4.928 4.017 0.911 18522
4765 1 9 . 1 1 35 35 LEU C C 47 175.076 175.076 177.304 -2.228 18522
4766 1 9 . 1 1 35 35 LEU CA C 47 53.278 53.278 57.655 -4.377 18522
4767 1 9 . 1 1 35 35 LEU CB C 47 44.321 44.321 39.981 4.340 18522
4768 1 9 . 1 1 35 35 LEU H H 47 8.629 8.629 8.545 0.084 18522
4769 1 9 . 1 1 36 36 TYR N N 48 119.326 119.326 112.913 6.413 18522
4770 1 9 . 1 1 36 36 TYR HA H 48 5.255 5.255 4.202 1.053 18522
4771 1 9 . 1 1 36 36 TYR C C 48 175.766 175.766 176.741 -0.975 18522
4772 1 9 . 1 1 36 36 TYR CA C 48 56.696 56.696 61.159 -4.463 18522
4773 1 9 . 1 1 36 36 TYR CB C 48 42.590 42.590 37.094 5.496 18522
4774 1 9 . 1 1 36 36 TYR H H 48 8.761 8.761 8.197 0.564 18522
4775 1 9 . 1 1 37 37 ILE N N 49 120.259 120.259 122.325 -2.066 18522
4776 1 9 . 1 1 37 37 ILE HA H 49 4.215 4.215 4.410 -0.195 18522
4777 1 9 . 1 1 37 37 ILE C C 49 177.429 177.429 176.689 0.740 18522
4778 1 9 . 1 1 37 37 ILE CA C 49 62.456 62.456 60.992 1.464 18522
4779 1 9 . 1 1 37 37 ILE CB C 49 37.352 37.352 37.121 0.231 18522
4780 1 9 . 1 1 37 37 ILE H H 49 8.959 8.959 7.793 1.166 18522
4781 1 9 . 1 1 38 38 VAL HA H 50 3.937 3.937 4.307 -0.370 18522
4782 1 9 . 1 1 38 38 VAL C C 50 174.408 174.408 175.404 -0.996 18522
4783 1 9 . 1 1 38 38 VAL CA C 50 62.259 62.259 62.559 -0.300 18522
4784 1 9 . 1 1 38 38 VAL CB C 50 31.584 31.584 32.834 -1.250 18522
4785 1 9 . 1 1 39 39 GLN N N 51 116.821 116.821 117.778 -0.957 18522
4786 1 9 . 1 1 39 39 GLN HA H 51 4.103 4.103 4.566 -0.463 18522
4787 1 9 . 1 1 39 39 GLN C C 51 172.856 172.856 172.921 -0.065 18522
4788 1 9 . 1 1 39 39 GLN CA C 51 55.127 55.127 55.495 -0.368 18522
4789 1 9 . 1 1 39 39 GLN CB C 51 32.376 32.376 32.652 -0.276 18522
4790 1 9 . 1 1 39 39 GLN H H 51 6.967 6.967 7.656 -0.689 18522
4791 1 9 . 1 1 40 40 VAL N N 52 123.482 123.482 121.244 2.238 18522
4792 1 9 . 1 1 40 40 VAL HA H 52 4.277 4.277 4.671 -0.394 18522
4793 1 9 . 1 1 40 40 VAL C C 52 176.198 176.198 174.124 2.074 18522
4794 1 9 . 1 1 40 40 VAL CA C 52 61.574 61.574 59.612 1.962 18522
4795 1 9 . 1 1 40 40 VAL CB C 52 32.875 32.875 34.736 -1.861 18522
4796 1 9 . 1 1 40 40 VAL H H 52 8.447 8.447 8.353 0.094 18522
4797 1 9 . 1 1 41 41 PHE N N 53 128.296 128.296 124.710 3.586 18522
4798 1 9 . 1 1 41 41 PHE HA H 53 4.400 4.400 4.656 -0.256 18522
4799 1 9 . 1 1 41 41 PHE C C 53 175.299 175.299 175.240 0.059 18522
4800 1 9 . 1 1 41 41 PHE CA C 53 58.494 58.494 58.216 0.278 18522
4801 1 9 . 1 1 41 41 PHE CB C 53 39.561 39.561 39.402 0.159 18522
4802 1 9 . 1 1 41 41 PHE H H 53 8.707 8.707 8.145 0.562 18522
4803 1 9 . 1 1 42 42 ASP N N 54 122.696 122.696 116.233 6.463 18522
4804 1 9 . 1 1 42 42 ASP HA H 54 4.272 4.272 4.704 -0.432 18522
4805 1 9 . 1 1 42 42 ASP C C 54 176.837 176.837 175.962 0.875 18522
4806 1 9 . 1 1 42 42 ASP CA C 54 55.291 55.291 54.990 0.300 18522
4807 1 9 . 1 1 42 42 ASP CB C 54 41.093 41.093 42.685 -1.592 18522
4808 1 9 . 1 1 42 42 ASP H H 54 8.901 8.901 8.438 0.463 18522
4809 1 9 . 1 1 43 43 ASN N N 55 113.923 113.923 116.779 -2.856 18522
4810 1 9 . 1 1 43 43 ASN HA H 55 4.258 4.258 4.828 -0.570 18522
4811 1 9 . 1 1 43 43 ASN C C 55 173.714 173.714 174.291 -0.577 18522
4812 1 9 . 1 1 43 43 ASN CA C 55 54.958 54.958 53.420 1.538 18522
4813 1 9 . 1 1 43 43 ASN CB C 55 37.150 37.150 39.438 -2.288 18522
4814 1 9 . 1 1 43 43 ASN H H 55 9.319 9.319 8.217 1.102 18522
4815 1 9 . 1 1 44 44 THR N N 56 108.020 108.020 110.047 -2.027 18522
4816 1 9 . 1 1 44 44 THR HA H 56 5.377 5.377 5.033 0.344 18522
4817 1 9 . 1 1 44 44 THR CA C 56 59.712 59.712 58.985 0.727 18522
4818 1 9 . 1 1 44 44 THR CB C 56 69.529 69.529 70.370 -0.841 18522
4819 1 9 . 1 1 44 44 THR H H 56 7.149 7.149 7.408 -0.259 18522
4820 1 9 . 1 1 45 45 PRO HA H 57 4.304 4.304 4.066 0.238 18522
4821 1 9 . 1 1 45 45 PRO C C 57 180.141 180.141 178.062 2.079 18522
4822 1 9 . 1 1 45 45 PRO CA C 57 66.090 66.090 65.633 0.457 18522
4823 1 9 . 1 1 45 45 PRO CB C 57 33.194 33.194 31.401 1.793 18522
4824 1 9 . 1 1 46 46 ALA N N 58 116.854 116.854 120.079 -3.225 18522
4825 1 9 . 1 1 46 46 ALA HA H 58 4.035 4.035 4.010 0.025 18522
4826 1 9 . 1 1 46 46 ALA C C 58 180.647 180.647 179.408 1.239 18522
4827 1 9 . 1 1 46 46 ALA CA C 58 55.195 55.195 55.293 -0.098 18522
4828 1 9 . 1 1 46 46 ALA CB C 58 18.880 18.880 18.113 0.767 18522
4829 1 9 . 1 1 46 46 ALA H H 58 8.938 8.938 7.809 1.129 18522
4830 1 9 . 1 1 47 47 ALA N N 59 123.250 123.250 120.739 2.511 18522
4831 1 9 . 1 1 47 47 ALA HA H 59 4.030 4.030 4.067 -0.037 18522
4832 1 9 . 1 1 47 47 ALA C C 59 179.852 179.852 179.513 0.339 18522
4833 1 9 . 1 1 47 47 ALA CA C 59 54.939 54.939 54.531 0.408 18522
4834 1 9 . 1 1 47 47 ALA CB C 59 19.688 19.688 18.654 1.034 18522
4835 1 9 . 1 1 47 47 ALA H H 59 7.658 7.658 7.431 0.227 18522
4836 1 9 . 1 1 48 48 LEU N N 60 118.654 118.654 119.859 -1.205 18522
4837 1 9 . 1 1 48 48 LEU HA H 60 4.026 4.026 4.126 -0.100 18522
4838 1 9 . 1 1 48 48 LEU C C 60 179.238 179.238 178.614 0.624 18522
4839 1 9 . 1 1 48 48 LEU CA C 60 57.261 57.261 58.168 -0.907 18522
4840 1 9 . 1 1 48 48 LEU CB C 60 41.445 41.445 40.822 0.623 18522
4841 1 9 . 1 1 48 48 LEU H H 60 8.636 8.636 8.490 0.146 18522
4842 1 9 . 1 1 49 49 ASP N N 61 117.382 117.382 117.046 0.336 18522
4843 1 9 . 1 1 49 49 ASP HA H 61 4.421 4.421 4.646 -0.225 18522
4844 1 9 . 1 1 49 49 ASP C C 61 177.668 177.668 178.101 -0.433 18522
4845 1 9 . 1 1 49 49 ASP CA C 61 57.087 57.087 54.907 2.180 18522
4846 1 9 . 1 1 49 49 ASP CB C 61 44.478 44.478 41.790 2.688 18522
4847 1 9 . 1 1 49 49 ASP H H 61 7.665 7.665 7.881 -0.216 18522
4848 1 9 . 1 1 50 50 GLY N N 62 103.228 103.228 106.712 -3.484 18522
4849 1 9 . 1 1 50 50 GLY C C 62 174.776 174.776 174.934 -0.158 18522
4850 1 9 . 1 1 50 50 GLY CA C 62 46.533 46.533 45.583 0.950 18522
4851 1 9 . 1 1 50 50 GLY H H 62 7.216 7.216 8.275 -1.059 18522
4852 1 9 . 1 1 51 51 THR N N 63 117.230 117.230 114.387 2.843 18522
4853 1 9 . 1 1 51 51 THR HA H 63 3.907 3.907 3.924 -0.017 18522
4854 1 9 . 1 1 51 51 THR C C 63 175.961 175.961 175.232 0.729 18522
4855 1 9 . 1 1 51 51 THR CA C 63 66.478 66.478 62.760 3.718 18522
4856 1 9 . 1 1 51 51 THR CB C 63 68.268 68.268 68.325 -0.057 18522
4857 1 9 . 1 1 51 51 THR H H 63 8.319 8.319 7.636 0.683 18522
4858 1 9 . 1 1 52 52 VAL N N 64 113.826 113.826 117.009 -3.183 18522
4859 1 9 . 1 1 52 52 VAL HA H 64 3.950 3.950 4.231 -0.281 18522
4860 1 9 . 1 1 52 52 VAL C C 64 173.883 173.883 174.351 -0.468 18522
4861 1 9 . 1 1 52 52 VAL CA C 64 60.708 60.708 60.553 0.155 18522
4862 1 9 . 1 1 52 52 VAL CB C 64 33.079 33.079 29.673 3.406 18522
4863 1 9 . 1 1 52 52 VAL H H 64 8.147 8.147 7.528 0.619 18522
4864 1 9 . 1 1 53 53 ALA N N 65 123.521 123.521 123.778 -0.257 18522
4865 1 9 . 1 1 53 53 ALA HA H 65 4.414 4.414 4.461 -0.047 18522
4866 1 9 . 1 1 53 53 ALA C C 65 175.247 175.247 176.948 -1.701 18522
4867 1 9 . 1 1 53 53 ALA CA C 65 50.440 50.440 50.588 -0.148 18522
4868 1 9 . 1 1 53 53 ALA CB C 65 23.266 23.266 20.506 2.760 18522
4869 1 9 . 1 1 53 53 ALA H H 65 8.633 8.633 7.383 1.250 18522
4870 1 9 . 1 1 54 54 ALA N N 66 120.818 120.818 122.589 -1.771 18522
4871 1 9 . 1 1 54 54 ALA HA H 66 3.720 3.720 3.867 -0.147 18522
4872 1 9 . 1 1 54 54 ALA C C 66 178.411 178.411 178.395 0.016 18522
4873 1 9 . 1 1 54 54 ALA CA C 66 53.016 53.016 53.248 -0.232 18522
4874 1 9 . 1 1 54 54 ALA CB C 66 17.840 17.840 17.903 -0.063 18522
4875 1 9 . 1 1 54 54 ALA H H 66 8.451 8.451 8.412 0.039 18522
4876 1 9 . 1 1 55 55 GLY N N 67 112.260 112.260 113.582 -1.322 18522
4877 1 9 . 1 1 55 55 GLY C C 67 173.296 173.296 173.578 -0.282 18522
4878 1 9 . 1 1 55 55 GLY CA C 67 45.025 45.025 44.635 0.390 18522
4879 1 9 . 1 1 55 55 GLY H H 67 9.600 9.600 8.542 1.058 18522
4880 1 9 . 1 1 56 56 ASP N N 68 121.293 121.293 120.780 0.513 18522
4881 1 9 . 1 1 56 56 ASP HA H 68 4.861 4.861 4.829 0.032 18522
4882 1 9 . 1 1 56 56 ASP C C 68 174.937 174.937 174.712 0.225 18522
4883 1 9 . 1 1 56 56 ASP CA C 68 55.641 55.641 53.629 2.012 18522
4884 1 9 . 1 1 56 56 ASP CB C 68 40.696 40.696 42.850 -2.154 18522
4885 1 9 . 1 1 56 56 ASP H H 68 8.043 8.043 7.630 0.413 18522
4886 1 9 . 1 1 57 57 GLU N N 69 122.814 122.814 119.426 3.388 18522
4887 1 9 . 1 1 57 57 GLU C C 69 177.202 177.202 176.081 1.121 18522
4888 1 9 . 1 1 57 57 GLU CA C 69 54.472 54.472 53.800 0.672 18522
4889 1 9 . 1 1 57 57 GLU CB C 69 32.800 32.800 31.271 1.529 18522
4890 1 9 . 1 1 57 57 GLU H H 69 8.455 8.455 7.954 0.501 18522
4891 1 9 . 1 1 58 58 ILE N N 70 125.862 125.862 123.593 2.269 18522
4892 1 9 . 1 1 58 58 ILE HA H 70 4.526 4.526 4.481 0.045 18522
4893 1 9 . 1 1 58 58 ILE C C 70 175.035 175.035 175.371 -0.336 18522
4894 1 9 . 1 1 58 58 ILE CA C 70 60.918 60.918 59.655 1.263 18522
4895 1 9 . 1 1 58 58 ILE CB C 70 39.236 39.236 38.621 0.615 18522
4896 1 9 . 1 1 58 58 ILE H H 70 8.619 8.619 8.126 0.493 18522
4897 1 9 . 1 1 59 59 THR N N 71 115.507 115.507 118.338 -2.831 18522
4898 1 9 . 1 1 59 59 THR HA H 71 4.513 4.513 4.056 0.457 18522
4899 1 9 . 1 1 59 59 THR C C 71 176.425 176.425 173.612 2.813 18522
4900 1 9 . 1 1 59 59 THR CA C 71 61.158 61.158 61.527 -0.369 18522
4901 1 9 . 1 1 59 59 THR CB C 71 69.604 69.604 70.164 -0.560 18522
4902 1 9 . 1 1 59 59 THR H H 71 9.242 9.242 8.998 0.244 18522
4903 1 9 . 1 1 60 60 GLY N N 72 111.789 111.789 109.409 2.380 18522
4904 1 9 . 1 1 60 60 GLY C C 72 170.981 170.981 171.275 -0.294 18522
4905 1 9 . 1 1 60 60 GLY CA C 72 46.554 46.554 44.636 1.918 18522
4906 1 9 . 1 1 60 60 GLY H H 72 7.883 7.883 8.165 -0.282 18522
4907 1 9 . 1 1 61 61 VAL N N 73 119.277 119.277 121.762 -2.485 18522
4908 1 9 . 1 1 61 61 VAL C C 73 175.951 175.951 175.898 0.053 18522
4909 1 9 . 1 1 61 61 VAL CA C 73 60.982 60.982 59.814 1.168 18522
4910 1 9 . 1 1 61 61 VAL CB C 73 36.197 36.197 33.975 2.221 18522
4911 1 9 . 1 1 61 61 VAL H H 73 8.424 8.424 8.753 -0.329 18522
4912 1 9 . 1 1 62 62 ASN N N 74 127.731 127.731 126.156 1.575 18522
4913 1 9 . 1 1 62 62 ASN HA H 74 4.520 4.520 4.300 0.220 18522
4914 1 9 . 1 1 62 62 ASN C C 74 174.878 174.878 174.796 0.082 18522
4915 1 9 . 1 1 62 62 ASN CA C 74 54.418 54.418 54.578 -0.160 18522
4916 1 9 . 1 1 62 62 ASN CB C 74 36.655 36.655 38.294 -1.639 18522
4917 1 9 . 1 1 62 62 ASN H H 74 10.384 10.384 9.225 1.159 18522
4918 1 9 . 1 1 63 63 GLY N N 75 104.633 104.633 104.239 0.394 18522
4919 1 9 . 1 1 63 63 GLY C C 75 173.610 173.610 173.426 0.184 18522
4920 1 9 . 1 1 63 63 GLY CA C 75 45.261 45.261 44.813 0.448 18522
4921 1 9 . 1 1 63 63 GLY H H 75 8.926 8.926 8.319 0.607 18522
4922 1 9 . 1 1 64 64 ARG N N 76 120.451 120.451 120.734 -0.283 18522
4923 1 9 . 1 1 64 64 ARG HA H 76 4.501 4.501 4.614 -0.113 18522
4924 1 9 . 1 1 64 64 ARG C C 76 175.085 175.085 175.536 -0.451 18522
4925 1 9 . 1 1 64 64 ARG CA C 76 54.252 54.252 54.249 0.003 18522
4926 1 9 . 1 1 64 64 ARG CB C 76 31.482 31.482 31.644 -0.162 18522
4927 1 9 . 1 1 64 64 ARG H H 76 7.753 7.753 7.826 -0.073 18522
4928 1 9 . 1 1 65 65 SER N N 77 116.586 116.586 117.902 -1.316 18522
4929 1 9 . 1 1 65 65 SER HA H 77 4.483 4.483 4.606 -0.123 18522
4930 1 9 . 1 1 65 65 SER C C 77 176.953 176.953 176.670 0.283 18522
4931 1 9 . 1 1 65 65 SER CA C 77 58.292 58.292 58.340 -0.048 18522
4932 1 9 . 1 1 65 65 SER CB C 77 63.643 63.643 63.873 -0.230 18522
4933 1 9 . 1 1 65 65 SER H H 77 8.555 8.555 8.772 -0.217 18522
4934 1 9 . 1 1 66 66 ILE N N 78 116.618 116.618 124.631 -8.013 18522
4935 1 9 . 1 1 66 66 ILE HA H 78 4.420 4.420 4.135 0.285 18522
4936 1 9 . 1 1 66 66 ILE C C 78 175.072 175.072 177.031 -1.959 18522
4937 1 9 . 1 1 66 66 ILE CA C 78 59.122 59.122 62.364 -3.242 18522
4938 1 9 . 1 1 66 66 ILE CB C 78 36.758 36.758 36.874 -0.116 18522
4939 1 9 . 1 1 66 66 ILE H H 78 7.599 7.599 8.641 -1.042 18522
4940 1 9 . 1 1 67 67 LYS N N 79 123.287 123.287 122.232 1.055 18522
4941 1 9 . 1 1 67 67 LYS HA H 79 4.049 4.049 4.125 -0.076 18522
4942 1 9 . 1 1 67 67 LYS C C 79 178.333 178.333 177.887 0.446 18522
4943 1 9 . 1 1 67 67 LYS CA C 79 58.321 58.321 58.392 -0.071 18522
4944 1 9 . 1 1 67 67 LYS CB C 79 31.635 31.635 32.145 -0.510 18522
4945 1 9 . 1 1 67 67 LYS H H 79 7.898 7.898 7.599 0.299 18522
4946 1 9 . 1 1 68 68 GLY N N 80 114.933 114.933 106.096 8.837 18522
4947 1 9 . 1 1 68 68 GLY C C 80 174.385 174.385 174.607 -0.222 18522
4948 1 9 . 1 1 68 68 GLY CA C 80 45.518 45.518 45.464 0.054 18522
4949 1 9 . 1 1 68 68 GLY H H 80 8.999 8.999 7.751 1.248 18522
4950 1 9 . 1 1 69 69 LYS N N 81 119.403 119.403 119.197 0.206 18522
4951 1 9 . 1 1 69 69 LYS HA H 81 4.043 4.043 4.722 -0.679 18522
4952 1 9 . 1 1 69 69 LYS C C 81 177.064 177.064 175.163 1.901 18522
4953 1 9 . 1 1 69 69 LYS CA C 81 54.722 54.722 54.633 0.090 18522
4954 1 9 . 1 1 69 69 LYS CB C 81 33.560 33.560 34.106 -0.546 18522
4955 1 9 . 1 1 69 69 LYS H H 81 7.845 7.845 7.767 0.078 18522
4956 1 9 . 1 1 70 70 THR N N 82 112.066 112.066 110.262 1.804 18522
4957 1 9 . 1 1 70 70 THR HA H 82 4.666 4.666 4.542 0.124 18522
4958 1 9 . 1 1 70 70 THR C C 82 175.955 175.955 174.627 1.328 18522
4959 1 9 . 1 1 70 70 THR CA C 82 60.438 60.438 60.271 0.167 18522
4960 1 9 . 1 1 70 70 THR CB C 82 71.629 71.629 72.158 -0.529 18522
4961 1 9 . 1 1 70 70 THR H H 82 9.153 9.153 7.717 1.436 18522
4962 1 9 . 1 1 71 71 LYS N N 83 118.730 118.730 121.545 -2.815 18522
4963 1 9 . 1 1 71 71 LYS HA H 83 3.870 3.870 3.918 -0.048 18522
4964 1 9 . 1 1 71 71 LYS C C 83 177.464 177.464 178.465 -1.001 18522
4965 1 9 . 1 1 71 71 LYS CA C 83 60.357 60.357 59.537 0.820 18522
4966 1 9 . 1 1 71 71 LYS CB C 83 31.350 31.350 31.840 -0.490 18522
4967 1 9 . 1 1 71 71 LYS H H 83 8.969 8.969 8.696 0.273 18522
4968 1 9 . 1 1 72 72 VAL N N 84 117.444 117.444 118.559 -1.115 18522
4969 1 9 . 1 1 72 72 VAL HA H 84 3.633 3.633 3.667 -0.034 18522
4970 1 9 . 1 1 72 72 VAL C C 84 178.315 178.315 177.302 1.013 18522
4971 1 9 . 1 1 72 72 VAL CA C 84 66.079 66.079 65.842 0.237 18522
4972 1 9 . 1 1 72 72 VAL CB C 84 32.091 32.091 31.237 0.854 18522
4973 1 9 . 1 1 72 72 VAL H H 84 7.631 7.631 8.253 -0.622 18522
4974 1 9 . 1 1 73 73 GLU N N 85 120.890 120.890 119.447 1.443 18522
4975 1 9 . 1 1 73 73 GLU HA H 85 3.964 3.964 4.098 -0.134 18522
4976 1 9 . 1 1 73 73 GLU C C 85 179.971 179.971 178.938 1.033 18522
4977 1 9 . 1 1 73 73 GLU CA C 85 59.316 59.316 59.305 0.011 18522
4978 1 9 . 1 1 73 73 GLU CB C 85 30.355 30.355 29.724 0.631 18522
4979 1 9 . 1 1 73 73 GLU H H 85 7.617 7.617 7.538 0.079 18522
4980 1 9 . 1 1 74 74 VAL N N 86 121.246 121.246 117.789 3.457 18522
4981 1 9 . 1 1 74 74 VAL HA H 86 3.630 3.630 3.622 0.008 18522
4982 1 9 . 1 1 74 74 VAL C C 86 177.217 177.217 177.711 -0.494 18522
4983 1 9 . 1 1 74 74 VAL CA C 86 66.678 66.678 66.369 0.309 18522
4984 1 9 . 1 1 74 74 VAL CB C 86 31.307 31.307 31.261 0.046 18522
4985 1 9 . 1 1 74 74 VAL H H 86 8.368 8.368 8.433 -0.065 18522
4986 1 9 . 1 1 75 75 ALA N N 87 122.148 122.148 121.850 0.298 18522
4987 1 9 . 1 1 75 75 ALA HA H 87 3.947 3.947 3.927 0.020 18522
4988 1 9 . 1 1 75 75 ALA C C 87 179.545 179.545 179.150 0.395 18522
4989 1 9 . 1 1 75 75 ALA CA C 87 55.851 55.851 55.279 0.572 18522
4990 1 9 . 1 1 75 75 ALA CB C 87 18.491 18.491 17.981 0.510 18522
4991 1 9 . 1 1 75 75 ALA H H 87 8.577 8.577 8.128 0.449 18522
4992 1 9 . 1 1 76 76 LYS N N 88 117.733 117.733 119.414 -1.681 18522
4993 1 9 . 1 1 76 76 LYS HA H 88 4.051 4.051 3.969 0.082 18522
4994 1 9 . 1 1 76 76 LYS CA C 88 59.393 59.393 59.300 0.093 18522
4995 1 9 . 1 1 76 76 LYS CB C 88 32.058 32.058 32.285 -0.228 18522
4996 1 9 . 1 1 76 76 LYS H H 88 7.854 7.854 7.339 0.515 18522
4997 1 9 . 1 1 77 77 MET N N 89 117.676 117.676 118.448 -0.772 18522
4998 1 9 . 1 1 77 77 MET HA H 89 4.048 4.048 3.985 0.063 18522
4999 1 9 . 1 1 77 77 MET C C 89 178.791 178.791 178.850 -0.059 18522
5000 1 9 . 1 1 77 77 MET CA C 89 59.128 59.128 59.797 -0.669 18522
5001 1 9 . 1 1 77 77 MET CB C 89 33.801 33.801 32.551 1.250 18522
5002 1 9 . 1 1 77 77 MET H H 89 7.759 7.759 8.345 -0.586 18522
5003 1 9 . 1 1 78 78 ILE N N 90 117.305 117.305 118.312 -1.007 18522
5004 1 9 . 1 1 78 78 ILE HA H 90 3.590 3.590 3.604 -0.014 18522
5005 1 9 . 1 1 78 78 ILE C C 90 178.658 178.658 178.034 0.624 18522
5006 1 9 . 1 1 78 78 ILE CA C 90 65.482 65.482 65.174 0.308 18522
5007 1 9 . 1 1 78 78 ILE CB C 90 38.845 38.845 37.744 1.101 18522
5008 1 9 . 1 1 78 78 ILE H H 90 7.972 7.972 8.263 -0.291 18522
5009 1 9 . 1 1 79 79 GLN N N 91 120.935 120.935 118.432 2.503 18522
5010 1 9 . 1 1 79 79 GLN HA H 91 3.998 3.998 4.183 -0.185 18522
5011 1 9 . 1 1 79 79 GLN C C 91 178.274 178.274 178.360 -0.086 18522
5012 1 9 . 1 1 79 79 GLN CA C 91 59.151 59.151 58.026 1.125 18522
5013 1 9 . 1 1 79 79 GLN CB C 91 28.934 28.934 28.860 0.074 18522
5014 1 9 . 1 1 79 79 GLN H H 91 8.826 8.826 7.975 0.851 18522
5015 1 9 . 1 1 80 80 GLU N N 92 115.213 115.213 121.693 -6.480 18522
5016 1 9 . 1 1 80 80 GLU HA H 92 4.061 4.061 4.070 -0.009 18522
5017 1 9 . 1 1 80 80 GLU C C 92 176.824 176.824 178.043 -1.219 18522
5018 1 9 . 1 1 80 80 GLU CA C 92 58.006 58.006 59.250 -1.244 18522
5019 1 9 . 1 1 80 80 GLU CB C 92 29.890 29.890 29.661 0.229 18522
5020 1 9 . 1 1 80 80 GLU H H 92 8.020 8.020 8.431 -0.411 18522
5021 1 9 . 1 1 81 81 VAL N N 93 119.047 119.047 116.866 2.181 18522
5022 1 9 . 1 1 81 81 VAL HA H 93 3.930 3.930 3.823 0.107 18522
5023 1 9 . 1 1 81 81 VAL C C 93 176.016 176.016 176.040 -0.024 18522
5024 1 9 . 1 1 81 81 VAL CA C 93 63.153 63.153 64.279 -1.126 18522
5025 1 9 . 1 1 81 81 VAL CB C 93 32.154 32.154 31.476 0.678 18522
5026 1 9 . 1 1 81 81 VAL H H 93 7.073 7.073 7.562 -0.489 18522
5027 1 9 . 1 1 82 82 LYS N N 94 128.366 128.366 119.591 8.775 18522
5028 1 9 . 1 1 82 82 LYS C C 94 177.460 177.460 177.151 0.309 18522
5029 1 9 . 1 1 82 82 LYS CA C 94 55.753 55.753 57.279 -1.526 18522
5030 1 9 . 1 1 82 82 LYS CB C 94 32.332 32.332 32.266 0.066 18522
5031 1 9 . 1 1 82 82 LYS H H 94 8.762 8.762 7.695 1.067 18522
5032 1 9 . 1 1 83 83 GLY N N 95 112.528 112.528 112.476 0.052 18522
5033 1 9 . 1 1 83 83 GLY C C 95 173.468 173.468 173.559 -0.091 18522
5034 1 9 . 1 1 83 83 GLY CA C 95 46.243 46.243 45.415 0.828 18522
5035 1 9 . 1 1 83 83 GLY H H 95 8.673 8.673 8.967 -0.294 18522
5036 1 9 . 1 1 84 84 GLU N N 96 121.485 121.485 121.029 0.456 18522
5037 1 9 . 1 1 84 84 GLU HA H 96 4.749 4.749 5.014 -0.265 18522
5038 1 9 . 1 1 84 84 GLU C C 96 174.583 174.583 174.514 0.069 18522
5039 1 9 . 1 1 84 84 GLU CA C 96 55.821 55.821 54.769 1.052 18522
5040 1 9 . 1 1 84 84 GLU CB C 96 31.410 31.410 33.796 -2.386 18522
5041 1 9 . 1 1 84 84 GLU H H 96 8.297 8.297 7.710 0.587 18522
5042 1 9 . 1 1 85 85 VAL N N 97 120.501 120.501 112.456 8.045 18522
5043 1 9 . 1 1 85 85 VAL HA H 97 4.665 4.665 4.572 0.093 18522
5044 1 9 . 1 1 85 85 VAL C C 97 173.047 173.047 174.090 -1.043 18522
5045 1 9 . 1 1 85 85 VAL CA C 97 60.114 60.114 60.849 -0.735 18522
5046 1 9 . 1 1 85 85 VAL CB C 97 35.184 35.184 35.300 -0.116 18522
5047 1 9 . 1 1 85 85 VAL H H 97 9.096 9.096 8.139 0.957 18522
5048 1 9 . 1 1 86 86 THR N N 98 125.019 125.019 120.439 4.580 18522
5049 1 9 . 1 1 86 86 THR HA H 98 4.076 4.076 4.786 -0.710 18522
5050 1 9 . 1 1 86 86 THR C C 98 173.807 173.807 173.555 0.252 18522
5051 1 9 . 1 1 86 86 THR CA C 98 61.735 61.735 61.370 0.365 18522
5052 1 9 . 1 1 86 86 THR CB C 98 69.531 69.531 69.881 -0.350 18522
5053 1 9 . 1 1 86 86 THR H H 98 9.352 9.352 8.124 1.228 18522
5054 1 9 . 1 1 87 87 ILE N N 99 128.383 128.383 123.821 4.562 18522
5055 1 9 . 1 1 87 87 ILE HA H 99 4.661 4.661 4.637 0.024 18522
5056 1 9 . 1 1 87 87 ILE C C 99 174.614 174.614 174.556 0.058 18522
5057 1 9 . 1 1 87 87 ILE CA C 99 58.258 58.258 59.692 -1.434 18522
5058 1 9 . 1 1 87 87 ILE CB C 99 38.528 38.528 38.782 -0.254 18522
5059 1 9 . 1 1 87 87 ILE H H 99 9.329 9.329 8.114 1.215 18522
5060 1 9 . 1 1 88 88 HIS N N 100 128.279 128.279 125.427 2.852 18522
5061 1 9 . 1 1 88 88 HIS HA H 100 4.948 4.948 5.043 -0.095 18522
5062 1 9 . 1 1 88 88 HIS C C 100 174.787 174.787 173.503 1.284 18522
5063 1 9 . 1 1 88 88 HIS CA C 100 54.620 54.620 55.587 -0.967 18522
5064 1 9 . 1 1 88 88 HIS H H 100 8.647 8.647 8.259 0.388 18522
5065 1 9 . 1 1 89 89 TYR N N 101 121.320 121.320 125.603 -4.283 18522
5066 1 9 . 1 1 89 89 TYR HA H 101 5.947 5.947 4.646 1.301 18522
5067 1 9 . 1 1 89 89 TYR C C 101 173.769 173.769 173.149 0.620 18522
5068 1 9 . 1 1 89 89 TYR CA C 101 55.669 55.669 58.218 -2.549 18522
5069 1 9 . 1 1 89 89 TYR CB C 101 42.195 42.195 41.149 1.046 18522
5070 1 9 . 1 1 89 89 TYR H H 101 8.414 8.414 9.200 -0.786 18522
5071 1 9 . 1 1 90 90 ASN N N 102 116.679 116.679 114.771 1.908 18522
5072 1 9 . 1 1 90 90 ASN HA H 102 5.335 5.335 4.808 0.527 18522
5073 1 9 . 1 1 90 90 ASN C C 102 175.406 175.406 172.868 2.538 18522
5074 1 9 . 1 1 90 90 ASN CA C 102 51.961 51.961 53.063 -1.102 18522
5075 1 9 . 1 1 90 90 ASN CB C 102 41.800 41.800 40.811 0.989 18522
5076 1 9 . 1 1 90 90 ASN H H 102 9.282 9.282 7.686 1.596 18522
5077 1 9 . 1 1 91 91 LYS N N 103 124.129 124.129 120.895 3.234 18522
5078 1 9 . 1 1 91 91 LYS C C 103 176.678 176.678 175.973 0.705 18522
5079 1 9 . 1 1 91 91 LYS CA C 103 55.006 55.006 54.431 0.576 18522
5080 1 9 . 1 1 91 91 LYS H H 103 8.949 8.949 8.134 0.815 18522
5081 1 9 . 1 1 92 92 LEU N N 104 127.043 127.043 114.434 12.609 18522
5082 1 9 . 1 1 92 92 LEU HA H 104 4.425 4.425 3.910 0.515 18522
5083 1 9 . 1 1 92 92 LEU CA C 104 55.060 55.060 55.711 -0.651 18522
5084 1 9 . 1 1 92 92 LEU CB C 104 42.559 42.559 40.469 2.090 18522
5085 1 9 . 1 1 92 92 LEU H H 104 9.150 9.150 8.240 0.910 18522
5086 1 9 . 1 1 93 93 GLN HA H 105 4.315 4.315 4.157 0.158 18522
5087 1 9 . 1 1 93 93 GLN C C 105 175.070 175.070 175.231 -0.161 18522
5088 1 9 . 1 1 93 93 GLN CA C 105 55.490 55.490 56.543 -1.053 18522
5089 1 9 . 1 1 93 93 GLN CB C 105 28.909 28.909 29.480 -0.571 18522
5090 1 9 . 1 1 94 94 ALA N N 106 125.133 125.133 120.057 5.076 18522
5091 1 9 . 1 1 94 94 ALA HA H 106 4.366 4.366 4.446 -0.080 18522
5092 1 9 . 1 1 94 94 ALA C C 106 176.392 176.392 175.270 1.122 18522
5093 1 9 . 1 1 94 94 ALA CA C 106 51.723 51.723 51.637 0.086 18522
5094 1 9 . 1 1 94 94 ALA CB C 106 20.185 20.185 20.725 -0.540 18522
5095 1 9 . 1 1 94 94 ALA H H 106 8.226 8.226 7.568 0.658 18522
5096 1 9 . 1 1 95 95 ASP N N 107 122.013 122.013 119.501 2.512 18522
5097 1 9 . 1 1 95 95 ASP HA H 107 4.413 4.413 5.041 -0.628 18522
5098 1 9 . 1 1 95 95 ASP C C 107 175.019 175.019 175.388 -0.369 18522
5099 1 9 . 1 1 95 95 ASP CA C 107 55.642 55.642 51.800 3.842 18522
5100 1 9 . 1 1 95 95 ASP CB C 107 41.266 41.266 43.659 -2.393 18522
5101 1 9 . 1 1 95 95 ASP H H 107 8.429 8.429 8.334 0.095 18522
5102 1 9 . 1 1 96 96 PRO HA H 108 4.207 4.207 4.031 0.176 18522
5103 1 9 . 1 1 96 96 PRO C C 108 178.840 178.840 178.267 0.573 18522
5104 1 9 . 1 1 96 96 PRO CA C 108 65.396 65.396 66.301 -0.905 18522
5105 1 9 . 1 1 96 96 PRO CB C 108 32.181 32.181 31.572 0.609 18522
5106 1 9 . 1 1 97 97 LYS N N 109 117.942 117.942 114.714 3.228 18522
5107 1 9 . 1 1 97 97 LYS HA H 109 4.143 4.143 3.993 0.150 18522
5108 1 9 . 1 1 97 97 LYS C C 109 178.099 178.099 178.647 -0.548 18522
5109 1 9 . 1 1 97 97 LYS CA C 109 58.167 58.167 59.005 -0.838 18522
5110 1 9 . 1 1 97 97 LYS CB C 109 31.649 31.649 31.314 0.335 18522
5111 1 9 . 1 1 97 97 LYS H H 109 8.335 8.335 8.289 0.046 18522
5112 1 9 . 1 1 98 98 GLN N N 110 119.159 119.159 117.076 2.083 18522
5113 1 9 . 1 1 98 98 GLN HA H 110 4.130 4.130 4.465 -0.335 18522
5114 1 9 . 1 1 98 98 GLN C C 110 178.298 178.298 177.816 0.482 18522
5115 1 9 . 1 1 98 98 GLN CA C 110 57.660 57.660 56.341 1.319 18522
5116 1 9 . 1 1 98 98 GLN CB C 110 28.720 28.720 29.068 -0.348 18522
5117 1 9 . 1 1 98 98 GLN H H 110 7.985 7.985 8.101 -0.116 18522
5118 1 9 . 1 1 99 99 LEU N N 111 120.490 120.490 122.978 -2.488 18522
5119 1 9 . 1 1 99 99 LEU HA H 111 3.877 3.877 4.188 -0.311 18522
5120 1 9 . 1 1 99 99 LEU C C 111 177.729 177.729 178.004 -0.275 18522
5121 1 9 . 1 1 99 99 LEU CA C 111 57.049 57.049 58.057 -1.008 18522
5122 1 9 . 1 1 99 99 LEU CB C 111 41.466 41.466 41.631 -0.165 18522
5123 1 9 . 1 1 99 99 LEU H H 111 7.994 7.994 8.457 -0.463 18522
5124 1 9 . 1 1 100 100 GLU N N 112 118.251 118.251 117.279 0.972 18522
5125 1 9 . 1 1 100 100 GLU HA H 112 3.972 3.972 3.873 0.099 18522
5126 1 9 . 1 1 100 100 GLU C C 112 178.402 178.402 178.027 0.375 18522
5127 1 9 . 1 1 100 100 GLU CA C 112 59.056 59.056 58.591 0.465 18522
5128 1 9 . 1 1 100 100 GLU CB C 112 29.732 29.732 29.016 0.716 18522
5129 1 9 . 1 1 100 100 GLU H H 112 7.760 7.760 7.791 -0.031 18522
5130 1 9 . 1 1 101 101 VAL N N 113 117.229 117.229 118.582 -1.353 18522
5131 1 9 . 1 1 101 101 VAL HA H 113 3.762 3.762 3.934 -0.172 18522
5132 1 9 . 1 1 101 101 VAL C C 113 178.107 178.107 177.082 1.025 18522
5133 1 9 . 1 1 101 101 VAL CA C 113 64.791 64.791 64.578 0.214 18522
5134 1 9 . 1 1 101 101 VAL CB C 113 32.149 32.149 31.908 0.241 18522
5135 1 9 . 1 1 101 101 VAL H H 113 7.437 7.437 7.415 0.022 18522
5136 1 9 . 1 1 102 102 LEU N N 114 122.124 122.124 117.261 4.863 18522
5137 1 9 . 1 1 102 102 LEU HA H 114 4.033 4.033 4.361 -0.328 18522
5138 1 9 . 1 1 102 102 LEU C C 114 178.506 178.506 179.321 -0.815 18522
5139 1 9 . 1 1 102 102 LEU CA C 114 57.243 57.243 55.527 1.716 18522
5140 1 9 . 1 1 102 102 LEU CB C 114 42.028 42.028 42.296 -0.268 18522
5141 1 9 . 1 1 102 102 LEU H H 114 7.765 7.765 8.123 -0.358 18522
5142 1 9 . 1 1 103 103 PHE N N 115 115.346 115.346 121.659 -6.313 18522
5143 1 9 . 1 1 103 103 PHE HA H 115 4.224 4.224 4.352 -0.128 18522
5144 1 9 . 1 1 103 103 PHE C C 115 175.621 175.621 174.444 1.177 18522
5145 1 9 . 1 1 103 103 PHE CA C 115 57.537 57.537 56.525 1.012 18522
5146 1 9 . 1 1 103 103 PHE CB C 115 38.057 38.057 36.784 1.273 18522
5147 1 9 . 1 1 103 103 PHE H H 115 7.805 7.805 7.880 -0.075 18522
5148 1 9 . 1 1 104 104 GLN N N 116 119.021 119.021 120.873 -1.852 18522
5149 1 9 . 1 1 104 104 GLN HA H 116 4.407 4.407 4.152 0.255 18522
5150 1 9 . 1 1 104 104 GLN C C 116 176.402 176.402 175.956 0.446 18522
5151 1 9 . 1 1 104 104 GLN CA C 116 55.521 55.521 56.171 -0.650 18522
5152 1 9 . 1 1 104 104 GLN CB C 116 29.170 29.170 27.833 1.337 18522
5153 1 9 . 1 1 104 104 GLN H H 116 7.974 7.974 8.348 -0.374 18522
5154 1 9 . 1 1 105 105 GLY N N 117 108.868 108.868 112.391 -3.523 18522
5155 1 9 . 1 1 105 105 GLY CA C 117 45.124 45.124 45.809 -0.685 18522
5156 1 9 . 1 1 105 105 GLY H H 117 8.195 8.195 8.260 -0.065 18522
5157 1 9 . 1 1 106 106 PRO HA H 118 4.490 4.490 4.207 0.283 18522
5158 1 9 . 1 1 106 106 PRO C C 118 176.001 176.001 177.417 -1.416 18522
5159 1 9 . 1 1 106 106 PRO CA C 118 63.523 63.523 64.142 -0.619 18522
5160 1 9 . 1 1 106 106 PRO CB C 118 32.078 32.078 31.790 0.288 18522
5161 1 9 . 1 1 107 107 GLN N N 119 126.950 126.950 118.387 8.563 18522
5162 1 9 . 1 1 107 107 GLN C C 119 181.211 181.211 176.807 4.404 18522
5163 1 9 . 1 1 107 107 GLN CA C 119 57.416 57.416 55.119 2.297 18522
5164 1 9 . 1 1 107 107 GLN H H 119 8.079 8.079 8.211 -0.132 18522
5165 1 9 . 1 1 111 111 ARG C C 123 174.608 174.608 174.848 -0.240 18522
5166 1 9 . 1 1 111 111 ARG CA C 123 55.099 55.099 56.917 -1.818 18522
5167 1 9 . 1 1 112 112 HIS N N 124 122.212 122.212 114.562 7.650 18522
5168 1 9 . 1 1 112 112 HIS HA H 124 4.718 4.718 4.359 0.359 18522
5169 1 9 . 1 1 112 112 HIS C C 124 176.040 176.040 174.218 1.822 18522
5170 1 9 . 1 1 112 112 HIS CA C 124 54.213 54.213 56.046 -1.833 18522
5171 1 9 . 1 1 112 112 HIS CB C 124 31.164 31.164 29.068 2.096 18522
5172 1 9 . 1 1 112 112 HIS H H 124 7.640 7.640 8.386 -0.746 18522
5173 1 9 . 1 1 113 113 TRP C C 125 176.168 176.168 175.140 1.028 18522
5174 1 9 . 1 1 114 114 LEU N N 126 121.893 121.893 129.886 -7.993 18522
5175 1 9 . 1 1 114 114 LEU HA H 126 4.869 4.869 4.516 0.353 18522
5176 1 9 . 1 1 114 114 LEU CA C 126 54.151 54.151 53.474 0.677 18522
5177 1 9 . 1 1 114 114 LEU CB C 126 45.144 45.144 44.240 0.904 18522
5178 1 9 . 1 1 114 114 LEU H H 126 8.606 8.606 7.988 0.618 18522
5179 1 9 . 1 1 115 115 LYS N N 127 125.850 125.850 124.274 1.576 18522
5180 1 9 . 1 1 115 115 LYS HA H 127 4.203 4.203 4.663 -0.460 18522
5181 1 9 . 1 1 115 115 LYS C C 127 175.564 175.564 174.156 1.408 18522
5182 1 9 . 1 1 115 115 LYS CA C 127 57.252 57.252 54.892 2.361 18522
5183 1 9 . 1 1 115 115 LYS CB C 127 33.406 33.406 35.074 -1.668 18522
5184 1 9 . 1 1 115 115 LYS H H 127 8.647 8.647 7.984 0.663 18522
5185 1 10 . 1 1 3 3 PRO C C 15 177.225 177.225 177.015 0.210 18522
5186 1 10 . 1 1 3 3 PRO CA C 15 63.508 63.508 62.645 0.863 18522
5187 1 10 . 1 1 3 3 PRO CB C 15 32.090 32.090 31.790 0.300 18522
5188 1 10 . 1 1 4 4 GLY N N 16 108.829 108.829 113.811 -4.982 18522
5189 1 10 . 1 1 4 4 GLY C C 16 173.398 173.398 174.592 -1.194 18522
5190 1 10 . 1 1 4 4 GLY CA C 16 45.128 45.128 44.506 0.622 18522
5191 1 10 . 1 1 4 4 GLY H H 16 8.489 8.489 8.430 0.059 18522
5192 1 10 . 1 1 5 5 ILE N N 17 121.763 121.763 120.076 1.687 18522
5193 1 10 . 1 1 5 5 ILE HA H 17 4.554 4.554 4.559 -0.005 18522
5194 1 10 . 1 1 5 5 ILE C C 17 174.332 174.332 173.982 0.350 18522
5195 1 10 . 1 1 5 5 ILE CA C 17 58.245 58.245 58.325 -0.080 18522
5196 1 10 . 1 1 5 5 ILE CB C 17 38.762 38.762 37.664 1.098 18522
5197 1 10 . 1 1 5 5 ILE H H 17 8.014 8.014 7.745 0.269 18522
5198 1 10 . 1 1 6 6 PRO C C 18 176.437 176.437 176.350 0.087 18522
5199 1 10 . 1 1 6 6 PRO CA C 18 62.667 62.667 62.452 0.215 18522
5200 1 10 . 1 1 6 6 PRO CB C 18 32.469 32.469 32.006 0.463 18522
5201 1 10 . 1 1 7 7 VAL N N 19 123.849 123.849 118.659 5.190 18522
5202 1 10 . 1 1 7 7 VAL HA H 19 4.550 4.550 3.965 0.585 18522
5203 1 10 . 1 1 7 7 VAL C C 19 174.453 174.453 174.564 -0.111 18522
5204 1 10 . 1 1 7 7 VAL CA C 19 59.846 59.846 61.643 -1.797 18522
5205 1 10 . 1 1 7 7 VAL CB C 19 33.510 33.510 30.519 2.991 18522
5206 1 10 . 1 1 7 7 VAL H H 19 8.754 8.754 8.206 0.548 18522
5207 1 10 . 1 1 8 8 PRO HA H 20 5.338 5.338 4.321 1.017 18522
5208 1 10 . 1 1 8 8 PRO C C 20 177.585 177.585 176.641 0.944 18522
5209 1 10 . 1 1 8 8 PRO CA C 20 62.406 62.406 63.182 -0.777 18522
5210 1 10 . 1 1 8 8 PRO CB C 20 32.891 32.891 31.804 1.087 18522
5211 1 10 . 1 1 9 9 GLY N N 21 108.426 108.426 112.205 -3.779 18522
5212 1 10 . 1 1 9 9 GLY C C 21 171.443 171.443 172.060 -0.617 18522
5213 1 10 . 1 1 9 9 GLY CA C 21 44.581 44.581 44.694 -0.113 18522
5214 1 10 . 1 1 9 9 GLY H H 21 8.258 8.258 8.265 -0.007 18522
5215 1 10 . 1 1 10 10 LYS N N 22 117.372 117.372 122.460 -5.088 18522
5216 1 10 . 1 1 10 10 LYS HA H 22 4.039 4.039 4.586 -0.547 18522
5217 1 10 . 1 1 10 10 LYS C C 22 174.463 174.463 174.486 -0.023 18522
5218 1 10 . 1 1 10 10 LYS CA C 22 55.263 55.263 55.561 -0.298 18522
5219 1 10 . 1 1 10 10 LYS CB C 22 35.227 35.227 34.039 1.188 18522
5220 1 10 . 1 1 10 10 LYS H H 22 8.175 8.175 8.140 0.035 18522
5221 1 10 . 1 1 11 11 VAL N N 23 120.387 120.387 116.592 3.795 18522
5222 1 10 . 1 1 11 11 VAL HA H 23 4.708 4.708 4.588 0.120 18522
5223 1 10 . 1 1 11 11 VAL C C 23 171.873 171.873 174.197 -2.324 18522
5224 1 10 . 1 1 11 11 VAL CA C 23 59.866 59.866 60.022 -0.156 18522
5225 1 10 . 1 1 11 11 VAL CB C 23 35.269 35.269 35.537 -0.268 18522
5226 1 10 . 1 1 11 11 VAL H H 23 8.862 8.862 8.153 0.709 18522
5227 1 10 . 1 1 12 12 THR N N 24 125.797 125.797 119.631 6.166 18522
5228 1 10 . 1 1 12 12 THR HA H 24 5.121 5.121 4.960 0.161 18522
5229 1 10 . 1 1 12 12 THR C C 24 173.407 173.407 173.733 -0.326 18522
5230 1 10 . 1 1 12 12 THR CA C 24 62.115 62.115 60.865 1.250 18522
5231 1 10 . 1 1 12 12 THR CB C 24 69.606 69.606 68.539 1.067 18522
5232 1 10 . 1 1 12 12 THR H H 24 8.859 8.859 8.281 0.578 18522
5233 1 10 . 1 1 13 13 LEU N N 25 127.960 127.960 127.322 0.638 18522
5234 1 10 . 1 1 13 13 LEU HA H 25 4.809 4.809 4.817 -0.008 18522
5235 1 10 . 1 1 13 13 LEU C C 25 175.029 175.029 175.594 -0.565 18522
5236 1 10 . 1 1 13 13 LEU CA C 25 52.623 52.623 52.934 -0.311 18522
5237 1 10 . 1 1 13 13 LEU CB C 25 46.242 46.242 44.596 1.646 18522
5238 1 10 . 1 1 13 13 LEU H H 25 9.258 9.258 7.942 1.316 18522
5239 1 10 . 1 1 14 14 GLN N N 26 120.858 120.858 116.946 3.912 18522
5240 1 10 . 1 1 14 14 GLN HA H 26 4.482 4.482 4.613 -0.131 18522
5241 1 10 . 1 1 14 14 GLN C C 26 174.515 174.515 175.535 -1.020 18522
5242 1 10 . 1 1 14 14 GLN CA C 26 54.576 54.576 54.494 0.082 18522
5243 1 10 . 1 1 14 14 GLN CB C 26 29.516 29.516 31.826 -2.310 18522
5244 1 10 . 1 1 14 14 GLN H H 26 8.530 8.530 8.338 0.192 18522
5245 1 10 . 1 1 15 15 LYS N N 27 119.583 119.583 123.248 -3.665 18522
5246 1 10 . 1 1 15 15 LYS HA H 27 4.180 4.180 4.365 -0.185 18522
5247 1 10 . 1 1 15 15 LYS C C 27 177.468 177.468 177.042 0.426 18522
5248 1 10 . 1 1 15 15 LYS CA C 27 55.956 55.956 56.555 -0.599 18522
5249 1 10 . 1 1 15 15 LYS CB C 27 34.099 34.099 32.303 1.796 18522
5250 1 10 . 1 1 15 15 LYS H H 27 8.099 8.099 8.458 -0.359 18522
5251 1 10 . 1 1 16 16 ASP N N 28 121.439 121.439 121.528 -0.089 18522
5252 1 10 . 1 1 16 16 ASP HA H 28 4.590 4.590 4.659 -0.069 18522
5253 1 10 . 1 1 16 16 ASP C C 28 178.392 178.392 177.639 0.753 18522
5254 1 10 . 1 1 16 16 ASP CA C 28 52.426 52.426 53.327 -0.901 18522
5255 1 10 . 1 1 16 16 ASP CB C 28 41.377 41.377 41.395 -0.018 18522
5256 1 10 . 1 1 16 16 ASP H H 28 8.888 8.888 8.593 0.295 18522
5257 1 10 . 1 1 17 17 ALA N N 29 119.578 119.578 120.565 -0.987 18522
5258 1 10 . 1 1 17 17 ALA HA H 29 4.188 4.188 4.146 0.042 18522
5259 1 10 . 1 1 17 17 ALA C C 29 178.763 178.763 178.433 0.330 18522
5260 1 10 . 1 1 17 17 ALA CA C 29 54.434 54.434 54.551 -0.117 18522
5261 1 10 . 1 1 17 17 ALA CB C 29 18.293 18.293 18.677 -0.384 18522
5262 1 10 . 1 1 17 17 ALA H H 29 8.392 8.392 8.401 -0.009 18522
5263 1 10 . 1 1 18 18 GLN N N 30 117.564 117.564 116.832 0.732 18522
5264 1 10 . 1 1 18 18 GLN HA H 30 4.399 4.399 4.281 0.118 18522
5265 1 10 . 1 1 18 18 GLN C C 30 175.168 175.168 175.603 -0.435 18522
5266 1 10 . 1 1 18 18 GLN CA C 30 55.339 55.339 54.850 0.489 18522
5267 1 10 . 1 1 18 18 GLN CB C 30 28.589 28.589 28.892 -0.303 18522
5268 1 10 . 1 1 18 18 GLN H H 30 8.353 8.353 8.406 -0.053 18522
5269 1 10 . 1 1 19 19 ASN N N 31 115.365 115.365 116.464 -1.099 18522
5270 1 10 . 1 1 19 19 ASN HA H 31 4.315 4.315 4.384 -0.069 18522
5271 1 10 . 1 1 19 19 ASN C C 31 174.043 174.043 173.484 0.559 18522
5272 1 10 . 1 1 19 19 ASN CA C 31 54.303 54.303 54.412 -0.109 18522
5273 1 10 . 1 1 19 19 ASN CB C 31 37.610 37.610 37.477 0.133 18522
5274 1 10 . 1 1 19 19 ASN H H 31 8.521 8.521 7.795 0.726 18522
5275 1 10 . 1 1 20 20 LEU N N 32 118.660 118.660 112.039 6.621 18522
5276 1 10 . 1 1 20 20 LEU HA H 32 4.900 4.900 4.937 -0.037 18522
5277 1 10 . 1 1 20 20 LEU C C 32 178.117 178.117 176.349 1.768 18522
5278 1 10 . 1 1 20 20 LEU CA C 32 53.957 53.957 52.976 0.981 18522
5279 1 10 . 1 1 20 20 LEU CB C 32 44.774 44.774 43.579 1.195 18522
5280 1 10 . 1 1 20 20 LEU H H 32 8.155 8.155 8.376 -0.221 18522
5281 1 10 . 1 1 21 21 ILE N N 33 116.785 116.785 116.523 0.262 18522
5282 1 10 . 1 1 21 21 ILE HA H 33 4.674 4.674 4.399 0.275 18522
5283 1 10 . 1 1 21 21 ILE C C 33 176.185 176.185 176.717 -0.532 18522
5284 1 10 . 1 1 21 21 ILE CA C 33 62.602 62.602 61.562 1.040 18522
5285 1 10 . 1 1 21 21 ILE CB C 33 39.016 39.016 39.383 -0.367 18522
5286 1 10 . 1 1 21 21 ILE H H 33 11.488 11.488 8.411 3.077 18522
5287 1 10 . 1 1 22 22 GLY N N 34 111.234 111.234 107.071 4.163 18522
5288 1 10 . 1 1 22 22 GLY C C 34 173.993 173.993 173.317 0.676 18522
5289 1 10 . 1 1 22 22 GLY CA C 34 45.980 45.980 45.358 0.621 18522
5290 1 10 . 1 1 22 22 GLY H H 34 9.854 9.854 8.516 1.338 18522
5291 1 10 . 1 1 23 23 ILE N N 35 111.117 111.117 113.004 -1.887 18522
5292 1 10 . 1 1 23 23 ILE HA H 35 5.535 5.535 5.527 0.008 18522
5293 1 10 . 1 1 23 23 ILE C C 35 175.033 175.033 174.078 0.955 18522
5294 1 10 . 1 1 23 23 ILE CA C 35 58.415 58.415 57.733 0.682 18522
5295 1 10 . 1 1 23 23 ILE CB C 35 41.577 41.577 41.711 -0.133 18522
5296 1 10 . 1 1 23 23 ILE H H 35 7.835 7.835 7.439 0.396 18522
5297 1 10 . 1 1 24 24 SER N N 36 114.908 114.908 115.720 -0.812 18522
5298 1 10 . 1 1 24 24 SER HA H 36 4.232 4.232 5.018 -0.786 18522
5299 1 10 . 1 1 24 24 SER C C 36 174.735 174.735 172.910 1.825 18522
5300 1 10 . 1 1 24 24 SER CA C 36 56.121 56.121 57.214 -1.093 18522
5301 1 10 . 1 1 24 24 SER CB C 36 66.097 66.097 65.549 0.548 18522
5302 1 10 . 1 1 24 24 SER H H 36 8.623 8.623 8.373 0.250 18522
5303 1 10 . 1 1 25 25 ILE N N 37 117.739 117.739 124.965 -7.226 18522
5304 1 10 . 1 1 25 25 ILE C C 37 174.340 174.340 174.724 -0.384 18522
5305 1 10 . 1 1 25 25 ILE CA C 37 59.123 59.123 60.563 -1.440 18522
5306 1 10 . 1 1 25 25 ILE CB C 37 41.637 41.637 40.480 1.157 18522
5307 1 10 . 1 1 25 25 ILE H H 37 9.130 9.130 8.825 0.305 18522
5308 1 10 . 1 1 26 26 GLY N N 38 108.069 108.069 113.917 -5.848 18522
5309 1 10 . 1 1 26 26 GLY CA C 38 44.112 44.112 44.334 -0.223 18522
5310 1 10 . 1 1 26 26 GLY H H 38 8.841 8.841 8.161 0.680 18522
5311 1 10 . 1 1 27 27 GLY N N 39 109.016 109.016 110.869 -1.853 18522
5312 1 10 . 1 1 27 27 GLY C C 39 173.956 173.956 174.575 -0.619 18522
5313 1 10 . 1 1 27 27 GLY H H 39 8.187 8.187 8.208 -0.021 18522
5314 1 10 . 1 1 28 28 GLY N N 40 111.783 111.783 110.634 1.149 18522
5315 1 10 . 1 1 28 28 GLY C C 40 174.255 174.255 174.820 -0.565 18522
5316 1 10 . 1 1 28 28 GLY CA C 40 47.098 47.098 46.629 0.469 18522
5317 1 10 . 1 1 28 28 GLY H H 40 8.275 8.275 8.213 0.062 18522
5318 1 10 . 1 1 29 29 ALA N N 41 123.128 123.128 121.235 1.893 18522
5319 1 10 . 1 1 29 29 ALA HA H 41 4.559 4.559 3.854 0.705 18522
5320 1 10 . 1 1 29 29 ALA CA C 41 51.073 51.073 54.394 -3.321 18522
5321 1 10 . 1 1 29 29 ALA CB C 41 21.926 21.926 17.219 4.707 18522
5322 1 10 . 1 1 29 29 ALA H H 41 8.012 8.012 7.295 0.717 18522
5323 1 10 . 1 1 31 31 TYR HA H 43 4.549 4.549 4.376 0.173 18522
5324 1 10 . 1 1 31 31 TYR CA C 43 57.147 57.147 60.314 -3.167 18522
5325 1 10 . 1 1 31 31 TYR CB C 43 37.495 37.495 39.760 -2.264 18522
5326 1 10 . 1 1 32 32 CYS N N 44 119.332 119.332 113.150 6.182 18522
5327 1 10 . 1 1 32 32 CYS HA H 44 4.859 4.859 4.923 -0.064 18522
5328 1 10 . 1 1 32 32 CYS CA C 44 57.406 57.406 57.385 0.021 18522
5329 1 10 . 1 1 32 32 CYS CB C 44 27.673 27.673 30.306 -2.633 18522
5330 1 10 . 1 1 32 32 CYS H H 44 7.504 7.504 7.855 -0.351 18522
5331 1 10 . 1 1 33 33 PRO HA H 45 4.413 4.413 4.620 -0.207 18522
5332 1 10 . 1 1 33 33 PRO CA C 45 64.885 64.885 63.714 1.171 18522
5333 1 10 . 1 1 33 33 PRO CB C 45 32.318 32.318 29.317 3.001 18522
5334 1 10 . 1 1 34 34 CYS N N 46 117.327 117.327 116.043 1.284 18522
5335 1 10 . 1 1 34 34 CYS C C 46 172.064 172.064 174.285 -2.221 18522
5336 1 10 . 1 1 34 34 CYS CA C 46 60.066 60.066 57.576 2.490 18522
5337 1 10 . 1 1 34 34 CYS CB C 46 28.715 28.715 29.638 -0.923 18522
5338 1 10 . 1 1 34 34 CYS H H 46 7.973 7.973 8.313 -0.340 18522
5339 1 10 . 1 1 35 35 LEU N N 47 124.270 124.270 118.564 5.706 18522
5340 1 10 . 1 1 35 35 LEU HA H 47 4.928 4.928 4.103 0.825 18522
5341 1 10 . 1 1 35 35 LEU C C 47 175.076 175.076 175.738 -0.662 18522
5342 1 10 . 1 1 35 35 LEU CA C 47 53.278 53.278 57.503 -4.225 18522
5343 1 10 . 1 1 35 35 LEU CB C 47 44.321 44.321 40.314 4.007 18522
5344 1 10 . 1 1 35 35 LEU H H 47 8.629 8.629 8.558 0.071 18522
5345 1 10 . 1 1 36 36 TYR N N 48 119.326 119.326 111.782 7.544 18522
5346 1 10 . 1 1 36 36 TYR HA H 48 5.255 5.255 4.962 0.293 18522
5347 1 10 . 1 1 36 36 TYR C C 48 175.766 175.766 173.318 2.448 18522
5348 1 10 . 1 1 36 36 TYR CA C 48 56.696 56.696 56.138 0.558 18522
5349 1 10 . 1 1 36 36 TYR CB C 48 42.590 42.590 40.273 2.317 18522
5350 1 10 . 1 1 36 36 TYR H H 48 8.761 8.761 7.341 1.420 18522
5351 1 10 . 1 1 37 37 ILE N N 49 120.259 120.259 121.533 -1.274 18522
5352 1 10 . 1 1 37 37 ILE HA H 49 4.215 4.215 4.613 -0.398 18522
5353 1 10 . 1 1 37 37 ILE C C 49 177.429 177.429 176.161 1.268 18522
5354 1 10 . 1 1 37 37 ILE CA C 49 62.456 62.456 59.714 2.742 18522
5355 1 10 . 1 1 37 37 ILE CB C 49 37.352 37.352 40.440 -3.088 18522
5356 1 10 . 1 1 37 37 ILE H H 49 8.959 8.959 8.640 0.319 18522
5357 1 10 . 1 1 38 38 VAL HA H 50 3.937 3.937 4.474 -0.537 18522
5358 1 10 . 1 1 38 38 VAL C C 50 174.408 174.408 175.564 -1.156 18522
5359 1 10 . 1 1 38 38 VAL CA C 50 62.259 62.259 62.283 -0.024 18522
5360 1 10 . 1 1 38 38 VAL CB C 50 31.584 31.584 32.339 -0.755 18522
5361 1 10 . 1 1 39 39 GLN N N 51 116.821 116.821 118.550 -1.729 18522
5362 1 10 . 1 1 39 39 GLN HA H 51 4.103 4.103 4.500 -0.397 18522
5363 1 10 . 1 1 39 39 GLN C C 51 172.856 172.856 172.928 -0.072 18522
5364 1 10 . 1 1 39 39 GLN CA C 51 55.127 55.127 55.632 -0.505 18522
5365 1 10 . 1 1 39 39 GLN CB C 51 32.376 32.376 32.632 -0.256 18522
5366 1 10 . 1 1 39 39 GLN H H 51 6.967 6.967 7.552 -0.585 18522
5367 1 10 . 1 1 40 40 VAL N N 52 123.482 123.482 120.828 2.654 18522
5368 1 10 . 1 1 40 40 VAL HA H 52 4.277 4.277 4.983 -0.706 18522
5369 1 10 . 1 1 40 40 VAL C C 52 176.198 176.198 174.067 2.131 18522
5370 1 10 . 1 1 40 40 VAL CA C 52 61.574 61.574 59.754 1.820 18522
5371 1 10 . 1 1 40 40 VAL CB C 52 32.875 32.875 35.839 -2.964 18522
5372 1 10 . 1 1 40 40 VAL H H 52 8.447 8.447 8.193 0.254 18522
5373 1 10 . 1 1 41 41 PHE N N 53 128.296 128.296 122.969 5.327 18522
5374 1 10 . 1 1 41 41 PHE HA H 53 4.400 4.400 4.810 -0.410 18522
5375 1 10 . 1 1 41 41 PHE C C 53 175.299 175.299 176.102 -0.803 18522
5376 1 10 . 1 1 41 41 PHE CA C 53 58.494 58.494 57.016 1.478 18522
5377 1 10 . 1 1 41 41 PHE CB C 53 39.561 39.561 40.831 -1.270 18522
5378 1 10 . 1 1 41 41 PHE H H 53 8.707 8.707 8.588 0.119 18522
5379 1 10 . 1 1 42 42 ASP N N 54 122.696 122.696 123.426 -0.730 18522
5380 1 10 . 1 1 42 42 ASP HA H 54 4.272 4.272 4.331 -0.059 18522
5381 1 10 . 1 1 42 42 ASP C C 54 176.837 176.837 176.330 0.507 18522
5382 1 10 . 1 1 42 42 ASP CA C 54 55.291 55.291 56.836 -1.545 18522
5383 1 10 . 1 1 42 42 ASP CB C 54 41.093 41.093 41.038 0.055 18522
5384 1 10 . 1 1 42 42 ASP H H 54 8.901 8.901 9.023 -0.122 18522
5385 1 10 . 1 1 43 43 ASN N N 55 113.923 113.923 113.035 0.888 18522
5386 1 10 . 1 1 43 43 ASN HA H 55 4.258 4.258 4.805 -0.547 18522
5387 1 10 . 1 1 43 43 ASN C C 55 173.714 173.714 175.185 -1.471 18522
5388 1 10 . 1 1 43 43 ASN CA C 55 54.958 54.958 52.945 2.013 18522
5389 1 10 . 1 1 43 43 ASN CB C 55 37.150 37.150 39.215 -2.065 18522
5390 1 10 . 1 1 43 43 ASN H H 55 9.319 9.319 8.060 1.259 18522
5391 1 10 . 1 1 44 44 THR N N 56 108.020 108.020 114.050 -6.030 18522
5392 1 10 . 1 1 44 44 THR HA H 56 5.377 5.377 4.830 0.547 18522
5393 1 10 . 1 1 44 44 THR CA C 56 59.712 59.712 59.595 0.117 18522
5394 1 10 . 1 1 44 44 THR CB C 56 69.529 69.529 70.544 -1.015 18522
5395 1 10 . 1 1 44 44 THR H H 56 7.149 7.149 7.864 -0.715 18522
5396 1 10 . 1 1 45 45 PRO HA H 57 4.304 4.304 4.091 0.213 18522
5397 1 10 . 1 1 45 45 PRO C C 57 180.141 180.141 178.298 1.843 18522
5398 1 10 . 1 1 45 45 PRO CA C 57 66.090 66.090 65.669 0.421 18522
5399 1 10 . 1 1 45 45 PRO CB C 57 33.194 33.194 31.441 1.754 18522
5400 1 10 . 1 1 46 46 ALA N N 58 116.854 116.854 120.325 -3.471 18522
5401 1 10 . 1 1 46 46 ALA HA H 58 4.035 4.035 4.003 0.032 18522
5402 1 10 . 1 1 46 46 ALA C C 58 180.647 180.647 179.488 1.159 18522
5403 1 10 . 1 1 46 46 ALA CA C 58 55.195 55.195 55.282 -0.087 18522
5404 1 10 . 1 1 46 46 ALA CB C 58 18.880 18.880 18.140 0.740 18522
5405 1 10 . 1 1 46 46 ALA H H 58 8.938 8.938 7.929 1.009 18522
5406 1 10 . 1 1 47 47 ALA N N 59 123.250 123.250 120.963 2.287 18522
5407 1 10 . 1 1 47 47 ALA HA H 59 4.030 4.030 4.159 -0.129 18522
5408 1 10 . 1 1 47 47 ALA C C 59 179.852 179.852 179.706 0.146 18522
5409 1 10 . 1 1 47 47 ALA CA C 59 54.939 54.939 54.609 0.330 18522
5410 1 10 . 1 1 47 47 ALA CB C 59 19.688 19.688 18.451 1.237 18522
5411 1 10 . 1 1 47 47 ALA H H 59 7.658 7.658 7.447 0.211 18522
5412 1 10 . 1 1 48 48 LEU N N 60 118.654 118.654 119.641 -0.987 18522
5413 1 10 . 1 1 48 48 LEU HA H 60 4.026 4.026 4.132 -0.106 18522
5414 1 10 . 1 1 48 48 LEU C C 60 179.238 179.238 178.630 0.608 18522
5415 1 10 . 1 1 48 48 LEU CA C 60 57.261 57.261 58.125 -0.864 18522
5416 1 10 . 1 1 48 48 LEU CB C 60 41.445 41.445 40.837 0.608 18522
5417 1 10 . 1 1 48 48 LEU H H 60 8.636 8.636 8.465 0.171 18522
5418 1 10 . 1 1 49 49 ASP N N 61 117.382 117.382 116.968 0.414 18522
5419 1 10 . 1 1 49 49 ASP HA H 61 4.421 4.421 4.642 -0.221 18522
5420 1 10 . 1 1 49 49 ASP C C 61 177.668 177.668 177.973 -0.305 18522
5421 1 10 . 1 1 49 49 ASP CA C 61 57.087 57.087 55.002 2.085 18522
5422 1 10 . 1 1 49 49 ASP CB C 61 44.478 44.478 41.823 2.655 18522
5423 1 10 . 1 1 49 49 ASP H H 61 7.665 7.665 7.874 -0.209 18522
5424 1 10 . 1 1 50 50 GLY N N 62 103.228 103.228 108.386 -5.158 18522
5425 1 10 . 1 1 50 50 GLY C C 62 174.776 174.776 175.366 -0.590 18522
5426 1 10 . 1 1 50 50 GLY CA C 62 46.533 46.533 45.978 0.555 18522
5427 1 10 . 1 1 50 50 GLY H H 62 7.216 7.216 8.526 -1.310 18522
5428 1 10 . 1 1 51 51 THR N N 63 117.230 117.230 110.827 6.403 18522
5429 1 10 . 1 1 51 51 THR HA H 63 3.907 3.907 3.846 0.061 18522
5430 1 10 . 1 1 51 51 THR C C 63 175.961 175.961 175.079 0.882 18522
5431 1 10 . 1 1 51 51 THR CA C 63 66.478 66.478 63.436 3.042 18522
5432 1 10 . 1 1 51 51 THR CB C 63 68.268 68.268 66.538 1.730 18522
5433 1 10 . 1 1 51 51 THR H H 63 8.319 8.319 8.048 0.271 18522
5434 1 10 . 1 1 52 52 VAL N N 64 113.826 113.826 117.312 -3.486 18522
5435 1 10 . 1 1 52 52 VAL HA H 64 3.950 3.950 4.221 -0.271 18522
5436 1 10 . 1 1 52 52 VAL C C 64 173.883 173.883 175.033 -1.150 18522
5437 1 10 . 1 1 52 52 VAL CA C 64 60.708 60.708 60.953 -0.245 18522
5438 1 10 . 1 1 52 52 VAL CB C 64 33.079 33.079 29.742 3.337 18522
5439 1 10 . 1 1 52 52 VAL H H 64 8.147 8.147 7.502 0.645 18522
5440 1 10 . 1 1 53 53 ALA N N 65 123.521 123.521 125.238 -1.717 18522
5441 1 10 . 1 1 53 53 ALA HA H 65 4.414 4.414 4.366 0.048 18522
5442 1 10 . 1 1 53 53 ALA C C 65 175.247 175.247 176.885 -1.638 18522
5443 1 10 . 1 1 53 53 ALA CA C 65 50.440 50.440 50.704 -0.264 18522
5444 1 10 . 1 1 53 53 ALA CB C 65 23.266 23.266 20.274 2.992 18522
5445 1 10 . 1 1 53 53 ALA H H 65 8.633 8.633 7.576 1.057 18522
5446 1 10 . 1 1 54 54 ALA N N 66 120.818 120.818 122.481 -1.663 18522
5447 1 10 . 1 1 54 54 ALA HA H 66 3.720 3.720 4.185 -0.465 18522
5448 1 10 . 1 1 54 54 ALA C C 66 178.411 178.411 178.249 0.162 18522
5449 1 10 . 1 1 54 54 ALA CA C 66 53.016 53.016 53.352 -0.336 18522
5450 1 10 . 1 1 54 54 ALA CB C 66 17.840 17.840 17.247 0.593 18522
5451 1 10 . 1 1 54 54 ALA H H 66 8.451 8.451 8.300 0.151 18522
5452 1 10 . 1 1 55 55 GLY N N 67 112.260 112.260 112.949 -0.689 18522
5453 1 10 . 1 1 55 55 GLY C C 67 173.296 173.296 173.930 -0.634 18522
5454 1 10 . 1 1 55 55 GLY CA C 67 45.025 45.025 44.772 0.253 18522
5455 1 10 . 1 1 55 55 GLY H H 67 9.600 9.600 8.363 1.237 18522
5456 1 10 . 1 1 56 56 ASP N N 68 121.293 121.293 122.287 -0.994 18522
5457 1 10 . 1 1 56 56 ASP HA H 68 4.861 4.861 4.770 0.091 18522
5458 1 10 . 1 1 56 56 ASP C C 68 174.937 174.937 174.552 0.385 18522
5459 1 10 . 1 1 56 56 ASP CA C 68 55.641 55.641 54.052 1.589 18522
5460 1 10 . 1 1 56 56 ASP CB C 68 40.696 40.696 43.331 -2.635 18522
5461 1 10 . 1 1 56 56 ASP H H 68 8.043 8.043 8.031 0.012 18522
5462 1 10 . 1 1 57 57 GLU N N 69 122.814 122.814 120.065 2.749 18522
5463 1 10 . 1 1 57 57 GLU C C 69 177.202 177.202 175.770 1.432 18522
5464 1 10 . 1 1 57 57 GLU CA C 69 54.472 54.472 54.873 -0.402 18522
5465 1 10 . 1 1 57 57 GLU CB C 69 32.800 32.800 31.552 1.248 18522
5466 1 10 . 1 1 57 57 GLU H H 69 8.455 8.455 8.149 0.306 18522
5467 1 10 . 1 1 58 58 ILE N N 70 125.862 125.862 124.946 0.916 18522
5468 1 10 . 1 1 58 58 ILE HA H 70 4.526 4.526 4.604 -0.078 18522
5469 1 10 . 1 1 58 58 ILE C C 70 175.035 175.035 175.175 -0.140 18522
5470 1 10 . 1 1 58 58 ILE CA C 70 60.918 60.918 59.920 0.998 18522
5471 1 10 . 1 1 58 58 ILE CB C 70 39.236 39.236 38.508 0.728 18522
5472 1 10 . 1 1 58 58 ILE H H 70 8.619 8.619 8.352 0.267 18522
5473 1 10 . 1 1 59 59 THR N N 71 115.507 115.507 121.223 -5.716 18522
5474 1 10 . 1 1 59 59 THR HA H 71 4.513 4.513 4.728 -0.215 18522
5475 1 10 . 1 1 59 59 THR C C 71 176.425 176.425 173.753 2.672 18522
5476 1 10 . 1 1 59 59 THR CA C 71 61.158 61.158 60.842 0.316 18522
5477 1 10 . 1 1 59 59 THR CB C 71 69.604 69.604 69.921 -0.317 18522
5478 1 10 . 1 1 59 59 THR H H 71 9.242 9.242 9.263 -0.021 18522
5479 1 10 . 1 1 60 60 GLY N N 72 111.789 111.789 108.573 3.216 18522
5480 1 10 . 1 1 60 60 GLY C C 72 170.981 170.981 171.434 -0.453 18522
5481 1 10 . 1 1 60 60 GLY CA C 72 46.554 46.554 45.181 1.373 18522
5482 1 10 . 1 1 60 60 GLY H H 72 7.883 7.883 7.978 -0.095 18522
5483 1 10 . 1 1 61 61 VAL N N 73 119.277 119.277 115.564 3.713 18522
5484 1 10 . 1 1 61 61 VAL C C 73 175.951 175.951 176.392 -0.441 18522
5485 1 10 . 1 1 61 61 VAL CA C 73 60.982 60.982 58.602 2.380 18522
5486 1 10 . 1 1 61 61 VAL CB C 73 36.197 36.197 35.252 0.945 18522
5487 1 10 . 1 1 61 61 VAL H H 73 8.424 8.424 8.785 -0.361 18522
5488 1 10 . 1 1 62 62 ASN N N 74 127.731 127.731 122.386 5.345 18522
5489 1 10 . 1 1 62 62 ASN HA H 74 4.520 4.520 4.291 0.229 18522
5490 1 10 . 1 1 62 62 ASN C C 74 174.878 174.878 175.467 -0.589 18522
5491 1 10 . 1 1 62 62 ASN CA C 74 54.418 54.418 54.678 -0.260 18522
5492 1 10 . 1 1 62 62 ASN CB C 74 36.655 36.655 38.467 -1.812 18522
5493 1 10 . 1 1 62 62 ASN H H 74 10.384 10.384 9.260 1.124 18522
5494 1 10 . 1 1 63 63 GLY N N 75 104.633 104.633 104.838 -0.205 18522
5495 1 10 . 1 1 63 63 GLY C C 75 173.610 173.610 173.191 0.419 18522
5496 1 10 . 1 1 63 63 GLY CA C 75 45.261 45.261 44.997 0.264 18522
5497 1 10 . 1 1 63 63 GLY H H 75 8.926 8.926 8.258 0.668 18522
5498 1 10 . 1 1 64 64 ARG N N 76 120.451 120.451 120.443 0.008 18522
5499 1 10 . 1 1 64 64 ARG HA H 76 4.501 4.501 4.648 -0.147 18522
5500 1 10 . 1 1 64 64 ARG C C 76 175.085 175.085 175.327 -0.242 18522
5501 1 10 . 1 1 64 64 ARG CA C 76 54.252 54.252 53.931 0.321 18522
5502 1 10 . 1 1 64 64 ARG CB C 76 31.482 31.482 32.411 -0.929 18522
5503 1 10 . 1 1 64 64 ARG H H 76 7.753 7.753 8.091 -0.338 18522
5504 1 10 . 1 1 65 65 SER N N 77 116.586 116.586 118.139 -1.553 18522
5505 1 10 . 1 1 65 65 SER HA H 77 4.483 4.483 4.489 -0.006 18522
5506 1 10 . 1 1 65 65 SER C C 77 176.953 176.953 176.555 0.398 18522
5507 1 10 . 1 1 65 65 SER CA C 77 58.292 58.292 59.711 -1.419 18522
5508 1 10 . 1 1 65 65 SER CB C 77 63.643 63.643 63.491 0.152 18522
5509 1 10 . 1 1 65 65 SER H H 77 8.555 8.555 8.788 -0.233 18522
5510 1 10 . 1 1 66 66 ILE N N 78 116.618 116.618 120.086 -3.468 18522
5511 1 10 . 1 1 66 66 ILE HA H 78 4.420 4.420 4.122 0.298 18522
5512 1 10 . 1 1 66 66 ILE C C 78 175.072 175.072 177.046 -1.974 18522
5513 1 10 . 1 1 66 66 ILE CA C 78 59.122 59.122 61.695 -2.573 18522
5514 1 10 . 1 1 66 66 ILE CB C 78 36.758 36.758 36.881 -0.123 18522
5515 1 10 . 1 1 66 66 ILE H H 78 7.599 7.599 8.585 -0.986 18522
5516 1 10 . 1 1 67 67 LYS N N 79 123.287 123.287 121.976 1.311 18522
5517 1 10 . 1 1 67 67 LYS HA H 79 4.049 4.049 3.950 0.099 18522
5518 1 10 . 1 1 67 67 LYS C C 79 178.333 178.333 178.137 0.196 18522
5519 1 10 . 1 1 67 67 LYS CA C 79 58.321 58.321 58.447 -0.126 18522
5520 1 10 . 1 1 67 67 LYS CB C 79 31.635 31.635 31.759 -0.124 18522
5521 1 10 . 1 1 67 67 LYS H H 79 7.898 7.898 8.328 -0.430 18522
5522 1 10 . 1 1 68 68 GLY N N 80 114.933 114.933 106.904 8.029 18522
5523 1 10 . 1 1 68 68 GLY C C 80 174.385 174.385 174.844 -0.459 18522
5524 1 10 . 1 1 68 68 GLY CA C 80 45.518 45.518 46.357 -0.839 18522
5525 1 10 . 1 1 68 68 GLY H H 80 8.999 8.999 7.701 1.298 18522
5526 1 10 . 1 1 69 69 LYS N N 81 119.403 119.403 117.413 1.990 18522
5527 1 10 . 1 1 69 69 LYS HA H 81 4.043 4.043 4.549 -0.506 18522
5528 1 10 . 1 1 69 69 LYS C C 81 177.064 177.064 174.963 2.101 18522
5529 1 10 . 1 1 69 69 LYS CA C 81 54.722 54.722 55.401 -0.679 18522
5530 1 10 . 1 1 69 69 LYS CB C 81 33.560 33.560 33.147 0.414 18522
5531 1 10 . 1 1 69 69 LYS H H 81 7.845 7.845 8.067 -0.222 18522
5532 1 10 . 1 1 70 70 THR N N 82 112.066 112.066 113.975 -1.909 18522
5533 1 10 . 1 1 70 70 THR HA H 82 4.666 4.666 4.527 0.139 18522
5534 1 10 . 1 1 70 70 THR C C 82 175.955 175.955 174.445 1.510 18522
5535 1 10 . 1 1 70 70 THR CA C 82 60.438 60.438 60.538 -0.100 18522
5536 1 10 . 1 1 70 70 THR CB C 82 71.629 71.629 70.788 0.841 18522
5537 1 10 . 1 1 70 70 THR H H 82 9.153 9.153 7.714 1.439 18522
5538 1 10 . 1 1 71 71 LYS N N 83 118.730 118.730 123.687 -4.957 18522
5539 1 10 . 1 1 71 71 LYS HA H 83 3.870 3.870 3.926 -0.056 18522
5540 1 10 . 1 1 71 71 LYS C C 83 177.464 177.464 178.284 -0.820 18522
5541 1 10 . 1 1 71 71 LYS CA C 83 60.357 60.357 59.916 0.441 18522
5542 1 10 . 1 1 71 71 LYS CB C 83 31.350 31.350 31.892 -0.542 18522
5543 1 10 . 1 1 71 71 LYS H H 83 8.969 8.969 8.786 0.183 18522
5544 1 10 . 1 1 72 72 VAL N N 84 117.444 117.444 119.043 -1.599 18522
5545 1 10 . 1 1 72 72 VAL HA H 84 3.633 3.633 3.669 -0.036 18522
5546 1 10 . 1 1 72 72 VAL C C 84 178.315 178.315 177.490 0.825 18522
5547 1 10 . 1 1 72 72 VAL CA C 84 66.079 66.079 65.742 0.337 18522
5548 1 10 . 1 1 72 72 VAL CB C 84 32.091 32.091 31.610 0.481 18522
5549 1 10 . 1 1 72 72 VAL H H 84 7.631 7.631 8.252 -0.621 18522
5550 1 10 . 1 1 73 73 GLU N N 85 120.890 120.890 119.057 1.833 18522
5551 1 10 . 1 1 73 73 GLU HA H 85 3.964 3.964 4.117 -0.153 18522
5552 1 10 . 1 1 73 73 GLU C C 85 179.971 179.971 178.884 1.087 18522
5553 1 10 . 1 1 73 73 GLU CA C 85 59.316 59.316 59.194 0.122 18522
5554 1 10 . 1 1 73 73 GLU CB C 85 30.355 30.355 29.585 0.770 18522
5555 1 10 . 1 1 73 73 GLU H H 85 7.617 7.617 7.664 -0.047 18522
5556 1 10 . 1 1 74 74 VAL N N 86 121.246 121.246 118.293 2.953 18522
5557 1 10 . 1 1 74 74 VAL HA H 86 3.630 3.630 3.846 -0.216 18522
5558 1 10 . 1 1 74 74 VAL C C 86 177.217 177.217 177.624 -0.407 18522
5559 1 10 . 1 1 74 74 VAL CA C 86 66.678 66.678 65.356 1.323 18522
5560 1 10 . 1 1 74 74 VAL CB C 86 31.307 31.307 30.290 1.017 18522
5561 1 10 . 1 1 74 74 VAL H H 86 8.368 8.368 8.116 0.252 18522
5562 1 10 . 1 1 75 75 ALA N N 87 122.148 122.148 123.251 -1.103 18522
5563 1 10 . 1 1 75 75 ALA HA H 87 3.947 3.947 3.915 0.032 18522
5564 1 10 . 1 1 75 75 ALA C C 87 179.545 179.545 179.245 0.300 18522
5565 1 10 . 1 1 75 75 ALA CA C 87 55.851 55.851 55.559 0.292 18522
5566 1 10 . 1 1 75 75 ALA CB C 87 18.491 18.491 17.951 0.540 18522
5567 1 10 . 1 1 75 75 ALA H H 87 8.577 8.577 8.503 0.074 18522
5568 1 10 . 1 1 76 76 LYS N N 88 117.733 117.733 118.984 -1.251 18522
5569 1 10 . 1 1 76 76 LYS HA H 88 4.051 4.051 3.997 0.054 18522
5570 1 10 . 1 1 76 76 LYS CA C 88 59.393 59.393 59.339 0.054 18522
5571 1 10 . 1 1 76 76 LYS CB C 88 32.058 32.058 32.277 -0.219 18522
5572 1 10 . 1 1 76 76 LYS H H 88 7.854 7.854 7.388 0.466 18522
5573 1 10 . 1 1 77 77 MET N N 89 117.676 117.676 119.174 -1.498 18522
5574 1 10 . 1 1 77 77 MET HA H 89 4.048 4.048 4.019 0.029 18522
5575 1 10 . 1 1 77 77 MET C C 89 178.791 178.791 178.783 0.008 18522
5576 1 10 . 1 1 77 77 MET CA C 89 59.128 59.128 59.361 -0.234 18522
5577 1 10 . 1 1 77 77 MET CB C 89 33.801 33.801 32.498 1.303 18522
5578 1 10 . 1 1 77 77 MET H H 89 7.759 7.759 7.893 -0.134 18522
5579 1 10 . 1 1 78 78 ILE N N 90 117.305 117.305 119.309 -2.004 18522
5580 1 10 . 1 1 78 78 ILE HA H 90 3.590 3.590 3.672 -0.082 18522
5581 1 10 . 1 1 78 78 ILE C C 90 178.658 178.658 178.132 0.526 18522
5582 1 10 . 1 1 78 78 ILE CA C 90 65.482 65.482 64.964 0.518 18522
5583 1 10 . 1 1 78 78 ILE CB C 90 38.845 38.845 36.784 2.061 18522
5584 1 10 . 1 1 78 78 ILE H H 90 7.972 7.972 8.620 -0.648 18522
5585 1 10 . 1 1 79 79 GLN N N 91 120.935 120.935 118.743 2.192 18522
5586 1 10 . 1 1 79 79 GLN HA H 91 3.998 3.998 4.228 -0.230 18522
5587 1 10 . 1 1 79 79 GLN C C 91 178.274 178.274 178.390 -0.116 18522
5588 1 10 . 1 1 79 79 GLN CA C 91 59.151 59.151 57.935 1.216 18522
5589 1 10 . 1 1 79 79 GLN CB C 91 28.934 28.934 28.722 0.212 18522
5590 1 10 . 1 1 79 79 GLN H H 91 8.826 8.826 8.079 0.747 18522
5591 1 10 . 1 1 80 80 GLU N N 92 115.213 115.213 121.568 -6.355 18522
5592 1 10 . 1 1 80 80 GLU HA H 92 4.061 4.061 4.069 -0.008 18522
5593 1 10 . 1 1 80 80 GLU C C 92 176.824 176.824 178.601 -1.777 18522
5594 1 10 . 1 1 80 80 GLU CA C 92 58.006 58.006 59.209 -1.204 18522
5595 1 10 . 1 1 80 80 GLU CB C 92 29.890 29.890 29.497 0.393 18522
5596 1 10 . 1 1 80 80 GLU H H 92 8.020 8.020 8.344 -0.324 18522
5597 1 10 . 1 1 81 81 VAL N N 93 119.047 119.047 115.262 3.785 18522
5598 1 10 . 1 1 81 81 VAL HA H 93 3.930 3.930 3.818 0.112 18522
5599 1 10 . 1 1 81 81 VAL C C 93 176.016 176.016 175.649 0.367 18522
5600 1 10 . 1 1 81 81 VAL CA C 93 63.153 63.153 63.661 -0.508 18522
5601 1 10 . 1 1 81 81 VAL CB C 93 32.154 32.154 32.083 0.071 18522
5602 1 10 . 1 1 81 81 VAL H H 93 7.073 7.073 7.535 -0.462 18522
5603 1 10 . 1 1 82 82 LYS N N 94 128.366 128.366 117.848 10.518 18522
5604 1 10 . 1 1 82 82 LYS C C 94 177.460 177.460 177.268 0.192 18522
5605 1 10 . 1 1 82 82 LYS CA C 94 55.753 55.753 57.116 -1.363 18522
5606 1 10 . 1 1 82 82 LYS CB C 94 32.332 32.332 32.282 0.049 18522
5607 1 10 . 1 1 82 82 LYS H H 94 8.762 8.762 7.317 1.445 18522
5608 1 10 . 1 1 83 83 GLY N N 95 112.528 112.528 112.506 0.022 18522
5609 1 10 . 1 1 83 83 GLY C C 95 173.468 173.468 173.214 0.254 18522
5610 1 10 . 1 1 83 83 GLY CA C 95 46.243 46.243 45.623 0.620 18522
5611 1 10 . 1 1 83 83 GLY H H 95 8.673 8.673 8.782 -0.109 18522
5612 1 10 . 1 1 84 84 GLU N N 96 121.485 121.485 121.840 -0.355 18522
5613 1 10 . 1 1 84 84 GLU HA H 96 4.749 4.749 5.070 -0.321 18522
5614 1 10 . 1 1 84 84 GLU C C 96 174.583 174.583 174.852 -0.269 18522
5615 1 10 . 1 1 84 84 GLU CA C 96 55.821 55.821 54.422 1.399 18522
5616 1 10 . 1 1 84 84 GLU CB C 96 31.410 31.410 33.584 -2.174 18522
5617 1 10 . 1 1 84 84 GLU H H 96 8.297 8.297 7.856 0.441 18522
5618 1 10 . 1 1 85 85 VAL N N 97 120.501 120.501 114.088 6.413 18522
5619 1 10 . 1 1 85 85 VAL HA H 97 4.665 4.665 4.570 0.095 18522
5620 1 10 . 1 1 85 85 VAL C C 97 173.047 173.047 174.008 -0.961 18522
5621 1 10 . 1 1 85 85 VAL CA C 97 60.114 60.114 60.179 -0.065 18522
5622 1 10 . 1 1 85 85 VAL CB C 97 35.184 35.184 35.491 -0.307 18522
5623 1 10 . 1 1 85 85 VAL H H 97 9.096 9.096 8.463 0.633 18522
5624 1 10 . 1 1 86 86 THR N N 98 125.019 125.019 118.695 6.324 18522
5625 1 10 . 1 1 86 86 THR HA H 98 4.076 4.076 4.899 -0.823 18522
5626 1 10 . 1 1 86 86 THR C C 98 173.807 173.807 174.189 -0.382 18522
5627 1 10 . 1 1 86 86 THR CA C 98 61.735 61.735 61.771 -0.036 18522
5628 1 10 . 1 1 86 86 THR CB C 98 69.531 69.531 69.693 -0.162 18522
5629 1 10 . 1 1 86 86 THR H H 98 9.352 9.352 8.260 1.092 18522
5630 1 10 . 1 1 87 87 ILE N N 99 128.383 128.383 123.527 4.856 18522
5631 1 10 . 1 1 87 87 ILE HA H 99 4.661 4.661 4.623 0.038 18522
5632 1 10 . 1 1 87 87 ILE C C 99 174.614 174.614 174.907 -0.293 18522
5633 1 10 . 1 1 87 87 ILE CA C 99 58.258 58.258 59.964 -1.706 18522
5634 1 10 . 1 1 87 87 ILE CB C 99 38.528 38.528 38.729 -0.201 18522
5635 1 10 . 1 1 87 87 ILE H H 99 9.329 9.329 8.050 1.279 18522
5636 1 10 . 1 1 88 88 HIS N N 100 128.279 128.279 123.811 4.468 18522
5637 1 10 . 1 1 88 88 HIS HA H 100 4.948 4.948 5.317 -0.369 18522
5638 1 10 . 1 1 88 88 HIS C C 100 174.787 174.787 173.865 0.922 18522
5639 1 10 . 1 1 88 88 HIS CA C 100 54.620 54.620 55.732 -1.112 18522
5640 1 10 . 1 1 88 88 HIS H H 100 8.647 8.647 8.388 0.259 18522
5641 1 10 . 1 1 89 89 TYR N N 101 121.320 121.320 124.457 -3.137 18522
5642 1 10 . 1 1 89 89 TYR HA H 101 5.947 5.947 4.709 1.238 18522
5643 1 10 . 1 1 89 89 TYR C C 101 173.769 173.769 173.252 0.517 18522
5644 1 10 . 1 1 89 89 TYR CA C 101 55.669 55.669 58.431 -2.762 18522
5645 1 10 . 1 1 89 89 TYR CB C 101 42.195 42.195 41.030 1.165 18522
5646 1 10 . 1 1 89 89 TYR H H 101 8.414 8.414 9.537 -1.123 18522
5647 1 10 . 1 1 90 90 ASN N N 102 116.679 116.679 116.009 0.670 18522
5648 1 10 . 1 1 90 90 ASN HA H 102 5.335 5.335 4.856 0.479 18522
5649 1 10 . 1 1 90 90 ASN C C 102 175.406 175.406 173.040 2.366 18522
5650 1 10 . 1 1 90 90 ASN CA C 102 51.961 51.961 53.038 -1.077 18522
5651 1 10 . 1 1 90 90 ASN CB C 102 41.800 41.800 40.815 0.985 18522
5652 1 10 . 1 1 90 90 ASN H H 102 9.282 9.282 7.825 1.457 18522
5653 1 10 . 1 1 91 91 LYS N N 103 124.129 124.129 120.153 3.976 18522
5654 1 10 . 1 1 91 91 LYS C C 103 176.678 176.678 174.813 1.865 18522
5655 1 10 . 1 1 91 91 LYS CA C 103 55.006 55.006 55.508 -0.502 18522
5656 1 10 . 1 1 91 91 LYS H H 103 8.949 8.949 8.445 0.504 18522
5657 1 10 . 1 1 92 92 LEU N N 104 127.043 127.043 113.130 13.913 18522
5658 1 10 . 1 1 92 92 LEU HA H 104 4.425 4.425 4.618 -0.193 18522
5659 1 10 . 1 1 92 92 LEU CA C 104 55.060 55.060 53.429 1.631 18522
5660 1 10 . 1 1 92 92 LEU CB C 104 42.559 42.559 44.319 -1.760 18522
5661 1 10 . 1 1 92 92 LEU H H 104 9.150 9.150 6.926 2.224 18522
5662 1 10 . 1 1 93 93 GLN HA H 105 4.315 4.315 4.493 -0.178 18522
5663 1 10 . 1 1 93 93 GLN C C 105 175.070 175.070 175.291 -0.221 18522
5664 1 10 . 1 1 93 93 GLN CA C 105 55.490 55.490 55.140 0.350 18522
5665 1 10 . 1 1 93 93 GLN CB C 105 28.909 28.909 29.466 -0.557 18522
5666 1 10 . 1 1 94 94 ALA N N 106 125.133 125.133 122.108 3.025 18522
5667 1 10 . 1 1 94 94 ALA HA H 106 4.366 4.366 4.091 0.275 18522
5668 1 10 . 1 1 94 94 ALA C C 106 176.392 176.392 175.614 0.778 18522
5669 1 10 . 1 1 94 94 ALA CA C 106 51.723 51.723 52.565 -0.842 18522
5670 1 10 . 1 1 94 94 ALA CB C 106 20.185 20.185 18.611 1.574 18522
5671 1 10 . 1 1 94 94 ALA H H 106 8.226 8.226 7.803 0.423 18522
5672 1 10 . 1 1 95 95 ASP N N 107 122.013 122.013 118.438 3.575 18522
5673 1 10 . 1 1 95 95 ASP HA H 107 4.413 4.413 5.145 -0.732 18522
5674 1 10 . 1 1 95 95 ASP C C 107 175.019 175.019 175.361 -0.342 18522
5675 1 10 . 1 1 95 95 ASP CA C 107 55.642 55.642 52.210 3.432 18522
5676 1 10 . 1 1 95 95 ASP CB C 107 41.266 41.266 42.340 -1.074 18522
5677 1 10 . 1 1 95 95 ASP H H 107 8.429 8.429 8.398 0.031 18522
5678 1 10 . 1 1 96 96 PRO HA H 108 4.207 4.207 4.023 0.184 18522
5679 1 10 . 1 1 96 96 PRO C C 108 178.840 178.840 178.257 0.583 18522
5680 1 10 . 1 1 96 96 PRO CA C 108 65.396 65.396 66.509 -1.113 18522
5681 1 10 . 1 1 96 96 PRO CB C 108 32.181 32.181 31.819 0.362 18522
5682 1 10 . 1 1 97 97 LYS N N 109 117.942 117.942 116.196 1.746 18522
5683 1 10 . 1 1 97 97 LYS HA H 109 4.143 4.143 4.021 0.122 18522
5684 1 10 . 1 1 97 97 LYS C C 109 178.099 178.099 178.739 -0.640 18522
5685 1 10 . 1 1 97 97 LYS CA C 109 58.167 58.167 59.575 -1.407 18522
5686 1 10 . 1 1 97 97 LYS CB C 109 31.649 31.649 31.592 0.057 18522
5687 1 10 . 1 1 97 97 LYS H H 109 8.335 8.335 8.642 -0.307 18522
5688 1 10 . 1 1 98 98 GLN N N 110 119.159 119.159 118.400 0.759 18522
5689 1 10 . 1 1 98 98 GLN HA H 110 4.130 4.130 4.255 -0.125 18522
5690 1 10 . 1 1 98 98 GLN C C 110 178.298 178.298 177.911 0.387 18522
5691 1 10 . 1 1 98 98 GLN CA C 110 57.660 57.660 57.790 -0.130 18522
5692 1 10 . 1 1 98 98 GLN CB C 110 28.720 28.720 28.789 -0.069 18522
5693 1 10 . 1 1 98 98 GLN H H 110 7.985 7.985 7.984 0.001 18522
5694 1 10 . 1 1 99 99 LEU N N 111 120.490 120.490 122.580 -2.090 18522
5695 1 10 . 1 1 99 99 LEU HA H 111 3.877 3.877 4.460 -0.583 18522
5696 1 10 . 1 1 99 99 LEU C C 111 177.729 177.729 177.706 0.023 18522
5697 1 10 . 1 1 99 99 LEU CA C 111 57.049 57.049 56.965 0.084 18522
5698 1 10 . 1 1 99 99 LEU CB C 111 41.466 41.466 42.756 -1.290 18522
5699 1 10 . 1 1 99 99 LEU H H 111 7.994 7.994 8.226 -0.233 18522
5700 1 10 . 1 1 100 100 GLU N N 112 118.251 118.251 119.231 -0.980 18522
5701 1 10 . 1 1 100 100 GLU HA H 112 3.972 3.972 4.048 -0.076 18522
5702 1 10 . 1 1 100 100 GLU C C 112 178.402 178.402 178.992 -0.590 18522
5703 1 10 . 1 1 100 100 GLU CA C 112 59.056 59.056 59.008 0.048 18522
5704 1 10 . 1 1 100 100 GLU CB C 112 29.732 29.732 28.996 0.736 18522
5705 1 10 . 1 1 100 100 GLU H H 112 7.760 7.760 8.406 -0.646 18522
5706 1 10 . 1 1 101 101 VAL N N 113 117.229 117.229 120.650 -3.421 18522
5707 1 10 . 1 1 101 101 VAL HA H 113 3.762 3.762 3.844 -0.082 18522
5708 1 10 . 1 1 101 101 VAL C C 113 178.107 178.107 176.906 1.201 18522
5709 1 10 . 1 1 101 101 VAL CA C 113 64.791 64.791 65.477 -0.686 18522
5710 1 10 . 1 1 101 101 VAL CB C 113 32.149 32.149 31.621 0.528 18522
5711 1 10 . 1 1 101 101 VAL H H 113 7.437 7.437 7.773 -0.336 18522
5712 1 10 . 1 1 102 102 LEU N N 114 122.124 122.124 118.209 3.915 18522
5713 1 10 . 1 1 102 102 LEU HA H 114 4.033 4.033 4.195 -0.162 18522
5714 1 10 . 1 1 102 102 LEU C C 114 178.506 178.506 178.603 -0.097 18522
5715 1 10 . 1 1 102 102 LEU CA C 114 57.243 57.243 56.218 1.025 18522
5716 1 10 . 1 1 102 102 LEU CB C 114 42.028 42.028 41.266 0.762 18522
5717 1 10 . 1 1 102 102 LEU H H 114 7.765 7.765 7.513 0.252 18522
5718 1 10 . 1 1 103 103 PHE N N 115 115.346 115.346 118.878 -3.532 18522
5719 1 10 . 1 1 103 103 PHE HA H 115 4.224 4.224 4.095 0.129 18522
5720 1 10 . 1 1 103 103 PHE C C 115 175.621 175.621 177.050 -1.429 18522
5721 1 10 . 1 1 103 103 PHE CA C 115 57.537 57.537 60.773 -3.236 18522
5722 1 10 . 1 1 103 103 PHE CB C 115 38.057 38.057 40.054 -1.997 18522
5723 1 10 . 1 1 103 103 PHE H H 115 7.805 7.805 7.804 0.001 18522
5724 1 10 . 1 1 104 104 GLN N N 116 119.021 119.021 117.704 1.317 18522
5725 1 10 . 1 1 104 104 GLN HA H 116 4.407 4.407 3.886 0.521 18522
5726 1 10 . 1 1 104 104 GLN C C 116 176.402 176.402 176.078 0.324 18522
5727 1 10 . 1 1 104 104 GLN CA C 116 55.521 55.521 58.016 -2.494 18522
5728 1 10 . 1 1 104 104 GLN CB C 116 29.170 29.170 27.259 1.911 18522
5729 1 10 . 1 1 104 104 GLN H H 116 7.974 7.974 8.459 -0.485 18522
5730 1 10 . 1 1 105 105 GLY N N 117 108.868 108.868 105.545 3.323 18522
5731 1 10 . 1 1 105 105 GLY CA C 117 45.124 45.124 45.499 -0.375 18522
5732 1 10 . 1 1 105 105 GLY H H 117 8.195 8.195 8.118 0.077 18522
5733 1 10 . 1 1 106 106 PRO HA H 118 4.490 4.490 3.875 0.615 18522
5734 1 10 . 1 1 106 106 PRO C C 118 176.001 176.001 174.917 1.084 18522
5735 1 10 . 1 1 106 106 PRO CA C 118 63.523 63.523 63.170 0.353 18522
5736 1 10 . 1 1 106 106 PRO CB C 118 32.078 32.078 31.076 1.002 18522
5737 1 10 . 1 1 107 107 GLN N N 119 126.950 126.950 121.222 5.728 18522
5738 1 10 . 1 1 107 107 GLN C C 119 181.211 181.211 175.202 6.009 18522
5739 1 10 . 1 1 107 107 GLN CA C 119 57.416 57.416 56.459 0.957 18522
5740 1 10 . 1 1 107 107 GLN H H 119 8.079 8.079 8.066 0.013 18522
5741 1 10 . 1 1 111 111 ARG C C 123 174.608 174.608 174.995 -0.387 18522
5742 1 10 . 1 1 111 111 ARG CA C 123 55.099 55.099 54.906 0.193 18522
5743 1 10 . 1 1 112 112 HIS N N 124 122.212 122.212 118.222 3.990 18522
5744 1 10 . 1 1 112 112 HIS HA H 124 4.718 4.718 4.037 0.681 18522
5745 1 10 . 1 1 112 112 HIS C C 124 176.040 176.040 174.407 1.633 18522
5746 1 10 . 1 1 112 112 HIS CA C 124 54.213 54.213 55.456 -1.243 18522
5747 1 10 . 1 1 112 112 HIS CB C 124 31.164 31.164 29.997 1.167 18522
5748 1 10 . 1 1 112 112 HIS H H 124 7.640 7.640 8.647 -1.007 18522
5749 1 10 . 1 1 113 113 TRP C C 125 176.168 176.168 176.110 0.058 18522
5750 1 10 . 1 1 114 114 LEU N N 126 121.893 121.893 124.175 -2.282 18522
5751 1 10 . 1 1 114 114 LEU HA H 126 4.869 4.869 4.693 0.176 18522
5752 1 10 . 1 1 114 114 LEU CA C 126 54.151 54.151 53.318 0.833 18522
5753 1 10 . 1 1 114 114 LEU CB C 126 45.144 45.144 43.626 1.518 18522
5754 1 10 . 1 1 114 114 LEU H H 126 8.606 8.606 8.198 0.408 18522
5755 1 10 . 1 1 115 115 LYS N N 127 125.850 125.850 119.941 5.909 18522
5756 1 10 . 1 1 115 115 LYS HA H 127 4.203 4.203 4.920 -0.717 18522
5757 1 10 . 1 1 115 115 LYS C C 127 175.564 175.564 174.368 1.196 18522
5758 1 10 . 1 1 115 115 LYS CA C 127 57.252 57.252 55.366 1.886 18522
5759 1 10 . 1 1 115 115 LYS CB C 127 33.406 33.406 34.445 -1.039 18522
5760 1 10 . 1 1 115 115 LYS H H 127 8.647 8.647 8.091 0.556 18522
5761 1 11 . 1 1 3 3 PRO C C 15 177.225 177.225 178.021 -0.796 18522
5762 1 11 . 1 1 3 3 PRO CA C 15 63.508 63.508 63.913 -0.405 18522
5763 1 11 . 1 1 3 3 PRO CB C 15 32.090 32.090 31.936 0.153 18522
5764 1 11 . 1 1 4 4 GLY N N 16 108.829 108.829 108.530 0.299 18522
5765 1 11 . 1 1 4 4 GLY C C 16 173.398 173.398 174.766 -1.368 18522
5766 1 11 . 1 1 4 4 GLY CA C 16 45.128 45.128 44.740 0.387 18522
5767 1 11 . 1 1 4 4 GLY H H 16 8.489 8.489 8.577 -0.088 18522
5768 1 11 . 1 1 5 5 ILE N N 17 121.763 121.763 120.393 1.370 18522
5769 1 11 . 1 1 5 5 ILE HA H 17 4.554 4.554 4.475 0.079 18522
5770 1 11 . 1 1 5 5 ILE C C 17 174.332 174.332 174.834 -0.502 18522
5771 1 11 . 1 1 5 5 ILE CA C 17 58.245 58.245 59.395 -1.150 18522
5772 1 11 . 1 1 5 5 ILE CB C 17 38.762 38.762 37.769 0.993 18522
5773 1 11 . 1 1 5 5 ILE H H 17 8.014 8.014 7.405 0.609 18522
5774 1 11 . 1 1 6 6 PRO C C 18 176.437 176.437 176.432 0.005 18522
5775 1 11 . 1 1 6 6 PRO CA C 18 62.667 62.667 64.235 -1.568 18522
5776 1 11 . 1 1 6 6 PRO CB C 18 32.469 32.469 32.027 0.442 18522
5777 1 11 . 1 1 7 7 VAL N N 19 123.849 123.849 119.212 4.637 18522
5778 1 11 . 1 1 7 7 VAL HA H 19 4.550 4.550 4.383 0.167 18522
5779 1 11 . 1 1 7 7 VAL C C 19 174.453 174.453 173.669 0.784 18522
5780 1 11 . 1 1 7 7 VAL CA C 19 59.846 59.846 58.934 0.912 18522
5781 1 11 . 1 1 7 7 VAL CB C 19 33.510 33.510 32.418 1.092 18522
5782 1 11 . 1 1 7 7 VAL H H 19 8.754 8.754 7.856 0.898 18522
5783 1 11 . 1 1 8 8 PRO HA H 20 5.338 5.338 4.875 0.463 18522
5784 1 11 . 1 1 8 8 PRO C C 20 177.585 177.585 176.487 1.098 18522
5785 1 11 . 1 1 8 8 PRO CA C 20 62.406 62.406 62.316 0.090 18522
5786 1 11 . 1 1 8 8 PRO CB C 20 32.891 32.891 32.190 0.701 18522
5787 1 11 . 1 1 9 9 GLY N N 21 108.426 108.426 110.161 -1.735 18522
5788 1 11 . 1 1 9 9 GLY C C 21 171.443 171.443 171.453 -0.010 18522
5789 1 11 . 1 1 9 9 GLY CA C 21 44.581 44.581 44.867 -0.286 18522
5790 1 11 . 1 1 9 9 GLY H H 21 8.258 8.258 7.788 0.470 18522
5791 1 11 . 1 1 10 10 LYS N N 22 117.372 117.372 120.173 -2.801 18522
5792 1 11 . 1 1 10 10 LYS HA H 22 4.039 4.039 5.441 -1.402 18522
5793 1 11 . 1 1 10 10 LYS C C 22 174.463 174.463 174.202 0.261 18522
5794 1 11 . 1 1 10 10 LYS CA C 22 55.263 55.263 54.737 0.526 18522
5795 1 11 . 1 1 10 10 LYS CB C 22 35.227 35.227 35.015 0.212 18522
5796 1 11 . 1 1 10 10 LYS H H 22 8.175 8.175 7.926 0.249 18522
5797 1 11 . 1 1 11 11 VAL N N 23 120.387 120.387 117.575 2.812 18522
5798 1 11 . 1 1 11 11 VAL HA H 23 4.708 4.708 4.633 0.075 18522
5799 1 11 . 1 1 11 11 VAL C C 23 171.873 171.873 173.926 -2.053 18522
5800 1 11 . 1 1 11 11 VAL CA C 23 59.866 59.866 59.779 0.088 18522
5801 1 11 . 1 1 11 11 VAL CB C 23 35.269 35.269 35.587 -0.318 18522
5802 1 11 . 1 1 11 11 VAL H H 23 8.862 8.862 8.799 0.063 18522
5803 1 11 . 1 1 12 12 THR N N 24 125.797 125.797 118.795 7.002 18522
5804 1 11 . 1 1 12 12 THR HA H 24 5.121 5.121 5.055 0.066 18522
5805 1 11 . 1 1 12 12 THR C C 24 173.407 173.407 173.583 -0.176 18522
5806 1 11 . 1 1 12 12 THR CA C 24 62.115 62.115 60.006 2.109 18522
5807 1 11 . 1 1 12 12 THR CB C 24 69.606 69.606 69.391 0.215 18522
5808 1 11 . 1 1 12 12 THR H H 24 8.859 8.859 8.320 0.539 18522
5809 1 11 . 1 1 13 13 LEU N N 25 127.960 127.960 127.211 0.749 18522
5810 1 11 . 1 1 13 13 LEU HA H 25 4.809 4.809 4.827 -0.018 18522
5811 1 11 . 1 1 13 13 LEU C C 25 175.029 175.029 175.456 -0.427 18522
5812 1 11 . 1 1 13 13 LEU CA C 25 52.623 52.623 52.347 0.276 18522
5813 1 11 . 1 1 13 13 LEU CB C 25 46.242 46.242 45.059 1.183 18522
5814 1 11 . 1 1 13 13 LEU H H 25 9.258 9.258 8.116 1.142 18522
5815 1 11 . 1 1 14 14 GLN N N 26 120.858 120.858 117.756 3.102 18522
5816 1 11 . 1 1 14 14 GLN HA H 26 4.482 4.482 4.588 -0.106 18522
5817 1 11 . 1 1 14 14 GLN C C 26 174.515 174.515 175.150 -0.635 18522
5818 1 11 . 1 1 14 14 GLN CA C 26 54.576 54.576 54.299 0.277 18522
5819 1 11 . 1 1 14 14 GLN CB C 26 29.516 29.516 31.823 -2.307 18522
5820 1 11 . 1 1 14 14 GLN H H 26 8.530 8.530 8.304 0.226 18522
5821 1 11 . 1 1 15 15 LYS N N 27 119.583 119.583 122.692 -3.109 18522
5822 1 11 . 1 1 15 15 LYS HA H 27 4.180 4.180 4.203 -0.023 18522
5823 1 11 . 1 1 15 15 LYS C C 27 177.468 177.468 176.956 0.512 18522
5824 1 11 . 1 1 15 15 LYS CA C 27 55.956 55.956 56.745 -0.789 18522
5825 1 11 . 1 1 15 15 LYS CB C 27 34.099 34.099 32.483 1.616 18522
5826 1 11 . 1 1 15 15 LYS H H 27 8.099 8.099 8.142 -0.043 18522
5827 1 11 . 1 1 16 16 ASP N N 28 121.439 121.439 122.297 -0.858 18522
5828 1 11 . 1 1 16 16 ASP HA H 28 4.590 4.590 4.623 -0.033 18522
5829 1 11 . 1 1 16 16 ASP C C 28 178.392 178.392 178.170 0.222 18522
5830 1 11 . 1 1 16 16 ASP CA C 28 52.426 52.426 54.088 -1.662 18522
5831 1 11 . 1 1 16 16 ASP CB C 28 41.377 41.377 42.492 -1.115 18522
5832 1 11 . 1 1 16 16 ASP H H 28 8.888 8.888 8.624 0.264 18522
5833 1 11 . 1 1 17 17 ALA N N 29 119.578 119.578 123.516 -3.938 18522
5834 1 11 . 1 1 17 17 ALA HA H 29 4.188 4.188 4.147 0.041 18522
5835 1 11 . 1 1 17 17 ALA C C 29 178.763 178.763 178.477 0.286 18522
5836 1 11 . 1 1 17 17 ALA CA C 29 54.434 54.434 54.397 0.037 18522
5837 1 11 . 1 1 17 17 ALA CB C 29 18.293 18.293 18.592 -0.299 18522
5838 1 11 . 1 1 17 17 ALA H H 29 8.392 8.392 8.626 -0.234 18522
5839 1 11 . 1 1 18 18 GLN N N 30 117.564 117.564 116.856 0.708 18522
5840 1 11 . 1 1 18 18 GLN HA H 30 4.399 4.399 4.325 0.074 18522
5841 1 11 . 1 1 18 18 GLN C C 30 175.168 175.168 175.560 -0.392 18522
5842 1 11 . 1 1 18 18 GLN CA C 30 55.339 55.339 55.244 0.095 18522
5843 1 11 . 1 1 18 18 GLN CB C 30 28.589 28.589 29.345 -0.756 18522
5844 1 11 . 1 1 18 18 GLN H H 30 8.353 8.353 7.805 0.548 18522
5845 1 11 . 1 1 19 19 ASN N N 31 115.365 115.365 115.852 -0.487 18522
5846 1 11 . 1 1 19 19 ASN HA H 31 4.315 4.315 4.426 -0.111 18522
5847 1 11 . 1 1 19 19 ASN C C 31 174.043 174.043 172.951 1.092 18522
5848 1 11 . 1 1 19 19 ASN CA C 31 54.303 54.303 54.510 -0.206 18522
5849 1 11 . 1 1 19 19 ASN CB C 31 37.610 37.610 37.894 -0.284 18522
5850 1 11 . 1 1 19 19 ASN H H 31 8.521 8.521 8.248 0.273 18522
5851 1 11 . 1 1 20 20 LEU N N 32 118.660 118.660 112.269 6.391 18522
5852 1 11 . 1 1 20 20 LEU HA H 32 4.900 4.900 4.850 0.050 18522
5853 1 11 . 1 1 20 20 LEU C C 32 178.117 178.117 176.974 1.143 18522
5854 1 11 . 1 1 20 20 LEU CA C 32 53.957 53.957 53.465 0.492 18522
5855 1 11 . 1 1 20 20 LEU CB C 32 44.774 44.774 43.462 1.312 18522
5856 1 11 . 1 1 20 20 LEU H H 32 8.155 8.155 7.399 0.756 18522
5857 1 11 . 1 1 21 21 ILE N N 33 116.785 116.785 116.071 0.714 18522
5858 1 11 . 1 1 21 21 ILE HA H 33 4.674 4.674 4.505 0.169 18522
5859 1 11 . 1 1 21 21 ILE C C 33 176.185 176.185 176.802 -0.617 18522
5860 1 11 . 1 1 21 21 ILE CA C 33 62.602 62.602 61.867 0.735 18522
5861 1 11 . 1 1 21 21 ILE CB C 33 39.016 39.016 38.596 0.420 18522
5862 1 11 . 1 1 21 21 ILE H H 33 11.488 11.488 7.966 3.522 18522
5863 1 11 . 1 1 22 22 GLY N N 34 111.234 111.234 106.674 4.560 18522
5864 1 11 . 1 1 22 22 GLY C C 34 173.993 173.993 173.413 0.580 18522
5865 1 11 . 1 1 22 22 GLY CA C 34 45.980 45.980 45.068 0.912 18522
5866 1 11 . 1 1 22 22 GLY H H 34 9.854 9.854 8.399 1.455 18522
5867 1 11 . 1 1 23 23 ILE N N 35 111.117 111.117 114.695 -3.578 18522
5868 1 11 . 1 1 23 23 ILE HA H 35 5.535 5.535 5.310 0.225 18522
5869 1 11 . 1 1 23 23 ILE C C 35 175.033 175.033 174.300 0.733 18522
5870 1 11 . 1 1 23 23 ILE CA C 35 58.415 58.415 57.887 0.528 18522
5871 1 11 . 1 1 23 23 ILE CB C 35 41.577 41.577 41.305 0.272 18522
5872 1 11 . 1 1 23 23 ILE H H 35 7.835 7.835 7.415 0.419 18522
5873 1 11 . 1 1 24 24 SER N N 36 114.908 114.908 115.755 -0.847 18522
5874 1 11 . 1 1 24 24 SER HA H 36 4.232 4.232 5.106 -0.874 18522
5875 1 11 . 1 1 24 24 SER C C 36 174.735 174.735 173.077 1.658 18522
5876 1 11 . 1 1 24 24 SER CA C 36 56.121 56.121 57.311 -1.190 18522
5877 1 11 . 1 1 24 24 SER CB C 36 66.097 66.097 65.572 0.525 18522
5878 1 11 . 1 1 24 24 SER H H 36 8.623 8.623 8.252 0.371 18522
5879 1 11 . 1 1 25 25 ILE N N 37 117.739 117.739 124.720 -6.981 18522
5880 1 11 . 1 1 25 25 ILE C C 37 174.340 174.340 175.469 -1.129 18522
5881 1 11 . 1 1 25 25 ILE CA C 37 59.123 59.123 59.678 -0.555 18522
5882 1 11 . 1 1 25 25 ILE CB C 37 41.637 41.637 41.305 0.332 18522
5883 1 11 . 1 1 25 25 ILE H H 37 9.130 9.130 8.761 0.369 18522
5884 1 11 . 1 1 26 26 GLY N N 38 108.069 108.069 112.179 -4.110 18522
5885 1 11 . 1 1 26 26 GLY CA C 38 44.112 44.112 45.381 -1.269 18522
5886 1 11 . 1 1 26 26 GLY H H 38 8.841 8.841 8.808 0.033 18522
5887 1 11 . 1 1 27 27 GLY N N 39 109.016 109.016 108.229 0.787 18522
5888 1 11 . 1 1 27 27 GLY C C 39 173.956 173.956 174.323 -0.367 18522
5889 1 11 . 1 1 27 27 GLY H H 39 8.187 8.187 8.717 -0.530 18522
5890 1 11 . 1 1 28 28 GLY N N 40 111.783 111.783 112.774 -0.991 18522
5891 1 11 . 1 1 28 28 GLY C C 40 174.255 174.255 172.867 1.388 18522
5892 1 11 . 1 1 28 28 GLY CA C 40 47.098 47.098 44.525 2.573 18522
5893 1 11 . 1 1 28 28 GLY H H 40 8.275 8.275 7.680 0.595 18522
5894 1 11 . 1 1 29 29 ALA N N 41 123.128 123.128 125.597 -2.469 18522
5895 1 11 . 1 1 29 29 ALA HA H 41 4.559 4.559 4.614 -0.055 18522
5896 1 11 . 1 1 29 29 ALA CA C 41 51.073 51.073 53.104 -2.031 18522
5897 1 11 . 1 1 29 29 ALA CB C 41 21.926 21.926 19.677 2.249 18522
5898 1 11 . 1 1 29 29 ALA H H 41 8.012 8.012 8.360 -0.348 18522
5899 1 11 . 1 1 31 31 TYR HA H 43 4.549 4.549 4.450 0.099 18522
5900 1 11 . 1 1 31 31 TYR CA C 43 57.147 57.147 59.364 -2.217 18522
5901 1 11 . 1 1 31 31 TYR CB C 43 37.495 37.495 39.358 -1.863 18522
5902 1 11 . 1 1 32 32 CYS N N 44 119.332 119.332 114.336 4.996 18522
5903 1 11 . 1 1 32 32 CYS HA H 44 4.859 4.859 4.704 0.155 18522
5904 1 11 . 1 1 32 32 CYS CA C 44 57.406 57.406 56.837 0.569 18522
5905 1 11 . 1 1 32 32 CYS CB C 44 27.673 27.673 27.385 0.288 18522
5906 1 11 . 1 1 32 32 CYS H H 44 7.504 7.504 8.149 -0.645 18522
5907 1 11 . 1 1 33 33 PRO HA H 45 4.413 4.413 4.741 -0.328 18522
5908 1 11 . 1 1 33 33 PRO CA C 45 64.885 64.885 62.099 2.786 18522
5909 1 11 . 1 1 33 33 PRO CB C 45 32.318 32.318 33.006 -0.688 18522
5910 1 11 . 1 1 34 34 CYS N N 46 117.327 117.327 117.781 -0.454 18522
5911 1 11 . 1 1 34 34 CYS C C 46 172.064 172.064 176.291 -4.227 18522
5912 1 11 . 1 1 34 34 CYS CA C 46 60.066 60.066 61.366 -1.300 18522
5913 1 11 . 1 1 34 34 CYS CB C 46 28.715 28.715 27.848 0.867 18522
5914 1 11 . 1 1 34 34 CYS H H 46 7.973 7.973 7.691 0.282 18522
5915 1 11 . 1 1 35 35 LEU N N 47 124.270 124.270 117.236 7.034 18522
5916 1 11 . 1 1 35 35 LEU HA H 47 4.928 4.928 3.682 1.246 18522
5917 1 11 . 1 1 35 35 LEU C C 47 175.076 175.076 177.368 -2.292 18522
5918 1 11 . 1 1 35 35 LEU CA C 47 53.278 53.278 57.221 -3.943 18522
5919 1 11 . 1 1 35 35 LEU CB C 47 44.321 44.321 39.985 4.336 18522
5920 1 11 . 1 1 35 35 LEU H H 47 8.629 8.629 8.103 0.526 18522
5921 1 11 . 1 1 36 36 TYR N N 48 119.326 119.326 112.026 7.300 18522
5922 1 11 . 1 1 36 36 TYR HA H 48 5.255 5.255 4.275 0.980 18522
5923 1 11 . 1 1 36 36 TYR C C 48 175.766 175.766 176.844 -1.078 18522
5924 1 11 . 1 1 36 36 TYR CA C 48 56.696 56.696 60.757 -4.061 18522
5925 1 11 . 1 1 36 36 TYR CB C 48 42.590 42.590 36.590 6.000 18522
5926 1 11 . 1 1 36 36 TYR H H 48 8.761 8.761 8.407 0.354 18522
5927 1 11 . 1 1 37 37 ILE N N 49 120.259 120.259 122.361 -2.102 18522
5928 1 11 . 1 1 37 37 ILE HA H 49 4.215 4.215 4.599 -0.384 18522
5929 1 11 . 1 1 37 37 ILE C C 49 177.429 177.429 176.656 0.773 18522
5930 1 11 . 1 1 37 37 ILE CA C 49 62.456 62.456 60.528 1.928 18522
5931 1 11 . 1 1 37 37 ILE CB C 49 37.352 37.352 37.386 -0.034 18522
5932 1 11 . 1 1 37 37 ILE H H 49 8.959 8.959 7.995 0.964 18522
5933 1 11 . 1 1 38 38 VAL HA H 50 3.937 3.937 3.961 -0.024 18522
5934 1 11 . 1 1 38 38 VAL C C 50 174.408 174.408 175.434 -1.026 18522
5935 1 11 . 1 1 38 38 VAL CA C 50 62.259 62.259 63.621 -1.362 18522
5936 1 11 . 1 1 38 38 VAL CB C 50 31.584 31.584 32.324 -0.740 18522
5937 1 11 . 1 1 39 39 GLN N N 51 116.821 116.821 115.675 1.146 18522
5938 1 11 . 1 1 39 39 GLN HA H 51 4.103 4.103 4.494 -0.391 18522
5939 1 11 . 1 1 39 39 GLN C C 51 172.856 172.856 172.891 -0.035 18522
5940 1 11 . 1 1 39 39 GLN CA C 51 55.127 55.127 54.949 0.178 18522
5941 1 11 . 1 1 39 39 GLN CB C 51 32.376 32.376 32.261 0.115 18522
5942 1 11 . 1 1 39 39 GLN H H 51 6.967 6.967 7.542 -0.575 18522
5943 1 11 . 1 1 40 40 VAL N N 52 123.482 123.482 118.901 4.581 18522
5944 1 11 . 1 1 40 40 VAL HA H 52 4.277 4.277 4.818 -0.541 18522
5945 1 11 . 1 1 40 40 VAL C C 52 176.198 176.198 173.923 2.275 18522
5946 1 11 . 1 1 40 40 VAL CA C 52 61.574 61.574 59.519 2.055 18522
5947 1 11 . 1 1 40 40 VAL CB C 52 32.875 32.875 35.247 -2.372 18522
5948 1 11 . 1 1 40 40 VAL H H 52 8.447 8.447 8.073 0.374 18522
5949 1 11 . 1 1 41 41 PHE N N 53 128.296 128.296 122.185 6.111 18522
5950 1 11 . 1 1 41 41 PHE HA H 53 4.400 4.400 4.835 -0.435 18522
5951 1 11 . 1 1 41 41 PHE C C 53 175.299 175.299 175.857 -0.558 18522
5952 1 11 . 1 1 41 41 PHE CA C 53 58.494 58.494 56.981 1.513 18522
5953 1 11 . 1 1 41 41 PHE CB C 53 39.561 39.561 40.649 -1.088 18522
5954 1 11 . 1 1 41 41 PHE H H 53 8.707 8.707 8.478 0.229 18522
5955 1 11 . 1 1 42 42 ASP N N 54 122.696 122.696 123.620 -0.924 18522
5956 1 11 . 1 1 42 42 ASP HA H 54 4.272 4.272 4.296 -0.024 18522
5957 1 11 . 1 1 42 42 ASP C C 54 176.837 176.837 176.364 0.473 18522
5958 1 11 . 1 1 42 42 ASP CA C 54 55.291 55.291 56.981 -1.690 18522
5959 1 11 . 1 1 42 42 ASP CB C 54 41.093 41.093 41.064 0.029 18522
5960 1 11 . 1 1 42 42 ASP H H 54 8.901 8.901 9.034 -0.133 18522
5961 1 11 . 1 1 43 43 ASN N N 55 113.923 113.923 112.867 1.056 18522
5962 1 11 . 1 1 43 43 ASN HA H 55 4.258 4.258 4.747 -0.489 18522
5963 1 11 . 1 1 43 43 ASN C C 55 173.714 173.714 175.242 -1.528 18522
5964 1 11 . 1 1 43 43 ASN CA C 55 54.958 54.958 53.001 1.957 18522
5965 1 11 . 1 1 43 43 ASN CB C 55 37.150 37.150 39.285 -2.135 18522
5966 1 11 . 1 1 43 43 ASN H H 55 9.319 9.319 8.104 1.215 18522
5967 1 11 . 1 1 44 44 THR N N 56 108.020 108.020 113.256 -5.236 18522
5968 1 11 . 1 1 44 44 THR HA H 56 5.377 5.377 4.887 0.490 18522
5969 1 11 . 1 1 44 44 THR CA C 56 59.712 59.712 59.341 0.371 18522
5970 1 11 . 1 1 44 44 THR CB C 56 69.529 69.529 70.030 -0.501 18522
5971 1 11 . 1 1 44 44 THR H H 56 7.149 7.149 7.875 -0.726 18522
5972 1 11 . 1 1 45 45 PRO HA H 57 4.304 4.304 4.057 0.247 18522
5973 1 11 . 1 1 45 45 PRO C C 57 180.141 180.141 178.010 2.131 18522
5974 1 11 . 1 1 45 45 PRO CA C 57 66.090 66.090 65.600 0.490 18522
5975 1 11 . 1 1 45 45 PRO CB C 57 33.194 33.194 31.397 1.797 18522
5976 1 11 . 1 1 46 46 ALA N N 58 116.854 116.854 120.276 -3.422 18522
5977 1 11 . 1 1 46 46 ALA HA H 58 4.035 4.035 3.969 0.066 18522
5978 1 11 . 1 1 46 46 ALA C C 58 180.647 180.647 179.420 1.227 18522
5979 1 11 . 1 1 46 46 ALA CA C 58 55.195 55.195 55.251 -0.056 18522
5980 1 11 . 1 1 46 46 ALA CB C 58 18.880 18.880 18.101 0.779 18522
5981 1 11 . 1 1 46 46 ALA H H 58 8.938 8.938 7.908 1.030 18522
5982 1 11 . 1 1 47 47 ALA N N 59 123.250 123.250 120.959 2.291 18522
5983 1 11 . 1 1 47 47 ALA HA H 59 4.030 4.030 4.128 -0.098 18522
5984 1 11 . 1 1 47 47 ALA C C 59 179.852 179.852 179.650 0.202 18522
5985 1 11 . 1 1 47 47 ALA CA C 59 54.939 54.939 54.549 0.390 18522
5986 1 11 . 1 1 47 47 ALA CB C 59 19.688 19.688 18.440 1.248 18522
5987 1 11 . 1 1 47 47 ALA H H 59 7.658 7.658 7.418 0.240 18522
5988 1 11 . 1 1 48 48 LEU N N 60 118.654 118.654 119.112 -0.458 18522
5989 1 11 . 1 1 48 48 LEU HA H 60 4.026 4.026 4.122 -0.096 18522
5990 1 11 . 1 1 48 48 LEU C C 60 179.238 179.238 178.236 1.002 18522
5991 1 11 . 1 1 48 48 LEU CA C 60 57.261 57.261 58.034 -0.773 18522
5992 1 11 . 1 1 48 48 LEU CB C 60 41.445 41.445 40.963 0.482 18522
5993 1 11 . 1 1 48 48 LEU H H 60 8.636 8.636 8.530 0.106 18522
5994 1 11 . 1 1 49 49 ASP N N 61 117.382 117.382 117.639 -0.257 18522
5995 1 11 . 1 1 49 49 ASP HA H 61 4.421 4.421 4.658 -0.237 18522
5996 1 11 . 1 1 49 49 ASP C C 61 177.668 177.668 177.895 -0.227 18522
5997 1 11 . 1 1 49 49 ASP CA C 61 57.087 57.087 55.322 1.765 18522
5998 1 11 . 1 1 49 49 ASP CB C 61 44.478 44.478 42.227 2.251 18522
5999 1 11 . 1 1 49 49 ASP H H 61 7.665 7.665 7.857 -0.192 18522
6000 1 11 . 1 1 50 50 GLY N N 62 103.228 103.228 107.199 -3.971 18522
6001 1 11 . 1 1 50 50 GLY C C 62 174.776 174.776 174.616 0.160 18522
6002 1 11 . 1 1 50 50 GLY CA C 62 46.533 46.533 45.795 0.738 18522
6003 1 11 . 1 1 50 50 GLY H H 62 7.216 7.216 8.352 -1.136 18522
6004 1 11 . 1 1 51 51 THR N N 63 117.230 117.230 108.367 8.863 18522
6005 1 11 . 1 1 51 51 THR HA H 63 3.907 3.907 3.866 0.041 18522
6006 1 11 . 1 1 51 51 THR C C 63 175.961 175.961 175.132 0.829 18522
6007 1 11 . 1 1 51 51 THR CA C 63 66.478 66.478 62.813 3.665 18522
6008 1 11 . 1 1 51 51 THR CB C 63 68.268 68.268 67.592 0.676 18522
6009 1 11 . 1 1 51 51 THR H H 63 8.319 8.319 7.696 0.623 18522
6010 1 11 . 1 1 52 52 VAL N N 64 113.826 113.826 117.049 -3.223 18522
6011 1 11 . 1 1 52 52 VAL HA H 64 3.950 3.950 3.892 0.058 18522
6012 1 11 . 1 1 52 52 VAL C C 64 173.883 173.883 174.946 -1.063 18522
6013 1 11 . 1 1 52 52 VAL CA C 64 60.708 60.708 60.140 0.568 18522
6014 1 11 . 1 1 52 52 VAL CB C 64 33.079 33.079 29.105 3.974 18522
6015 1 11 . 1 1 52 52 VAL H H 64 8.147 8.147 7.472 0.675 18522
6016 1 11 . 1 1 53 53 ALA N N 65 123.521 123.521 125.184 -1.663 18522
6017 1 11 . 1 1 53 53 ALA HA H 65 4.414 4.414 4.300 0.114 18522
6018 1 11 . 1 1 53 53 ALA C C 65 175.247 175.247 176.766 -1.519 18522
6019 1 11 . 1 1 53 53 ALA CA C 65 50.440 50.440 50.829 -0.389 18522
6020 1 11 . 1 1 53 53 ALA CB C 65 23.266 23.266 20.246 3.020 18522
6021 1 11 . 1 1 53 53 ALA H H 65 8.633 8.633 7.572 1.061 18522
6022 1 11 . 1 1 54 54 ALA N N 66 120.818 120.818 122.176 -1.358 18522
6023 1 11 . 1 1 54 54 ALA HA H 66 3.720 3.720 3.909 -0.189 18522
6024 1 11 . 1 1 54 54 ALA C C 66 178.411 178.411 178.248 0.163 18522
6025 1 11 . 1 1 54 54 ALA CA C 66 53.016 53.016 53.414 -0.398 18522
6026 1 11 . 1 1 54 54 ALA CB C 66 17.840 17.840 17.488 0.352 18522
6027 1 11 . 1 1 54 54 ALA H H 66 8.451 8.451 8.260 0.191 18522
6028 1 11 . 1 1 55 55 GLY N N 67 112.260 112.260 113.832 -1.572 18522
6029 1 11 . 1 1 55 55 GLY C C 67 173.296 173.296 173.889 -0.593 18522
6030 1 11 . 1 1 55 55 GLY CA C 67 45.025 45.025 44.736 0.289 18522
6031 1 11 . 1 1 55 55 GLY H H 67 9.600 9.600 8.368 1.232 18522
6032 1 11 . 1 1 56 56 ASP N N 68 121.293 121.293 121.530 -0.237 18522
6033 1 11 . 1 1 56 56 ASP HA H 68 4.861 4.861 4.802 0.059 18522
6034 1 11 . 1 1 56 56 ASP C C 68 174.937 174.937 175.171 -0.234 18522
6035 1 11 . 1 1 56 56 ASP CA C 68 55.641 55.641 54.575 1.066 18522
6036 1 11 . 1 1 56 56 ASP CB C 68 40.696 40.696 42.744 -2.048 18522
6037 1 11 . 1 1 56 56 ASP H H 68 8.043 8.043 7.717 0.326 18522
6038 1 11 . 1 1 57 57 GLU N N 69 122.814 122.814 123.861 -1.047 18522
6039 1 11 . 1 1 57 57 GLU C C 69 177.202 177.202 176.627 0.575 18522
6040 1 11 . 1 1 57 57 GLU CA C 69 54.472 54.472 55.203 -0.731 18522
6041 1 11 . 1 1 57 57 GLU CB C 69 32.800 32.800 29.939 2.861 18522
6042 1 11 . 1 1 57 57 GLU H H 69 8.455 8.455 8.936 -0.481 18522
6043 1 11 . 1 1 58 58 ILE N N 70 125.862 125.862 128.989 -3.127 18522
6044 1 11 . 1 1 58 58 ILE HA H 70 4.526 4.526 4.464 0.062 18522
6045 1 11 . 1 1 58 58 ILE C C 70 175.035 175.035 176.614 -1.579 18522
6046 1 11 . 1 1 58 58 ILE CA C 70 60.918 60.918 62.127 -1.209 18522
6047 1 11 . 1 1 58 58 ILE CB C 70 39.236 39.236 36.845 2.391 18522
6048 1 11 . 1 1 58 58 ILE H H 70 8.619 8.619 8.283 0.336 18522
6049 1 11 . 1 1 59 59 THR N N 71 115.507 115.507 122.688 -7.181 18522
6050 1 11 . 1 1 59 59 THR HA H 71 4.513 4.513 4.366 0.147 18522
6051 1 11 . 1 1 59 59 THR C C 71 176.425 176.425 174.120 2.305 18522
6052 1 11 . 1 1 59 59 THR CA C 71 61.158 61.158 61.827 -0.668 18522
6053 1 11 . 1 1 59 59 THR CB C 71 69.604 69.604 69.530 0.074 18522
6054 1 11 . 1 1 59 59 THR H H 71 9.242 9.242 8.866 0.376 18522
6055 1 11 . 1 1 60 60 GLY N N 72 111.789 111.789 109.066 2.723 18522
6056 1 11 . 1 1 60 60 GLY C C 72 170.981 170.981 171.500 -0.519 18522
6057 1 11 . 1 1 60 60 GLY CA C 72 46.554 46.554 44.883 1.671 18522
6058 1 11 . 1 1 60 60 GLY H H 72 7.883 7.883 7.797 0.086 18522
6059 1 11 . 1 1 61 61 VAL N N 73 119.277 119.277 123.661 -4.384 18522
6060 1 11 . 1 1 61 61 VAL C C 73 175.951 175.951 175.775 0.176 18522
6061 1 11 . 1 1 61 61 VAL CA C 73 60.982 60.982 59.586 1.396 18522
6062 1 11 . 1 1 61 61 VAL CB C 73 36.197 36.197 33.668 2.529 18522
6063 1 11 . 1 1 61 61 VAL H H 73 8.424 8.424 8.759 -0.335 18522
6064 1 11 . 1 1 62 62 ASN N N 74 127.731 127.731 127.327 0.404 18522
6065 1 11 . 1 1 62 62 ASN HA H 74 4.520 4.520 4.331 0.189 18522
6066 1 11 . 1 1 62 62 ASN C C 74 174.878 174.878 174.940 -0.062 18522
6067 1 11 . 1 1 62 62 ASN CA C 74 54.418 54.418 54.582 -0.164 18522
6068 1 11 . 1 1 62 62 ASN CB C 74 36.655 36.655 38.138 -1.483 18522
6069 1 11 . 1 1 62 62 ASN H H 74 10.384 10.384 9.472 0.912 18522
6070 1 11 . 1 1 63 63 GLY N N 75 104.633 104.633 103.088 1.545 18522
6071 1 11 . 1 1 63 63 GLY C C 75 173.610 173.610 173.645 -0.035 18522
6072 1 11 . 1 1 63 63 GLY CA C 75 45.261 45.261 45.123 0.138 18522
6073 1 11 . 1 1 63 63 GLY H H 75 8.926 8.926 8.722 0.204 18522
6074 1 11 . 1 1 64 64 ARG N N 76 120.451 120.451 122.214 -1.763 18522
6075 1 11 . 1 1 64 64 ARG HA H 76 4.501 4.501 4.676 -0.175 18522
6076 1 11 . 1 1 64 64 ARG C C 76 175.085 175.085 175.683 -0.598 18522
6077 1 11 . 1 1 64 64 ARG CA C 76 54.252 54.252 54.357 -0.105 18522
6078 1 11 . 1 1 64 64 ARG CB C 76 31.482 31.482 31.201 0.281 18522
6079 1 11 . 1 1 64 64 ARG H H 76 7.753 7.753 7.936 -0.183 18522
6080 1 11 . 1 1 65 65 SER N N 77 116.586 116.586 120.547 -3.961 18522
6081 1 11 . 1 1 65 65 SER HA H 77 4.483 4.483 4.596 -0.113 18522
6082 1 11 . 1 1 65 65 SER C C 77 176.953 176.953 175.967 0.986 18522
6083 1 11 . 1 1 65 65 SER CA C 77 58.292 58.292 58.328 -0.036 18522
6084 1 11 . 1 1 65 65 SER CB C 77 63.643 63.643 63.586 0.057 18522
6085 1 11 . 1 1 65 65 SER H H 77 8.555 8.555 9.002 -0.447 18522
6086 1 11 . 1 1 66 66 ILE N N 78 116.618 116.618 120.877 -4.259 18522
6087 1 11 . 1 1 66 66 ILE HA H 78 4.420 4.420 4.120 0.300 18522
6088 1 11 . 1 1 66 66 ILE C C 78 175.072 175.072 177.355 -2.283 18522
6089 1 11 . 1 1 66 66 ILE CA C 78 59.122 59.122 61.520 -2.397 18522
6090 1 11 . 1 1 66 66 ILE CB C 78 36.758 36.758 36.804 -0.046 18522
6091 1 11 . 1 1 66 66 ILE H H 78 7.599 7.599 8.438 -0.839 18522
6092 1 11 . 1 1 67 67 LYS N N 79 123.287 123.287 122.687 0.600 18522
6093 1 11 . 1 1 67 67 LYS HA H 79 4.049 4.049 4.095 -0.046 18522
6094 1 11 . 1 1 67 67 LYS C C 79 178.333 178.333 177.797 0.536 18522
6095 1 11 . 1 1 67 67 LYS CA C 79 58.321 58.321 58.064 0.257 18522
6096 1 11 . 1 1 67 67 LYS CB C 79 31.635 31.635 31.818 -0.183 18522
6097 1 11 . 1 1 67 67 LYS H H 79 7.898 7.898 8.164 -0.266 18522
6098 1 11 . 1 1 68 68 GLY N N 80 114.933 114.933 106.290 8.643 18522
6099 1 11 . 1 1 68 68 GLY C C 80 174.385 174.385 174.349 0.036 18522
6100 1 11 . 1 1 68 68 GLY CA C 80 45.518 45.518 45.349 0.169 18522
6101 1 11 . 1 1 68 68 GLY H H 80 8.999 8.999 8.049 0.950 18522
6102 1 11 . 1 1 69 69 LYS N N 81 119.403 119.403 118.319 1.084 18522
6103 1 11 . 1 1 69 69 LYS HA H 81 4.043 4.043 4.545 -0.501 18522
6104 1 11 . 1 1 69 69 LYS C C 81 177.064 177.064 175.242 1.822 18522
6105 1 11 . 1 1 69 69 LYS CA C 81 54.722 54.722 54.798 -0.076 18522
6106 1 11 . 1 1 69 69 LYS CB C 81 33.560 33.560 33.968 -0.408 18522
6107 1 11 . 1 1 69 69 LYS H H 81 7.845 7.845 7.755 0.090 18522
6108 1 11 . 1 1 70 70 THR N N 82 112.066 112.066 115.322 -3.256 18522
6109 1 11 . 1 1 70 70 THR HA H 82 4.666 4.666 4.718 -0.052 18522
6110 1 11 . 1 1 70 70 THR C C 82 175.955 175.955 175.142 0.813 18522
6111 1 11 . 1 1 70 70 THR CA C 82 60.438 60.438 60.993 -0.555 18522
6112 1 11 . 1 1 70 70 THR CB C 82 71.629 71.629 72.937 -1.308 18522
6113 1 11 . 1 1 70 70 THR H H 82 9.153 9.153 8.201 0.952 18522
6114 1 11 . 1 1 71 71 LYS N N 83 118.730 118.730 125.189 -6.459 18522
6115 1 11 . 1 1 71 71 LYS HA H 83 3.870 3.870 3.908 -0.038 18522
6116 1 11 . 1 1 71 71 LYS C C 83 177.464 177.464 177.929 -0.465 18522
6117 1 11 . 1 1 71 71 LYS CA C 83 60.357 60.357 59.730 0.627 18522
6118 1 11 . 1 1 71 71 LYS CB C 83 31.350 31.350 31.602 -0.251 18522
6119 1 11 . 1 1 71 71 LYS H H 83 8.969 8.969 8.857 0.112 18522
6120 1 11 . 1 1 72 72 VAL N N 84 117.444 117.444 118.299 -0.855 18522
6121 1 11 . 1 1 72 72 VAL HA H 84 3.633 3.633 3.629 0.004 18522
6122 1 11 . 1 1 72 72 VAL C C 84 178.315 178.315 177.562 0.753 18522
6123 1 11 . 1 1 72 72 VAL CA C 84 66.079 66.079 65.530 0.549 18522
6124 1 11 . 1 1 72 72 VAL CB C 84 32.091 32.091 31.679 0.412 18522
6125 1 11 . 1 1 72 72 VAL H H 84 7.631 7.631 8.283 -0.652 18522
6126 1 11 . 1 1 73 73 GLU N N 85 120.890 120.890 119.038 1.852 18522
6127 1 11 . 1 1 73 73 GLU HA H 85 3.964 3.964 4.074 -0.110 18522
6128 1 11 . 1 1 73 73 GLU C C 85 179.971 179.971 178.883 1.088 18522
6129 1 11 . 1 1 73 73 GLU CA C 85 59.316 59.316 59.466 -0.150 18522
6130 1 11 . 1 1 73 73 GLU CB C 85 30.355 30.355 29.662 0.693 18522
6131 1 11 . 1 1 73 73 GLU H H 85 7.617 7.617 7.500 0.117 18522
6132 1 11 . 1 1 74 74 VAL N N 86 121.246 121.246 118.413 2.833 18522
6133 1 11 . 1 1 74 74 VAL HA H 86 3.630 3.630 3.707 -0.077 18522
6134 1 11 . 1 1 74 74 VAL C C 86 177.217 177.217 177.627 -0.410 18522
6135 1 11 . 1 1 74 74 VAL CA C 86 66.678 66.678 66.284 0.394 18522
6136 1 11 . 1 1 74 74 VAL CB C 86 31.307 31.307 30.939 0.368 18522
6137 1 11 . 1 1 74 74 VAL H H 86 8.368 8.368 8.244 0.124 18522
6138 1 11 . 1 1 75 75 ALA N N 87 122.148 122.148 122.439 -0.291 18522
6139 1 11 . 1 1 75 75 ALA HA H 87 3.947 3.947 3.906 0.041 18522
6140 1 11 . 1 1 75 75 ALA C C 87 179.545 179.545 179.200 0.345 18522
6141 1 11 . 1 1 75 75 ALA CA C 87 55.851 55.851 55.478 0.373 18522
6142 1 11 . 1 1 75 75 ALA CB C 87 18.491 18.491 17.887 0.604 18522
6143 1 11 . 1 1 75 75 ALA H H 87 8.577 8.577 8.302 0.275 18522
6144 1 11 . 1 1 76 76 LYS N N 88 117.733 117.733 119.749 -2.016 18522
6145 1 11 . 1 1 76 76 LYS HA H 88 4.051 4.051 4.232 -0.181 18522
6146 1 11 . 1 1 76 76 LYS CA C 88 59.393 59.393 59.118 0.275 18522
6147 1 11 . 1 1 76 76 LYS CB C 88 32.058 32.058 32.344 -0.286 18522
6148 1 11 . 1 1 76 76 LYS H H 88 7.854 7.854 7.388 0.466 18522
6149 1 11 . 1 1 77 77 MET N N 89 117.676 117.676 117.935 -0.259 18522
6150 1 11 . 1 1 77 77 MET HA H 89 4.048 4.048 4.091 -0.043 18522
6151 1 11 . 1 1 77 77 MET C C 89 178.791 178.791 178.989 -0.198 18522
6152 1 11 . 1 1 77 77 MET CA C 89 59.128 59.128 59.545 -0.417 18522
6153 1 11 . 1 1 77 77 MET CB C 89 33.801 33.801 32.625 1.176 18522
6154 1 11 . 1 1 77 77 MET H H 89 7.759 7.759 8.165 -0.406 18522
6155 1 11 . 1 1 78 78 ILE N N 90 117.305 117.305 119.923 -2.618 18522
6156 1 11 . 1 1 78 78 ILE HA H 90 3.590 3.590 3.662 -0.072 18522
6157 1 11 . 1 1 78 78 ILE C C 90 178.658 178.658 178.294 0.364 18522
6158 1 11 . 1 1 78 78 ILE CA C 90 65.482 65.482 64.910 0.572 18522
6159 1 11 . 1 1 78 78 ILE CB C 90 38.845 38.845 37.951 0.894 18522
6160 1 11 . 1 1 78 78 ILE H H 90 7.972 7.972 8.250 -0.278 18522
6161 1 11 . 1 1 79 79 GLN N N 91 120.935 120.935 119.254 1.681 18522
6162 1 11 . 1 1 79 79 GLN HA H 91 3.998 3.998 3.972 0.026 18522
6163 1 11 . 1 1 79 79 GLN C C 91 178.274 178.274 178.309 -0.035 18522
6164 1 11 . 1 1 79 79 GLN CA C 91 59.151 59.151 58.753 0.398 18522
6165 1 11 . 1 1 79 79 GLN CB C 91 28.934 28.934 28.909 0.025 18522
6166 1 11 . 1 1 79 79 GLN H H 91 8.826 8.826 8.309 0.517 18522
6167 1 11 . 1 1 80 80 GLU N N 92 115.213 115.213 119.133 -3.920 18522
6168 1 11 . 1 1 80 80 GLU HA H 92 4.061 4.061 4.041 0.020 18522
6169 1 11 . 1 1 80 80 GLU C C 92 176.824 176.824 179.070 -2.246 18522
6170 1 11 . 1 1 80 80 GLU CA C 92 58.006 58.006 59.400 -1.394 18522
6171 1 11 . 1 1 80 80 GLU CB C 92 29.890 29.890 29.708 0.182 18522
6172 1 11 . 1 1 80 80 GLU H H 92 8.020 8.020 8.342 -0.322 18522
6173 1 11 . 1 1 81 81 VAL N N 93 119.047 119.047 113.757 5.290 18522
6174 1 11 . 1 1 81 81 VAL HA H 93 3.930 3.930 3.790 0.140 18522
6175 1 11 . 1 1 81 81 VAL C C 93 176.016 176.016 176.232 -0.216 18522
6176 1 11 . 1 1 81 81 VAL CA C 93 63.153 63.153 63.857 -0.704 18522
6177 1 11 . 1 1 81 81 VAL CB C 93 32.154 32.154 31.899 0.255 18522
6178 1 11 . 1 1 81 81 VAL H H 93 7.073 7.073 7.328 -0.255 18522
6179 1 11 . 1 1 82 82 LYS N N 94 128.366 128.366 119.725 8.641 18522
6180 1 11 . 1 1 82 82 LYS C C 94 177.460 177.460 176.818 0.642 18522
6181 1 11 . 1 1 82 82 LYS CA C 94 55.753 55.753 57.111 -1.358 18522
6182 1 11 . 1 1 82 82 LYS CB C 94 32.332 32.332 32.159 0.173 18522
6183 1 11 . 1 1 82 82 LYS H H 94 8.762 8.762 7.530 1.232 18522
6184 1 11 . 1 1 83 83 GLY N N 95 112.528 112.528 113.157 -0.629 18522
6185 1 11 . 1 1 83 83 GLY C C 95 173.468 173.468 172.894 0.574 18522
6186 1 11 . 1 1 83 83 GLY CA C 95 46.243 46.243 45.282 0.961 18522
6187 1 11 . 1 1 83 83 GLY H H 95 8.673 8.673 8.871 -0.198 18522
6188 1 11 . 1 1 84 84 GLU N N 96 121.485 121.485 119.951 1.534 18522
6189 1 11 . 1 1 84 84 GLU HA H 96 4.749 4.749 5.000 -0.251 18522
6190 1 11 . 1 1 84 84 GLU C C 96 174.583 174.583 174.264 0.319 18522
6191 1 11 . 1 1 84 84 GLU CA C 96 55.821 55.821 54.749 1.072 18522
6192 1 11 . 1 1 84 84 GLU CB C 96 31.410 31.410 33.979 -2.569 18522
6193 1 11 . 1 1 84 84 GLU H H 96 8.297 8.297 7.389 0.908 18522
6194 1 11 . 1 1 85 85 VAL N N 97 120.501 120.501 111.989 8.512 18522
6195 1 11 . 1 1 85 85 VAL HA H 97 4.665 4.665 4.573 0.092 18522
6196 1 11 . 1 1 85 85 VAL C C 97 173.047 173.047 174.036 -0.989 18522
6197 1 11 . 1 1 85 85 VAL CA C 97 60.114 60.114 60.436 -0.322 18522
6198 1 11 . 1 1 85 85 VAL CB C 97 35.184 35.184 35.484 -0.300 18522
6199 1 11 . 1 1 85 85 VAL H H 97 9.096 9.096 8.421 0.675 18522
6200 1 11 . 1 1 86 86 THR N N 98 125.019 125.019 119.748 5.271 18522
6201 1 11 . 1 1 86 86 THR HA H 98 4.076 4.076 5.139 -1.063 18522
6202 1 11 . 1 1 86 86 THR C C 98 173.807 173.807 173.369 0.438 18522
6203 1 11 . 1 1 86 86 THR CA C 98 61.735 61.735 61.935 -0.201 18522
6204 1 11 . 1 1 86 86 THR CB C 98 69.531 69.531 70.384 -0.853 18522
6205 1 11 . 1 1 86 86 THR H H 98 9.352 9.352 8.169 1.183 18522
6206 1 11 . 1 1 87 87 ILE N N 99 128.383 128.383 124.491 3.892 18522
6207 1 11 . 1 1 87 87 ILE HA H 99 4.661 4.661 5.011 -0.350 18522
6208 1 11 . 1 1 87 87 ILE C C 99 174.614 174.614 174.235 0.379 18522
6209 1 11 . 1 1 87 87 ILE CA C 99 58.258 58.258 58.691 -0.433 18522
6210 1 11 . 1 1 87 87 ILE CB C 99 38.528 38.528 38.410 0.118 18522
6211 1 11 . 1 1 87 87 ILE H H 99 9.329 9.329 9.102 0.227 18522
6212 1 11 . 1 1 88 88 HIS N N 100 128.279 128.279 128.420 -0.141 18522
6213 1 11 . 1 1 88 88 HIS HA H 100 4.948 4.948 5.334 -0.386 18522
6214 1 11 . 1 1 88 88 HIS C C 100 174.787 174.787 174.263 0.524 18522
6215 1 11 . 1 1 88 88 HIS CA C 100 54.620 54.620 54.610 0.010 18522
6216 1 11 . 1 1 88 88 HIS H H 100 8.647 8.647 9.135 -0.488 18522
6217 1 11 . 1 1 89 89 TYR N N 101 121.320 121.320 124.190 -2.870 18522
6218 1 11 . 1 1 89 89 TYR HA H 101 5.947 5.947 5.741 0.206 18522
6219 1 11 . 1 1 89 89 TYR C C 101 173.769 173.769 173.464 0.305 18522
6220 1 11 . 1 1 89 89 TYR CA C 101 55.669 55.669 54.934 0.734 18522
6221 1 11 . 1 1 89 89 TYR CB C 101 42.195 42.195 40.710 1.485 18522
6222 1 11 . 1 1 89 89 TYR H H 101 8.414 8.414 8.944 -0.530 18522
6223 1 11 . 1 1 90 90 ASN N N 102 116.679 116.679 119.343 -2.664 18522
6224 1 11 . 1 1 90 90 ASN HA H 102 5.335 5.335 5.582 -0.247 18522
6225 1 11 . 1 1 90 90 ASN C C 102 175.406 175.406 174.990 0.416 18522
6226 1 11 . 1 1 90 90 ASN CA C 102 51.961 51.961 51.115 0.846 18522
6227 1 11 . 1 1 90 90 ASN CB C 102 41.800 41.800 42.368 -0.568 18522
6228 1 11 . 1 1 90 90 ASN H H 102 9.282 9.282 8.991 0.291 18522
6229 1 11 . 1 1 91 91 LYS N N 103 124.129 124.129 121.326 2.803 18522
6230 1 11 . 1 1 91 91 LYS C C 103 176.678 176.678 175.292 1.386 18522
6231 1 11 . 1 1 91 91 LYS CA C 103 55.006 55.006 55.600 -0.594 18522
6232 1 11 . 1 1 91 91 LYS H H 103 8.949 8.949 8.477 0.472 18522
6233 1 11 . 1 1 92 92 LEU N N 104 127.043 127.043 118.716 8.327 18522
6234 1 11 . 1 1 92 92 LEU HA H 104 4.425 4.425 4.617 -0.192 18522
6235 1 11 . 1 1 92 92 LEU CA C 104 55.060 55.060 54.257 0.803 18522
6236 1 11 . 1 1 92 92 LEU CB C 104 42.559 42.559 44.289 -1.730 18522
6237 1 11 . 1 1 92 92 LEU H H 104 9.150 9.150 7.665 1.485 18522
6238 1 11 . 1 1 93 93 GLN HA H 105 4.315 4.315 4.459 -0.144 18522
6239 1 11 . 1 1 93 93 GLN C C 105 175.070 175.070 175.613 -0.543 18522
6240 1 11 . 1 1 93 93 GLN CA C 105 55.490 55.490 54.786 0.704 18522
6241 1 11 . 1 1 93 93 GLN CB C 105 28.909 28.909 29.301 -0.392 18522
6242 1 11 . 1 1 94 94 ALA N N 106 125.133 125.133 121.418 3.715 18522
6243 1 11 . 1 1 94 94 ALA HA H 106 4.366 4.366 4.108 0.258 18522
6244 1 11 . 1 1 94 94 ALA C C 106 176.392 176.392 176.129 0.263 18522
6245 1 11 . 1 1 94 94 ALA CA C 106 51.723 51.723 52.634 -0.911 18522
6246 1 11 . 1 1 94 94 ALA CB C 106 20.185 20.185 18.583 1.602 18522
6247 1 11 . 1 1 94 94 ALA H H 106 8.226 8.226 7.992 0.234 18522
6248 1 11 . 1 1 95 95 ASP N N 107 122.013 122.013 119.967 2.046 18522
6249 1 11 . 1 1 95 95 ASP HA H 107 4.413 4.413 4.994 -0.581 18522
6250 1 11 . 1 1 95 95 ASP C C 107 175.019 175.019 175.636 -0.617 18522
6251 1 11 . 1 1 95 95 ASP CA C 107 55.642 55.642 51.963 3.679 18522
6252 1 11 . 1 1 95 95 ASP CB C 107 41.266 41.266 43.248 -1.982 18522
6253 1 11 . 1 1 95 95 ASP H H 107 8.429 8.429 8.111 0.318 18522
6254 1 11 . 1 1 96 96 PRO HA H 108 4.207 4.207 3.950 0.257 18522
6255 1 11 . 1 1 96 96 PRO C C 108 178.840 178.840 178.205 0.635 18522
6256 1 11 . 1 1 96 96 PRO CA C 108 65.396 65.396 66.659 -1.263 18522
6257 1 11 . 1 1 96 96 PRO CB C 108 32.181 32.181 31.668 0.513 18522
6258 1 11 . 1 1 97 97 LYS N N 109 117.942 117.942 115.259 2.683 18522
6259 1 11 . 1 1 97 97 LYS HA H 109 4.143 4.143 4.072 0.071 18522
6260 1 11 . 1 1 97 97 LYS C C 109 178.099 178.099 179.125 -1.026 18522
6261 1 11 . 1 1 97 97 LYS CA C 109 58.167 58.167 59.141 -0.974 18522
6262 1 11 . 1 1 97 97 LYS CB C 109 31.649 31.649 31.514 0.135 18522
6263 1 11 . 1 1 97 97 LYS H H 109 8.335 8.335 8.429 -0.094 18522
6264 1 11 . 1 1 98 98 GLN N N 110 119.159 119.159 118.412 0.747 18522
6265 1 11 . 1 1 98 98 GLN HA H 110 4.130 4.130 4.266 -0.136 18522
6266 1 11 . 1 1 98 98 GLN C C 110 178.298 178.298 178.279 0.019 18522
6267 1 11 . 1 1 98 98 GLN CA C 110 57.660 57.660 57.785 -0.125 18522
6268 1 11 . 1 1 98 98 GLN CB C 110 28.720 28.720 29.387 -0.667 18522
6269 1 11 . 1 1 98 98 GLN H H 110 7.985 7.985 8.164 -0.179 18522
6270 1 11 . 1 1 99 99 LEU N N 111 120.490 120.490 122.759 -2.269 18522
6271 1 11 . 1 1 99 99 LEU HA H 111 3.877 3.877 4.090 -0.213 18522
6272 1 11 . 1 1 99 99 LEU C C 111 177.729 177.729 178.209 -0.480 18522
6273 1 11 . 1 1 99 99 LEU CA C 111 57.049 57.049 58.221 -1.172 18522
6274 1 11 . 1 1 99 99 LEU CB C 111 41.466 41.466 41.917 -0.452 18522
6275 1 11 . 1 1 99 99 LEU H H 111 7.994 7.994 8.531 -0.537 18522
6276 1 11 . 1 1 100 100 GLU N N 112 118.251 118.251 117.313 0.938 18522
6277 1 11 . 1 1 100 100 GLU HA H 112 3.972 3.972 4.074 -0.102 18522
6278 1 11 . 1 1 100 100 GLU C C 112 178.402 178.402 178.303 0.099 18522
6279 1 11 . 1 1 100 100 GLU CA C 112 59.056 59.056 59.069 -0.013 18522
6280 1 11 . 1 1 100 100 GLU CB C 112 29.732 29.732 29.160 0.572 18522
6281 1 11 . 1 1 100 100 GLU H H 112 7.760 7.760 8.248 -0.488 18522
6282 1 11 . 1 1 101 101 VAL N N 113 117.229 117.229 118.535 -1.306 18522
6283 1 11 . 1 1 101 101 VAL HA H 113 3.762 3.762 3.870 -0.108 18522
6284 1 11 . 1 1 101 101 VAL C C 113 178.107 178.107 178.158 -0.051 18522
6285 1 11 . 1 1 101 101 VAL CA C 113 64.791 64.791 65.120 -0.329 18522
6286 1 11 . 1 1 101 101 VAL CB C 113 32.149 32.149 31.704 0.445 18522
6287 1 11 . 1 1 101 101 VAL H H 113 7.437 7.437 7.521 -0.084 18522
6288 1 11 . 1 1 102 102 LEU N N 114 122.124 122.124 118.572 3.552 18522
6289 1 11 . 1 1 102 102 LEU HA H 114 4.033 4.033 4.298 -0.265 18522
6290 1 11 . 1 1 102 102 LEU C C 114 178.506 178.506 178.304 0.202 18522
6291 1 11 . 1 1 102 102 LEU CA C 114 57.243 57.243 56.552 0.691 18522
6292 1 11 . 1 1 102 102 LEU CB C 114 42.028 42.028 42.194 -0.166 18522
6293 1 11 . 1 1 102 102 LEU H H 114 7.765 7.765 7.762 0.003 18522
6294 1 11 . 1 1 103 103 PHE N N 115 115.346 115.346 118.670 -3.324 18522
6295 1 11 . 1 1 103 103 PHE HA H 115 4.224 4.224 4.459 -0.235 18522
6296 1 11 . 1 1 103 103 PHE C C 115 175.621 175.621 176.007 -0.386 18522
6297 1 11 . 1 1 103 103 PHE CA C 115 57.537 57.537 56.825 0.711 18522
6298 1 11 . 1 1 103 103 PHE CB C 115 38.057 38.057 38.572 -0.515 18522
6299 1 11 . 1 1 103 103 PHE H H 115 7.805 7.805 7.898 -0.093 18522
6300 1 11 . 1 1 104 104 GLN N N 116 119.021 119.021 120.586 -1.565 18522
6301 1 11 . 1 1 104 104 GLN HA H 116 4.407 4.407 4.104 0.303 18522
6302 1 11 . 1 1 104 104 GLN C C 116 176.402 176.402 176.691 -0.289 18522
6303 1 11 . 1 1 104 104 GLN CA C 116 55.521 55.521 57.326 -1.805 18522
6304 1 11 . 1 1 104 104 GLN CB C 116 29.170 29.170 29.061 0.110 18522
6305 1 11 . 1 1 104 104 GLN H H 116 7.974 7.974 7.472 0.502 18522
6306 1 11 . 1 1 105 105 GLY N N 117 108.868 108.868 107.034 1.834 18522
6307 1 11 . 1 1 105 105 GLY CA C 117 45.124 45.124 44.612 0.512 18522
6308 1 11 . 1 1 105 105 GLY H H 117 8.195 8.195 7.814 0.381 18522
6309 1 11 . 1 1 106 106 PRO HA H 118 4.490 4.490 4.322 0.168 18522
6310 1 11 . 1 1 106 106 PRO C C 118 176.001 176.001 177.126 -1.125 18522
6311 1 11 . 1 1 106 106 PRO CA C 118 63.523 63.523 63.248 0.275 18522
6312 1 11 . 1 1 106 106 PRO CB C 118 32.078 32.078 31.941 0.137 18522
6313 1 11 . 1 1 107 107 GLN N N 119 126.950 126.950 118.532 8.418 18522
6314 1 11 . 1 1 107 107 GLN C C 119 181.211 181.211 177.307 3.904 18522
6315 1 11 . 1 1 107 107 GLN CA C 119 57.416 57.416 55.778 1.639 18522
6316 1 11 . 1 1 107 107 GLN H H 119 8.079 8.079 7.396 0.683 18522
6317 1 11 . 1 1 111 111 ARG C C 123 174.608 174.608 174.922 -0.314 18522
6318 1 11 . 1 1 111 111 ARG CA C 123 55.099 55.099 56.554 -1.455 18522
6319 1 11 . 1 1 112 112 HIS N N 124 122.212 122.212 114.916 7.296 18522
6320 1 11 . 1 1 112 112 HIS HA H 124 4.718 4.718 4.881 -0.163 18522
6321 1 11 . 1 1 112 112 HIS C C 124 176.040 176.040 174.616 1.424 18522
6322 1 11 . 1 1 112 112 HIS CA C 124 54.213 54.213 53.642 0.571 18522
6323 1 11 . 1 1 112 112 HIS CB C 124 31.164 31.164 30.673 0.491 18522
6324 1 11 . 1 1 112 112 HIS H H 124 7.640 7.640 8.010 -0.370 18522
6325 1 11 . 1 1 113 113 TRP C C 125 176.168 176.168 174.907 1.261 18522
6326 1 11 . 1 1 114 114 LEU N N 126 121.893 121.893 122.787 -0.894 18522
6327 1 11 . 1 1 114 114 LEU HA H 126 4.869 4.869 4.661 0.208 18522
6328 1 11 . 1 1 114 114 LEU CA C 126 54.151 54.151 53.791 0.360 18522
6329 1 11 . 1 1 114 114 LEU CB C 126 45.144 45.144 44.924 0.220 18522
6330 1 11 . 1 1 114 114 LEU H H 126 8.606 8.606 8.428 0.178 18522
6331 1 11 . 1 1 115 115 LYS N N 127 125.850 125.850 121.121 4.729 18522
6332 1 11 . 1 1 115 115 LYS HA H 127 4.203 4.203 5.134 -0.931 18522
6333 1 11 . 1 1 115 115 LYS C C 127 175.564 175.564 174.477 1.087 18522
6334 1 11 . 1 1 115 115 LYS CA C 127 57.252 57.252 55.396 1.856 18522
6335 1 11 . 1 1 115 115 LYS CB C 127 33.406 33.406 34.785 -1.379 18522
6336 1 11 . 1 1 115 115 LYS H H 127 8.647 8.647 8.153 0.494 18522
6337 1 12 . 1 1 3 3 PRO C C 15 177.225 177.225 177.175 0.050 18522
6338 1 12 . 1 1 3 3 PRO CA C 15 63.508 63.508 62.438 1.070 18522
6339 1 12 . 1 1 3 3 PRO CB C 15 32.090 32.090 32.608 -0.518 18522
6340 1 12 . 1 1 4 4 GLY N N 16 108.829 108.829 108.026 0.803 18522
6341 1 12 . 1 1 4 4 GLY C C 16 173.398 173.398 174.776 -1.378 18522
6342 1 12 . 1 1 4 4 GLY CA C 16 45.128 45.128 45.750 -0.622 18522
6343 1 12 . 1 1 4 4 GLY H H 16 8.489 8.489 8.350 0.139 18522
6344 1 12 . 1 1 5 5 ILE N N 17 121.763 121.763 116.576 5.187 18522
6345 1 12 . 1 1 5 5 ILE HA H 17 4.554 4.554 4.822 -0.268 18522
6346 1 12 . 1 1 5 5 ILE C C 17 174.332 174.332 174.649 -0.317 18522
6347 1 12 . 1 1 5 5 ILE CA C 17 58.245 58.245 57.449 0.796 18522
6348 1 12 . 1 1 5 5 ILE CB C 17 38.762 38.762 39.207 -0.445 18522
6349 1 12 . 1 1 5 5 ILE H H 17 8.014 8.014 7.485 0.529 18522
6350 1 12 . 1 1 6 6 PRO C C 18 176.437 176.437 176.327 0.110 18522
6351 1 12 . 1 1 6 6 PRO CA C 18 62.667 62.667 64.929 -2.262 18522
6352 1 12 . 1 1 6 6 PRO CB C 18 32.469 32.469 31.993 0.476 18522
6353 1 12 . 1 1 7 7 VAL N N 19 123.849 123.849 118.631 5.218 18522
6354 1 12 . 1 1 7 7 VAL HA H 19 4.550 4.550 4.474 0.076 18522
6355 1 12 . 1 1 7 7 VAL C C 19 174.453 174.453 173.596 0.857 18522
6356 1 12 . 1 1 7 7 VAL CA C 19 59.846 59.846 59.108 0.738 18522
6357 1 12 . 1 1 7 7 VAL CB C 19 33.510 33.510 33.152 0.358 18522
6358 1 12 . 1 1 7 7 VAL H H 19 8.754 8.754 7.812 0.942 18522
6359 1 12 . 1 1 8 8 PRO HA H 20 5.338 5.338 4.816 0.522 18522
6360 1 12 . 1 1 8 8 PRO C C 20 177.585 177.585 177.164 0.421 18522
6361 1 12 . 1 1 8 8 PRO CA C 20 62.406 62.406 61.898 0.508 18522
6362 1 12 . 1 1 8 8 PRO CB C 20 32.891 32.891 32.747 0.144 18522
6363 1 12 . 1 1 9 9 GLY N N 21 108.426 108.426 112.603 -4.177 18522
6364 1 12 . 1 1 9 9 GLY C C 21 171.443 171.443 172.679 -1.236 18522
6365 1 12 . 1 1 9 9 GLY CA C 21 44.581 44.581 45.063 -0.482 18522
6366 1 12 . 1 1 9 9 GLY H H 21 8.258 8.258 7.893 0.365 18522
6367 1 12 . 1 1 10 10 LYS N N 22 117.372 117.372 120.942 -3.570 18522
6368 1 12 . 1 1 10 10 LYS HA H 22 4.039 4.039 4.357 -0.318 18522
6369 1 12 . 1 1 10 10 LYS C C 22 174.463 174.463 174.544 -0.081 18522
6370 1 12 . 1 1 10 10 LYS CA C 22 55.263 55.263 56.469 -1.206 18522
6371 1 12 . 1 1 10 10 LYS CB C 22 35.227 35.227 34.883 0.345 18522
6372 1 12 . 1 1 10 10 LYS H H 22 8.175 8.175 7.979 0.196 18522
6373 1 12 . 1 1 11 11 VAL N N 23 120.387 120.387 120.701 -0.314 18522
6374 1 12 . 1 1 11 11 VAL HA H 23 4.708 4.708 4.443 0.265 18522
6375 1 12 . 1 1 11 11 VAL C C 23 171.873 171.873 173.174 -1.301 18522
6376 1 12 . 1 1 11 11 VAL CA C 23 59.866 59.866 59.777 0.089 18522
6377 1 12 . 1 1 11 11 VAL CB C 23 35.269 35.269 34.927 0.342 18522
6378 1 12 . 1 1 11 11 VAL H H 23 8.862 8.862 7.529 1.333 18522
6379 1 12 . 1 1 12 12 THR N N 24 125.797 125.797 117.938 7.859 18522
6380 1 12 . 1 1 12 12 THR HA H 24 5.121 5.121 4.772 0.349 18522
6381 1 12 . 1 1 12 12 THR C C 24 173.407 173.407 172.915 0.492 18522
6382 1 12 . 1 1 12 12 THR CA C 24 62.115 62.115 60.422 1.693 18522
6383 1 12 . 1 1 12 12 THR CB C 24 69.606 69.606 70.416 -0.810 18522
6384 1 12 . 1 1 12 12 THR H H 24 8.859 8.859 8.195 0.664 18522
6385 1 12 . 1 1 13 13 LEU N N 25 127.960 127.960 124.713 3.247 18522
6386 1 12 . 1 1 13 13 LEU HA H 25 4.809 4.809 4.857 -0.048 18522
6387 1 12 . 1 1 13 13 LEU C C 25 175.029 175.029 175.465 -0.436 18522
6388 1 12 . 1 1 13 13 LEU CA C 25 52.623 52.623 52.445 0.178 18522
6389 1 12 . 1 1 13 13 LEU CB C 25 46.242 46.242 45.545 0.697 18522
6390 1 12 . 1 1 13 13 LEU H H 25 9.258 9.258 8.244 1.014 18522
6391 1 12 . 1 1 14 14 GLN N N 26 120.858 120.858 116.195 4.663 18522
6392 1 12 . 1 1 14 14 GLN HA H 26 4.482 4.482 4.670 -0.188 18522
6393 1 12 . 1 1 14 14 GLN C C 26 174.515 174.515 175.288 -0.773 18522
6394 1 12 . 1 1 14 14 GLN CA C 26 54.576 54.576 54.383 0.193 18522
6395 1 12 . 1 1 14 14 GLN CB C 26 29.516 29.516 31.580 -2.064 18522
6396 1 12 . 1 1 14 14 GLN H H 26 8.530 8.530 8.265 0.265 18522
6397 1 12 . 1 1 15 15 LYS N N 27 119.583 119.583 121.282 -1.699 18522
6398 1 12 . 1 1 15 15 LYS HA H 27 4.180 4.180 4.391 -0.211 18522
6399 1 12 . 1 1 15 15 LYS C C 27 177.468 177.468 176.961 0.507 18522
6400 1 12 . 1 1 15 15 LYS CA C 27 55.956 55.956 56.524 -0.568 18522
6401 1 12 . 1 1 15 15 LYS CB C 27 34.099 34.099 32.351 1.748 18522
6402 1 12 . 1 1 15 15 LYS H H 27 8.099 8.099 8.161 -0.062 18522
6403 1 12 . 1 1 16 16 ASP N N 28 121.439 121.439 121.313 0.126 18522
6404 1 12 . 1 1 16 16 ASP HA H 28 4.590 4.590 4.640 -0.050 18522
6405 1 12 . 1 1 16 16 ASP C C 28 178.392 178.392 177.727 0.665 18522
6406 1 12 . 1 1 16 16 ASP CA C 28 52.426 52.426 53.605 -1.179 18522
6407 1 12 . 1 1 16 16 ASP CB C 28 41.377 41.377 42.697 -1.320 18522
6408 1 12 . 1 1 16 16 ASP H H 28 8.888 8.888 8.654 0.234 18522
6409 1 12 . 1 1 17 17 ALA N N 29 119.578 119.578 123.875 -4.297 18522
6410 1 12 . 1 1 17 17 ALA HA H 29 4.188 4.188 4.096 0.092 18522
6411 1 12 . 1 1 17 17 ALA C C 29 178.763 178.763 178.265 0.498 18522
6412 1 12 . 1 1 17 17 ALA CA C 29 54.434 54.434 54.637 -0.203 18522
6413 1 12 . 1 1 17 17 ALA CB C 29 18.293 18.293 18.716 -0.423 18522
6414 1 12 . 1 1 17 17 ALA H H 29 8.392 8.392 8.709 -0.317 18522
6415 1 12 . 1 1 18 18 GLN N N 30 117.564 117.564 116.738 0.826 18522
6416 1 12 . 1 1 18 18 GLN HA H 30 4.399 4.399 4.349 0.050 18522
6417 1 12 . 1 1 18 18 GLN C C 30 175.168 175.168 175.590 -0.422 18522
6418 1 12 . 1 1 18 18 GLN CA C 30 55.339 55.339 55.187 0.152 18522
6419 1 12 . 1 1 18 18 GLN CB C 30 28.589 28.589 29.305 -0.716 18522
6420 1 12 . 1 1 18 18 GLN H H 30 8.353 8.353 7.933 0.420 18522
6421 1 12 . 1 1 19 19 ASN N N 31 115.365 115.365 116.496 -1.131 18522
6422 1 12 . 1 1 19 19 ASN HA H 31 4.315 4.315 4.416 -0.101 18522
6423 1 12 . 1 1 19 19 ASN C C 31 174.043 174.043 172.915 1.128 18522
6424 1 12 . 1 1 19 19 ASN CA C 31 54.303 54.303 54.324 -0.021 18522
6425 1 12 . 1 1 19 19 ASN CB C 31 37.610 37.610 37.603 0.007 18522
6426 1 12 . 1 1 19 19 ASN H H 31 8.521 8.521 8.324 0.197 18522
6427 1 12 . 1 1 20 20 LEU N N 32 118.660 118.660 112.166 6.494 18522
6428 1 12 . 1 1 20 20 LEU HA H 32 4.900 4.900 4.836 0.064 18522
6429 1 12 . 1 1 20 20 LEU C C 32 178.117 178.117 176.325 1.792 18522
6430 1 12 . 1 1 20 20 LEU CA C 32 53.957 53.957 53.610 0.347 18522
6431 1 12 . 1 1 20 20 LEU CB C 32 44.774 44.774 43.711 1.063 18522
6432 1 12 . 1 1 20 20 LEU H H 32 8.155 8.155 7.403 0.752 18522
6433 1 12 . 1 1 21 21 ILE N N 33 116.785 116.785 115.220 1.565 18522
6434 1 12 . 1 1 21 21 ILE HA H 33 4.674 4.674 4.623 0.051 18522
6435 1 12 . 1 1 21 21 ILE C C 33 176.185 176.185 176.763 -0.578 18522
6436 1 12 . 1 1 21 21 ILE CA C 33 62.602 62.602 61.148 1.454 18522
6437 1 12 . 1 1 21 21 ILE CB C 33 39.016 39.016 39.148 -0.132 18522
6438 1 12 . 1 1 21 21 ILE H H 33 11.488 11.488 8.577 2.911 18522
6439 1 12 . 1 1 22 22 GLY N N 34 111.234 111.234 109.202 2.032 18522
6440 1 12 . 1 1 22 22 GLY C C 34 173.993 173.993 173.541 0.452 18522
6441 1 12 . 1 1 22 22 GLY CA C 34 45.980 45.980 45.464 0.516 18522
6442 1 12 . 1 1 22 22 GLY H H 34 9.854 9.854 8.876 0.978 18522
6443 1 12 . 1 1 23 23 ILE N N 35 111.117 111.117 113.914 -2.797 18522
6444 1 12 . 1 1 23 23 ILE HA H 35 5.535 5.535 5.182 0.353 18522
6445 1 12 . 1 1 23 23 ILE C C 35 175.033 175.033 174.378 0.655 18522
6446 1 12 . 1 1 23 23 ILE CA C 35 58.415 58.415 57.766 0.649 18522
6447 1 12 . 1 1 23 23 ILE CB C 35 41.577 41.577 41.216 0.361 18522
6448 1 12 . 1 1 23 23 ILE H H 35 7.835 7.835 7.523 0.312 18522
6449 1 12 . 1 1 24 24 SER N N 36 114.908 114.908 115.642 -0.734 18522
6450 1 12 . 1 1 24 24 SER HA H 36 4.232 4.232 5.032 -0.800 18522
6451 1 12 . 1 1 24 24 SER C C 36 174.735 174.735 172.942 1.793 18522
6452 1 12 . 1 1 24 24 SER CA C 36 56.121 56.121 57.081 -0.960 18522
6453 1 12 . 1 1 24 24 SER CB C 36 66.097 66.097 65.742 0.355 18522
6454 1 12 . 1 1 24 24 SER H H 36 8.623 8.623 8.426 0.197 18522
6455 1 12 . 1 1 25 25 ILE N N 37 117.739 117.739 124.998 -7.259 18522
6456 1 12 . 1 1 25 25 ILE C C 37 174.340 174.340 175.630 -1.290 18522
6457 1 12 . 1 1 25 25 ILE CA C 37 59.123 59.123 58.738 0.385 18522
6458 1 12 . 1 1 25 25 ILE CB C 37 41.637 41.637 40.066 1.571 18522
6459 1 12 . 1 1 25 25 ILE H H 37 9.130 9.130 8.706 0.424 18522
6460 1 12 . 1 1 26 26 GLY N N 38 108.069 108.069 112.802 -4.733 18522
6461 1 12 . 1 1 26 26 GLY CA C 38 44.112 44.112 45.190 -1.078 18522
6462 1 12 . 1 1 26 26 GLY H H 38 8.841 8.841 8.620 0.221 18522
6463 1 12 . 1 1 27 27 GLY N N 39 109.016 109.016 109.592 -0.576 18522
6464 1 12 . 1 1 27 27 GLY C C 39 173.956 173.956 174.180 -0.224 18522
6465 1 12 . 1 1 27 27 GLY H H 39 8.187 8.187 8.694 -0.507 18522
6466 1 12 . 1 1 28 28 GLY N N 40 111.783 111.783 113.919 -2.136 18522
6467 1 12 . 1 1 28 28 GLY C C 40 174.255 174.255 172.929 1.326 18522
6468 1 12 . 1 1 28 28 GLY CA C 40 47.098 47.098 44.728 2.370 18522
6469 1 12 . 1 1 28 28 GLY H H 40 8.275 8.275 7.945 0.330 18522
6470 1 12 . 1 1 29 29 ALA N N 41 123.128 123.128 127.303 -4.175 18522
6471 1 12 . 1 1 29 29 ALA HA H 41 4.559 4.559 4.263 0.296 18522
6472 1 12 . 1 1 29 29 ALA CA C 41 51.073 51.073 53.084 -2.011 18522
6473 1 12 . 1 1 29 29 ALA CB C 41 21.926 21.926 19.900 2.026 18522
6474 1 12 . 1 1 29 29 ALA H H 41 8.012 8.012 8.067 -0.055 18522
6475 1 12 . 1 1 31 31 TYR HA H 43 4.549 4.549 4.064 0.485 18522
6476 1 12 . 1 1 31 31 TYR CA C 43 57.147 57.147 59.095 -1.948 18522
6477 1 12 . 1 1 31 31 TYR CB C 43 37.495 37.495 36.981 0.514 18522
6478 1 12 . 1 1 32 32 CYS N N 44 119.332 119.332 115.924 3.408 18522
6479 1 12 . 1 1 32 32 CYS HA H 44 4.859 4.859 4.484 0.375 18522
6480 1 12 . 1 1 32 32 CYS CA C 44 57.406 57.406 59.876 -2.470 18522
6481 1 12 . 1 1 32 32 CYS CB C 44 27.673 27.673 27.711 -0.038 18522
6482 1 12 . 1 1 32 32 CYS H H 44 7.504 7.504 7.818 -0.314 18522
6483 1 12 . 1 1 33 33 PRO HA H 45 4.413 4.413 4.414 -0.001 18522
6484 1 12 . 1 1 33 33 PRO CA C 45 64.885 64.885 62.871 2.014 18522
6485 1 12 . 1 1 33 33 PRO CB C 45 32.318 32.318 31.585 0.733 18522
6486 1 12 . 1 1 34 34 CYS N N 46 117.327 117.327 123.599 -6.272 18522
6487 1 12 . 1 1 34 34 CYS C C 46 172.064 172.064 175.988 -3.924 18522
6488 1 12 . 1 1 34 34 CYS CA C 46 60.066 60.066 62.490 -2.425 18522
6489 1 12 . 1 1 34 34 CYS CB C 46 28.715 28.715 27.851 0.864 18522
6490 1 12 . 1 1 34 34 CYS H H 46 7.973 7.973 8.545 -0.572 18522
6491 1 12 . 1 1 35 35 LEU N N 47 124.270 124.270 116.468 7.802 18522
6492 1 12 . 1 1 35 35 LEU HA H 47 4.928 4.928 3.569 1.359 18522
6493 1 12 . 1 1 35 35 LEU C C 47 175.076 175.076 176.899 -1.823 18522
6494 1 12 . 1 1 35 35 LEU CA C 47 53.278 53.278 57.510 -4.232 18522
6495 1 12 . 1 1 35 35 LEU CB C 47 44.321 44.321 39.597 4.724 18522
6496 1 12 . 1 1 35 35 LEU H H 47 8.629 8.629 8.682 -0.053 18522
6497 1 12 . 1 1 36 36 TYR N N 48 119.326 119.326 111.645 7.681 18522
6498 1 12 . 1 1 36 36 TYR HA H 48 5.255 5.255 4.152 1.103 18522
6499 1 12 . 1 1 36 36 TYR C C 48 175.766 175.766 175.740 0.026 18522
6500 1 12 . 1 1 36 36 TYR CA C 48 56.696 56.696 60.338 -3.642 18522
6501 1 12 . 1 1 36 36 TYR CB C 48 42.590 42.590 36.420 6.170 18522
6502 1 12 . 1 1 36 36 TYR H H 48 8.761 8.761 8.490 0.271 18522
6503 1 12 . 1 1 37 37 ILE N N 49 120.259 120.259 121.517 -1.258 18522
6504 1 12 . 1 1 37 37 ILE HA H 49 4.215 4.215 4.799 -0.584 18522
6505 1 12 . 1 1 37 37 ILE C C 49 177.429 177.429 176.345 1.084 18522
6506 1 12 . 1 1 37 37 ILE CA C 49 62.456 62.456 59.669 2.787 18522
6507 1 12 . 1 1 37 37 ILE CB C 49 37.352 37.352 37.483 -0.131 18522
6508 1 12 . 1 1 37 37 ILE H H 49 8.959 8.959 7.618 1.341 18522
6509 1 12 . 1 1 38 38 VAL HA H 50 3.937 3.937 3.983 -0.046 18522
6510 1 12 . 1 1 38 38 VAL C C 50 174.408 174.408 175.383 -0.975 18522
6511 1 12 . 1 1 38 38 VAL CA C 50 62.259 62.259 64.481 -2.222 18522
6512 1 12 . 1 1 38 38 VAL CB C 50 31.584 31.584 32.466 -0.882 18522
6513 1 12 . 1 1 39 39 GLN N N 51 116.821 116.821 114.876 1.945 18522
6514 1 12 . 1 1 39 39 GLN HA H 51 4.103 4.103 4.441 -0.338 18522
6515 1 12 . 1 1 39 39 GLN C C 51 172.856 172.856 173.086 -0.230 18522
6516 1 12 . 1 1 39 39 GLN CA C 51 55.127 55.127 55.118 0.009 18522
6517 1 12 . 1 1 39 39 GLN CB C 51 32.376 32.376 32.035 0.341 18522
6518 1 12 . 1 1 39 39 GLN H H 51 6.967 6.967 7.521 -0.554 18522
6519 1 12 . 1 1 40 40 VAL N N 52 123.482 123.482 118.567 4.915 18522
6520 1 12 . 1 1 40 40 VAL HA H 52 4.277 4.277 4.622 -0.345 18522
6521 1 12 . 1 1 40 40 VAL C C 52 176.198 176.198 173.923 2.275 18522
6522 1 12 . 1 1 40 40 VAL CA C 52 61.574 61.574 59.861 1.713 18522
6523 1 12 . 1 1 40 40 VAL CB C 52 32.875 32.875 35.841 -2.966 18522
6524 1 12 . 1 1 40 40 VAL H H 52 8.447 8.447 8.164 0.283 18522
6525 1 12 . 1 1 41 41 PHE N N 53 128.296 128.296 123.126 5.170 18522
6526 1 12 . 1 1 41 41 PHE HA H 53 4.400 4.400 4.853 -0.453 18522
6527 1 12 . 1 1 41 41 PHE C C 53 175.299 175.299 176.342 -1.043 18522
6528 1 12 . 1 1 41 41 PHE CA C 53 58.494 58.494 56.407 2.087 18522
6529 1 12 . 1 1 41 41 PHE CB C 53 39.561 39.561 40.449 -0.888 18522
6530 1 12 . 1 1 41 41 PHE H H 53 8.707 8.707 8.517 0.190 18522
6531 1 12 . 1 1 42 42 ASP N N 54 122.696 122.696 124.115 -1.419 18522
6532 1 12 . 1 1 42 42 ASP HA H 54 4.272 4.272 4.347 -0.075 18522
6533 1 12 . 1 1 42 42 ASP C C 54 176.837 176.837 176.269 0.568 18522
6534 1 12 . 1 1 42 42 ASP CA C 54 55.291 55.291 57.432 -2.141 18522
6535 1 12 . 1 1 42 42 ASP CB C 54 41.093 41.093 40.981 0.112 18522
6536 1 12 . 1 1 42 42 ASP H H 54 8.901 8.901 9.029 -0.128 18522
6537 1 12 . 1 1 43 43 ASN N N 55 113.923 113.923 114.272 -0.349 18522
6538 1 12 . 1 1 43 43 ASN HA H 55 4.258 4.258 4.829 -0.571 18522
6539 1 12 . 1 1 43 43 ASN C C 55 173.714 173.714 175.286 -1.572 18522
6540 1 12 . 1 1 43 43 ASN CA C 55 54.958 54.958 53.086 1.872 18522
6541 1 12 . 1 1 43 43 ASN CB C 55 37.150 37.150 39.507 -2.357 18522
6542 1 12 . 1 1 43 43 ASN H H 55 9.319 9.319 8.082 1.237 18522
6543 1 12 . 1 1 44 44 THR N N 56 108.020 108.020 113.685 -5.665 18522
6544 1 12 . 1 1 44 44 THR HA H 56 5.377 5.377 4.995 0.382 18522
6545 1 12 . 1 1 44 44 THR CA C 56 59.712 59.712 59.332 0.380 18522
6546 1 12 . 1 1 44 44 THR CB C 56 69.529 69.529 70.857 -1.328 18522
6547 1 12 . 1 1 44 44 THR H H 56 7.149 7.149 7.930 -0.781 18522
6548 1 12 . 1 1 45 45 PRO HA H 57 4.304 4.304 4.105 0.199 18522
6549 1 12 . 1 1 45 45 PRO C C 57 180.141 180.141 178.292 1.849 18522
6550 1 12 . 1 1 45 45 PRO CA C 57 66.090 66.090 65.674 0.416 18522
6551 1 12 . 1 1 45 45 PRO CB C 57 33.194 33.194 31.448 1.746 18522
6552 1 12 . 1 1 46 46 ALA N N 58 116.854 116.854 120.147 -3.293 18522
6553 1 12 . 1 1 46 46 ALA HA H 58 4.035 4.035 4.005 0.030 18522
6554 1 12 . 1 1 46 46 ALA C C 58 180.647 180.647 179.439 1.208 18522
6555 1 12 . 1 1 46 46 ALA CA C 58 55.195 55.195 55.320 -0.125 18522
6556 1 12 . 1 1 46 46 ALA CB C 58 18.880 18.880 18.129 0.751 18522
6557 1 12 . 1 1 46 46 ALA H H 58 8.938 8.938 7.862 1.076 18522
6558 1 12 . 1 1 47 47 ALA N N 59 123.250 123.250 120.333 2.917 18522
6559 1 12 . 1 1 47 47 ALA HA H 59 4.030 4.030 4.025 0.005 18522
6560 1 12 . 1 1 47 47 ALA C C 59 179.852 179.852 179.416 0.436 18522
6561 1 12 . 1 1 47 47 ALA CA C 59 54.939 54.939 54.398 0.541 18522
6562 1 12 . 1 1 47 47 ALA CB C 59 19.688 19.688 18.745 0.943 18522
6563 1 12 . 1 1 47 47 ALA H H 59 7.658 7.658 7.342 0.316 18522
6564 1 12 . 1 1 48 48 LEU N N 60 118.654 118.654 119.747 -1.093 18522
6565 1 12 . 1 1 48 48 LEU HA H 60 4.026 4.026 4.145 -0.119 18522
6566 1 12 . 1 1 48 48 LEU C C 60 179.238 179.238 178.606 0.632 18522
6567 1 12 . 1 1 48 48 LEU CA C 60 57.261 57.261 58.127 -0.866 18522
6568 1 12 . 1 1 48 48 LEU CB C 60 41.445 41.445 40.867 0.578 18522
6569 1 12 . 1 1 48 48 LEU H H 60 8.636 8.636 8.529 0.107 18522
6570 1 12 . 1 1 49 49 ASP N N 61 117.382 117.382 116.578 0.804 18522
6571 1 12 . 1 1 49 49 ASP HA H 61 4.421 4.421 4.647 -0.226 18522
6572 1 12 . 1 1 49 49 ASP C C 61 177.668 177.668 177.894 -0.226 18522
6573 1 12 . 1 1 49 49 ASP CA C 61 57.087 57.087 54.828 2.259 18522
6574 1 12 . 1 1 49 49 ASP CB C 61 44.478 44.478 41.783 2.695 18522
6575 1 12 . 1 1 49 49 ASP H H 61 7.665 7.665 7.960 -0.295 18522
6576 1 12 . 1 1 50 50 GLY N N 62 103.228 103.228 107.907 -4.679 18522
6577 1 12 . 1 1 50 50 GLY C C 62 174.776 174.776 175.436 -0.660 18522
6578 1 12 . 1 1 50 50 GLY CA C 62 46.533 46.533 45.950 0.583 18522
6579 1 12 . 1 1 50 50 GLY H H 62 7.216 7.216 8.473 -1.257 18522
6580 1 12 . 1 1 51 51 THR N N 63 117.230 117.230 111.010 6.220 18522
6581 1 12 . 1 1 51 51 THR HA H 63 3.907 3.907 3.873 0.034 18522
6582 1 12 . 1 1 51 51 THR C C 63 175.961 175.961 174.988 0.973 18522
6583 1 12 . 1 1 51 51 THR CA C 63 66.478 66.478 63.471 3.007 18522
6584 1 12 . 1 1 51 51 THR CB C 63 68.268 68.268 66.186 2.082 18522
6585 1 12 . 1 1 51 51 THR H H 63 8.319 8.319 8.034 0.285 18522
6586 1 12 . 1 1 52 52 VAL N N 64 113.826 113.826 115.614 -1.788 18522
6587 1 12 . 1 1 52 52 VAL HA H 64 3.950 3.950 4.669 -0.719 18522
6588 1 12 . 1 1 52 52 VAL C C 64 173.883 173.883 175.340 -1.457 18522
6589 1 12 . 1 1 52 52 VAL CA C 64 60.708 60.708 60.774 -0.066 18522
6590 1 12 . 1 1 52 52 VAL CB C 64 33.079 33.079 30.166 2.913 18522
6591 1 12 . 1 1 52 52 VAL H H 64 8.147 8.147 7.589 0.558 18522
6592 1 12 . 1 1 53 53 ALA N N 65 123.521 123.521 125.719 -2.198 18522
6593 1 12 . 1 1 53 53 ALA HA H 65 4.414 4.414 4.390 0.024 18522
6594 1 12 . 1 1 53 53 ALA C C 65 175.247 175.247 176.961 -1.714 18522
6595 1 12 . 1 1 53 53 ALA CA C 65 50.440 50.440 51.078 -0.638 18522
6596 1 12 . 1 1 53 53 ALA CB C 65 23.266 23.266 20.111 3.155 18522
6597 1 12 . 1 1 53 53 ALA H H 65 8.633 8.633 7.655 0.978 18522
6598 1 12 . 1 1 54 54 ALA N N 66 120.818 120.818 121.420 -0.602 18522
6599 1 12 . 1 1 54 54 ALA HA H 66 3.720 3.720 4.006 -0.286 18522
6600 1 12 . 1 1 54 54 ALA C C 66 178.411 178.411 178.521 -0.110 18522
6601 1 12 . 1 1 54 54 ALA CA C 66 53.016 53.016 53.451 -0.435 18522
6602 1 12 . 1 1 54 54 ALA CB C 66 17.840 17.840 18.567 -0.727 18522
6603 1 12 . 1 1 54 54 ALA H H 66 8.451 8.451 8.124 0.327 18522
6604 1 12 . 1 1 55 55 GLY N N 67 112.260 112.260 112.935 -0.675 18522
6605 1 12 . 1 1 55 55 GLY C C 67 173.296 173.296 174.211 -0.915 18522
6606 1 12 . 1 1 55 55 GLY CA C 67 45.025 45.025 44.630 0.395 18522
6607 1 12 . 1 1 55 55 GLY H H 67 9.600 9.600 8.331 1.269 18522
6608 1 12 . 1 1 56 56 ASP N N 68 121.293 121.293 121.849 -0.556 18522
6609 1 12 . 1 1 56 56 ASP HA H 68 4.861 4.861 4.583 0.278 18522
6610 1 12 . 1 1 56 56 ASP C C 68 174.937 174.937 173.634 1.303 18522
6611 1 12 . 1 1 56 56 ASP CA C 68 55.641 55.641 53.557 2.084 18522
6612 1 12 . 1 1 56 56 ASP CB C 68 40.696 40.696 43.136 -2.440 18522
6613 1 12 . 1 1 56 56 ASP H H 68 8.043 8.043 7.495 0.548 18522
6614 1 12 . 1 1 57 57 GLU N N 69 122.814 122.814 120.405 2.409 18522
6615 1 12 . 1 1 57 57 GLU C C 69 177.202 177.202 175.966 1.236 18522
6616 1 12 . 1 1 57 57 GLU CA C 69 54.472 54.472 54.526 -0.055 18522
6617 1 12 . 1 1 57 57 GLU CB C 69 32.800 32.800 30.959 1.841 18522
6618 1 12 . 1 1 57 57 GLU H H 69 8.455 8.455 7.840 0.615 18522
6619 1 12 . 1 1 58 58 ILE N N 70 125.862 125.862 126.678 -0.816 18522
6620 1 12 . 1 1 58 58 ILE HA H 70 4.526 4.526 4.357 0.169 18522
6621 1 12 . 1 1 58 58 ILE C C 70 175.035 175.035 176.454 -1.419 18522
6622 1 12 . 1 1 58 58 ILE CA C 70 60.918 60.918 60.790 0.128 18522
6623 1 12 . 1 1 58 58 ILE CB C 70 39.236 39.236 35.965 3.271 18522
6624 1 12 . 1 1 58 58 ILE H H 70 8.619 8.619 8.120 0.499 18522
6625 1 12 . 1 1 59 59 THR N N 71 115.507 115.507 121.084 -5.577 18522
6626 1 12 . 1 1 59 59 THR HA H 71 4.513 4.513 4.567 -0.054 18522
6627 1 12 . 1 1 59 59 THR C C 71 176.425 176.425 174.372 2.053 18522
6628 1 12 . 1 1 59 59 THR CA C 71 61.158 61.158 64.147 -2.989 18522
6629 1 12 . 1 1 59 59 THR CB C 71 69.604 69.604 70.143 -0.539 18522
6630 1 12 . 1 1 59 59 THR H H 71 9.242 9.242 8.779 0.463 18522
6631 1 12 . 1 1 60 60 GLY N N 72 111.789 111.789 107.284 4.505 18522
6632 1 12 . 1 1 60 60 GLY C C 72 170.981 170.981 171.121 -0.140 18522
6633 1 12 . 1 1 60 60 GLY CA C 72 46.554 46.554 44.839 1.715 18522
6634 1 12 . 1 1 60 60 GLY H H 72 7.883 7.883 7.484 0.399 18522
6635 1 12 . 1 1 61 61 VAL N N 73 119.277 119.277 118.726 0.551 18522
6636 1 12 . 1 1 61 61 VAL C C 73 175.951 175.951 175.721 0.230 18522
6637 1 12 . 1 1 61 61 VAL CA C 73 60.982 60.982 58.786 2.196 18522
6638 1 12 . 1 1 61 61 VAL CB C 73 36.197 36.197 35.274 0.923 18522
6639 1 12 . 1 1 61 61 VAL H H 73 8.424 8.424 8.737 -0.313 18522
6640 1 12 . 1 1 62 62 ASN N N 74 127.731 127.731 126.301 1.430 18522
6641 1 12 . 1 1 62 62 ASN HA H 74 4.520 4.520 4.261 0.259 18522
6642 1 12 . 1 1 62 62 ASN C C 74 174.878 174.878 175.269 -0.391 18522
6643 1 12 . 1 1 62 62 ASN CA C 74 54.418 54.418 54.348 0.070 18522
6644 1 12 . 1 1 62 62 ASN CB C 74 36.655 36.655 37.886 -1.231 18522
6645 1 12 . 1 1 62 62 ASN H H 74 10.384 10.384 8.752 1.632 18522
6646 1 12 . 1 1 63 63 GLY N N 75 104.633 104.633 103.503 1.130 18522
6647 1 12 . 1 1 63 63 GLY C C 75 173.610 173.610 173.752 -0.142 18522
6648 1 12 . 1 1 63 63 GLY CA C 75 45.261 45.261 45.054 0.207 18522
6649 1 12 . 1 1 63 63 GLY H H 75 8.926 8.926 8.400 0.526 18522
6650 1 12 . 1 1 64 64 ARG N N 76 120.451 120.451 121.738 -1.287 18522
6651 1 12 . 1 1 64 64 ARG HA H 76 4.501 4.501 4.696 -0.195 18522
6652 1 12 . 1 1 64 64 ARG C C 76 175.085 175.085 175.886 -0.801 18522
6653 1 12 . 1 1 64 64 ARG CA C 76 54.252 54.252 54.141 0.112 18522
6654 1 12 . 1 1 64 64 ARG CB C 76 31.482 31.482 31.526 -0.044 18522
6655 1 12 . 1 1 64 64 ARG H H 76 7.753 7.753 8.008 -0.255 18522
6656 1 12 . 1 1 65 65 SER N N 77 116.586 116.586 118.736 -2.150 18522
6657 1 12 . 1 1 65 65 SER HA H 77 4.483 4.483 4.686 -0.203 18522
6658 1 12 . 1 1 65 65 SER C C 77 176.953 176.953 175.250 1.703 18522
6659 1 12 . 1 1 65 65 SER CA C 77 58.292 58.292 59.659 -1.367 18522
6660 1 12 . 1 1 65 65 SER CB C 77 63.643 63.643 63.741 -0.098 18522
6661 1 12 . 1 1 65 65 SER H H 77 8.555 8.555 8.789 -0.234 18522
6662 1 12 . 1 1 66 66 ILE N N 78 116.618 116.618 119.581 -2.963 18522
6663 1 12 . 1 1 66 66 ILE HA H 78 4.420 4.420 4.167 0.253 18522
6664 1 12 . 1 1 66 66 ILE C C 78 175.072 175.072 177.521 -2.449 18522
6665 1 12 . 1 1 66 66 ILE CA C 78 59.122 59.122 61.261 -2.139 18522
6666 1 12 . 1 1 66 66 ILE CB C 78 36.758 36.758 37.382 -0.624 18522
6667 1 12 . 1 1 66 66 ILE H H 78 7.599 7.599 8.156 -0.557 18522
6668 1 12 . 1 1 67 67 LYS N N 79 123.287 123.287 122.583 0.704 18522
6669 1 12 . 1 1 67 67 LYS HA H 79 4.049 4.049 3.907 0.142 18522
6670 1 12 . 1 1 67 67 LYS C C 79 178.333 178.333 177.964 0.369 18522
6671 1 12 . 1 1 67 67 LYS CA C 79 58.321 58.321 58.307 0.014 18522
6672 1 12 . 1 1 67 67 LYS CB C 79 31.635 31.635 31.768 -0.133 18522
6673 1 12 . 1 1 67 67 LYS H H 79 7.898 7.898 8.002 -0.104 18522
6674 1 12 . 1 1 68 68 GLY N N 80 114.933 114.933 105.345 9.588 18522
6675 1 12 . 1 1 68 68 GLY C C 80 174.385 174.385 174.452 -0.067 18522
6676 1 12 . 1 1 68 68 GLY CA C 80 45.518 45.518 45.881 -0.363 18522
6677 1 12 . 1 1 68 68 GLY H H 80 8.999 8.999 8.320 0.679 18522
6678 1 12 . 1 1 69 69 LYS N N 81 119.403 119.403 119.197 0.206 18522
6679 1 12 . 1 1 69 69 LYS HA H 81 4.043 4.043 4.597 -0.554 18522
6680 1 12 . 1 1 69 69 LYS C C 81 177.064 177.064 174.729 2.335 18522
6681 1 12 . 1 1 69 69 LYS CA C 81 54.722 54.722 55.033 -0.311 18522
6682 1 12 . 1 1 69 69 LYS CB C 81 33.560 33.560 33.226 0.334 18522
6683 1 12 . 1 1 69 69 LYS H H 81 7.845 7.845 7.828 0.017 18522
6684 1 12 . 1 1 70 70 THR N N 82 112.066 112.066 108.701 3.365 18522
6685 1 12 . 1 1 70 70 THR HA H 82 4.666 4.666 4.665 0.001 18522
6686 1 12 . 1 1 70 70 THR C C 82 175.955 175.955 175.586 0.369 18522
6687 1 12 . 1 1 70 70 THR CA C 82 60.438 60.438 59.772 0.666 18522
6688 1 12 . 1 1 70 70 THR CB C 82 71.629 71.629 72.378 -0.749 18522
6689 1 12 . 1 1 70 70 THR H H 82 9.153 9.153 7.731 1.422 18522
6690 1 12 . 1 1 71 71 LYS N N 83 118.730 118.730 122.500 -3.770 18522
6691 1 12 . 1 1 71 71 LYS HA H 83 3.870 3.870 3.877 -0.007 18522
6692 1 12 . 1 1 71 71 LYS C C 83 177.464 177.464 178.274 -0.810 18522
6693 1 12 . 1 1 71 71 LYS CA C 83 60.357 60.357 60.527 -0.170 18522
6694 1 12 . 1 1 71 71 LYS CB C 83 31.350 31.350 31.670 -0.320 18522
6695 1 12 . 1 1 71 71 LYS H H 83 8.969 8.969 8.934 0.035 18522
6696 1 12 . 1 1 72 72 VAL N N 84 117.444 117.444 119.628 -2.184 18522
6697 1 12 . 1 1 72 72 VAL HA H 84 3.633 3.633 3.632 0.001 18522
6698 1 12 . 1 1 72 72 VAL C C 84 178.315 178.315 177.547 0.768 18522
6699 1 12 . 1 1 72 72 VAL CA C 84 66.079 66.079 65.855 0.224 18522
6700 1 12 . 1 1 72 72 VAL CB C 84 32.091 32.091 31.658 0.433 18522
6701 1 12 . 1 1 72 72 VAL H H 84 7.631 7.631 8.244 -0.613 18522
6702 1 12 . 1 1 73 73 GLU N N 85 120.890 120.890 119.468 1.422 18522
6703 1 12 . 1 1 73 73 GLU HA H 85 3.964 3.964 3.985 -0.021 18522
6704 1 12 . 1 1 73 73 GLU C C 85 179.971 179.971 178.775 1.196 18522
6705 1 12 . 1 1 73 73 GLU CA C 85 59.316 59.316 59.483 -0.167 18522
6706 1 12 . 1 1 73 73 GLU CB C 85 30.355 30.355 29.832 0.523 18522
6707 1 12 . 1 1 73 73 GLU H H 85 7.617 7.617 7.581 0.036 18522
6708 1 12 . 1 1 74 74 VAL N N 86 121.246 121.246 118.821 2.425 18522
6709 1 12 . 1 1 74 74 VAL HA H 86 3.630 3.630 3.679 -0.049 18522
6710 1 12 . 1 1 74 74 VAL C C 86 177.217 177.217 177.620 -0.403 18522
6711 1 12 . 1 1 74 74 VAL CA C 86 66.678 66.678 66.106 0.572 18522
6712 1 12 . 1 1 74 74 VAL CB C 86 31.307 31.307 31.000 0.307 18522
6713 1 12 . 1 1 74 74 VAL H H 86 8.368 8.368 8.185 0.183 18522
6714 1 12 . 1 1 75 75 ALA N N 87 122.148 122.148 122.194 -0.046 18522
6715 1 12 . 1 1 75 75 ALA HA H 87 3.947 3.947 3.943 0.004 18522
6716 1 12 . 1 1 75 75 ALA C C 87 179.545 179.545 179.228 0.317 18522
6717 1 12 . 1 1 75 75 ALA CA C 87 55.851 55.851 55.316 0.535 18522
6718 1 12 . 1 1 75 75 ALA CB C 87 18.491 18.491 17.989 0.502 18522
6719 1 12 . 1 1 75 75 ALA H H 87 8.577 8.577 8.134 0.443 18522
6720 1 12 . 1 1 76 76 LYS N N 88 117.733 117.733 120.185 -2.452 18522
6721 1 12 . 1 1 76 76 LYS HA H 88 4.051 4.051 4.263 -0.212 18522
6722 1 12 . 1 1 76 76 LYS CA C 88 59.393 59.393 59.067 0.326 18522
6723 1 12 . 1 1 76 76 LYS CB C 88 32.058 32.058 32.408 -0.350 18522
6724 1 12 . 1 1 76 76 LYS H H 88 7.854 7.854 7.501 0.353 18522
6725 1 12 . 1 1 77 77 MET N N 89 117.676 117.676 118.023 -0.347 18522
6726 1 12 . 1 1 77 77 MET HA H 89 4.048 4.048 4.108 -0.060 18522
6727 1 12 . 1 1 77 77 MET C C 89 178.791 178.791 178.905 -0.114 18522
6728 1 12 . 1 1 77 77 MET CA C 89 59.128 59.128 58.254 0.874 18522
6729 1 12 . 1 1 77 77 MET CB C 89 33.801 33.801 31.747 2.054 18522
6730 1 12 . 1 1 77 77 MET H H 89 7.759 7.759 8.444 -0.685 18522
6731 1 12 . 1 1 78 78 ILE N N 90 117.305 117.305 119.854 -2.549 18522
6732 1 12 . 1 1 78 78 ILE HA H 90 3.590 3.590 3.537 0.053 18522
6733 1 12 . 1 1 78 78 ILE C C 90 178.658 178.658 178.013 0.645 18522
6734 1 12 . 1 1 78 78 ILE CA C 90 65.482 65.482 65.466 0.016 18522
6735 1 12 . 1 1 78 78 ILE CB C 90 38.845 38.845 37.529 1.316 18522
6736 1 12 . 1 1 78 78 ILE H H 90 7.972 7.972 7.658 0.314 18522
6737 1 12 . 1 1 79 79 GLN N N 91 120.935 120.935 119.197 1.738 18522
6738 1 12 . 1 1 79 79 GLN HA H 91 3.998 3.998 3.949 0.049 18522
6739 1 12 . 1 1 79 79 GLN C C 91 178.274 178.274 178.644 -0.370 18522
6740 1 12 . 1 1 79 79 GLN CA C 91 59.151 59.151 58.630 0.521 18522
6741 1 12 . 1 1 79 79 GLN CB C 91 28.934 28.934 28.691 0.243 18522
6742 1 12 . 1 1 79 79 GLN H H 91 8.826 8.826 8.202 0.624 18522
6743 1 12 . 1 1 80 80 GLU N N 92 115.213 115.213 119.587 -4.374 18522
6744 1 12 . 1 1 80 80 GLU HA H 92 4.061 4.061 4.066 -0.005 18522
6745 1 12 . 1 1 80 80 GLU C C 92 176.824 176.824 178.889 -2.065 18522
6746 1 12 . 1 1 80 80 GLU CA C 92 58.006 58.006 59.099 -1.093 18522
6747 1 12 . 1 1 80 80 GLU CB C 92 29.890 29.890 29.783 0.107 18522
6748 1 12 . 1 1 80 80 GLU H H 92 8.020 8.020 8.121 -0.101 18522
6749 1 12 . 1 1 81 81 VAL N N 93 119.047 119.047 114.237 4.810 18522
6750 1 12 . 1 1 81 81 VAL HA H 93 3.930 3.930 3.812 0.118 18522
6751 1 12 . 1 1 81 81 VAL C C 93 176.016 176.016 175.726 0.290 18522
6752 1 12 . 1 1 81 81 VAL CA C 93 63.153 63.153 63.544 -0.391 18522
6753 1 12 . 1 1 81 81 VAL CB C 93 32.154 32.154 32.056 0.098 18522
6754 1 12 . 1 1 81 81 VAL H H 93 7.073 7.073 7.541 -0.468 18522
6755 1 12 . 1 1 82 82 LYS N N 94 128.366 128.366 119.099 9.267 18522
6756 1 12 . 1 1 82 82 LYS C C 94 177.460 177.460 177.135 0.325 18522
6757 1 12 . 1 1 82 82 LYS CA C 94 55.753 55.753 57.087 -1.334 18522
6758 1 12 . 1 1 82 82 LYS CB C 94 32.332 32.332 32.493 -0.161 18522
6759 1 12 . 1 1 82 82 LYS H H 94 8.762 8.762 7.404 1.358 18522
6760 1 12 . 1 1 83 83 GLY N N 95 112.528 112.528 113.147 -0.619 18522
6761 1 12 . 1 1 83 83 GLY C C 95 173.468 173.468 173.043 0.425 18522
6762 1 12 . 1 1 83 83 GLY CA C 95 46.243 46.243 45.432 0.811 18522
6763 1 12 . 1 1 83 83 GLY H H 95 8.673 8.673 8.755 -0.082 18522
6764 1 12 . 1 1 84 84 GLU N N 96 121.485 121.485 121.007 0.478 18522
6765 1 12 . 1 1 84 84 GLU HA H 96 4.749 4.749 5.301 -0.552 18522
6766 1 12 . 1 1 84 84 GLU C C 96 174.583 174.583 174.497 0.086 18522
6767 1 12 . 1 1 84 84 GLU CA C 96 55.821 55.821 54.527 1.294 18522
6768 1 12 . 1 1 84 84 GLU CB C 96 31.410 31.410 33.199 -1.789 18522
6769 1 12 . 1 1 84 84 GLU H H 96 8.297 8.297 7.749 0.548 18522
6770 1 12 . 1 1 85 85 VAL N N 97 120.501 120.501 113.948 6.553 18522
6771 1 12 . 1 1 85 85 VAL HA H 97 4.665 4.665 4.586 0.079 18522
6772 1 12 . 1 1 85 85 VAL C C 97 173.047 173.047 174.023 -0.976 18522
6773 1 12 . 1 1 85 85 VAL CA C 97 60.114 60.114 60.439 -0.325 18522
6774 1 12 . 1 1 85 85 VAL CB C 97 35.184 35.184 35.706 -0.522 18522
6775 1 12 . 1 1 85 85 VAL H H 97 9.096 9.096 8.525 0.571 18522
6776 1 12 . 1 1 86 86 THR N N 98 125.019 125.019 115.999 9.020 18522
6777 1 12 . 1 1 86 86 THR HA H 98 4.076 4.076 4.650 -0.574 18522
6778 1 12 . 1 1 86 86 THR C C 98 173.807 173.807 174.134 -0.327 18522
6779 1 12 . 1 1 86 86 THR CA C 98 61.735 61.735 60.458 1.277 18522
6780 1 12 . 1 1 86 86 THR CB C 98 69.531 69.531 69.950 -0.419 18522
6781 1 12 . 1 1 86 86 THR H H 98 9.352 9.352 8.131 1.221 18522
6782 1 12 . 1 1 87 87 ILE N N 99 128.383 128.383 123.007 5.376 18522
6783 1 12 . 1 1 87 87 ILE HA H 99 4.661 4.661 4.710 -0.049 18522
6784 1 12 . 1 1 87 87 ILE C C 99 174.614 174.614 174.483 0.131 18522
6785 1 12 . 1 1 87 87 ILE CA C 99 58.258 58.258 58.825 -0.567 18522
6786 1 12 . 1 1 87 87 ILE CB C 99 38.528 38.528 38.562 -0.034 18522
6787 1 12 . 1 1 87 87 ILE H H 99 9.329 9.329 8.326 1.003 18522
6788 1 12 . 1 1 88 88 HIS N N 100 128.279 128.279 126.821 1.458 18522
6789 1 12 . 1 1 88 88 HIS HA H 100 4.948 4.948 4.821 0.127 18522
6790 1 12 . 1 1 88 88 HIS C C 100 174.787 174.787 174.480 0.307 18522
6791 1 12 . 1 1 88 88 HIS CA C 100 54.620 54.620 53.796 0.824 18522
6792 1 12 . 1 1 88 88 HIS H H 100 8.647 8.647 8.207 0.440 18522
6793 1 12 . 1 1 89 89 TYR N N 101 121.320 121.320 124.195 -2.875 18522
6794 1 12 . 1 1 89 89 TYR HA H 101 5.947 5.947 4.455 1.492 18522
6795 1 12 . 1 1 89 89 TYR C C 101 173.769 173.769 174.878 -1.109 18522
6796 1 12 . 1 1 89 89 TYR CA C 101 55.669 55.669 58.347 -2.678 18522
6797 1 12 . 1 1 89 89 TYR CB C 101 42.195 42.195 39.828 2.367 18522
6798 1 12 . 1 1 89 89 TYR H H 101 8.414 8.414 8.817 -0.403 18522
6799 1 12 . 1 1 90 90 ASN N N 102 116.679 116.679 114.522 2.157 18522
6800 1 12 . 1 1 90 90 ASN HA H 102 5.335 5.335 4.919 0.416 18522
6801 1 12 . 1 1 90 90 ASN C C 102 175.406 175.406 174.034 1.372 18522
6802 1 12 . 1 1 90 90 ASN CA C 102 51.961 51.961 53.425 -1.464 18522
6803 1 12 . 1 1 90 90 ASN CB C 102 41.800 41.800 41.115 0.685 18522
6804 1 12 . 1 1 90 90 ASN H H 102 9.282 9.282 7.817 1.465 18522
6805 1 12 . 1 1 91 91 LYS N N 103 124.129 124.129 118.712 5.417 18522
6806 1 12 . 1 1 91 91 LYS C C 103 176.678 176.678 175.553 1.125 18522
6807 1 12 . 1 1 91 91 LYS CA C 103 55.006 55.006 56.396 -1.390 18522
6808 1 12 . 1 1 91 91 LYS H H 103 8.949 8.949 8.425 0.524 18522
6809 1 12 . 1 1 92 92 LEU N N 104 127.043 127.043 115.505 11.538 18522
6810 1 12 . 1 1 92 92 LEU HA H 104 4.425 4.425 4.949 -0.524 18522
6811 1 12 . 1 1 92 92 LEU CA C 104 55.060 55.060 53.798 1.262 18522
6812 1 12 . 1 1 92 92 LEU CB C 104 42.559 42.559 43.063 -0.504 18522
6813 1 12 . 1 1 92 92 LEU H H 104 9.150 9.150 7.773 1.377 18522
6814 1 12 . 1 1 93 93 GLN HA H 105 4.315 4.315 4.407 -0.092 18522
6815 1 12 . 1 1 93 93 GLN C C 105 175.070 175.070 175.573 -0.503 18522
6816 1 12 . 1 1 93 93 GLN CA C 105 55.490 55.490 56.724 -1.234 18522
6817 1 12 . 1 1 93 93 GLN CB C 105 28.909 28.909 29.592 -0.683 18522
6818 1 12 . 1 1 94 94 ALA N N 106 125.133 125.133 121.517 3.616 18522
6819 1 12 . 1 1 94 94 ALA HA H 106 4.366 4.366 4.601 -0.235 18522
6820 1 12 . 1 1 94 94 ALA C C 106 176.392 176.392 175.415 0.977 18522
6821 1 12 . 1 1 94 94 ALA CA C 106 51.723 51.723 51.086 0.637 18522
6822 1 12 . 1 1 94 94 ALA CB C 106 20.185 20.185 21.219 -1.034 18522
6823 1 12 . 1 1 94 94 ALA H H 106 8.226 8.226 7.698 0.528 18522
6824 1 12 . 1 1 95 95 ASP N N 107 122.013 122.013 119.842 2.171 18522
6825 1 12 . 1 1 95 95 ASP HA H 107 4.413 4.413 4.988 -0.575 18522
6826 1 12 . 1 1 95 95 ASP C C 107 175.019 175.019 175.076 -0.057 18522
6827 1 12 . 1 1 95 95 ASP CA C 107 55.642 55.642 51.051 4.591 18522
6828 1 12 . 1 1 95 95 ASP CB C 107 41.266 41.266 43.770 -2.503 18522
6829 1 12 . 1 1 95 95 ASP H H 107 8.429 8.429 8.356 0.073 18522
6830 1 12 . 1 1 96 96 PRO HA H 108 4.207 4.207 3.995 0.212 18522
6831 1 12 . 1 1 96 96 PRO C C 108 178.840 178.840 178.122 0.718 18522
6832 1 12 . 1 1 96 96 PRO CA C 108 65.396 65.396 65.904 -0.508 18522
6833 1 12 . 1 1 96 96 PRO CB C 108 32.181 32.181 31.826 0.355 18522
6834 1 12 . 1 1 97 97 LYS N N 109 117.942 117.942 115.443 2.499 18522
6835 1 12 . 1 1 97 97 LYS HA H 109 4.143 4.143 4.007 0.136 18522
6836 1 12 . 1 1 97 97 LYS C C 109 178.099 178.099 179.404 -1.305 18522
6837 1 12 . 1 1 97 97 LYS CA C 109 58.167 58.167 59.085 -0.918 18522
6838 1 12 . 1 1 97 97 LYS CB C 109 31.649 31.649 31.496 0.153 18522
6839 1 12 . 1 1 97 97 LYS H H 109 8.335 8.335 7.767 0.568 18522
6840 1 12 . 1 1 98 98 GLN N N 110 119.159 119.159 118.022 1.137 18522
6841 1 12 . 1 1 98 98 GLN HA H 110 4.130 4.130 4.377 -0.247 18522
6842 1 12 . 1 1 98 98 GLN C C 110 178.298 178.298 177.967 0.331 18522
6843 1 12 . 1 1 98 98 GLN CA C 110 57.660 57.660 56.957 0.703 18522
6844 1 12 . 1 1 98 98 GLN CB C 110 28.720 28.720 28.819 -0.099 18522
6845 1 12 . 1 1 98 98 GLN H H 110 7.985 7.985 8.214 -0.229 18522
6846 1 12 . 1 1 99 99 LEU N N 111 120.490 120.490 122.784 -2.294 18522
6847 1 12 . 1 1 99 99 LEU HA H 111 3.877 3.877 4.096 -0.219 18522
6848 1 12 . 1 1 99 99 LEU C C 111 177.729 177.729 178.317 -0.588 18522
6849 1 12 . 1 1 99 99 LEU CA C 111 57.049 57.049 57.888 -0.839 18522
6850 1 12 . 1 1 99 99 LEU CB C 111 41.466 41.466 41.657 -0.191 18522
6851 1 12 . 1 1 99 99 LEU H H 111 7.994 7.994 8.563 -0.569 18522
6852 1 12 . 1 1 100 100 GLU N N 112 118.251 118.251 118.579 -0.328 18522
6853 1 12 . 1 1 100 100 GLU HA H 112 3.972 3.972 4.161 -0.189 18522
6854 1 12 . 1 1 100 100 GLU C C 112 178.402 178.402 178.952 -0.550 18522
6855 1 12 . 1 1 100 100 GLU CA C 112 59.056 59.056 59.167 -0.111 18522
6856 1 12 . 1 1 100 100 GLU CB C 112 29.732 29.732 29.014 0.718 18522
6857 1 12 . 1 1 100 100 GLU H H 112 7.760 7.760 8.153 -0.393 18522
6858 1 12 . 1 1 101 101 VAL N N 113 117.229 117.229 119.560 -2.331 18522
6859 1 12 . 1 1 101 101 VAL HA H 113 3.762 3.762 4.123 -0.361 18522
6860 1 12 . 1 1 101 101 VAL C C 113 178.107 178.107 178.710 -0.603 18522
6861 1 12 . 1 1 101 101 VAL CA C 113 64.791 64.791 65.335 -0.544 18522
6862 1 12 . 1 1 101 101 VAL CB C 113 32.149 32.149 31.957 0.192 18522
6863 1 12 . 1 1 101 101 VAL H H 113 7.437 7.437 7.364 0.073 18522
6864 1 12 . 1 1 102 102 LEU N N 114 122.124 122.124 119.924 2.200 18522
6865 1 12 . 1 1 102 102 LEU HA H 114 4.033 4.033 4.087 -0.054 18522
6866 1 12 . 1 1 102 102 LEU C C 114 178.506 178.506 178.153 0.353 18522
6867 1 12 . 1 1 102 102 LEU CA C 114 57.243 57.243 57.112 0.131 18522
6868 1 12 . 1 1 102 102 LEU CB C 114 42.028 42.028 41.699 0.329 18522
6869 1 12 . 1 1 102 102 LEU H H 114 7.765 7.765 8.082 -0.317 18522
6870 1 12 . 1 1 103 103 PHE N N 115 115.346 115.346 117.304 -1.958 18522
6871 1 12 . 1 1 103 103 PHE HA H 115 4.224 4.224 4.412 -0.188 18522
6872 1 12 . 1 1 103 103 PHE C C 115 175.621 175.621 175.941 -0.320 18522
6873 1 12 . 1 1 103 103 PHE CA C 115 57.537 57.537 58.161 -0.624 18522
6874 1 12 . 1 1 103 103 PHE CB C 115 38.057 38.057 39.325 -1.268 18522
6875 1 12 . 1 1 103 103 PHE H H 115 7.805 7.805 7.723 0.082 18522
6876 1 12 . 1 1 104 104 GLN N N 116 119.021 119.021 119.352 -0.331 18522
6877 1 12 . 1 1 104 104 GLN HA H 116 4.407 4.407 4.270 0.137 18522
6878 1 12 . 1 1 104 104 GLN C C 116 176.402 176.402 175.783 0.619 18522
6879 1 12 . 1 1 104 104 GLN CA C 116 55.521 55.521 55.868 -0.347 18522
6880 1 12 . 1 1 104 104 GLN CB C 116 29.170 29.170 28.796 0.374 18522
6881 1 12 . 1 1 104 104 GLN H H 116 7.974 7.974 7.487 0.487 18522
6882 1 12 . 1 1 105 105 GLY N N 117 108.868 108.868 107.053 1.815 18522
6883 1 12 . 1 1 105 105 GLY CA C 117 45.124 45.124 44.877 0.247 18522
6884 1 12 . 1 1 105 105 GLY H H 117 8.195 8.195 7.471 0.724 18522
6885 1 12 . 1 1 106 106 PRO HA H 118 4.490 4.490 4.176 0.314 18522
6886 1 12 . 1 1 106 106 PRO C C 118 176.001 176.001 176.809 -0.808 18522
6887 1 12 . 1 1 106 106 PRO CA C 118 63.523 63.523 63.145 0.378 18522
6888 1 12 . 1 1 106 106 PRO CB C 118 32.078 32.078 32.478 -0.400 18522
6889 1 12 . 1 1 107 107 GLN N N 119 126.950 126.950 115.173 11.777 18522
6890 1 12 . 1 1 107 107 GLN C C 119 181.211 181.211 175.162 6.049 18522
6891 1 12 . 1 1 107 107 GLN CA C 119 57.416 57.416 55.983 1.433 18522
6892 1 12 . 1 1 107 107 GLN H H 119 8.079 8.079 8.395 -0.316 18522
6893 1 12 . 1 1 111 111 ARG C C 123 174.608 174.608 175.694 -1.086 18522
6894 1 12 . 1 1 111 111 ARG CA C 123 55.099 55.099 56.509 -1.410 18522
6895 1 12 . 1 1 112 112 HIS N N 124 122.212 122.212 120.135 2.077 18522
6896 1 12 . 1 1 112 112 HIS HA H 124 4.718 4.718 4.802 -0.084 18522
6897 1 12 . 1 1 112 112 HIS C C 124 176.040 176.040 173.789 2.251 18522
6898 1 12 . 1 1 112 112 HIS CA C 124 54.213 54.213 54.337 -0.124 18522
6899 1 12 . 1 1 112 112 HIS CB C 124 31.164 31.164 30.619 0.545 18522
6900 1 12 . 1 1 112 112 HIS H H 124 7.640 7.640 8.156 -0.516 18522
6901 1 12 . 1 1 113 113 TRP C C 125 176.168 176.168 174.361 1.807 18522
6902 1 12 . 1 1 114 114 LEU N N 126 121.893 121.893 123.495 -1.602 18522
6903 1 12 . 1 1 114 114 LEU HA H 126 4.869 4.869 4.773 0.096 18522
6904 1 12 . 1 1 114 114 LEU CA C 126 54.151 54.151 52.959 1.192 18522
6905 1 12 . 1 1 114 114 LEU CB C 126 45.144 45.144 45.579 -0.435 18522
6906 1 12 . 1 1 114 114 LEU H H 126 8.606 8.606 8.446 0.160 18522
6907 1 12 . 1 1 115 115 LYS N N 127 125.850 125.850 119.160 6.690 18522
6908 1 12 . 1 1 115 115 LYS HA H 127 4.203 4.203 4.704 -0.501 18522
6909 1 12 . 1 1 115 115 LYS C C 127 175.564 175.564 174.374 1.190 18522
6910 1 12 . 1 1 115 115 LYS CA C 127 57.252 57.252 55.717 1.535 18522
6911 1 12 . 1 1 115 115 LYS CB C 127 33.406 33.406 35.033 -1.627 18522
6912 1 12 . 1 1 115 115 LYS H H 127 8.647 8.647 8.007 0.640 18522
6913 1 13 . 1 1 3 3 PRO C C 15 177.225 177.225 176.989 0.236 18522
6914 1 13 . 1 1 3 3 PRO CA C 15 63.508 63.508 62.933 0.575 18522
6915 1 13 . 1 1 3 3 PRO CB C 15 32.090 32.090 32.021 0.069 18522
6916 1 13 . 1 1 4 4 GLY N N 16 108.829 108.829 108.886 -0.057 18522
6917 1 13 . 1 1 4 4 GLY C C 16 173.398 173.398 174.417 -1.019 18522
6918 1 13 . 1 1 4 4 GLY CA C 16 45.128 45.128 44.983 0.145 18522
6919 1 13 . 1 1 4 4 GLY H H 16 8.489 8.489 7.921 0.568 18522
6920 1 13 . 1 1 5 5 ILE N N 17 121.763 121.763 116.679 5.084 18522
6921 1 13 . 1 1 5 5 ILE HA H 17 4.554 4.554 4.493 0.061 18522
6922 1 13 . 1 1 5 5 ILE C C 17 174.332 174.332 175.591 -1.259 18522
6923 1 13 . 1 1 5 5 ILE CA C 17 58.245 58.245 59.045 -0.800 18522
6924 1 13 . 1 1 5 5 ILE CB C 17 38.762 38.762 37.567 1.195 18522
6925 1 13 . 1 1 5 5 ILE H H 17 8.014 8.014 7.718 0.296 18522
6926 1 13 . 1 1 6 6 PRO C C 18 176.437 176.437 176.280 0.157 18522
6927 1 13 . 1 1 6 6 PRO CA C 18 62.667 62.667 63.528 -0.861 18522
6928 1 13 . 1 1 6 6 PRO CB C 18 32.469 32.469 31.965 0.504 18522
6929 1 13 . 1 1 7 7 VAL N N 19 123.849 123.849 120.299 3.550 18522
6930 1 13 . 1 1 7 7 VAL HA H 19 4.550 4.550 4.338 0.212 18522
6931 1 13 . 1 1 7 7 VAL C C 19 174.453 174.453 173.967 0.486 18522
6932 1 13 . 1 1 7 7 VAL CA C 19 59.846 59.846 60.057 -0.211 18522
6933 1 13 . 1 1 7 7 VAL CB C 19 33.510 33.510 31.291 2.219 18522
6934 1 13 . 1 1 7 7 VAL H H 19 8.754 8.754 8.114 0.640 18522
6935 1 13 . 1 1 8 8 PRO HA H 20 5.338 5.338 5.006 0.332 18522
6936 1 13 . 1 1 8 8 PRO C C 20 177.585 177.585 176.303 1.282 18522
6937 1 13 . 1 1 8 8 PRO CA C 20 62.406 62.406 61.826 0.580 18522
6938 1 13 . 1 1 8 8 PRO CB C 20 32.891 32.891 32.541 0.349 18522
6939 1 13 . 1 1 9 9 GLY N N 21 108.426 108.426 110.605 -2.179 18522
6940 1 13 . 1 1 9 9 GLY C C 21 171.443 171.443 171.457 -0.014 18522
6941 1 13 . 1 1 9 9 GLY CA C 21 44.581 44.581 44.121 0.460 18522
6942 1 13 . 1 1 9 9 GLY H H 21 8.258 8.258 8.589 -0.331 18522
6943 1 13 . 1 1 10 10 LYS N N 22 117.372 117.372 119.810 -2.438 18522
6944 1 13 . 1 1 10 10 LYS HA H 22 4.039 4.039 5.232 -1.193 18522
6945 1 13 . 1 1 10 10 LYS C C 22 174.463 174.463 174.465 -0.002 18522
6946 1 13 . 1 1 10 10 LYS CA C 22 55.263 55.263 55.493 -0.230 18522
6947 1 13 . 1 1 10 10 LYS CB C 22 35.227 35.227 35.645 -0.418 18522
6948 1 13 . 1 1 10 10 LYS H H 22 8.175 8.175 7.910 0.265 18522
6949 1 13 . 1 1 11 11 VAL N N 23 120.387 120.387 117.891 2.496 18522
6950 1 13 . 1 1 11 11 VAL HA H 23 4.708 4.708 4.518 0.190 18522
6951 1 13 . 1 1 11 11 VAL C C 23 171.873 171.873 174.889 -3.016 18522
6952 1 13 . 1 1 11 11 VAL CA C 23 59.866 59.866 60.207 -0.341 18522
6953 1 13 . 1 1 11 11 VAL CB C 23 35.269 35.269 35.580 -0.311 18522
6954 1 13 . 1 1 11 11 VAL H H 23 8.862 8.862 8.487 0.375 18522
6955 1 13 . 1 1 12 12 THR N N 24 125.797 125.797 120.816 4.981 18522
6956 1 13 . 1 1 12 12 THR HA H 24 5.121 5.121 4.537 0.584 18522
6957 1 13 . 1 1 12 12 THR C C 24 173.407 173.407 173.953 -0.546 18522
6958 1 13 . 1 1 12 12 THR CA C 24 62.115 62.115 61.446 0.669 18522
6959 1 13 . 1 1 12 12 THR CB C 24 69.606 69.606 68.018 1.588 18522
6960 1 13 . 1 1 12 12 THR H H 24 8.859 8.859 8.390 0.469 18522
6961 1 13 . 1 1 13 13 LEU N N 25 127.960 127.960 128.411 -0.451 18522
6962 1 13 . 1 1 13 13 LEU HA H 25 4.809 4.809 4.849 -0.040 18522
6963 1 13 . 1 1 13 13 LEU C C 25 175.029 175.029 175.503 -0.474 18522
6964 1 13 . 1 1 13 13 LEU CA C 25 52.623 52.623 53.172 -0.548 18522
6965 1 13 . 1 1 13 13 LEU CB C 25 46.242 46.242 44.149 2.093 18522
6966 1 13 . 1 1 13 13 LEU H H 25 9.258 9.258 7.933 1.325 18522
6967 1 13 . 1 1 14 14 GLN N N 26 120.858 120.858 115.293 5.565 18522
6968 1 13 . 1 1 14 14 GLN HA H 26 4.482 4.482 4.579 -0.097 18522
6969 1 13 . 1 1 14 14 GLN C C 26 174.515 174.515 174.949 -0.434 18522
6970 1 13 . 1 1 14 14 GLN CA C 26 54.576 54.576 54.317 0.259 18522
6971 1 13 . 1 1 14 14 GLN CB C 26 29.516 29.516 31.738 -2.223 18522
6972 1 13 . 1 1 14 14 GLN H H 26 8.530 8.530 8.249 0.281 18522
6973 1 13 . 1 1 15 15 LYS N N 27 119.583 119.583 121.747 -2.164 18522
6974 1 13 . 1 1 15 15 LYS HA H 27 4.180 4.180 4.298 -0.118 18522
6975 1 13 . 1 1 15 15 LYS C C 27 177.468 177.468 176.964 0.504 18522
6976 1 13 . 1 1 15 15 LYS CA C 27 55.956 55.956 56.964 -1.008 18522
6977 1 13 . 1 1 15 15 LYS CB C 27 34.099 34.099 32.294 1.806 18522
6978 1 13 . 1 1 15 15 LYS H H 27 8.099 8.099 8.269 -0.170 18522
6979 1 13 . 1 1 16 16 ASP N N 28 121.439 121.439 122.833 -1.394 18522
6980 1 13 . 1 1 16 16 ASP HA H 28 4.590 4.590 4.677 -0.087 18522
6981 1 13 . 1 1 16 16 ASP C C 28 178.392 178.392 177.711 0.681 18522
6982 1 13 . 1 1 16 16 ASP CA C 28 52.426 52.426 53.205 -0.779 18522
6983 1 13 . 1 1 16 16 ASP CB C 28 41.377 41.377 42.785 -1.408 18522
6984 1 13 . 1 1 16 16 ASP H H 28 8.888 8.888 8.631 0.257 18522
6985 1 13 . 1 1 17 17 ALA N N 29 119.578 119.578 124.154 -4.576 18522
6986 1 13 . 1 1 17 17 ALA HA H 29 4.188 4.188 4.077 0.111 18522
6987 1 13 . 1 1 17 17 ALA C C 29 178.763 178.763 178.291 0.472 18522
6988 1 13 . 1 1 17 17 ALA CA C 29 54.434 54.434 54.568 -0.134 18522
6989 1 13 . 1 1 17 17 ALA CB C 29 18.293 18.293 18.669 -0.376 18522
6990 1 13 . 1 1 17 17 ALA H H 29 8.392 8.392 8.720 -0.328 18522
6991 1 13 . 1 1 18 18 GLN N N 30 117.564 117.564 116.777 0.787 18522
6992 1 13 . 1 1 18 18 GLN HA H 30 4.399 4.399 4.273 0.126 18522
6993 1 13 . 1 1 18 18 GLN C C 30 175.168 175.168 175.477 -0.309 18522
6994 1 13 . 1 1 18 18 GLN CA C 30 55.339 55.339 55.408 -0.070 18522
6995 1 13 . 1 1 18 18 GLN CB C 30 28.589 28.589 29.319 -0.730 18522
6996 1 13 . 1 1 18 18 GLN H H 30 8.353 8.353 7.910 0.443 18522
6997 1 13 . 1 1 19 19 ASN N N 31 115.365 115.365 116.574 -1.209 18522
6998 1 13 . 1 1 19 19 ASN HA H 31 4.315 4.315 4.405 -0.090 18522
6999 1 13 . 1 1 19 19 ASN C C 31 174.043 174.043 173.137 0.906 18522
7000 1 13 . 1 1 19 19 ASN CA C 31 54.303 54.303 53.915 0.388 18522
7001 1 13 . 1 1 19 19 ASN CB C 31 37.610 37.610 38.128 -0.518 18522
7002 1 13 . 1 1 19 19 ASN H H 31 8.521 8.521 8.159 0.362 18522
7003 1 13 . 1 1 20 20 LEU N N 32 118.660 118.660 110.293 8.367 18522
7004 1 13 . 1 1 20 20 LEU HA H 32 4.900 4.900 4.826 0.074 18522
7005 1 13 . 1 1 20 20 LEU C C 32 178.117 178.117 176.060 2.057 18522
7006 1 13 . 1 1 20 20 LEU CA C 32 53.957 53.957 53.711 0.247 18522
7007 1 13 . 1 1 20 20 LEU CB C 32 44.774 44.774 44.285 0.488 18522
7008 1 13 . 1 1 20 20 LEU H H 32 8.155 8.155 7.347 0.808 18522
7009 1 13 . 1 1 21 21 ILE N N 33 116.785 116.785 116.548 0.237 18522
7010 1 13 . 1 1 21 21 ILE HA H 33 4.674 4.674 4.518 0.156 18522
7011 1 13 . 1 1 21 21 ILE C C 33 176.185 176.185 176.698 -0.513 18522
7012 1 13 . 1 1 21 21 ILE CA C 33 62.602 62.602 61.318 1.284 18522
7013 1 13 . 1 1 21 21 ILE CB C 33 39.016 39.016 39.630 -0.614 18522
7014 1 13 . 1 1 21 21 ILE H H 33 11.488 11.488 8.426 3.062 18522
7015 1 13 . 1 1 22 22 GLY N N 34 111.234 111.234 108.660 2.574 18522
7016 1 13 . 1 1 22 22 GLY C C 34 173.993 173.993 174.256 -0.263 18522
7017 1 13 . 1 1 22 22 GLY CA C 34 45.980 45.980 45.105 0.875 18522
7018 1 13 . 1 1 22 22 GLY H H 34 9.854 9.854 8.543 1.311 18522
7019 1 13 . 1 1 23 23 ILE N N 35 111.117 111.117 113.422 -2.305 18522
7020 1 13 . 1 1 23 23 ILE HA H 35 5.535 5.535 5.199 0.336 18522
7021 1 13 . 1 1 23 23 ILE C C 35 175.033 175.033 173.963 1.070 18522
7022 1 13 . 1 1 23 23 ILE CA C 35 58.415 58.415 58.228 0.187 18522
7023 1 13 . 1 1 23 23 ILE CB C 35 41.577 41.577 42.370 -0.793 18522
7024 1 13 . 1 1 23 23 ILE H H 35 7.835 7.835 7.158 0.677 18522
7025 1 13 . 1 1 24 24 SER N N 36 114.908 114.908 115.771 -0.863 18522
7026 1 13 . 1 1 24 24 SER HA H 36 4.232 4.232 5.207 -0.975 18522
7027 1 13 . 1 1 24 24 SER C C 36 174.735 174.735 173.259 1.476 18522
7028 1 13 . 1 1 24 24 SER CA C 36 56.121 56.121 57.662 -1.541 18522
7029 1 13 . 1 1 24 24 SER CB C 36 66.097 66.097 65.042 1.055 18522
7030 1 13 . 1 1 24 24 SER H H 36 8.623 8.623 8.523 0.100 18522
7031 1 13 . 1 1 25 25 ILE N N 37 117.739 117.739 122.548 -4.809 18522
7032 1 13 . 1 1 25 25 ILE C C 37 174.340 174.340 174.991 -0.651 18522
7033 1 13 . 1 1 25 25 ILE CA C 37 59.123 59.123 58.894 0.229 18522
7034 1 13 . 1 1 25 25 ILE CB C 37 41.637 41.637 42.257 -0.620 18522
7035 1 13 . 1 1 25 25 ILE H H 37 9.130 9.130 7.818 1.312 18522
7036 1 13 . 1 1 26 26 GLY N N 38 108.069 108.069 107.041 1.028 18522
7037 1 13 . 1 1 26 26 GLY CA C 38 44.112 44.112 44.720 -0.608 18522
7038 1 13 . 1 1 26 26 GLY H H 38 8.841 8.841 7.544 1.297 18522
7039 1 13 . 1 1 27 27 GLY N N 39 109.016 109.016 107.059 1.957 18522
7040 1 13 . 1 1 27 27 GLY C C 39 173.956 173.956 174.976 -1.020 18522
7041 1 13 . 1 1 27 27 GLY H H 39 8.187 8.187 8.509 -0.322 18522
7042 1 13 . 1 1 28 28 GLY N N 40 111.783 111.783 111.309 0.474 18522
7043 1 13 . 1 1 28 28 GLY C C 40 174.255 174.255 173.725 0.530 18522
7044 1 13 . 1 1 28 28 GLY CA C 40 47.098 47.098 44.515 2.583 18522
7045 1 13 . 1 1 28 28 GLY H H 40 8.275 8.275 7.818 0.457 18522
7046 1 13 . 1 1 29 29 ALA N N 41 123.128 123.128 122.750 0.378 18522
7047 1 13 . 1 1 29 29 ALA HA H 41 4.559 4.559 4.532 0.027 18522
7048 1 13 . 1 1 29 29 ALA CA C 41 51.073 51.073 50.747 0.326 18522
7049 1 13 . 1 1 29 29 ALA CB C 41 21.926 21.926 20.302 1.624 18522
7050 1 13 . 1 1 29 29 ALA H H 41 8.012 8.012 7.670 0.342 18522
7051 1 13 . 1 1 31 31 TYR HA H 43 4.549 4.549 4.193 0.356 18522
7052 1 13 . 1 1 31 31 TYR CA C 43 57.147 57.147 59.197 -2.050 18522
7053 1 13 . 1 1 31 31 TYR CB C 43 37.495 37.495 38.157 -0.662 18522
7054 1 13 . 1 1 32 32 CYS N N 44 119.332 119.332 114.620 4.712 18522
7055 1 13 . 1 1 32 32 CYS HA H 44 4.859 4.859 4.273 0.586 18522
7056 1 13 . 1 1 32 32 CYS CA C 44 57.406 57.406 57.477 -0.071 18522
7057 1 13 . 1 1 32 32 CYS CB C 44 27.673 27.673 24.655 3.018 18522
7058 1 13 . 1 1 32 32 CYS H H 44 7.504 7.504 7.813 -0.309 18522
7059 1 13 . 1 1 33 33 PRO HA H 45 4.413 4.413 4.472 -0.059 18522
7060 1 13 . 1 1 33 33 PRO CA C 45 64.885 64.885 64.380 0.505 18522
7061 1 13 . 1 1 33 33 PRO CB C 45 32.318 32.318 32.866 -0.548 18522
7062 1 13 . 1 1 34 34 CYS N N 46 117.327 117.327 112.546 4.781 18522
7063 1 13 . 1 1 34 34 CYS C C 46 172.064 172.064 172.778 -0.714 18522
7064 1 13 . 1 1 34 34 CYS CA C 46 60.066 60.066 57.739 2.327 18522
7065 1 13 . 1 1 34 34 CYS CB C 46 28.715 28.715 29.982 -1.267 18522
7066 1 13 . 1 1 34 34 CYS H H 46 7.973 7.973 7.654 0.319 18522
7067 1 13 . 1 1 35 35 LEU N N 47 124.270 124.270 115.541 8.729 18522
7068 1 13 . 1 1 35 35 LEU HA H 47 4.928 4.928 5.042 -0.114 18522
7069 1 13 . 1 1 35 35 LEU C C 47 175.076 175.076 174.579 0.497 18522
7070 1 13 . 1 1 35 35 LEU CA C 47 53.278 53.278 55.698 -2.420 18522
7071 1 13 . 1 1 35 35 LEU CB C 47 44.321 44.321 42.586 1.735 18522
7072 1 13 . 1 1 35 35 LEU H H 47 8.629 8.629 8.412 0.217 18522
7073 1 13 . 1 1 36 36 TYR N N 48 119.326 119.326 119.066 0.260 18522
7074 1 13 . 1 1 36 36 TYR HA H 48 5.255 5.255 5.139 0.116 18522
7075 1 13 . 1 1 36 36 TYR C C 48 175.766 175.766 175.560 0.206 18522
7076 1 13 . 1 1 36 36 TYR CA C 48 56.696 56.696 55.983 0.712 18522
7077 1 13 . 1 1 36 36 TYR CB C 48 42.590 42.590 37.611 4.979 18522
7078 1 13 . 1 1 36 36 TYR H H 48 8.761 8.761 7.047 1.714 18522
7079 1 13 . 1 1 37 37 ILE N N 49 120.259 120.259 125.974 -5.715 18522
7080 1 13 . 1 1 37 37 ILE HA H 49 4.215 4.215 4.186 0.029 18522
7081 1 13 . 1 1 37 37 ILE C C 49 177.429 177.429 175.318 2.111 18522
7082 1 13 . 1 1 37 37 ILE CA C 49 62.456 62.456 60.929 1.526 18522
7083 1 13 . 1 1 37 37 ILE CB C 49 37.352 37.352 38.156 -0.804 18522
7084 1 13 . 1 1 37 37 ILE H H 49 8.959 8.959 8.535 0.424 18522
7085 1 13 . 1 1 38 38 VAL HA H 50 3.937 3.937 4.236 -0.299 18522
7086 1 13 . 1 1 38 38 VAL C C 50 174.408 174.408 175.767 -1.359 18522
7087 1 13 . 1 1 38 38 VAL CA C 50 62.259 62.259 63.919 -1.660 18522
7088 1 13 . 1 1 38 38 VAL CB C 50 31.584 31.584 32.046 -0.462 18522
7089 1 13 . 1 1 39 39 GLN N N 51 116.821 116.821 117.137 -0.316 18522
7090 1 13 . 1 1 39 39 GLN HA H 51 4.103 4.103 4.440 -0.337 18522
7091 1 13 . 1 1 39 39 GLN C C 51 172.856 172.856 172.932 -0.076 18522
7092 1 13 . 1 1 39 39 GLN CA C 51 55.127 55.127 54.999 0.128 18522
7093 1 13 . 1 1 39 39 GLN CB C 51 32.376 32.376 32.433 -0.057 18522
7094 1 13 . 1 1 39 39 GLN H H 51 6.967 6.967 7.740 -0.773 18522
7095 1 13 . 1 1 40 40 VAL N N 52 123.482 123.482 121.725 1.757 18522
7096 1 13 . 1 1 40 40 VAL HA H 52 4.277 4.277 4.569 -0.292 18522
7097 1 13 . 1 1 40 40 VAL C C 52 176.198 176.198 174.339 1.859 18522
7098 1 13 . 1 1 40 40 VAL CA C 52 61.574 61.574 59.553 2.021 18522
7099 1 13 . 1 1 40 40 VAL CB C 52 32.875 32.875 34.608 -1.733 18522
7100 1 13 . 1 1 40 40 VAL H H 52 8.447 8.447 8.107 0.340 18522
7101 1 13 . 1 1 41 41 PHE N N 53 128.296 128.296 123.937 4.359 18522
7102 1 13 . 1 1 41 41 PHE HA H 53 4.400 4.400 4.697 -0.297 18522
7103 1 13 . 1 1 41 41 PHE C C 53 175.299 175.299 175.180 0.119 18522
7104 1 13 . 1 1 41 41 PHE CA C 53 58.494 58.494 58.287 0.207 18522
7105 1 13 . 1 1 41 41 PHE CB C 53 39.561 39.561 39.607 -0.046 18522
7106 1 13 . 1 1 41 41 PHE H H 53 8.707 8.707 8.216 0.491 18522
7107 1 13 . 1 1 42 42 ASP N N 54 122.696 122.696 116.562 6.134 18522
7108 1 13 . 1 1 42 42 ASP HA H 54 4.272 4.272 4.695 -0.423 18522
7109 1 13 . 1 1 42 42 ASP C C 54 176.837 176.837 176.144 0.693 18522
7110 1 13 . 1 1 42 42 ASP CA C 54 55.291 55.291 54.982 0.309 18522
7111 1 13 . 1 1 42 42 ASP CB C 54 41.093 41.093 42.370 -1.277 18522
7112 1 13 . 1 1 42 42 ASP H H 54 8.901 8.901 8.498 0.403 18522
7113 1 13 . 1 1 43 43 ASN N N 55 113.923 113.923 116.658 -2.735 18522
7114 1 13 . 1 1 43 43 ASN HA H 55 4.258 4.258 4.834 -0.576 18522
7115 1 13 . 1 1 43 43 ASN C C 55 173.714 173.714 174.706 -0.992 18522
7116 1 13 . 1 1 43 43 ASN CA C 55 54.958 54.958 53.412 1.546 18522
7117 1 13 . 1 1 43 43 ASN CB C 55 37.150 37.150 39.545 -2.395 18522
7118 1 13 . 1 1 43 43 ASN H H 55 9.319 9.319 8.227 1.092 18522
7119 1 13 . 1 1 44 44 THR N N 56 108.020 108.020 110.328 -2.308 18522
7120 1 13 . 1 1 44 44 THR HA H 56 5.377 5.377 4.809 0.568 18522
7121 1 13 . 1 1 44 44 THR CA C 56 59.712 59.712 58.736 0.976 18522
7122 1 13 . 1 1 44 44 THR CB C 56 69.529 69.529 70.551 -1.022 18522
7123 1 13 . 1 1 44 44 THR H H 56 7.149 7.149 7.545 -0.396 18522
7124 1 13 . 1 1 45 45 PRO HA H 57 4.304 4.304 4.106 0.198 18522
7125 1 13 . 1 1 45 45 PRO C C 57 180.141 180.141 177.892 2.249 18522
7126 1 13 . 1 1 45 45 PRO CA C 57 66.090 66.090 65.612 0.478 18522
7127 1 13 . 1 1 45 45 PRO CB C 57 33.194 33.194 31.497 1.697 18522
7128 1 13 . 1 1 46 46 ALA N N 58 116.854 116.854 119.464 -2.610 18522
7129 1 13 . 1 1 46 46 ALA HA H 58 4.035 4.035 4.020 0.015 18522
7130 1 13 . 1 1 46 46 ALA C C 58 180.647 180.647 179.475 1.172 18522
7131 1 13 . 1 1 46 46 ALA CA C 58 55.195 55.195 55.185 0.010 18522
7132 1 13 . 1 1 46 46 ALA CB C 58 18.880 18.880 18.114 0.765 18522
7133 1 13 . 1 1 46 46 ALA H H 58 8.938 8.938 7.871 1.067 18522
7134 1 13 . 1 1 47 47 ALA N N 59 123.250 123.250 120.895 2.355 18522
7135 1 13 . 1 1 47 47 ALA HA H 59 4.030 4.030 4.074 -0.044 18522
7136 1 13 . 1 1 47 47 ALA C C 59 179.852 179.852 179.844 0.008 18522
7137 1 13 . 1 1 47 47 ALA CA C 59 54.939 54.939 54.666 0.273 18522
7138 1 13 . 1 1 47 47 ALA CB C 59 19.688 19.688 18.815 0.873 18522
7139 1 13 . 1 1 47 47 ALA H H 59 7.658 7.658 7.403 0.255 18522
7140 1 13 . 1 1 48 48 LEU N N 60 118.654 118.654 118.914 -0.260 18522
7141 1 13 . 1 1 48 48 LEU HA H 60 4.026 4.026 4.207 -0.181 18522
7142 1 13 . 1 1 48 48 LEU C C 60 179.238 179.238 178.483 0.755 18522
7143 1 13 . 1 1 48 48 LEU CA C 60 57.261 57.261 58.041 -0.780 18522
7144 1 13 . 1 1 48 48 LEU CB C 60 41.445 41.445 41.419 0.026 18522
7145 1 13 . 1 1 48 48 LEU H H 60 8.636 8.636 8.503 0.133 18522
7146 1 13 . 1 1 49 49 ASP N N 61 117.382 117.382 117.847 -0.465 18522
7147 1 13 . 1 1 49 49 ASP HA H 61 4.421 4.421 4.606 -0.185 18522
7148 1 13 . 1 1 49 49 ASP C C 61 177.668 177.668 177.615 0.053 18522
7149 1 13 . 1 1 49 49 ASP CA C 61 57.087 57.087 53.969 3.118 18522
7150 1 13 . 1 1 49 49 ASP CB C 61 44.478 44.478 41.270 3.208 18522
7151 1 13 . 1 1 49 49 ASP H H 61 7.665 7.665 7.861 -0.196 18522
7152 1 13 . 1 1 50 50 GLY N N 62 103.228 103.228 108.353 -5.125 18522
7153 1 13 . 1 1 50 50 GLY C C 62 174.776 174.776 174.872 -0.096 18522
7154 1 13 . 1 1 50 50 GLY CA C 62 46.533 46.533 46.048 0.485 18522
7155 1 13 . 1 1 50 50 GLY H H 62 7.216 7.216 8.020 -0.804 18522
7156 1 13 . 1 1 51 51 THR N N 63 117.230 117.230 111.577 5.653 18522
7157 1 13 . 1 1 51 51 THR HA H 63 3.907 3.907 3.793 0.114 18522
7158 1 13 . 1 1 51 51 THR C C 63 175.961 175.961 173.891 2.070 18522
7159 1 13 . 1 1 51 51 THR CA C 63 66.478 66.478 63.059 3.419 18522
7160 1 13 . 1 1 51 51 THR CB C 63 68.268 68.268 66.662 1.606 18522
7161 1 13 . 1 1 51 51 THR H H 63 8.319 8.319 7.788 0.531 18522
7162 1 13 . 1 1 52 52 VAL N N 64 113.826 113.826 113.867 -0.041 18522
7163 1 13 . 1 1 52 52 VAL HA H 64 3.950 3.950 4.285 -0.335 18522
7164 1 13 . 1 1 52 52 VAL C C 64 173.883 173.883 174.711 -0.828 18522
7165 1 13 . 1 1 52 52 VAL CA C 64 60.708 60.708 59.830 0.878 18522
7166 1 13 . 1 1 52 52 VAL CB C 64 33.079 33.079 30.965 2.114 18522
7167 1 13 . 1 1 52 52 VAL H H 64 8.147 8.147 7.246 0.901 18522
7168 1 13 . 1 1 53 53 ALA N N 65 123.521 123.521 123.096 0.425 18522
7169 1 13 . 1 1 53 53 ALA HA H 65 4.414 4.414 4.480 -0.066 18522
7170 1 13 . 1 1 53 53 ALA C C 65 175.247 175.247 176.672 -1.425 18522
7171 1 13 . 1 1 53 53 ALA CA C 65 50.440 50.440 50.289 0.151 18522
7172 1 13 . 1 1 53 53 ALA CB C 65 23.266 23.266 20.533 2.733 18522
7173 1 13 . 1 1 53 53 ALA H H 65 8.633 8.633 7.223 1.410 18522
7174 1 13 . 1 1 54 54 ALA N N 66 120.818 120.818 123.052 -2.234 18522
7175 1 13 . 1 1 54 54 ALA HA H 66 3.720 3.720 4.072 -0.352 18522
7176 1 13 . 1 1 54 54 ALA C C 66 178.411 178.411 178.199 0.212 18522
7177 1 13 . 1 1 54 54 ALA CA C 66 53.016 53.016 53.348 -0.332 18522
7178 1 13 . 1 1 54 54 ALA CB C 66 17.840 17.840 17.398 0.442 18522
7179 1 13 . 1 1 54 54 ALA H H 66 8.451 8.451 8.456 -0.005 18522
7180 1 13 . 1 1 55 55 GLY N N 67 112.260 112.260 112.621 -0.361 18522
7181 1 13 . 1 1 55 55 GLY C C 67 173.296 173.296 173.601 -0.305 18522
7182 1 13 . 1 1 55 55 GLY CA C 67 45.025 45.025 44.938 0.087 18522
7183 1 13 . 1 1 55 55 GLY H H 67 9.600 9.600 8.305 1.295 18522
7184 1 13 . 1 1 56 56 ASP N N 68 121.293 121.293 122.492 -1.199 18522
7185 1 13 . 1 1 56 56 ASP HA H 68 4.861 4.861 5.012 -0.151 18522
7186 1 13 . 1 1 56 56 ASP C C 68 174.937 174.937 174.606 0.331 18522
7187 1 13 . 1 1 56 56 ASP CA C 68 55.641 55.641 54.370 1.271 18522
7188 1 13 . 1 1 56 56 ASP CB C 68 40.696 40.696 42.450 -1.754 18522
7189 1 13 . 1 1 56 56 ASP H H 68 8.043 8.043 7.859 0.184 18522
7190 1 13 . 1 1 57 57 GLU N N 69 122.814 122.814 120.744 2.070 18522
7191 1 13 . 1 1 57 57 GLU C C 69 177.202 177.202 176.361 0.841 18522
7192 1 13 . 1 1 57 57 GLU CA C 69 54.472 54.472 54.548 -0.076 18522
7193 1 13 . 1 1 57 57 GLU CB C 69 32.800 32.800 30.523 2.277 18522
7194 1 13 . 1 1 57 57 GLU H H 69 8.455 8.455 9.127 -0.672 18522
7195 1 13 . 1 1 58 58 ILE N N 70 125.862 125.862 128.098 -2.236 18522
7196 1 13 . 1 1 58 58 ILE HA H 70 4.526 4.526 4.395 0.131 18522
7197 1 13 . 1 1 58 58 ILE C C 70 175.035 175.035 176.537 -1.502 18522
7198 1 13 . 1 1 58 58 ILE CA C 70 60.918 60.918 61.913 -0.995 18522
7199 1 13 . 1 1 58 58 ILE CB C 70 39.236 39.236 36.995 2.241 18522
7200 1 13 . 1 1 58 58 ILE H H 70 8.619 8.619 9.210 -0.591 18522
7201 1 13 . 1 1 59 59 THR N N 71 115.507 115.507 123.307 -7.800 18522
7202 1 13 . 1 1 59 59 THR HA H 71 4.513 4.513 4.554 -0.041 18522
7203 1 13 . 1 1 59 59 THR C C 71 176.425 176.425 174.210 2.215 18522
7204 1 13 . 1 1 59 59 THR CA C 71 61.158 61.158 61.777 -0.619 18522
7205 1 13 . 1 1 59 59 THR CB C 71 69.604 69.604 69.678 -0.074 18522
7206 1 13 . 1 1 59 59 THR H H 71 9.242 9.242 9.036 0.206 18522
7207 1 13 . 1 1 60 60 GLY N N 72 111.789 111.789 108.545 3.244 18522
7208 1 13 . 1 1 60 60 GLY C C 72 170.981 170.981 171.822 -0.841 18522
7209 1 13 . 1 1 60 60 GLY CA C 72 46.554 46.554 45.528 1.026 18522
7210 1 13 . 1 1 60 60 GLY H H 72 7.883 7.883 7.683 0.200 18522
7211 1 13 . 1 1 61 61 VAL N N 73 119.277 119.277 118.627 0.650 18522
7212 1 13 . 1 1 61 61 VAL C C 73 175.951 175.951 175.941 0.010 18522
7213 1 13 . 1 1 61 61 VAL CA C 73 60.982 60.982 59.232 1.750 18522
7214 1 13 . 1 1 61 61 VAL CB C 73 36.197 36.197 34.044 2.153 18522
7215 1 13 . 1 1 61 61 VAL H H 73 8.424 8.424 8.551 -0.127 18522
7216 1 13 . 1 1 62 62 ASN N N 74 127.731 127.731 124.198 3.533 18522
7217 1 13 . 1 1 62 62 ASN HA H 74 4.520 4.520 4.283 0.237 18522
7218 1 13 . 1 1 62 62 ASN C C 74 174.878 174.878 175.195 -0.317 18522
7219 1 13 . 1 1 62 62 ASN CA C 74 54.418 54.418 54.381 0.037 18522
7220 1 13 . 1 1 62 62 ASN CB C 74 36.655 36.655 37.779 -1.125 18522
7221 1 13 . 1 1 62 62 ASN H H 74 10.384 10.384 9.118 1.266 18522
7222 1 13 . 1 1 63 63 GLY N N 75 104.633 104.633 103.318 1.315 18522
7223 1 13 . 1 1 63 63 GLY C C 75 173.610 173.610 173.343 0.267 18522
7224 1 13 . 1 1 63 63 GLY CA C 75 45.261 45.261 45.016 0.245 18522
7225 1 13 . 1 1 63 63 GLY H H 75 8.926 8.926 7.930 0.996 18522
7226 1 13 . 1 1 64 64 ARG N N 76 120.451 120.451 120.072 0.379 18522
7227 1 13 . 1 1 64 64 ARG HA H 76 4.501 4.501 4.676 -0.175 18522
7228 1 13 . 1 1 64 64 ARG C C 76 175.085 175.085 174.992 0.093 18522
7229 1 13 . 1 1 64 64 ARG CA C 76 54.252 54.252 53.983 0.269 18522
7230 1 13 . 1 1 64 64 ARG CB C 76 31.482 31.482 32.614 -1.132 18522
7231 1 13 . 1 1 64 64 ARG H H 76 7.753 7.753 8.098 -0.345 18522
7232 1 13 . 1 1 65 65 SER N N 77 116.586 116.586 116.521 0.065 18522
7233 1 13 . 1 1 65 65 SER HA H 77 4.483 4.483 4.617 -0.134 18522
7234 1 13 . 1 1 65 65 SER C C 77 176.953 176.953 176.488 0.465 18522
7235 1 13 . 1 1 65 65 SER CA C 77 58.292 58.292 58.695 -0.403 18522
7236 1 13 . 1 1 65 65 SER CB C 77 63.643 63.643 63.524 0.119 18522
7237 1 13 . 1 1 65 65 SER H H 77 8.555 8.555 8.674 -0.119 18522
7238 1 13 . 1 1 66 66 ILE N N 78 116.618 116.618 120.850 -4.232 18522
7239 1 13 . 1 1 66 66 ILE HA H 78 4.420 4.420 4.224 0.196 18522
7240 1 13 . 1 1 66 66 ILE C C 78 175.072 175.072 176.957 -1.885 18522
7241 1 13 . 1 1 66 66 ILE CA C 78 59.122 59.122 61.731 -2.609 18522
7242 1 13 . 1 1 66 66 ILE CB C 78 36.758 36.758 37.303 -0.545 18522
7243 1 13 . 1 1 66 66 ILE H H 78 7.599 7.599 8.224 -0.625 18522
7244 1 13 . 1 1 67 67 LYS N N 79 123.287 123.287 121.778 1.509 18522
7245 1 13 . 1 1 67 67 LYS HA H 79 4.049 4.049 4.179 -0.130 18522
7246 1 13 . 1 1 67 67 LYS C C 79 178.333 178.333 177.809 0.524 18522
7247 1 13 . 1 1 67 67 LYS CA C 79 58.321 58.321 57.907 0.414 18522
7248 1 13 . 1 1 67 67 LYS CB C 79 31.635 31.635 31.828 -0.193 18522
7249 1 13 . 1 1 67 67 LYS H H 79 7.898 7.898 8.338 -0.440 18522
7250 1 13 . 1 1 68 68 GLY N N 80 114.933 114.933 107.871 7.062 18522
7251 1 13 . 1 1 68 68 GLY C C 80 174.385 174.385 174.620 -0.235 18522
7252 1 13 . 1 1 68 68 GLY CA C 80 45.518 45.518 45.846 -0.328 18522
7253 1 13 . 1 1 68 68 GLY H H 80 8.999 8.999 8.197 0.802 18522
7254 1 13 . 1 1 69 69 LYS N N 81 119.403 119.403 118.815 0.588 18522
7255 1 13 . 1 1 69 69 LYS HA H 81 4.043 4.043 4.648 -0.605 18522
7256 1 13 . 1 1 69 69 LYS C C 81 177.064 177.064 174.720 2.344 18522
7257 1 13 . 1 1 69 69 LYS CA C 81 54.722 54.722 54.904 -0.182 18522
7258 1 13 . 1 1 69 69 LYS CB C 81 33.560 33.560 33.197 0.363 18522
7259 1 13 . 1 1 69 69 LYS H H 81 7.845 7.845 7.914 -0.069 18522
7260 1 13 . 1 1 70 70 THR N N 82 112.066 112.066 114.608 -2.542 18522
7261 1 13 . 1 1 70 70 THR HA H 82 4.666 4.666 4.732 -0.066 18522
7262 1 13 . 1 1 70 70 THR C C 82 175.955 175.955 175.461 0.494 18522
7263 1 13 . 1 1 70 70 THR CA C 82 60.438 60.438 60.681 -0.242 18522
7264 1 13 . 1 1 70 70 THR CB C 82 71.629 71.629 72.292 -0.663 18522
7265 1 13 . 1 1 70 70 THR H H 82 9.153 9.153 8.132 1.021 18522
7266 1 13 . 1 1 71 71 LYS N N 83 118.730 118.730 123.729 -4.999 18522
7267 1 13 . 1 1 71 71 LYS HA H 83 3.870 3.870 3.941 -0.071 18522
7268 1 13 . 1 1 71 71 LYS C C 83 177.464 177.464 178.332 -0.868 18522
7269 1 13 . 1 1 71 71 LYS CA C 83 60.357 60.357 59.886 0.471 18522
7270 1 13 . 1 1 71 71 LYS CB C 83 31.350 31.350 31.615 -0.265 18522
7271 1 13 . 1 1 71 71 LYS H H 83 8.969 8.969 8.707 0.262 18522
7272 1 13 . 1 1 72 72 VAL N N 84 117.444 117.444 118.778 -1.334 18522
7273 1 13 . 1 1 72 72 VAL HA H 84 3.633 3.633 3.722 -0.089 18522
7274 1 13 . 1 1 72 72 VAL C C 84 178.315 178.315 177.608 0.707 18522
7275 1 13 . 1 1 72 72 VAL CA C 84 66.079 66.079 65.473 0.606 18522
7276 1 13 . 1 1 72 72 VAL CB C 84 32.091 32.091 31.614 0.477 18522
7277 1 13 . 1 1 72 72 VAL H H 84 7.631 7.631 8.198 -0.567 18522
7278 1 13 . 1 1 73 73 GLU N N 85 120.890 120.890 119.396 1.494 18522
7279 1 13 . 1 1 73 73 GLU HA H 85 3.964 3.964 4.122 -0.158 18522
7280 1 13 . 1 1 73 73 GLU C C 85 179.971 179.971 178.888 1.083 18522
7281 1 13 . 1 1 73 73 GLU CA C 85 59.316 59.316 59.358 -0.042 18522
7282 1 13 . 1 1 73 73 GLU CB C 85 30.355 30.355 29.718 0.637 18522
7283 1 13 . 1 1 73 73 GLU H H 85 7.617 7.617 7.645 -0.028 18522
7284 1 13 . 1 1 74 74 VAL N N 86 121.246 121.246 118.568 2.678 18522
7285 1 13 . 1 1 74 74 VAL HA H 86 3.630 3.630 3.712 -0.082 18522
7286 1 13 . 1 1 74 74 VAL C C 86 177.217 177.217 177.681 -0.464 18522
7287 1 13 . 1 1 74 74 VAL CA C 86 66.678 66.678 66.028 0.650 18522
7288 1 13 . 1 1 74 74 VAL CB C 86 31.307 31.307 30.755 0.552 18522
7289 1 13 . 1 1 74 74 VAL H H 86 8.368 8.368 8.416 -0.048 18522
7290 1 13 . 1 1 75 75 ALA N N 87 122.148 122.148 122.469 -0.321 18522
7291 1 13 . 1 1 75 75 ALA HA H 87 3.947 3.947 3.908 0.039 18522
7292 1 13 . 1 1 75 75 ALA C C 87 179.545 179.545 179.046 0.499 18522
7293 1 13 . 1 1 75 75 ALA CA C 87 55.851 55.851 55.629 0.223 18522
7294 1 13 . 1 1 75 75 ALA CB C 87 18.491 18.491 18.252 0.239 18522
7295 1 13 . 1 1 75 75 ALA H H 87 8.577 8.577 7.917 0.660 18522
7296 1 13 . 1 1 76 76 LYS N N 88 117.733 117.733 119.251 -1.518 18522
7297 1 13 . 1 1 76 76 LYS HA H 88 4.051 4.051 4.157 -0.106 18522
7298 1 13 . 1 1 76 76 LYS CA C 88 59.393 59.393 58.926 0.467 18522
7299 1 13 . 1 1 76 76 LYS CB C 88 32.058 32.058 32.395 -0.337 18522
7300 1 13 . 1 1 76 76 LYS H H 88 7.854 7.854 7.357 0.497 18522
7301 1 13 . 1 1 77 77 MET N N 89 117.676 117.676 115.960 1.716 18522
7302 1 13 . 1 1 77 77 MET HA H 89 4.048 4.048 4.190 -0.142 18522
7303 1 13 . 1 1 77 77 MET C C 89 178.791 178.791 178.658 0.133 18522
7304 1 13 . 1 1 77 77 MET CA C 89 59.128 59.128 57.970 1.158 18522
7305 1 13 . 1 1 77 77 MET CB C 89 33.801 33.801 32.059 1.742 18522
7306 1 13 . 1 1 77 77 MET H H 89 7.759 7.759 8.286 -0.527 18522
7307 1 13 . 1 1 78 78 ILE N N 90 117.305 117.305 115.950 1.355 18522
7308 1 13 . 1 1 78 78 ILE HA H 90 3.590 3.590 3.937 -0.347 18522
7309 1 13 . 1 1 78 78 ILE C C 90 178.658 178.658 177.687 0.971 18522
7310 1 13 . 1 1 78 78 ILE CA C 90 65.482 65.482 63.065 2.417 18522
7311 1 13 . 1 1 78 78 ILE CB C 90 38.845 38.845 37.576 1.269 18522
7312 1 13 . 1 1 78 78 ILE H H 90 7.972 7.972 7.223 0.749 18522
7313 1 13 . 1 1 79 79 GLN N N 91 120.935 120.935 118.566 2.369 18522
7314 1 13 . 1 1 79 79 GLN HA H 91 3.998 3.998 4.443 -0.445 18522
7315 1 13 . 1 1 79 79 GLN C C 91 178.274 178.274 177.955 0.319 18522
7316 1 13 . 1 1 79 79 GLN CA C 91 59.151 59.151 57.662 1.489 18522
7317 1 13 . 1 1 79 79 GLN CB C 91 28.934 28.934 29.037 -0.103 18522
7318 1 13 . 1 1 79 79 GLN H H 91 8.826 8.826 8.040 0.786 18522
7319 1 13 . 1 1 80 80 GLU N N 92 115.213 115.213 120.910 -5.697 18522
7320 1 13 . 1 1 80 80 GLU HA H 92 4.061 4.061 4.233 -0.172 18522
7321 1 13 . 1 1 80 80 GLU C C 92 176.824 176.824 176.426 0.398 18522
7322 1 13 . 1 1 80 80 GLU CA C 92 58.006 58.006 57.311 0.695 18522
7323 1 13 . 1 1 80 80 GLU CB C 92 29.890 29.890 30.283 -0.393 18522
7324 1 13 . 1 1 80 80 GLU H H 92 8.020 8.020 7.826 0.194 18522
7325 1 13 . 1 1 81 81 VAL N N 93 119.047 119.047 120.396 -1.349 18522
7326 1 13 . 1 1 81 81 VAL HA H 93 3.930 3.930 3.877 0.053 18522
7327 1 13 . 1 1 81 81 VAL C C 93 176.016 176.016 175.714 0.302 18522
7328 1 13 . 1 1 81 81 VAL CA C 93 63.153 63.153 62.972 0.181 18522
7329 1 13 . 1 1 81 81 VAL CB C 93 32.154 32.154 31.760 0.394 18522
7330 1 13 . 1 1 81 81 VAL H H 93 7.073 7.073 7.627 -0.554 18522
7331 1 13 . 1 1 82 82 LYS N N 94 128.366 128.366 128.082 0.284 18522
7332 1 13 . 1 1 82 82 LYS C C 94 177.460 177.460 177.117 0.343 18522
7333 1 13 . 1 1 82 82 LYS CA C 94 55.753 55.753 56.104 -0.351 18522
7334 1 13 . 1 1 82 82 LYS CB C 94 32.332 32.332 30.482 1.850 18522
7335 1 13 . 1 1 82 82 LYS H H 94 8.762 8.762 8.658 0.104 18522
7336 1 13 . 1 1 83 83 GLY N N 95 112.528 112.528 111.065 1.463 18522
7337 1 13 . 1 1 83 83 GLY C C 95 173.468 173.468 173.405 0.063 18522
7338 1 13 . 1 1 83 83 GLY CA C 95 46.243 46.243 45.367 0.876 18522
7339 1 13 . 1 1 83 83 GLY H H 95 8.673 8.673 8.185 0.488 18522
7340 1 13 . 1 1 84 84 GLU N N 96 121.485 121.485 119.274 2.211 18522
7341 1 13 . 1 1 84 84 GLU HA H 96 4.749 4.749 4.642 0.107 18522
7342 1 13 . 1 1 84 84 GLU C C 96 174.583 174.583 174.413 0.170 18522
7343 1 13 . 1 1 84 84 GLU CA C 96 55.821 55.821 54.745 1.076 18522
7344 1 13 . 1 1 84 84 GLU CB C 96 31.410 31.410 33.104 -1.694 18522
7345 1 13 . 1 1 84 84 GLU H H 96 8.297 8.297 7.676 0.621 18522
7346 1 13 . 1 1 85 85 VAL N N 97 120.501 120.501 112.946 7.555 18522
7347 1 13 . 1 1 85 85 VAL HA H 97 4.665 4.665 4.616 0.049 18522
7348 1 13 . 1 1 85 85 VAL C C 97 173.047 173.047 173.955 -0.908 18522
7349 1 13 . 1 1 85 85 VAL CA C 97 60.114 60.114 60.178 -0.064 18522
7350 1 13 . 1 1 85 85 VAL CB C 97 35.184 35.184 35.532 -0.348 18522
7351 1 13 . 1 1 85 85 VAL H H 97 9.096 9.096 8.027 1.069 18522
7352 1 13 . 1 1 86 86 THR N N 98 125.019 125.019 114.493 10.526 18522
7353 1 13 . 1 1 86 86 THR HA H 98 4.076 4.076 4.948 -0.872 18522
7354 1 13 . 1 1 86 86 THR C C 98 173.807 173.807 173.966 -0.159 18522
7355 1 13 . 1 1 86 86 THR CA C 98 61.735 61.735 60.492 1.243 18522
7356 1 13 . 1 1 86 86 THR CB C 98 69.531 69.531 70.837 -1.306 18522
7357 1 13 . 1 1 86 86 THR H H 98 9.352 9.352 8.118 1.234 18522
7358 1 13 . 1 1 87 87 ILE N N 99 128.383 128.383 122.607 5.776 18522
7359 1 13 . 1 1 87 87 ILE HA H 99 4.661 4.661 4.824 -0.163 18522
7360 1 13 . 1 1 87 87 ILE C C 99 174.614 174.614 174.370 0.244 18522
7361 1 13 . 1 1 87 87 ILE CA C 99 58.258 58.258 59.126 -0.868 18522
7362 1 13 . 1 1 87 87 ILE CB C 99 38.528 38.528 38.340 0.188 18522
7363 1 13 . 1 1 87 87 ILE H H 99 9.329 9.329 8.392 0.937 18522
7364 1 13 . 1 1 88 88 HIS N N 100 128.279 128.279 127.479 0.800 18522
7365 1 13 . 1 1 88 88 HIS HA H 100 4.948 4.948 5.139 -0.191 18522
7366 1 13 . 1 1 88 88 HIS C C 100 174.787 174.787 174.845 -0.058 18522
7367 1 13 . 1 1 88 88 HIS CA C 100 54.620 54.620 54.551 0.069 18522
7368 1 13 . 1 1 88 88 HIS H H 100 8.647 8.647 8.588 0.059 18522
7369 1 13 . 1 1 89 89 TYR N N 101 121.320 121.320 121.815 -0.495 18522
7370 1 13 . 1 1 89 89 TYR HA H 101 5.947 5.947 5.515 0.432 18522
7371 1 13 . 1 1 89 89 TYR C C 101 173.769 173.769 173.009 0.760 18522
7372 1 13 . 1 1 89 89 TYR CA C 101 55.669 55.669 56.030 -0.361 18522
7373 1 13 . 1 1 89 89 TYR CB C 101 42.195 42.195 40.896 1.299 18522
7374 1 13 . 1 1 89 89 TYR H H 101 8.414 8.414 9.073 -0.659 18522
7375 1 13 . 1 1 90 90 ASN N N 102 116.679 116.679 116.930 -0.251 18522
7376 1 13 . 1 1 90 90 ASN HA H 102 5.335 5.335 5.395 -0.060 18522
7377 1 13 . 1 1 90 90 ASN C C 102 175.406 175.406 174.027 1.379 18522
7378 1 13 . 1 1 90 90 ASN CA C 102 51.961 51.961 51.904 0.057 18522
7379 1 13 . 1 1 90 90 ASN CB C 102 41.800 41.800 43.705 -1.905 18522
7380 1 13 . 1 1 90 90 ASN H H 102 9.282 9.282 9.087 0.195 18522
7381 1 13 . 1 1 91 91 LYS N N 103 124.129 124.129 120.490 3.639 18522
7382 1 13 . 1 1 91 91 LYS C C 103 176.678 176.678 175.983 0.695 18522
7383 1 13 . 1 1 91 91 LYS CA C 103 55.006 55.006 55.239 -0.233 18522
7384 1 13 . 1 1 91 91 LYS H H 103 8.949 8.949 8.456 0.493 18522
7385 1 13 . 1 1 92 92 LEU N N 104 127.043 127.043 120.520 6.523 18522
7386 1 13 . 1 1 92 92 LEU HA H 104 4.425 4.425 3.934 0.491 18522
7387 1 13 . 1 1 92 92 LEU CA C 104 55.060 55.060 56.222 -1.162 18522
7388 1 13 . 1 1 92 92 LEU CB C 104 42.559 42.559 41.153 1.406 18522
7389 1 13 . 1 1 92 92 LEU H H 104 9.150 9.150 8.746 0.404 18522
7390 1 13 . 1 1 93 93 GLN HA H 105 4.315 4.315 4.560 -0.245 18522
7391 1 13 . 1 1 93 93 GLN C C 105 175.070 175.070 174.135 0.935 18522
7392 1 13 . 1 1 93 93 GLN CA C 105 55.490 55.490 55.694 -0.204 18522
7393 1 13 . 1 1 93 93 GLN CB C 105 28.909 28.909 30.090 -1.181 18522
7394 1 13 . 1 1 94 94 ALA N N 106 125.133 125.133 122.203 2.930 18522
7395 1 13 . 1 1 94 94 ALA HA H 106 4.366 4.366 4.528 -0.162 18522
7396 1 13 . 1 1 94 94 ALA C C 106 176.392 176.392 175.366 1.026 18522
7397 1 13 . 1 1 94 94 ALA CA C 106 51.723 51.723 52.030 -0.307 18522
7398 1 13 . 1 1 94 94 ALA CB C 106 20.185 20.185 20.211 -0.026 18522
7399 1 13 . 1 1 94 94 ALA H H 106 8.226 8.226 7.667 0.559 18522
7400 1 13 . 1 1 95 95 ASP N N 107 122.013 122.013 119.960 2.053 18522
7401 1 13 . 1 1 95 95 ASP HA H 107 4.413 4.413 5.055 -0.642 18522
7402 1 13 . 1 1 95 95 ASP C C 107 175.019 175.019 175.284 -0.265 18522
7403 1 13 . 1 1 95 95 ASP CA C 107 55.642 55.642 52.258 3.385 18522
7404 1 13 . 1 1 95 95 ASP CB C 107 41.266 41.266 41.705 -0.439 18522
7405 1 13 . 1 1 95 95 ASP H H 107 8.429 8.429 8.340 0.089 18522
7406 1 13 . 1 1 96 96 PRO HA H 108 4.207 4.207 3.999 0.208 18522
7407 1 13 . 1 1 96 96 PRO C C 108 178.840 178.840 178.062 0.778 18522
7408 1 13 . 1 1 96 96 PRO CA C 108 65.396 65.396 66.141 -0.745 18522
7409 1 13 . 1 1 96 96 PRO CB C 108 32.181 32.181 31.855 0.326 18522
7410 1 13 . 1 1 97 97 LYS N N 109 117.942 117.942 115.261 2.681 18522
7411 1 13 . 1 1 97 97 LYS HA H 109 4.143 4.143 4.010 0.133 18522
7412 1 13 . 1 1 97 97 LYS C C 109 178.099 178.099 178.907 -0.808 18522
7413 1 13 . 1 1 97 97 LYS CA C 109 58.167 58.167 59.246 -1.079 18522
7414 1 13 . 1 1 97 97 LYS CB C 109 31.649 31.649 31.338 0.311 18522
7415 1 13 . 1 1 97 97 LYS H H 109 8.335 8.335 8.399 -0.064 18522
7416 1 13 . 1 1 98 98 GLN N N 110 119.159 119.159 118.037 1.122 18522
7417 1 13 . 1 1 98 98 GLN HA H 110 4.130 4.130 4.212 -0.082 18522
7418 1 13 . 1 1 98 98 GLN C C 110 178.298 178.298 178.144 0.154 18522
7419 1 13 . 1 1 98 98 GLN CA C 110 57.660 57.660 57.401 0.259 18522
7420 1 13 . 1 1 98 98 GLN CB C 110 28.720 28.720 28.251 0.469 18522
7421 1 13 . 1 1 98 98 GLN H H 110 7.985 7.985 7.986 -0.001 18522
7422 1 13 . 1 1 99 99 LEU N N 111 120.490 120.490 121.248 -0.758 18522
7423 1 13 . 1 1 99 99 LEU HA H 111 3.877 3.877 4.400 -0.523 18522
7424 1 13 . 1 1 99 99 LEU C C 111 177.729 177.729 178.104 -0.375 18522
7425 1 13 . 1 1 99 99 LEU CA C 111 57.049 57.049 57.249 -0.200 18522
7426 1 13 . 1 1 99 99 LEU CB C 111 41.466 41.466 42.107 -0.641 18522
7427 1 13 . 1 1 99 99 LEU H H 111 7.994 7.994 8.189 -0.195 18522
7428 1 13 . 1 1 100 100 GLU N N 112 118.251 118.251 118.698 -0.447 18522
7429 1 13 . 1 1 100 100 GLU HA H 112 3.972 3.972 4.007 -0.035 18522
7430 1 13 . 1 1 100 100 GLU C C 112 178.402 178.402 178.389 0.013 18522
7431 1 13 . 1 1 100 100 GLU CA C 112 59.056 59.056 59.155 -0.099 18522
7432 1 13 . 1 1 100 100 GLU CB C 112 29.732 29.732 29.132 0.600 18522
7433 1 13 . 1 1 100 100 GLU H H 112 7.760 7.760 8.177 -0.417 18522
7434 1 13 . 1 1 101 101 VAL N N 113 117.229 117.229 119.677 -2.448 18522
7435 1 13 . 1 1 101 101 VAL HA H 113 3.762 3.762 3.874 -0.112 18522
7436 1 13 . 1 1 101 101 VAL C C 113 178.107 178.107 178.011 0.096 18522
7437 1 13 . 1 1 101 101 VAL CA C 113 64.791 64.791 65.113 -0.322 18522
7438 1 13 . 1 1 101 101 VAL CB C 113 32.149 32.149 31.919 0.230 18522
7439 1 13 . 1 1 101 101 VAL H H 113 7.437 7.437 7.611 -0.174 18522
7440 1 13 . 1 1 102 102 LEU N N 114 122.124 122.124 120.423 1.701 18522
7441 1 13 . 1 1 102 102 LEU HA H 114 4.033 4.033 4.197 -0.164 18522
7442 1 13 . 1 1 102 102 LEU C C 114 178.506 178.506 177.539 0.967 18522
7443 1 13 . 1 1 102 102 LEU CA C 114 57.243 57.243 56.923 0.320 18522
7444 1 13 . 1 1 102 102 LEU CB C 114 42.028 42.028 40.763 1.265 18522
7445 1 13 . 1 1 102 102 LEU H H 114 7.765 7.765 7.423 0.342 18522
7446 1 13 . 1 1 103 103 PHE N N 115 115.346 115.346 117.116 -1.770 18522
7447 1 13 . 1 1 103 103 PHE HA H 115 4.224 4.224 4.074 0.150 18522
7448 1 13 . 1 1 103 103 PHE C C 115 175.621 175.621 176.314 -0.693 18522
7449 1 13 . 1 1 103 103 PHE CA C 115 57.537 57.537 58.200 -0.663 18522
7450 1 13 . 1 1 103 103 PHE CB C 115 38.057 38.057 39.269 -1.212 18522
7451 1 13 . 1 1 103 103 PHE H H 115 7.805 7.805 7.621 0.184 18522
7452 1 13 . 1 1 104 104 GLN N N 116 119.021 119.021 119.216 -0.195 18522
7453 1 13 . 1 1 104 104 GLN HA H 116 4.407 4.407 4.179 0.228 18522
7454 1 13 . 1 1 104 104 GLN C C 116 176.402 176.402 175.386 1.016 18522
7455 1 13 . 1 1 104 104 GLN CA C 116 55.521 55.521 56.206 -0.685 18522
7456 1 13 . 1 1 104 104 GLN CB C 116 29.170 29.170 26.857 2.313 18522
7457 1 13 . 1 1 104 104 GLN H H 116 7.974 7.974 7.462 0.512 18522
7458 1 13 . 1 1 105 105 GLY N N 117 108.868 108.868 107.133 1.735 18522
7459 1 13 . 1 1 105 105 GLY CA C 117 45.124 45.124 45.830 -0.706 18522
7460 1 13 . 1 1 105 105 GLY H H 117 8.195 8.195 8.090 0.105 18522
7461 1 13 . 1 1 106 106 PRO HA H 118 4.490 4.490 4.120 0.370 18522
7462 1 13 . 1 1 106 106 PRO C C 118 176.001 176.001 176.418 -0.417 18522
7463 1 13 . 1 1 106 106 PRO CA C 118 63.523 63.523 64.919 -1.396 18522
7464 1 13 . 1 1 106 106 PRO CB C 118 32.078 32.078 30.218 1.861 18522
7465 1 13 . 1 1 107 107 GLN N N 119 126.950 126.950 116.142 10.808 18522
7466 1 13 . 1 1 107 107 GLN C C 119 181.211 181.211 176.708 4.503 18522
7467 1 13 . 1 1 107 107 GLN CA C 119 57.416 57.416 58.199 -0.783 18522
7468 1 13 . 1 1 107 107 GLN H H 119 8.079 8.079 8.335 -0.256 18522
7469 1 13 . 1 1 111 111 ARG C C 123 174.608 174.608 176.439 -1.831 18522
7470 1 13 . 1 1 111 111 ARG CA C 123 55.099 55.099 58.157 -3.058 18522
7471 1 13 . 1 1 112 112 HIS N N 124 122.212 122.212 120.567 1.645 18522
7472 1 13 . 1 1 112 112 HIS HA H 124 4.718 4.718 4.415 0.303 18522
7473 1 13 . 1 1 112 112 HIS C C 124 176.040 176.040 174.039 2.001 18522
7474 1 13 . 1 1 112 112 HIS CA C 124 54.213 54.213 54.355 -0.142 18522
7475 1 13 . 1 1 112 112 HIS CB C 124 31.164 31.164 28.215 2.949 18522
7476 1 13 . 1 1 112 112 HIS H H 124 7.640 7.640 8.322 -0.682 18522
7477 1 13 . 1 1 113 113 TRP C C 125 176.168 176.168 175.174 0.994 18522
7478 1 13 . 1 1 114 114 LEU N N 126 121.893 121.893 122.410 -0.517 18522
7479 1 13 . 1 1 114 114 LEU HA H 126 4.869 4.869 4.641 0.228 18522
7480 1 13 . 1 1 114 114 LEU CA C 126 54.151 54.151 54.536 -0.385 18522
7481 1 13 . 1 1 114 114 LEU CB C 126 45.144 45.144 43.464 1.680 18522
7482 1 13 . 1 1 114 114 LEU H H 126 8.606 8.606 8.798 -0.192 18522
7483 1 13 . 1 1 115 115 LYS N N 127 125.850 125.850 124.341 1.509 18522
7484 1 13 . 1 1 115 115 LYS HA H 127 4.203 4.203 5.100 -0.897 18522
7485 1 13 . 1 1 115 115 LYS C C 127 175.564 175.564 174.448 1.116 18522
7486 1 13 . 1 1 115 115 LYS CA C 127 57.252 57.252 55.162 2.090 18522
7487 1 13 . 1 1 115 115 LYS CB C 127 33.406 33.406 35.232 -1.826 18522
7488 1 13 . 1 1 115 115 LYS H H 127 8.647 8.647 8.320 0.327 18522
7489 1 14 . 1 1 3 3 PRO C C 15 177.225 177.225 176.288 0.937 18522
7490 1 14 . 1 1 3 3 PRO CA C 15 63.508 63.508 63.361 0.147 18522
7491 1 14 . 1 1 3 3 PRO CB C 15 32.090 32.090 32.262 -0.172 18522
7492 1 14 . 1 1 4 4 GLY N N 16 108.829 108.829 106.824 2.005 18522
7493 1 14 . 1 1 4 4 GLY C C 16 173.398 173.398 172.808 0.590 18522
7494 1 14 . 1 1 4 4 GLY CA C 16 45.128 45.128 44.803 0.325 18522
7495 1 14 . 1 1 4 4 GLY H H 16 8.489 8.489 8.094 0.395 18522
7496 1 14 . 1 1 5 5 ILE N N 17 121.763 121.763 119.859 1.904 18522
7497 1 14 . 1 1 5 5 ILE HA H 17 4.554 4.554 4.852 -0.298 18522
7498 1 14 . 1 1 5 5 ILE C C 17 174.332 174.332 174.472 -0.140 18522
7499 1 14 . 1 1 5 5 ILE CA C 17 58.245 58.245 57.802 0.443 18522
7500 1 14 . 1 1 5 5 ILE CB C 17 38.762 38.762 38.742 0.020 18522
7501 1 14 . 1 1 5 5 ILE H H 17 8.014 8.014 8.062 -0.047 18522
7502 1 14 . 1 1 6 6 PRO C C 18 176.437 176.437 175.576 0.861 18522
7503 1 14 . 1 1 6 6 PRO CA C 18 62.667 62.667 64.524 -1.857 18522
7504 1 14 . 1 1 6 6 PRO CB C 18 32.469 32.469 31.971 0.498 18522
7505 1 14 . 1 1 7 7 VAL N N 19 123.849 123.849 115.599 8.250 18522
7506 1 14 . 1 1 7 7 VAL HA H 19 4.550 4.550 4.611 -0.061 18522
7507 1 14 . 1 1 7 7 VAL C C 19 174.453 174.453 173.426 1.027 18522
7508 1 14 . 1 1 7 7 VAL CA C 19 59.846 59.846 58.391 1.455 18522
7509 1 14 . 1 1 7 7 VAL CB C 19 33.510 33.510 33.202 0.308 18522
7510 1 14 . 1 1 7 7 VAL H H 19 8.754 8.754 7.594 1.160 18522
7511 1 14 . 1 1 8 8 PRO HA H 20 5.338 5.338 5.420 -0.082 18522
7512 1 14 . 1 1 8 8 PRO C C 20 177.585 177.585 177.015 0.570 18522
7513 1 14 . 1 1 8 8 PRO CA C 20 62.406 62.406 62.016 0.390 18522
7514 1 14 . 1 1 8 8 PRO CB C 20 32.891 32.891 31.225 1.666 18522
7515 1 14 . 1 1 9 9 GLY N N 21 108.426 108.426 112.879 -4.453 18522
7516 1 14 . 1 1 9 9 GLY C C 21 171.443 171.443 171.628 -0.185 18522
7517 1 14 . 1 1 9 9 GLY CA C 21 44.581 44.581 43.257 1.324 18522
7518 1 14 . 1 1 9 9 GLY H H 21 8.258 8.258 8.823 -0.565 18522
7519 1 14 . 1 1 10 10 LYS N N 22 117.372 117.372 121.344 -3.972 18522
7520 1 14 . 1 1 10 10 LYS HA H 22 4.039 4.039 5.254 -1.215 18522
7521 1 14 . 1 1 10 10 LYS C C 22 174.463 174.463 174.338 0.125 18522
7522 1 14 . 1 1 10 10 LYS CA C 22 55.263 55.263 54.038 1.225 18522
7523 1 14 . 1 1 10 10 LYS CB C 22 35.227 35.227 35.028 0.199 18522
7524 1 14 . 1 1 10 10 LYS H H 22 8.175 8.175 7.893 0.282 18522
7525 1 14 . 1 1 11 11 VAL N N 23 120.387 120.387 121.996 -1.609 18522
7526 1 14 . 1 1 11 11 VAL HA H 23 4.708 4.708 4.429 0.279 18522
7527 1 14 . 1 1 11 11 VAL C C 23 171.873 171.873 173.859 -1.986 18522
7528 1 14 . 1 1 11 11 VAL CA C 23 59.866 59.866 60.826 -0.960 18522
7529 1 14 . 1 1 11 11 VAL CB C 23 35.269 35.269 36.209 -0.940 18522
7530 1 14 . 1 1 11 11 VAL H H 23 8.862 8.862 8.603 0.259 18522
7531 1 14 . 1 1 12 12 THR N N 24 125.797 125.797 122.285 3.512 18522
7532 1 14 . 1 1 12 12 THR HA H 24 5.121 5.121 4.954 0.167 18522
7533 1 14 . 1 1 12 12 THR C C 24 173.407 173.407 173.189 0.218 18522
7534 1 14 . 1 1 12 12 THR CA C 24 62.115 62.115 60.277 1.838 18522
7535 1 14 . 1 1 12 12 THR CB C 24 69.606 69.606 69.576 0.030 18522
7536 1 14 . 1 1 12 12 THR H H 24 8.859 8.859 8.320 0.539 18522
7537 1 14 . 1 1 13 13 LEU N N 25 127.960 127.960 126.843 1.117 18522
7538 1 14 . 1 1 13 13 LEU HA H 25 4.809 4.809 4.868 -0.059 18522
7539 1 14 . 1 1 13 13 LEU C C 25 175.029 175.029 175.140 -0.111 18522
7540 1 14 . 1 1 13 13 LEU CA C 25 52.623 52.623 52.554 0.069 18522
7541 1 14 . 1 1 13 13 LEU CB C 25 46.242 46.242 45.332 0.910 18522
7542 1 14 . 1 1 13 13 LEU H H 25 9.258 9.258 8.358 0.900 18522
7543 1 14 . 1 1 14 14 GLN N N 26 120.858 120.858 117.319 3.539 18522
7544 1 14 . 1 1 14 14 GLN HA H 26 4.482 4.482 4.580 -0.098 18522
7545 1 14 . 1 1 14 14 GLN C C 26 174.515 174.515 175.431 -0.916 18522
7546 1 14 . 1 1 14 14 GLN CA C 26 54.576 54.576 54.082 0.494 18522
7547 1 14 . 1 1 14 14 GLN CB C 26 29.516 29.516 31.824 -2.308 18522
7548 1 14 . 1 1 14 14 GLN H H 26 8.530 8.530 8.344 0.186 18522
7549 1 14 . 1 1 15 15 LYS N N 27 119.583 119.583 121.404 -1.821 18522
7550 1 14 . 1 1 15 15 LYS HA H 27 4.180 4.180 4.295 -0.115 18522
7551 1 14 . 1 1 15 15 LYS C C 27 177.468 177.468 176.848 0.620 18522
7552 1 14 . 1 1 15 15 LYS CA C 27 55.956 55.956 56.712 -0.756 18522
7553 1 14 . 1 1 15 15 LYS CB C 27 34.099 34.099 32.296 1.803 18522
7554 1 14 . 1 1 15 15 LYS H H 27 8.099 8.099 8.269 -0.170 18522
7555 1 14 . 1 1 16 16 ASP N N 28 121.439 121.439 122.571 -1.132 18522
7556 1 14 . 1 1 16 16 ASP HA H 28 4.590 4.590 4.564 0.026 18522
7557 1 14 . 1 1 16 16 ASP C C 28 178.392 178.392 177.931 0.461 18522
7558 1 14 . 1 1 16 16 ASP CA C 28 52.426 52.426 53.999 -1.573 18522
7559 1 14 . 1 1 16 16 ASP CB C 28 41.377 41.377 42.464 -1.087 18522
7560 1 14 . 1 1 16 16 ASP H H 28 8.888 8.888 8.656 0.232 18522
7561 1 14 . 1 1 17 17 ALA N N 29 119.578 119.578 123.637 -4.059 18522
7562 1 14 . 1 1 17 17 ALA HA H 29 4.188 4.188 4.090 0.098 18522
7563 1 14 . 1 1 17 17 ALA C C 29 178.763 178.763 178.281 0.482 18522
7564 1 14 . 1 1 17 17 ALA CA C 29 54.434 54.434 54.481 -0.048 18522
7565 1 14 . 1 1 17 17 ALA CB C 29 18.293 18.293 18.750 -0.457 18522
7566 1 14 . 1 1 17 17 ALA H H 29 8.392 8.392 8.638 -0.246 18522
7567 1 14 . 1 1 18 18 GLN N N 30 117.564 117.564 117.815 -0.251 18522
7568 1 14 . 1 1 18 18 GLN HA H 30 4.399 4.399 4.380 0.019 18522
7569 1 14 . 1 1 18 18 GLN C C 30 175.168 175.168 175.433 -0.265 18522
7570 1 14 . 1 1 18 18 GLN CA C 30 55.339 55.339 54.894 0.445 18522
7571 1 14 . 1 1 18 18 GLN CB C 30 28.589 28.589 29.100 -0.511 18522
7572 1 14 . 1 1 18 18 GLN H H 30 8.353 8.353 7.897 0.456 18522
7573 1 14 . 1 1 19 19 ASN N N 31 115.365 115.365 115.103 0.262 18522
7574 1 14 . 1 1 19 19 ASN HA H 31 4.315 4.315 4.361 -0.046 18522
7575 1 14 . 1 1 19 19 ASN C C 31 174.043 174.043 173.149 0.894 18522
7576 1 14 . 1 1 19 19 ASN CA C 31 54.303 54.303 54.814 -0.511 18522
7577 1 14 . 1 1 19 19 ASN CB C 31 37.610 37.610 37.500 0.110 18522
7578 1 14 . 1 1 19 19 ASN H H 31 8.521 8.521 8.268 0.253 18522
7579 1 14 . 1 1 20 20 LEU N N 32 118.660 118.660 111.488 7.172 18522
7580 1 14 . 1 1 20 20 LEU HA H 32 4.900 4.900 4.937 -0.037 18522
7581 1 14 . 1 1 20 20 LEU C C 32 178.117 178.117 177.465 0.652 18522
7582 1 14 . 1 1 20 20 LEU CA C 32 53.957 53.957 53.223 0.734 18522
7583 1 14 . 1 1 20 20 LEU CB C 32 44.774 44.774 43.739 1.035 18522
7584 1 14 . 1 1 20 20 LEU H H 32 8.155 8.155 7.298 0.857 18522
7585 1 14 . 1 1 21 21 ILE N N 33 116.785 116.785 115.596 1.189 18522
7586 1 14 . 1 1 21 21 ILE HA H 33 4.674 4.674 4.456 0.218 18522
7587 1 14 . 1 1 21 21 ILE C C 33 176.185 176.185 176.526 -0.341 18522
7588 1 14 . 1 1 21 21 ILE CA C 33 62.602 62.602 61.209 1.393 18522
7589 1 14 . 1 1 21 21 ILE CB C 33 39.016 39.016 39.666 -0.650 18522
7590 1 14 . 1 1 21 21 ILE H H 33 11.488 11.488 8.297 3.191 18522
7591 1 14 . 1 1 22 22 GLY N N 34 111.234 111.234 108.474 2.760 18522
7592 1 14 . 1 1 22 22 GLY C C 34 173.993 173.993 174.259 -0.266 18522
7593 1 14 . 1 1 22 22 GLY CA C 34 45.980 45.980 45.113 0.867 18522
7594 1 14 . 1 1 22 22 GLY H H 34 9.854 9.854 8.530 1.324 18522
7595 1 14 . 1 1 23 23 ILE N N 35 111.117 111.117 113.323 -2.206 18522
7596 1 14 . 1 1 23 23 ILE HA H 35 5.535 5.535 5.323 0.212 18522
7597 1 14 . 1 1 23 23 ILE C C 35 175.033 175.033 173.935 1.098 18522
7598 1 14 . 1 1 23 23 ILE CA C 35 58.415 58.415 58.036 0.379 18522
7599 1 14 . 1 1 23 23 ILE CB C 35 41.577 41.577 42.508 -0.931 18522
7600 1 14 . 1 1 23 23 ILE H H 35 7.835 7.835 7.086 0.749 18522
7601 1 14 . 1 1 24 24 SER N N 36 114.908 114.908 115.436 -0.528 18522
7602 1 14 . 1 1 24 24 SER HA H 36 4.232 4.232 5.284 -1.052 18522
7603 1 14 . 1 1 24 24 SER C C 36 174.735 174.735 172.756 1.979 18522
7604 1 14 . 1 1 24 24 SER CA C 36 56.121 56.121 57.337 -1.216 18522
7605 1 14 . 1 1 24 24 SER CB C 36 66.097 66.097 65.290 0.807 18522
7606 1 14 . 1 1 24 24 SER H H 36 8.623 8.623 8.333 0.290 18522
7607 1 14 . 1 1 25 25 ILE N N 37 117.739 117.739 125.427 -7.688 18522
7608 1 14 . 1 1 25 25 ILE C C 37 174.340 174.340 174.719 -0.379 18522
7609 1 14 . 1 1 25 25 ILE CA C 37 59.123 59.123 59.932 -0.809 18522
7610 1 14 . 1 1 25 25 ILE CB C 37 41.637 41.637 42.239 -0.602 18522
7611 1 14 . 1 1 25 25 ILE H H 37 9.130 9.130 8.406 0.724 18522
7612 1 14 . 1 1 26 26 GLY N N 38 108.069 108.069 113.989 -5.920 18522
7613 1 14 . 1 1 26 26 GLY CA C 38 44.112 44.112 44.865 -0.753 18522
7614 1 14 . 1 1 26 26 GLY H H 38 8.841 8.841 9.098 -0.257 18522
7615 1 14 . 1 1 27 27 GLY N N 39 109.016 109.016 109.059 -0.043 18522
7616 1 14 . 1 1 27 27 GLY C C 39 173.956 173.956 174.457 -0.501 18522
7617 1 14 . 1 1 27 27 GLY H H 39 8.187 8.187 8.272 -0.085 18522
7618 1 14 . 1 1 28 28 GLY N N 40 111.783 111.783 111.884 -0.101 18522
7619 1 14 . 1 1 28 28 GLY C C 40 174.255 174.255 172.538 1.717 18522
7620 1 14 . 1 1 28 28 GLY CA C 40 47.098 47.098 44.847 2.251 18522
7621 1 14 . 1 1 28 28 GLY H H 40 8.275 8.275 7.484 0.791 18522
7622 1 14 . 1 1 29 29 ALA N N 41 123.128 123.128 121.526 1.602 18522
7623 1 14 . 1 1 29 29 ALA HA H 41 4.559 4.559 4.557 0.002 18522
7624 1 14 . 1 1 29 29 ALA CA C 41 51.073 51.073 52.444 -1.371 18522
7625 1 14 . 1 1 29 29 ALA CB C 41 21.926 21.926 20.558 1.368 18522
7626 1 14 . 1 1 29 29 ALA H H 41 8.012 8.012 8.445 -0.433 18522
7627 1 14 . 1 1 31 31 TYR HA H 43 4.549 4.549 4.214 0.335 18522
7628 1 14 . 1 1 31 31 TYR CA C 43 57.147 57.147 59.834 -2.687 18522
7629 1 14 . 1 1 31 31 TYR CB C 43 37.495 37.495 37.410 0.085 18522
7630 1 14 . 1 1 32 32 CYS N N 44 119.332 119.332 114.621 4.711 18522
7631 1 14 . 1 1 32 32 CYS HA H 44 4.859 4.859 4.170 0.689 18522
7632 1 14 . 1 1 32 32 CYS CA C 44 57.406 57.406 58.804 -1.398 18522
7633 1 14 . 1 1 32 32 CYS CB C 44 27.673 27.673 26.033 1.640 18522
7634 1 14 . 1 1 32 32 CYS H H 44 7.504 7.504 8.367 -0.863 18522
7635 1 14 . 1 1 33 33 PRO HA H 45 4.413 4.413 4.545 -0.132 18522
7636 1 14 . 1 1 33 33 PRO CA C 45 64.885 64.885 64.015 0.870 18522
7637 1 14 . 1 1 33 33 PRO CB C 45 32.318 32.318 32.820 -0.502 18522
7638 1 14 . 1 1 34 34 CYS N N 46 117.327 117.327 113.080 4.247 18522
7639 1 14 . 1 1 34 34 CYS C C 46 172.064 172.064 173.575 -1.511 18522
7640 1 14 . 1 1 34 34 CYS CA C 46 60.066 60.066 58.150 1.916 18522
7641 1 14 . 1 1 34 34 CYS CB C 46 28.715 28.715 31.262 -2.547 18522
7642 1 14 . 1 1 34 34 CYS H H 46 7.973 7.973 8.090 -0.117 18522
7643 1 14 . 1 1 35 35 LEU N N 47 124.270 124.270 116.225 8.045 18522
7644 1 14 . 1 1 35 35 LEU HA H 47 4.928 4.928 4.413 0.515 18522
7645 1 14 . 1 1 35 35 LEU C C 47 175.076 175.076 176.768 -1.692 18522
7646 1 14 . 1 1 35 35 LEU CA C 47 53.278 53.278 56.065 -2.787 18522
7647 1 14 . 1 1 35 35 LEU CB C 47 44.321 44.321 41.928 2.393 18522
7648 1 14 . 1 1 35 35 LEU H H 47 8.629 8.629 8.490 0.139 18522
7649 1 14 . 1 1 36 36 TYR N N 48 119.326 119.326 116.172 3.154 18522
7650 1 14 . 1 1 36 36 TYR HA H 48 5.255 5.255 4.036 1.219 18522
7651 1 14 . 1 1 36 36 TYR C C 48 175.766 175.766 175.540 0.226 18522
7652 1 14 . 1 1 36 36 TYR CA C 48 56.696 56.696 61.720 -5.024 18522
7653 1 14 . 1 1 36 36 TYR CB C 48 42.590 42.590 37.038 5.552 18522
7654 1 14 . 1 1 36 36 TYR H H 48 8.761 8.761 7.296 1.465 18522
7655 1 14 . 1 1 37 37 ILE N N 49 120.259 120.259 122.031 -1.772 18522
7656 1 14 . 1 1 37 37 ILE HA H 49 4.215 4.215 4.204 0.011 18522
7657 1 14 . 1 1 37 37 ILE C C 49 177.429 177.429 176.323 1.106 18522
7658 1 14 . 1 1 37 37 ILE CA C 49 62.456 62.456 61.755 0.701 18522
7659 1 14 . 1 1 37 37 ILE CB C 49 37.352 37.352 37.257 0.095 18522
7660 1 14 . 1 1 37 37 ILE H H 49 8.959 8.959 7.827 1.132 18522
7661 1 14 . 1 1 38 38 VAL HA H 50 3.937 3.937 3.922 0.015 18522
7662 1 14 . 1 1 38 38 VAL C C 50 174.408 174.408 175.173 -0.765 18522
7663 1 14 . 1 1 38 38 VAL CA C 50 62.259 62.259 63.306 -1.047 18522
7664 1 14 . 1 1 38 38 VAL CB C 50 31.584 31.584 32.221 -0.637 18522
7665 1 14 . 1 1 39 39 GLN N N 51 116.821 116.821 118.421 -1.600 18522
7666 1 14 . 1 1 39 39 GLN HA H 51 4.103 4.103 4.319 -0.216 18522
7667 1 14 . 1 1 39 39 GLN C C 51 172.856 172.856 173.018 -0.162 18522
7668 1 14 . 1 1 39 39 GLN CA C 51 55.127 55.127 54.703 0.424 18522
7669 1 14 . 1 1 39 39 GLN CB C 51 32.376 32.376 32.272 0.104 18522
7670 1 14 . 1 1 39 39 GLN H H 51 6.967 6.967 7.318 -0.351 18522
7671 1 14 . 1 1 40 40 VAL N N 52 123.482 123.482 122.132 1.350 18522
7672 1 14 . 1 1 40 40 VAL HA H 52 4.277 4.277 4.774 -0.497 18522
7673 1 14 . 1 1 40 40 VAL C C 52 176.198 176.198 174.307 1.891 18522
7674 1 14 . 1 1 40 40 VAL CA C 52 61.574 61.574 59.578 1.996 18522
7675 1 14 . 1 1 40 40 VAL CB C 52 32.875 32.875 34.679 -1.804 18522
7676 1 14 . 1 1 40 40 VAL H H 52 8.447 8.447 8.077 0.370 18522
7677 1 14 . 1 1 41 41 PHE N N 53 128.296 128.296 123.492 4.804 18522
7678 1 14 . 1 1 41 41 PHE HA H 53 4.400 4.400 4.692 -0.292 18522
7679 1 14 . 1 1 41 41 PHE C C 53 175.299 175.299 175.052 0.247 18522
7680 1 14 . 1 1 41 41 PHE CA C 53 58.494 58.494 58.271 0.223 18522
7681 1 14 . 1 1 41 41 PHE CB C 53 39.561 39.561 39.855 -0.294 18522
7682 1 14 . 1 1 41 41 PHE H H 53 8.707 8.707 8.365 0.342 18522
7683 1 14 . 1 1 42 42 ASP N N 54 122.696 122.696 115.786 6.910 18522
7684 1 14 . 1 1 42 42 ASP HA H 54 4.272 4.272 4.655 -0.383 18522
7685 1 14 . 1 1 42 42 ASP C C 54 176.837 176.837 176.115 0.722 18522
7686 1 14 . 1 1 42 42 ASP CA C 54 55.291 55.291 54.921 0.370 18522
7687 1 14 . 1 1 42 42 ASP CB C 54 41.093 41.093 42.361 -1.268 18522
7688 1 14 . 1 1 42 42 ASP H H 54 8.901 8.901 8.484 0.417 18522
7689 1 14 . 1 1 43 43 ASN N N 55 113.923 113.923 116.633 -2.710 18522
7690 1 14 . 1 1 43 43 ASN HA H 55 4.258 4.258 4.837 -0.579 18522
7691 1 14 . 1 1 43 43 ASN C C 55 173.714 173.714 174.766 -1.052 18522
7692 1 14 . 1 1 43 43 ASN CA C 55 54.958 54.958 53.545 1.413 18522
7693 1 14 . 1 1 43 43 ASN CB C 55 37.150 37.150 39.569 -2.420 18522
7694 1 14 . 1 1 43 43 ASN H H 55 9.319 9.319 8.287 1.032 18522
7695 1 14 . 1 1 44 44 THR N N 56 108.020 108.020 110.551 -2.531 18522
7696 1 14 . 1 1 44 44 THR HA H 56 5.377 5.377 5.065 0.312 18522
7697 1 14 . 1 1 44 44 THR CA C 56 59.712 59.712 58.886 0.826 18522
7698 1 14 . 1 1 44 44 THR CB C 56 69.529 69.529 70.280 -0.751 18522
7699 1 14 . 1 1 44 44 THR H H 56 7.149 7.149 7.489 -0.340 18522
7700 1 14 . 1 1 45 45 PRO HA H 57 4.304 4.304 4.065 0.239 18522
7701 1 14 . 1 1 45 45 PRO C C 57 180.141 180.141 177.900 2.241 18522
7702 1 14 . 1 1 45 45 PRO CA C 57 66.090 66.090 65.649 0.441 18522
7703 1 14 . 1 1 45 45 PRO CB C 57 33.194 33.194 31.482 1.712 18522
7704 1 14 . 1 1 46 46 ALA N N 58 116.854 116.854 119.305 -2.451 18522
7705 1 14 . 1 1 46 46 ALA HA H 58 4.035 4.035 4.001 0.034 18522
7706 1 14 . 1 1 46 46 ALA C C 58 180.647 180.647 179.383 1.264 18522
7707 1 14 . 1 1 46 46 ALA CA C 58 55.195 55.195 55.144 0.051 18522
7708 1 14 . 1 1 46 46 ALA CB C 58 18.880 18.880 18.089 0.791 18522
7709 1 14 . 1 1 46 46 ALA H H 58 8.938 8.938 7.802 1.136 18522
7710 1 14 . 1 1 47 47 ALA N N 59 123.250 123.250 121.049 2.201 18522
7711 1 14 . 1 1 47 47 ALA HA H 59 4.030 4.030 4.062 -0.032 18522
7712 1 14 . 1 1 47 47 ALA C C 59 179.852 179.852 179.771 0.081 18522
7713 1 14 . 1 1 47 47 ALA CA C 59 54.939 54.939 54.633 0.306 18522
7714 1 14 . 1 1 47 47 ALA CB C 59 19.688 19.688 18.802 0.886 18522
7715 1 14 . 1 1 47 47 ALA H H 59 7.658 7.658 7.405 0.253 18522
7716 1 14 . 1 1 48 48 LEU N N 60 118.654 118.654 118.233 0.421 18522
7717 1 14 . 1 1 48 48 LEU HA H 60 4.026 4.026 4.174 -0.148 18522
7718 1 14 . 1 1 48 48 LEU C C 60 179.238 179.238 178.248 0.990 18522
7719 1 14 . 1 1 48 48 LEU CA C 60 57.261 57.261 57.791 -0.530 18522
7720 1 14 . 1 1 48 48 LEU CB C 60 41.445 41.445 41.650 -0.205 18522
7721 1 14 . 1 1 48 48 LEU H H 60 8.636 8.636 8.471 0.165 18522
7722 1 14 . 1 1 49 49 ASP N N 61 117.382 117.382 119.000 -1.618 18522
7723 1 14 . 1 1 49 49 ASP HA H 61 4.421 4.421 4.616 -0.195 18522
7724 1 14 . 1 1 49 49 ASP C C 61 177.668 177.668 177.646 0.022 18522
7725 1 14 . 1 1 49 49 ASP CA C 61 57.087 57.087 54.511 2.576 18522
7726 1 14 . 1 1 49 49 ASP CB C 61 44.478 44.478 41.619 2.859 18522
7727 1 14 . 1 1 49 49 ASP H H 61 7.665 7.665 7.726 -0.061 18522
7728 1 14 . 1 1 50 50 GLY N N 62 103.228 103.228 107.668 -4.440 18522
7729 1 14 . 1 1 50 50 GLY C C 62 174.776 174.776 175.134 -0.358 18522
7730 1 14 . 1 1 50 50 GLY CA C 62 46.533 46.533 45.662 0.871 18522
7731 1 14 . 1 1 50 50 GLY H H 62 7.216 7.216 7.847 -0.631 18522
7732 1 14 . 1 1 51 51 THR N N 63 117.230 117.230 113.532 3.698 18522
7733 1 14 . 1 1 51 51 THR HA H 63 3.907 3.907 3.894 0.013 18522
7734 1 14 . 1 1 51 51 THR C C 63 175.961 175.961 174.824 1.137 18522
7735 1 14 . 1 1 51 51 THR CA C 63 66.478 66.478 63.369 3.109 18522
7736 1 14 . 1 1 51 51 THR CB C 63 68.268 68.268 68.288 -0.020 18522
7737 1 14 . 1 1 51 51 THR H H 63 8.319 8.319 7.593 0.726 18522
7738 1 14 . 1 1 52 52 VAL N N 64 113.826 113.826 116.278 -2.452 18522
7739 1 14 . 1 1 52 52 VAL HA H 64 3.950 3.950 3.993 -0.043 18522
7740 1 14 . 1 1 52 52 VAL C C 64 173.883 173.883 174.202 -0.319 18522
7741 1 14 . 1 1 52 52 VAL CA C 64 60.708 60.708 59.419 1.289 18522
7742 1 14 . 1 1 52 52 VAL CB C 64 33.079 33.079 29.313 3.766 18522
7743 1 14 . 1 1 52 52 VAL H H 64 8.147 8.147 7.396 0.751 18522
7744 1 14 . 1 1 53 53 ALA N N 65 123.521 123.521 124.124 -0.603 18522
7745 1 14 . 1 1 53 53 ALA HA H 65 4.414 4.414 4.351 0.063 18522
7746 1 14 . 1 1 53 53 ALA C C 65 175.247 175.247 176.703 -1.456 18522
7747 1 14 . 1 1 53 53 ALA CA C 65 50.440 50.440 50.656 -0.216 18522
7748 1 14 . 1 1 53 53 ALA CB C 65 23.266 23.266 20.736 2.530 18522
7749 1 14 . 1 1 53 53 ALA H H 65 8.633 8.633 7.095 1.538 18522
7750 1 14 . 1 1 54 54 ALA N N 66 120.818 120.818 122.709 -1.891 18522
7751 1 14 . 1 1 54 54 ALA HA H 66 3.720 3.720 3.799 -0.079 18522
7752 1 14 . 1 1 54 54 ALA C C 66 178.411 178.411 178.118 0.293 18522
7753 1 14 . 1 1 54 54 ALA CA C 66 53.016 53.016 53.073 -0.057 18522
7754 1 14 . 1 1 54 54 ALA CB C 66 17.840 17.840 17.543 0.297 18522
7755 1 14 . 1 1 54 54 ALA H H 66 8.451 8.451 8.382 0.069 18522
7756 1 14 . 1 1 55 55 GLY N N 67 112.260 112.260 113.696 -1.436 18522
7757 1 14 . 1 1 55 55 GLY C C 67 173.296 173.296 173.619 -0.323 18522
7758 1 14 . 1 1 55 55 GLY CA C 67 45.025 45.025 44.639 0.386 18522
7759 1 14 . 1 1 55 55 GLY H H 67 9.600 9.600 8.312 1.288 18522
7760 1 14 . 1 1 56 56 ASP N N 68 121.293 121.293 122.041 -0.748 18522
7761 1 14 . 1 1 56 56 ASP HA H 68 4.861 4.861 4.755 0.106 18522
7762 1 14 . 1 1 56 56 ASP C C 68 174.937 174.937 174.579 0.358 18522
7763 1 14 . 1 1 56 56 ASP CA C 68 55.641 55.641 54.512 1.129 18522
7764 1 14 . 1 1 56 56 ASP CB C 68 40.696 40.696 42.639 -1.943 18522
7765 1 14 . 1 1 56 56 ASP H H 68 8.043 8.043 7.771 0.272 18522
7766 1 14 . 1 1 57 57 GLU N N 69 122.814 122.814 123.085 -0.271 18522
7767 1 14 . 1 1 57 57 GLU C C 69 177.202 177.202 176.247 0.955 18522
7768 1 14 . 1 1 57 57 GLU CA C 69 54.472 54.472 54.795 -0.323 18522
7769 1 14 . 1 1 57 57 GLU CB C 69 32.800 32.800 30.010 2.790 18522
7770 1 14 . 1 1 57 57 GLU H H 69 8.455 8.455 8.228 0.227 18522
7771 1 14 . 1 1 58 58 ILE N N 70 125.862 125.862 125.674 0.188 18522
7772 1 14 . 1 1 58 58 ILE HA H 70 4.526 4.526 4.244 0.282 18522
7773 1 14 . 1 1 58 58 ILE C C 70 175.035 175.035 176.150 -1.115 18522
7774 1 14 . 1 1 58 58 ILE CA C 70 60.918 60.918 61.215 -0.297 18522
7775 1 14 . 1 1 58 58 ILE CB C 70 39.236 39.236 37.062 2.175 18522
7776 1 14 . 1 1 58 58 ILE H H 70 8.619 8.619 8.348 0.271 18522
7777 1 14 . 1 1 59 59 THR N N 71 115.507 115.507 118.173 -2.666 18522
7778 1 14 . 1 1 59 59 THR HA H 71 4.513 4.513 4.229 0.284 18522
7779 1 14 . 1 1 59 59 THR C C 71 176.425 176.425 173.664 2.761 18522
7780 1 14 . 1 1 59 59 THR CA C 71 61.158 61.158 61.640 -0.482 18522
7781 1 14 . 1 1 59 59 THR CB C 71 69.604 69.604 71.109 -1.505 18522
7782 1 14 . 1 1 59 59 THR H H 71 9.242 9.242 8.913 0.329 18522
7783 1 14 . 1 1 60 60 GLY N N 72 111.789 111.789 108.824 2.965 18522
7784 1 14 . 1 1 60 60 GLY C C 72 170.981 170.981 171.213 -0.232 18522
7785 1 14 . 1 1 60 60 GLY CA C 72 46.554 46.554 45.751 0.803 18522
7786 1 14 . 1 1 60 60 GLY H H 72 7.883 7.883 7.529 0.354 18522
7787 1 14 . 1 1 61 61 VAL N N 73 119.277 119.277 119.802 -0.525 18522
7788 1 14 . 1 1 61 61 VAL C C 73 175.951 175.951 175.348 0.603 18522
7789 1 14 . 1 1 61 61 VAL CA C 73 60.982 60.982 58.909 2.073 18522
7790 1 14 . 1 1 61 61 VAL CB C 73 36.197 36.197 34.657 1.540 18522
7791 1 14 . 1 1 61 61 VAL H H 73 8.424 8.424 8.839 -0.415 18522
7792 1 14 . 1 1 62 62 ASN N N 74 127.731 127.731 127.432 0.299 18522
7793 1 14 . 1 1 62 62 ASN HA H 74 4.520 4.520 4.473 0.047 18522
7794 1 14 . 1 1 62 62 ASN C C 74 174.878 174.878 175.278 -0.400 18522
7795 1 14 . 1 1 62 62 ASN CA C 74 54.418 54.418 54.718 -0.300 18522
7796 1 14 . 1 1 62 62 ASN CB C 74 36.655 36.655 37.411 -0.756 18522
7797 1 14 . 1 1 62 62 ASN H H 74 10.384 10.384 9.669 0.715 18522
7798 1 14 . 1 1 63 63 GLY N N 75 104.633 104.633 102.074 2.559 18522
7799 1 14 . 1 1 63 63 GLY C C 75 173.610 173.610 173.694 -0.084 18522
7800 1 14 . 1 1 63 63 GLY CA C 75 45.261 45.261 44.841 0.420 18522
7801 1 14 . 1 1 63 63 GLY H H 75 8.926 8.926 8.821 0.105 18522
7802 1 14 . 1 1 64 64 ARG N N 76 120.451 120.451 121.979 -1.528 18522
7803 1 14 . 1 1 64 64 ARG HA H 76 4.501 4.501 4.653 -0.152 18522
7804 1 14 . 1 1 64 64 ARG C C 76 175.085 175.085 175.866 -0.781 18522
7805 1 14 . 1 1 64 64 ARG CA C 76 54.252 54.252 54.006 0.246 18522
7806 1 14 . 1 1 64 64 ARG CB C 76 31.482 31.482 31.172 0.310 18522
7807 1 14 . 1 1 64 64 ARG H H 76 7.753 7.753 8.054 -0.301 18522
7808 1 14 . 1 1 65 65 SER N N 77 116.586 116.586 121.095 -4.509 18522
7809 1 14 . 1 1 65 65 SER HA H 77 4.483 4.483 4.521 -0.038 18522
7810 1 14 . 1 1 65 65 SER C C 77 176.953 176.953 175.517 1.436 18522
7811 1 14 . 1 1 65 65 SER CA C 77 58.292 58.292 58.420 -0.129 18522
7812 1 14 . 1 1 65 65 SER CB C 77 63.643 63.643 63.759 -0.116 18522
7813 1 14 . 1 1 65 65 SER H H 77 8.555 8.555 9.019 -0.464 18522
7814 1 14 . 1 1 66 66 ILE N N 78 116.618 116.618 120.473 -3.855 18522
7815 1 14 . 1 1 66 66 ILE HA H 78 4.420 4.420 4.235 0.185 18522
7816 1 14 . 1 1 66 66 ILE C C 78 175.072 175.072 177.356 -2.284 18522
7817 1 14 . 1 1 66 66 ILE CA C 78 59.122 59.122 61.884 -2.762 18522
7818 1 14 . 1 1 66 66 ILE CB C 78 36.758 36.758 37.323 -0.565 18522
7819 1 14 . 1 1 66 66 ILE H H 78 7.599 7.599 8.210 -0.611 18522
7820 1 14 . 1 1 67 67 LYS N N 79 123.287 123.287 121.861 1.426 18522
7821 1 14 . 1 1 67 67 LYS HA H 79 4.049 4.049 4.156 -0.107 18522
7822 1 14 . 1 1 67 67 LYS C C 79 178.333 178.333 177.901 0.432 18522
7823 1 14 . 1 1 67 67 LYS CA C 79 58.321 58.321 58.555 -0.234 18522
7824 1 14 . 1 1 67 67 LYS CB C 79 31.635 31.635 32.256 -0.621 18522
7825 1 14 . 1 1 67 67 LYS H H 79 7.898 7.898 8.573 -0.675 18522
7826 1 14 . 1 1 68 68 GLY N N 80 114.933 114.933 107.126 7.807 18522
7827 1 14 . 1 1 68 68 GLY C C 80 174.385 174.385 174.832 -0.447 18522
7828 1 14 . 1 1 68 68 GLY CA C 80 45.518 45.518 46.111 -0.593 18522
7829 1 14 . 1 1 68 68 GLY H H 80 8.999 8.999 8.248 0.751 18522
7830 1 14 . 1 1 69 69 LYS N N 81 119.403 119.403 119.710 -0.307 18522
7831 1 14 . 1 1 69 69 LYS HA H 81 4.043 4.043 4.514 -0.471 18522
7832 1 14 . 1 1 69 69 LYS C C 81 177.064 177.064 175.749 1.315 18522
7833 1 14 . 1 1 69 69 LYS CA C 81 54.722 54.722 55.220 -0.498 18522
7834 1 14 . 1 1 69 69 LYS CB C 81 33.560 33.560 33.178 0.382 18522
7835 1 14 . 1 1 69 69 LYS H H 81 7.845 7.845 7.831 0.014 18522
7836 1 14 . 1 1 70 70 THR N N 82 112.066 112.066 115.531 -3.465 18522
7837 1 14 . 1 1 70 70 THR HA H 82 4.666 4.666 4.532 0.134 18522
7838 1 14 . 1 1 70 70 THR C C 82 175.955 175.955 174.970 0.985 18522
7839 1 14 . 1 1 70 70 THR CA C 82 60.438 60.438 61.423 -0.985 18522
7840 1 14 . 1 1 70 70 THR CB C 82 71.629 71.629 72.385 -0.756 18522
7841 1 14 . 1 1 70 70 THR H H 82 9.153 9.153 7.941 1.212 18522
7842 1 14 . 1 1 71 71 LYS N N 83 118.730 118.730 125.068 -6.338 18522
7843 1 14 . 1 1 71 71 LYS HA H 83 3.870 3.870 3.962 -0.092 18522
7844 1 14 . 1 1 71 71 LYS C C 83 177.464 177.464 178.375 -0.911 18522
7845 1 14 . 1 1 71 71 LYS CA C 83 60.357 60.357 59.825 0.532 18522
7846 1 14 . 1 1 71 71 LYS CB C 83 31.350 31.350 31.664 -0.314 18522
7847 1 14 . 1 1 71 71 LYS H H 83 8.969 8.969 8.800 0.169 18522
7848 1 14 . 1 1 72 72 VAL N N 84 117.444 117.444 118.810 -1.366 18522
7849 1 14 . 1 1 72 72 VAL HA H 84 3.633 3.633 3.810 -0.177 18522
7850 1 14 . 1 1 72 72 VAL C C 84 178.315 178.315 177.724 0.591 18522
7851 1 14 . 1 1 72 72 VAL CA C 84 66.079 66.079 65.582 0.497 18522
7852 1 14 . 1 1 72 72 VAL CB C 84 32.091 32.091 31.067 1.024 18522
7853 1 14 . 1 1 72 72 VAL H H 84 7.631 7.631 8.211 -0.580 18522
7854 1 14 . 1 1 73 73 GLU N N 85 120.890 120.890 119.305 1.585 18522
7855 1 14 . 1 1 73 73 GLU HA H 85 3.964 3.964 4.105 -0.141 18522
7856 1 14 . 1 1 73 73 GLU C C 85 179.971 179.971 178.945 1.026 18522
7857 1 14 . 1 1 73 73 GLU CA C 85 59.316 59.316 59.661 -0.345 18522
7858 1 14 . 1 1 73 73 GLU CB C 85 30.355 30.355 29.566 0.789 18522
7859 1 14 . 1 1 73 73 GLU H H 85 7.617 7.617 7.630 -0.013 18522
7860 1 14 . 1 1 74 74 VAL N N 86 121.246 121.246 118.393 2.853 18522
7861 1 14 . 1 1 74 74 VAL HA H 86 3.630 3.630 3.815 -0.185 18522
7862 1 14 . 1 1 74 74 VAL C C 86 177.217 177.217 177.559 -0.342 18522
7863 1 14 . 1 1 74 74 VAL CA C 86 66.678 66.678 65.762 0.916 18522
7864 1 14 . 1 1 74 74 VAL CB C 86 31.307 31.307 30.614 0.693 18522
7865 1 14 . 1 1 74 74 VAL H H 86 8.368 8.368 8.291 0.077 18522
7866 1 14 . 1 1 75 75 ALA N N 87 122.148 122.148 122.829 -0.681 18522
7867 1 14 . 1 1 75 75 ALA HA H 87 3.947 3.947 3.921 0.026 18522
7868 1 14 . 1 1 75 75 ALA C C 87 179.545 179.545 179.338 0.207 18522
7869 1 14 . 1 1 75 75 ALA CA C 87 55.851 55.851 55.481 0.370 18522
7870 1 14 . 1 1 75 75 ALA CB C 87 18.491 18.491 17.948 0.543 18522
7871 1 14 . 1 1 75 75 ALA H H 87 8.577 8.577 8.037 0.540 18522
7872 1 14 . 1 1 76 76 LYS N N 88 117.733 117.733 119.166 -1.433 18522
7873 1 14 . 1 1 76 76 LYS HA H 88 4.051 4.051 3.985 0.066 18522
7874 1 14 . 1 1 76 76 LYS CA C 88 59.393 59.393 59.441 -0.047 18522
7875 1 14 . 1 1 76 76 LYS CB C 88 32.058 32.058 32.316 -0.258 18522
7876 1 14 . 1 1 76 76 LYS H H 88 7.854 7.854 7.502 0.352 18522
7877 1 14 . 1 1 77 77 MET N N 89 117.676 117.676 118.200 -0.524 18522
7878 1 14 . 1 1 77 77 MET HA H 89 4.048 4.048 4.068 -0.020 18522
7879 1 14 . 1 1 77 77 MET C C 89 178.791 178.791 178.857 -0.066 18522
7880 1 14 . 1 1 77 77 MET CA C 89 59.128 59.128 59.465 -0.338 18522
7881 1 14 . 1 1 77 77 MET CB C 89 33.801 33.801 32.582 1.219 18522
7882 1 14 . 1 1 77 77 MET H H 89 7.759 7.759 8.163 -0.404 18522
7883 1 14 . 1 1 78 78 ILE N N 90 117.305 117.305 120.080 -2.775 18522
7884 1 14 . 1 1 78 78 ILE HA H 90 3.590 3.590 3.691 -0.101 18522
7885 1 14 . 1 1 78 78 ILE C C 90 178.658 178.658 178.156 0.502 18522
7886 1 14 . 1 1 78 78 ILE CA C 90 65.482 65.482 65.559 -0.077 18522
7887 1 14 . 1 1 78 78 ILE CB C 90 38.845 38.845 37.637 1.208 18522
7888 1 14 . 1 1 78 78 ILE H H 90 7.972 7.972 8.308 -0.336 18522
7889 1 14 . 1 1 79 79 GLN N N 91 120.935 120.935 118.833 2.102 18522
7890 1 14 . 1 1 79 79 GLN HA H 91 3.998 3.998 4.186 -0.188 18522
7891 1 14 . 1 1 79 79 GLN C C 91 178.274 178.274 178.202 0.072 18522
7892 1 14 . 1 1 79 79 GLN CA C 91 59.151 59.151 57.486 1.665 18522
7893 1 14 . 1 1 79 79 GLN CB C 91 28.934 28.934 28.239 0.695 18522
7894 1 14 . 1 1 79 79 GLN H H 91 8.826 8.826 8.297 0.529 18522
7895 1 14 . 1 1 80 80 GLU N N 92 115.213 115.213 119.721 -4.508 18522
7896 1 14 . 1 1 80 80 GLU HA H 92 4.061 4.061 4.236 -0.175 18522
7897 1 14 . 1 1 80 80 GLU C C 92 176.824 176.824 178.690 -1.866 18522
7898 1 14 . 1 1 80 80 GLU CA C 92 58.006 58.006 58.363 -0.357 18522
7899 1 14 . 1 1 80 80 GLU CB C 92 29.890 29.890 30.114 -0.224 18522
7900 1 14 . 1 1 80 80 GLU H H 92 8.020 8.020 8.314 -0.294 18522
7901 1 14 . 1 1 81 81 VAL N N 93 119.047 119.047 118.623 0.424 18522
7902 1 14 . 1 1 81 81 VAL HA H 93 3.930 3.930 4.087 -0.157 18522
7903 1 14 . 1 1 81 81 VAL C C 93 176.016 176.016 174.898 1.118 18522
7904 1 14 . 1 1 81 81 VAL CA C 93 63.153 63.153 61.029 2.124 18522
7905 1 14 . 1 1 81 81 VAL CB C 93 32.154 32.154 29.639 2.515 18522
7906 1 14 . 1 1 81 81 VAL H H 93 7.073 7.073 7.843 -0.770 18522
7907 1 14 . 1 1 82 82 LYS N N 94 128.366 128.366 122.319 6.047 18522
7908 1 14 . 1 1 82 82 LYS C C 94 177.460 177.460 177.397 0.063 18522
7909 1 14 . 1 1 82 82 LYS CA C 94 55.753 55.753 57.858 -2.106 18522
7910 1 14 . 1 1 82 82 LYS CB C 94 32.332 32.332 31.943 0.389 18522
7911 1 14 . 1 1 82 82 LYS H H 94 8.762 8.762 8.078 0.684 18522
7912 1 14 . 1 1 83 83 GLY N N 95 112.528 112.528 111.323 1.205 18522
7913 1 14 . 1 1 83 83 GLY C C 95 173.468 173.468 173.459 0.009 18522
7914 1 14 . 1 1 83 83 GLY CA C 95 46.243 46.243 45.017 1.226 18522
7915 1 14 . 1 1 83 83 GLY H H 95 8.673 8.673 9.029 -0.356 18522
7916 1 14 . 1 1 84 84 GLU N N 96 121.485 121.485 119.645 1.840 18522
7917 1 14 . 1 1 84 84 GLU HA H 96 4.749 4.749 5.110 -0.361 18522
7918 1 14 . 1 1 84 84 GLU C C 96 174.583 174.583 174.408 0.175 18522
7919 1 14 . 1 1 84 84 GLU CA C 96 55.821 55.821 54.795 1.026 18522
7920 1 14 . 1 1 84 84 GLU CB C 96 31.410 31.410 33.959 -2.549 18522
7921 1 14 . 1 1 84 84 GLU H H 96 8.297 8.297 7.772 0.525 18522
7922 1 14 . 1 1 85 85 VAL N N 97 120.501 120.501 115.746 4.755 18522
7923 1 14 . 1 1 85 85 VAL HA H 97 4.665 4.665 4.683 -0.018 18522
7924 1 14 . 1 1 85 85 VAL C C 97 173.047 173.047 174.393 -1.346 18522
7925 1 14 . 1 1 85 85 VAL CA C 97 60.114 60.114 60.216 -0.102 18522
7926 1 14 . 1 1 85 85 VAL CB C 97 35.184 35.184 35.712 -0.527 18522
7927 1 14 . 1 1 85 85 VAL H H 97 9.096 9.096 9.069 0.027 18522
7928 1 14 . 1 1 86 86 THR N N 98 125.019 125.019 121.944 3.075 18522
7929 1 14 . 1 1 86 86 THR HA H 98 4.076 4.076 5.086 -1.010 18522
7930 1 14 . 1 1 86 86 THR C C 98 173.807 173.807 173.537 0.270 18522
7931 1 14 . 1 1 86 86 THR CA C 98 61.735 61.735 61.865 -0.130 18522
7932 1 14 . 1 1 86 86 THR CB C 98 69.531 69.531 70.247 -0.716 18522
7933 1 14 . 1 1 86 86 THR H H 98 9.352 9.352 8.835 0.517 18522
7934 1 14 . 1 1 87 87 ILE N N 99 128.383 128.383 124.449 3.934 18522
7935 1 14 . 1 1 87 87 ILE HA H 99 4.661 4.661 4.728 -0.067 18522
7936 1 14 . 1 1 87 87 ILE C C 99 174.614 174.614 174.336 0.278 18522
7937 1 14 . 1 1 87 87 ILE CA C 99 58.258 58.258 59.093 -0.835 18522
7938 1 14 . 1 1 87 87 ILE CB C 99 38.528 38.528 38.703 -0.175 18522
7939 1 14 . 1 1 87 87 ILE H H 99 9.329 9.329 9.086 0.243 18522
7940 1 14 . 1 1 88 88 HIS N N 100 128.279 128.279 126.536 1.743 18522
7941 1 14 . 1 1 88 88 HIS HA H 100 4.948 4.948 5.586 -0.638 18522
7942 1 14 . 1 1 88 88 HIS C C 100 174.787 174.787 174.879 -0.092 18522
7943 1 14 . 1 1 88 88 HIS CA C 100 54.620 54.620 54.363 0.257 18522
7944 1 14 . 1 1 88 88 HIS H H 100 8.647 8.647 8.949 -0.302 18522
7945 1 14 . 1 1 89 89 TYR N N 101 121.320 121.320 122.423 -1.103 18522
7946 1 14 . 1 1 89 89 TYR HA H 101 5.947 5.947 5.347 0.600 18522
7947 1 14 . 1 1 89 89 TYR C C 101 173.769 173.769 173.225 0.544 18522
7948 1 14 . 1 1 89 89 TYR CA C 101 55.669 55.669 55.599 0.070 18522
7949 1 14 . 1 1 89 89 TYR CB C 101 42.195 42.195 40.975 1.220 18522
7950 1 14 . 1 1 89 89 TYR H H 101 8.414 8.414 9.033 -0.619 18522
7951 1 14 . 1 1 90 90 ASN N N 102 116.679 116.679 118.229 -1.550 18522
7952 1 14 . 1 1 90 90 ASN HA H 102 5.335 5.335 5.506 -0.171 18522
7953 1 14 . 1 1 90 90 ASN C C 102 175.406 175.406 174.568 0.838 18522
7954 1 14 . 1 1 90 90 ASN CA C 102 51.961 51.961 51.421 0.540 18522
7955 1 14 . 1 1 90 90 ASN CB C 102 41.800 41.800 43.113 -1.313 18522
7956 1 14 . 1 1 90 90 ASN H H 102 9.282 9.282 9.022 0.260 18522
7957 1 14 . 1 1 91 91 LYS N N 103 124.129 124.129 119.960 4.169 18522
7958 1 14 . 1 1 91 91 LYS C C 103 176.678 176.678 177.041 -0.363 18522
7959 1 14 . 1 1 91 91 LYS CA C 103 55.006 55.006 54.310 0.696 18522
7960 1 14 . 1 1 91 91 LYS H H 103 8.949 8.949 8.449 0.500 18522
7961 1 14 . 1 1 92 92 LEU N N 104 127.043 127.043 116.576 10.467 18522
7962 1 14 . 1 1 92 92 LEU HA H 104 4.425 4.425 4.014 0.411 18522
7963 1 14 . 1 1 92 92 LEU CA C 104 55.060 55.060 55.623 -0.563 18522
7964 1 14 . 1 1 92 92 LEU CB C 104 42.559 42.559 39.407 3.152 18522
7965 1 14 . 1 1 92 92 LEU H H 104 9.150 9.150 8.510 0.640 18522
7966 1 14 . 1 1 93 93 GLN HA H 105 4.315 4.315 4.266 0.049 18522
7967 1 14 . 1 1 93 93 GLN C C 105 175.070 175.070 174.774 0.296 18522
7968 1 14 . 1 1 93 93 GLN CA C 105 55.490 55.490 55.969 -0.479 18522
7969 1 14 . 1 1 93 93 GLN CB C 105 28.909 28.909 27.661 1.248 18522
7970 1 14 . 1 1 94 94 ALA N N 106 125.133 125.133 122.892 2.241 18522
7971 1 14 . 1 1 94 94 ALA HA H 106 4.366 4.366 4.532 -0.167 18522
7972 1 14 . 1 1 94 94 ALA C C 106 176.392 176.392 174.950 1.442 18522
7973 1 14 . 1 1 94 94 ALA CA C 106 51.723 51.723 51.608 0.115 18522
7974 1 14 . 1 1 94 94 ALA CB C 106 20.185 20.185 21.563 -1.378 18522
7975 1 14 . 1 1 94 94 ALA H H 106 8.226 8.226 8.102 0.124 18522
7976 1 14 . 1 1 95 95 ASP N N 107 122.013 122.013 118.682 3.331 18522
7977 1 14 . 1 1 95 95 ASP HA H 107 4.413 4.413 5.069 -0.656 18522
7978 1 14 . 1 1 95 95 ASP C C 107 175.019 175.019 175.120 -0.101 18522
7979 1 14 . 1 1 95 95 ASP CA C 107 55.642 55.642 52.698 2.944 18522
7980 1 14 . 1 1 95 95 ASP CB C 107 41.266 41.266 42.298 -1.032 18522
7981 1 14 . 1 1 95 95 ASP H H 107 8.429 8.429 8.475 -0.046 18522
7982 1 14 . 1 1 96 96 PRO HA H 108 4.207 4.207 4.075 0.132 18522
7983 1 14 . 1 1 96 96 PRO C C 108 178.840 178.840 178.325 0.515 18522
7984 1 14 . 1 1 96 96 PRO CA C 108 65.396 65.396 66.351 -0.955 18522
7985 1 14 . 1 1 96 96 PRO CB C 108 32.181 32.181 31.628 0.553 18522
7986 1 14 . 1 1 97 97 LYS N N 109 117.942 117.942 115.177 2.765 18522
7987 1 14 . 1 1 97 97 LYS HA H 109 4.143 4.143 4.055 0.088 18522
7988 1 14 . 1 1 97 97 LYS C C 109 178.099 178.099 179.034 -0.935 18522
7989 1 14 . 1 1 97 97 LYS CA C 109 58.167 58.167 59.105 -0.938 18522
7990 1 14 . 1 1 97 97 LYS CB C 109 31.649 31.649 31.489 0.160 18522
7991 1 14 . 1 1 97 97 LYS H H 109 8.335 8.335 8.331 0.004 18522
7992 1 14 . 1 1 98 98 GLN N N 110 119.159 119.159 118.028 1.131 18522
7993 1 14 . 1 1 98 98 GLN HA H 110 4.130 4.130 4.429 -0.299 18522
7994 1 14 . 1 1 98 98 GLN C C 110 178.298 178.298 178.017 0.281 18522
7995 1 14 . 1 1 98 98 GLN CA C 110 57.660 57.660 56.938 0.722 18522
7996 1 14 . 1 1 98 98 GLN CB C 110 28.720 28.720 29.001 -0.281 18522
7997 1 14 . 1 1 98 98 GLN H H 110 7.985 7.985 8.097 -0.112 18522
7998 1 14 . 1 1 99 99 LEU N N 111 120.490 120.490 122.121 -1.631 18522
7999 1 14 . 1 1 99 99 LEU HA H 111 3.877 3.877 4.243 -0.366 18522
8000 1 14 . 1 1 99 99 LEU C C 111 177.729 177.729 178.365 -0.636 18522
8001 1 14 . 1 1 99 99 LEU CA C 111 57.049 57.049 57.766 -0.717 18522
8002 1 14 . 1 1 99 99 LEU CB C 111 41.466 41.466 41.861 -0.395 18522
8003 1 14 . 1 1 99 99 LEU H H 111 7.994 7.994 8.534 -0.540 18522
8004 1 14 . 1 1 100 100 GLU N N 112 118.251 118.251 118.976 -0.725 18522
8005 1 14 . 1 1 100 100 GLU HA H 112 3.972 3.972 4.145 -0.173 18522
8006 1 14 . 1 1 100 100 GLU C C 112 178.402 178.402 178.939 -0.537 18522
8007 1 14 . 1 1 100 100 GLU CA C 112 59.056 59.056 59.356 -0.300 18522
8008 1 14 . 1 1 100 100 GLU CB C 112 29.732 29.732 28.967 0.765 18522
8009 1 14 . 1 1 100 100 GLU H H 112 7.760 7.760 8.073 -0.313 18522
8010 1 14 . 1 1 101 101 VAL N N 113 117.229 117.229 120.749 -3.520 18522
8011 1 14 . 1 1 101 101 VAL HA H 113 3.762 3.762 3.759 0.003 18522
8012 1 14 . 1 1 101 101 VAL C C 113 178.107 178.107 177.589 0.518 18522
8013 1 14 . 1 1 101 101 VAL CA C 113 64.791 64.791 66.516 -1.725 18522
8014 1 14 . 1 1 101 101 VAL CB C 113 32.149 32.149 31.699 0.450 18522
8015 1 14 . 1 1 101 101 VAL H H 113 7.437 7.437 7.390 0.047 18522
8016 1 14 . 1 1 102 102 LEU N N 114 122.124 122.124 117.858 4.266 18522
8017 1 14 . 1 1 102 102 LEU HA H 114 4.033 4.033 4.175 -0.142 18522
8018 1 14 . 1 1 102 102 LEU C C 114 178.506 178.506 178.995 -0.489 18522
8019 1 14 . 1 1 102 102 LEU CA C 114 57.243 57.243 57.028 0.215 18522
8020 1 14 . 1 1 102 102 LEU CB C 114 42.028 42.028 41.885 0.144 18522
8021 1 14 . 1 1 102 102 LEU H H 114 7.765 7.765 7.546 0.219 18522
8022 1 14 . 1 1 103 103 PHE N N 115 115.346 115.346 120.367 -5.021 18522
8023 1 14 . 1 1 103 103 PHE HA H 115 4.224 4.224 4.258 -0.034 18522
8024 1 14 . 1 1 103 103 PHE C C 115 175.621 175.621 177.063 -1.442 18522
8025 1 14 . 1 1 103 103 PHE CA C 115 57.537 57.537 60.698 -3.161 18522
8026 1 14 . 1 1 103 103 PHE CB C 115 38.057 38.057 39.314 -1.257 18522
8027 1 14 . 1 1 103 103 PHE H H 115 7.805 7.805 7.909 -0.104 18522
8028 1 14 . 1 1 104 104 GLN N N 116 119.021 119.021 118.525 0.496 18522
8029 1 14 . 1 1 104 104 GLN HA H 116 4.407 4.407 4.210 0.197 18522
8030 1 14 . 1 1 104 104 GLN C C 116 176.402 176.402 175.878 0.524 18522
8031 1 14 . 1 1 104 104 GLN CA C 116 55.521 55.521 56.455 -0.934 18522
8032 1 14 . 1 1 104 104 GLN CB C 116 29.170 29.170 30.922 -1.752 18522
8033 1 14 . 1 1 104 104 GLN H H 116 7.974 7.974 7.908 0.066 18522
8034 1 14 . 1 1 105 105 GLY N N 117 108.868 108.868 107.591 1.277 18522
8035 1 14 . 1 1 105 105 GLY CA C 117 45.124 45.124 44.691 0.433 18522
8036 1 14 . 1 1 105 105 GLY H H 117 8.195 8.195 8.175 0.020 18522
8037 1 14 . 1 1 106 106 PRO HA H 118 4.490 4.490 4.335 0.155 18522
8038 1 14 . 1 1 106 106 PRO C C 118 176.001 176.001 176.420 -0.419 18522
8039 1 14 . 1 1 106 106 PRO CA C 118 63.523 63.523 64.174 -0.651 18522
8040 1 14 . 1 1 106 106 PRO CB C 118 32.078 32.078 32.284 -0.206 18522
8041 1 14 . 1 1 107 107 GLN N N 119 126.950 126.950 115.210 11.740 18522
8042 1 14 . 1 1 107 107 GLN C C 119 181.211 181.211 173.691 7.520 18522
8043 1 14 . 1 1 107 107 GLN CA C 119 57.416 57.416 54.614 2.801 18522
8044 1 14 . 1 1 107 107 GLN H H 119 8.079 8.079 7.748 0.331 18522
8045 1 14 . 1 1 111 111 ARG C C 123 174.608 174.608 174.670 -0.062 18522
8046 1 14 . 1 1 111 111 ARG CA C 123 55.099 55.099 55.976 -0.877 18522
8047 1 14 . 1 1 112 112 HIS N N 124 122.212 122.212 121.624 0.588 18522
8048 1 14 . 1 1 112 112 HIS HA H 124 4.718 4.718 4.470 0.248 18522
8049 1 14 . 1 1 112 112 HIS C C 124 176.040 176.040 173.096 2.944 18522
8050 1 14 . 1 1 112 112 HIS CA C 124 54.213 54.213 54.171 0.042 18522
8051 1 14 . 1 1 112 112 HIS CB C 124 31.164 31.164 30.347 0.817 18522
8052 1 14 . 1 1 112 112 HIS H H 124 7.640 7.640 8.294 -0.654 18522
8053 1 14 . 1 1 113 113 TRP C C 125 176.168 176.168 174.240 1.928 18522
8054 1 14 . 1 1 114 114 LEU N N 126 121.893 121.893 116.641 5.252 18522
8055 1 14 . 1 1 114 114 LEU HA H 126 4.869 4.869 4.855 0.014 18522
8056 1 14 . 1 1 114 114 LEU CA C 126 54.151 54.151 53.670 0.481 18522
8057 1 14 . 1 1 114 114 LEU CB C 126 45.144 45.144 44.076 1.068 18522
8058 1 14 . 1 1 114 114 LEU H H 126 8.606 8.606 8.922 -0.316 18522
8059 1 14 . 1 1 115 115 LYS N N 127 125.850 125.850 120.742 5.108 18522
8060 1 14 . 1 1 115 115 LYS HA H 127 4.203 4.203 5.004 -0.801 18522
8061 1 14 . 1 1 115 115 LYS C C 127 175.564 175.564 175.228 0.336 18522
8062 1 14 . 1 1 115 115 LYS CA C 127 57.252 57.252 55.763 1.489 18522
8063 1 14 . 1 1 115 115 LYS CB C 127 33.406 33.406 33.439 -0.033 18522
8064 1 14 . 1 1 115 115 LYS H H 127 8.647 8.647 8.403 0.244 18522
8065 1 15 . 1 1 3 3 PRO C C 15 177.225 177.225 177.191 0.034 18522
8066 1 15 . 1 1 3 3 PRO CA C 15 63.508 63.508 62.283 1.225 18522
8067 1 15 . 1 1 3 3 PRO CB C 15 32.090 32.090 30.251 1.839 18522
8068 1 15 . 1 1 4 4 GLY N N 16 108.829 108.829 112.265 -3.436 18522
8069 1 15 . 1 1 4 4 GLY C C 16 173.398 173.398 174.689 -1.291 18522
8070 1 15 . 1 1 4 4 GLY CA C 16 45.128 45.128 44.987 0.141 18522
8071 1 15 . 1 1 4 4 GLY H H 16 8.489 8.489 8.047 0.442 18522
8072 1 15 . 1 1 5 5 ILE N N 17 121.763 121.763 119.672 2.091 18522
8073 1 15 . 1 1 5 5 ILE HA H 17 4.554 4.554 4.333 0.221 18522
8074 1 15 . 1 1 5 5 ILE C C 17 174.332 174.332 175.865 -1.533 18522
8075 1 15 . 1 1 5 5 ILE CA C 17 58.245 58.245 58.943 -0.698 18522
8076 1 15 . 1 1 5 5 ILE CB C 17 38.762 38.762 37.539 1.223 18522
8077 1 15 . 1 1 5 5 ILE H H 17 8.014 8.014 7.888 0.126 18522
8078 1 15 . 1 1 6 6 PRO C C 18 176.437 176.437 176.318 0.119 18522
8079 1 15 . 1 1 6 6 PRO CA C 18 62.667 62.667 64.428 -1.761 18522
8080 1 15 . 1 1 6 6 PRO CB C 18 32.469 32.469 31.918 0.551 18522
8081 1 15 . 1 1 7 7 VAL N N 19 123.849 123.849 112.919 10.930 18522
8082 1 15 . 1 1 7 7 VAL HA H 19 4.550 4.550 4.618 -0.068 18522
8083 1 15 . 1 1 7 7 VAL C C 19 174.453 174.453 172.999 1.454 18522
8084 1 15 . 1 1 7 7 VAL CA C 19 59.846 59.846 58.180 1.666 18522
8085 1 15 . 1 1 7 7 VAL CB C 19 33.510 33.510 33.345 0.165 18522
8086 1 15 . 1 1 7 7 VAL H H 19 8.754 8.754 7.441 1.313 18522
8087 1 15 . 1 1 8 8 PRO HA H 20 5.338 5.338 4.663 0.675 18522
8088 1 15 . 1 1 8 8 PRO C C 20 177.585 177.585 176.642 0.943 18522
8089 1 15 . 1 1 8 8 PRO CA C 20 62.406 62.406 62.783 -0.377 18522
8090 1 15 . 1 1 8 8 PRO CB C 20 32.891 32.891 31.400 1.491 18522
8091 1 15 . 1 1 9 9 GLY N N 21 108.426 108.426 112.808 -4.382 18522
8092 1 15 . 1 1 9 9 GLY C C 21 171.443 171.443 172.289 -0.846 18522
8093 1 15 . 1 1 9 9 GLY CA C 21 44.581 44.581 44.464 0.117 18522
8094 1 15 . 1 1 9 9 GLY H H 21 8.258 8.258 8.746 -0.488 18522
8095 1 15 . 1 1 10 10 LYS N N 22 117.372 117.372 126.336 -8.964 18522
8096 1 15 . 1 1 10 10 LYS HA H 22 4.039 4.039 5.280 -1.241 18522
8097 1 15 . 1 1 10 10 LYS C C 22 174.463 174.463 175.802 -1.339 18522
8098 1 15 . 1 1 10 10 LYS CA C 22 55.263 55.263 55.151 0.112 18522
8099 1 15 . 1 1 10 10 LYS CB C 22 35.227 35.227 34.445 0.782 18522
8100 1 15 . 1 1 10 10 LYS H H 22 8.175 8.175 8.218 -0.043 18522
8101 1 15 . 1 1 11 11 VAL N N 23 120.387 120.387 119.934 0.453 18522
8102 1 15 . 1 1 11 11 VAL HA H 23 4.708 4.708 4.599 0.109 18522
8103 1 15 . 1 1 11 11 VAL C C 23 171.873 171.873 174.303 -2.430 18522
8104 1 15 . 1 1 11 11 VAL CA C 23 59.866 59.866 59.739 0.127 18522
8105 1 15 . 1 1 11 11 VAL CB C 23 35.269 35.269 35.339 -0.070 18522
8106 1 15 . 1 1 11 11 VAL H H 23 8.862 8.862 7.991 0.871 18522
8107 1 15 . 1 1 12 12 THR N N 24 125.797 125.797 119.081 6.716 18522
8108 1 15 . 1 1 12 12 THR HA H 24 5.121 5.121 4.741 0.380 18522
8109 1 15 . 1 1 12 12 THR C C 24 173.407 173.407 173.424 -0.017 18522
8110 1 15 . 1 1 12 12 THR CA C 24 62.115 62.115 60.092 2.023 18522
8111 1 15 . 1 1 12 12 THR CB C 24 69.606 69.606 69.755 -0.149 18522
8112 1 15 . 1 1 12 12 THR H H 24 8.859 8.859 8.294 0.565 18522
8113 1 15 . 1 1 13 13 LEU N N 25 127.960 127.960 126.836 1.124 18522
8114 1 15 . 1 1 13 13 LEU HA H 25 4.809 4.809 4.835 -0.026 18522
8115 1 15 . 1 1 13 13 LEU C C 25 175.029 175.029 175.244 -0.215 18522
8116 1 15 . 1 1 13 13 LEU CA C 25 52.623 52.623 52.287 0.336 18522
8117 1 15 . 1 1 13 13 LEU CB C 25 46.242 46.242 45.257 0.985 18522
8118 1 15 . 1 1 13 13 LEU H H 25 9.258 9.258 8.141 1.117 18522
8119 1 15 . 1 1 14 14 GLN N N 26 120.858 120.858 117.674 3.184 18522
8120 1 15 . 1 1 14 14 GLN HA H 26 4.482 4.482 4.553 -0.071 18522
8121 1 15 . 1 1 14 14 GLN C C 26 174.515 174.515 174.834 -0.319 18522
8122 1 15 . 1 1 14 14 GLN CA C 26 54.576 54.576 54.195 0.381 18522
8123 1 15 . 1 1 14 14 GLN CB C 26 29.516 29.516 31.866 -2.350 18522
8124 1 15 . 1 1 14 14 GLN H H 26 8.530 8.530 8.305 0.225 18522
8125 1 15 . 1 1 15 15 LYS N N 27 119.583 119.583 122.524 -2.941 18522
8126 1 15 . 1 1 15 15 LYS HA H 27 4.180 4.180 4.199 -0.019 18522
8127 1 15 . 1 1 15 15 LYS C C 27 177.468 177.468 176.964 0.504 18522
8128 1 15 . 1 1 15 15 LYS CA C 27 55.956 55.956 57.011 -1.056 18522
8129 1 15 . 1 1 15 15 LYS CB C 27 34.099 34.099 32.587 1.512 18522
8130 1 15 . 1 1 15 15 LYS H H 27 8.099 8.099 8.113 -0.014 18522
8131 1 15 . 1 1 16 16 ASP N N 28 121.439 121.439 122.256 -0.817 18522
8132 1 15 . 1 1 16 16 ASP HA H 28 4.590 4.590 4.639 -0.049 18522
8133 1 15 . 1 1 16 16 ASP C C 28 178.392 178.392 178.151 0.241 18522
8134 1 15 . 1 1 16 16 ASP CA C 28 52.426 52.426 54.286 -1.860 18522
8135 1 15 . 1 1 16 16 ASP CB C 28 41.377 41.377 42.535 -1.158 18522
8136 1 15 . 1 1 16 16 ASP H H 28 8.888 8.888 8.544 0.344 18522
8137 1 15 . 1 1 17 17 ALA N N 29 119.578 119.578 122.612 -3.034 18522
8138 1 15 . 1 1 17 17 ALA HA H 29 4.188 4.188 4.157 0.031 18522
8139 1 15 . 1 1 17 17 ALA C C 29 178.763 178.763 178.301 0.462 18522
8140 1 15 . 1 1 17 17 ALA CA C 29 54.434 54.434 54.443 -0.009 18522
8141 1 15 . 1 1 17 17 ALA CB C 29 18.293 18.293 18.594 -0.301 18522
8142 1 15 . 1 1 17 17 ALA H H 29 8.392 8.392 8.595 -0.203 18522
8143 1 15 . 1 1 18 18 GLN N N 30 117.564 117.564 117.616 -0.052 18522
8144 1 15 . 1 1 18 18 GLN HA H 30 4.399 4.399 4.326 0.073 18522
8145 1 15 . 1 1 18 18 GLN C C 30 175.168 175.168 175.673 -0.505 18522
8146 1 15 . 1 1 18 18 GLN CA C 30 55.339 55.339 54.932 0.407 18522
8147 1 15 . 1 1 18 18 GLN CB C 30 28.589 28.589 29.151 -0.562 18522
8148 1 15 . 1 1 18 18 GLN H H 30 8.353 8.353 7.971 0.382 18522
8149 1 15 . 1 1 19 19 ASN N N 31 115.365 115.365 115.401 -0.036 18522
8150 1 15 . 1 1 19 19 ASN HA H 31 4.315 4.315 4.381 -0.066 18522
8151 1 15 . 1 1 19 19 ASN C C 31 174.043 174.043 173.031 1.012 18522
8152 1 15 . 1 1 19 19 ASN CA C 31 54.303 54.303 54.610 -0.307 18522
8153 1 15 . 1 1 19 19 ASN CB C 31 37.610 37.610 37.887 -0.277 18522
8154 1 15 . 1 1 19 19 ASN H H 31 8.521 8.521 8.119 0.402 18522
8155 1 15 . 1 1 20 20 LEU N N 32 118.660 118.660 113.857 4.803 18522
8156 1 15 . 1 1 20 20 LEU HA H 32 4.900 4.900 4.958 -0.058 18522
8157 1 15 . 1 1 20 20 LEU C C 32 178.117 178.117 176.698 1.419 18522
8158 1 15 . 1 1 20 20 LEU CA C 32 53.957 53.957 53.989 -0.032 18522
8159 1 15 . 1 1 20 20 LEU CB C 32 44.774 44.774 43.577 1.197 18522
8160 1 15 . 1 1 20 20 LEU H H 32 8.155 8.155 7.357 0.797 18522
8161 1 15 . 1 1 21 21 ILE N N 33 116.785 116.785 115.048 1.737 18522
8162 1 15 . 1 1 21 21 ILE HA H 33 4.674 4.674 4.438 0.236 18522
8163 1 15 . 1 1 21 21 ILE C C 33 176.185 176.185 176.208 -0.023 18522
8164 1 15 . 1 1 21 21 ILE CA C 33 62.602 62.602 61.461 1.141 18522
8165 1 15 . 1 1 21 21 ILE CB C 33 39.016 39.016 38.707 0.309 18522
8166 1 15 . 1 1 21 21 ILE H H 33 11.488 11.488 8.190 3.298 18522
8167 1 15 . 1 1 22 22 GLY N N 34 111.234 111.234 108.889 2.345 18522
8168 1 15 . 1 1 22 22 GLY C C 34 173.993 173.993 173.579 0.414 18522
8169 1 15 . 1 1 22 22 GLY CA C 34 45.980 45.980 45.403 0.577 18522
8170 1 15 . 1 1 22 22 GLY H H 34 9.854 9.854 8.365 1.489 18522
8171 1 15 . 1 1 23 23 ILE N N 35 111.117 111.117 113.432 -2.315 18522
8172 1 15 . 1 1 23 23 ILE HA H 35 5.535 5.535 5.331 0.204 18522
8173 1 15 . 1 1 23 23 ILE C C 35 175.033 175.033 173.992 1.041 18522
8174 1 15 . 1 1 23 23 ILE CA C 35 58.415 58.415 57.952 0.463 18522
8175 1 15 . 1 1 23 23 ILE CB C 35 41.577 41.577 41.665 -0.088 18522
8176 1 15 . 1 1 23 23 ILE H H 35 7.835 7.835 8.220 -0.385 18522
8177 1 15 . 1 1 24 24 SER N N 36 114.908 114.908 115.908 -1.000 18522
8178 1 15 . 1 1 24 24 SER HA H 36 4.232 4.232 5.173 -0.941 18522
8179 1 15 . 1 1 24 24 SER C C 36 174.735 174.735 172.822 1.913 18522
8180 1 15 . 1 1 24 24 SER CA C 36 56.121 56.121 57.260 -1.139 18522
8181 1 15 . 1 1 24 24 SER CB C 36 66.097 66.097 65.777 0.320 18522
8182 1 15 . 1 1 24 24 SER H H 36 8.623 8.623 8.319 0.304 18522
8183 1 15 . 1 1 25 25 ILE N N 37 117.739 117.739 124.359 -6.620 18522
8184 1 15 . 1 1 25 25 ILE C C 37 174.340 174.340 175.235 -0.895 18522
8185 1 15 . 1 1 25 25 ILE CA C 37 59.123 59.123 58.627 0.496 18522
8186 1 15 . 1 1 25 25 ILE CB C 37 41.637 41.637 40.933 0.704 18522
8187 1 15 . 1 1 25 25 ILE H H 37 9.130 9.130 8.738 0.393 18522
8188 1 15 . 1 1 26 26 GLY N N 38 108.069 108.069 112.839 -4.770 18522
8189 1 15 . 1 1 26 26 GLY CA C 38 44.112 44.112 45.711 -1.599 18522
8190 1 15 . 1 1 26 26 GLY H H 38 8.841 8.841 8.911 -0.070 18522
8191 1 15 . 1 1 27 27 GLY N N 39 109.016 109.016 107.576 1.440 18522
8192 1 15 . 1 1 27 27 GLY C C 39 173.956 173.956 174.891 -0.935 18522
8193 1 15 . 1 1 27 27 GLY H H 39 8.187 8.187 8.472 -0.285 18522
8194 1 15 . 1 1 28 28 GLY N N 40 111.783 111.783 108.067 3.716 18522
8195 1 15 . 1 1 28 28 GLY C C 40 174.255 174.255 173.162 1.093 18522
8196 1 15 . 1 1 28 28 GLY CA C 40 47.098 47.098 45.413 1.685 18522
8197 1 15 . 1 1 28 28 GLY H H 40 8.275 8.275 8.244 0.031 18522
8198 1 15 . 1 1 29 29 ALA N N 41 123.128 123.128 121.611 1.517 18522
8199 1 15 . 1 1 29 29 ALA HA H 41 4.559 4.559 4.573 -0.014 18522
8200 1 15 . 1 1 29 29 ALA CA C 41 51.073 51.073 53.491 -2.418 18522
8201 1 15 . 1 1 29 29 ALA CB C 41 21.926 21.926 19.813 2.113 18522
8202 1 15 . 1 1 29 29 ALA H H 41 8.012 8.012 8.058 -0.046 18522
8203 1 15 . 1 1 31 31 TYR HA H 43 4.549 4.549 4.809 -0.260 18522
8204 1 15 . 1 1 31 31 TYR CA C 43 57.147 57.147 59.863 -2.716 18522
8205 1 15 . 1 1 31 31 TYR CB C 43 37.495 37.495 39.834 -2.339 18522
8206 1 15 . 1 1 32 32 CYS N N 44 119.332 119.332 115.403 3.929 18522
8207 1 15 . 1 1 32 32 CYS HA H 44 4.859 4.859 5.104 -0.245 18522
8208 1 15 . 1 1 32 32 CYS CA C 44 57.406 57.406 56.805 0.601 18522
8209 1 15 . 1 1 32 32 CYS CB C 44 27.673 27.673 27.473 0.200 18522
8210 1 15 . 1 1 32 32 CYS H H 44 7.504 7.504 8.364 -0.860 18522
8211 1 15 . 1 1 33 33 PRO HA H 45 4.413 4.413 4.822 -0.409 18522
8212 1 15 . 1 1 33 33 PRO CA C 45 64.885 64.885 61.769 3.116 18522
8213 1 15 . 1 1 33 33 PRO CB C 45 32.318 32.318 32.670 -0.352 18522
8214 1 15 . 1 1 34 34 CYS N N 46 117.327 117.327 114.895 2.432 18522
8215 1 15 . 1 1 34 34 CYS C C 46 172.064 172.064 175.966 -3.902 18522
8216 1 15 . 1 1 34 34 CYS CA C 46 60.066 60.066 60.169 -0.103 18522
8217 1 15 . 1 1 34 34 CYS CB C 46 28.715 28.715 27.699 1.016 18522
8218 1 15 . 1 1 34 34 CYS H H 46 7.973 7.973 8.143 -0.170 18522
8219 1 15 . 1 1 35 35 LEU N N 47 124.270 124.270 115.616 8.654 18522
8220 1 15 . 1 1 35 35 LEU HA H 47 4.928 4.928 3.549 1.379 18522
8221 1 15 . 1 1 35 35 LEU C C 47 175.076 175.076 177.159 -2.083 18522
8222 1 15 . 1 1 35 35 LEU CA C 47 53.278 53.278 57.571 -4.293 18522
8223 1 15 . 1 1 35 35 LEU CB C 47 44.321 44.321 39.803 4.518 18522
8224 1 15 . 1 1 35 35 LEU H H 47 8.629 8.629 9.072 -0.443 18522
8225 1 15 . 1 1 36 36 TYR N N 48 119.326 119.326 112.841 6.485 18522
8226 1 15 . 1 1 36 36 TYR HA H 48 5.255 5.255 4.048 1.207 18522
8227 1 15 . 1 1 36 36 TYR C C 48 175.766 175.766 176.860 -1.094 18522
8228 1 15 . 1 1 36 36 TYR CA C 48 56.696 56.696 60.956 -4.260 18522
8229 1 15 . 1 1 36 36 TYR CB C 48 42.590 42.590 36.778 5.812 18522
8230 1 15 . 1 1 36 36 TYR H H 48 8.761 8.761 7.755 1.006 18522
8231 1 15 . 1 1 37 37 ILE N N 49 120.259 120.259 122.290 -2.031 18522
8232 1 15 . 1 1 37 37 ILE HA H 49 4.215 4.215 4.380 -0.165 18522
8233 1 15 . 1 1 37 37 ILE C C 49 177.429 177.429 176.113 1.316 18522
8234 1 15 . 1 1 37 37 ILE CA C 49 62.456 62.456 60.955 1.501 18522
8235 1 15 . 1 1 37 37 ILE CB C 49 37.352 37.352 37.274 0.078 18522
8236 1 15 . 1 1 37 37 ILE H H 49 8.959 8.959 7.968 0.991 18522
8237 1 15 . 1 1 38 38 VAL HA H 50 3.937 3.937 3.766 0.171 18522
8238 1 15 . 1 1 38 38 VAL C C 50 174.408 174.408 175.431 -1.023 18522
8239 1 15 . 1 1 38 38 VAL CA C 50 62.259 62.259 62.516 -0.257 18522
8240 1 15 . 1 1 38 38 VAL CB C 50 31.584 31.584 31.650 -0.066 18522
8241 1 15 . 1 1 39 39 GLN N N 51 116.821 116.821 117.668 -0.847 18522
8242 1 15 . 1 1 39 39 GLN HA H 51 4.103 4.103 4.329 -0.226 18522
8243 1 15 . 1 1 39 39 GLN C C 51 172.856 172.856 172.942 -0.086 18522
8244 1 15 . 1 1 39 39 GLN CA C 51 55.127 55.127 55.088 0.039 18522
8245 1 15 . 1 1 39 39 GLN CB C 51 32.376 32.376 32.204 0.172 18522
8246 1 15 . 1 1 39 39 GLN H H 51 6.967 6.967 7.313 -0.346 18522
8247 1 15 . 1 1 40 40 VAL N N 52 123.482 123.482 121.392 2.090 18522
8248 1 15 . 1 1 40 40 VAL HA H 52 4.277 4.277 4.672 -0.395 18522
8249 1 15 . 1 1 40 40 VAL C C 52 176.198 176.198 174.333 1.865 18522
8250 1 15 . 1 1 40 40 VAL CA C 52 61.574 61.574 59.823 1.751 18522
8251 1 15 . 1 1 40 40 VAL CB C 52 32.875 32.875 34.964 -2.089 18522
8252 1 15 . 1 1 40 40 VAL H H 52 8.447 8.447 8.014 0.433 18522
8253 1 15 . 1 1 41 41 PHE N N 53 128.296 128.296 123.914 4.382 18522
8254 1 15 . 1 1 41 41 PHE HA H 53 4.400 4.400 4.700 -0.300 18522
8255 1 15 . 1 1 41 41 PHE C C 53 175.299 175.299 175.056 0.243 18522
8256 1 15 . 1 1 41 41 PHE CA C 53 58.494 58.494 58.302 0.192 18522
8257 1 15 . 1 1 41 41 PHE CB C 53 39.561 39.561 39.793 -0.232 18522
8258 1 15 . 1 1 41 41 PHE H H 53 8.707 8.707 8.140 0.567 18522
8259 1 15 . 1 1 42 42 ASP N N 54 122.696 122.696 115.797 6.899 18522
8260 1 15 . 1 1 42 42 ASP HA H 54 4.272 4.272 4.672 -0.400 18522
8261 1 15 . 1 1 42 42 ASP C C 54 176.837 176.837 176.041 0.796 18522
8262 1 15 . 1 1 42 42 ASP CA C 54 55.291 55.291 55.005 0.286 18522
8263 1 15 . 1 1 42 42 ASP CB C 54 41.093 41.093 42.488 -1.395 18522
8264 1 15 . 1 1 42 42 ASP H H 54 8.901 8.901 8.434 0.467 18522
8265 1 15 . 1 1 43 43 ASN N N 55 113.923 113.923 117.010 -3.087 18522
8266 1 15 . 1 1 43 43 ASN HA H 55 4.258 4.258 4.825 -0.567 18522
8267 1 15 . 1 1 43 43 ASN C C 55 173.714 173.714 174.594 -0.880 18522
8268 1 15 . 1 1 43 43 ASN CA C 55 54.958 54.958 53.691 1.267 18522
8269 1 15 . 1 1 43 43 ASN CB C 55 37.150 37.150 39.479 -2.329 18522
8270 1 15 . 1 1 43 43 ASN H H 55 9.319 9.319 8.258 1.061 18522
8271 1 15 . 1 1 44 44 THR N N 56 108.020 108.020 111.375 -3.355 18522
8272 1 15 . 1 1 44 44 THR HA H 56 5.377 5.377 4.989 0.388 18522
8273 1 15 . 1 1 44 44 THR CA C 56 59.712 59.712 59.389 0.323 18522
8274 1 15 . 1 1 44 44 THR CB C 56 69.529 69.529 70.112 -0.583 18522
8275 1 15 . 1 1 44 44 THR H H 56 7.149 7.149 7.511 -0.362 18522
8276 1 15 . 1 1 45 45 PRO HA H 57 4.304 4.304 4.100 0.204 18522
8277 1 15 . 1 1 45 45 PRO C C 57 180.141 180.141 178.165 1.976 18522
8278 1 15 . 1 1 45 45 PRO CA C 57 66.090 66.090 65.737 0.353 18522
8279 1 15 . 1 1 45 45 PRO CB C 57 33.194 33.194 31.429 1.765 18522
8280 1 15 . 1 1 46 46 ALA N N 58 116.854 116.854 119.996 -3.142 18522
8281 1 15 . 1 1 46 46 ALA HA H 58 4.035 4.035 4.020 0.015 18522
8282 1 15 . 1 1 46 46 ALA C C 58 180.647 180.647 179.459 1.188 18522
8283 1 15 . 1 1 46 46 ALA CA C 58 55.195 55.195 55.245 -0.050 18522
8284 1 15 . 1 1 46 46 ALA CB C 58 18.880 18.880 18.108 0.772 18522
8285 1 15 . 1 1 46 46 ALA H H 58 8.938 8.938 7.795 1.143 18522
8286 1 15 . 1 1 47 47 ALA N N 59 123.250 123.250 121.049 2.201 18522
8287 1 15 . 1 1 47 47 ALA HA H 59 4.030 4.030 4.044 -0.014 18522
8288 1 15 . 1 1 47 47 ALA C C 59 179.852 179.852 179.503 0.349 18522
8289 1 15 . 1 1 47 47 ALA CA C 59 54.939 54.939 54.551 0.388 18522
8290 1 15 . 1 1 47 47 ALA CB C 59 19.688 19.688 18.583 1.105 18522
8291 1 15 . 1 1 47 47 ALA H H 59 7.658 7.658 7.457 0.201 18522
8292 1 15 . 1 1 48 48 LEU N N 60 118.654 118.654 119.687 -1.033 18522
8293 1 15 . 1 1 48 48 LEU HA H 60 4.026 4.026 4.123 -0.097 18522
8294 1 15 . 1 1 48 48 LEU C C 60 179.238 179.238 178.661 0.577 18522
8295 1 15 . 1 1 48 48 LEU CA C 60 57.261 57.261 58.154 -0.893 18522
8296 1 15 . 1 1 48 48 LEU CB C 60 41.445 41.445 40.860 0.585 18522
8297 1 15 . 1 1 48 48 LEU H H 60 8.636 8.636 8.458 0.178 18522
8298 1 15 . 1 1 49 49 ASP N N 61 117.382 117.382 117.045 0.337 18522
8299 1 15 . 1 1 49 49 ASP HA H 61 4.421 4.421 4.652 -0.231 18522
8300 1 15 . 1 1 49 49 ASP C C 61 177.668 177.668 178.104 -0.436 18522
8301 1 15 . 1 1 49 49 ASP CA C 61 57.087 57.087 54.883 2.204 18522
8302 1 15 . 1 1 49 49 ASP CB C 61 44.478 44.478 41.809 2.670 18522
8303 1 15 . 1 1 49 49 ASP H H 61 7.665 7.665 7.957 -0.292 18522
8304 1 15 . 1 1 50 50 GLY N N 62 103.228 103.228 106.654 -3.426 18522
8305 1 15 . 1 1 50 50 GLY C C 62 174.776 174.776 174.671 0.105 18522
8306 1 15 . 1 1 50 50 GLY CA C 62 46.533 46.533 45.582 0.951 18522
8307 1 15 . 1 1 50 50 GLY H H 62 7.216 7.216 8.386 -1.170 18522
8308 1 15 . 1 1 51 51 THR N N 63 117.230 117.230 114.301 2.929 18522
8309 1 15 . 1 1 51 51 THR HA H 63 3.907 3.907 3.858 0.049 18522
8310 1 15 . 1 1 51 51 THR C C 63 175.961 175.961 173.759 2.202 18522
8311 1 15 . 1 1 51 51 THR CA C 63 66.478 66.478 62.409 4.069 18522
8312 1 15 . 1 1 51 51 THR CB C 63 68.268 68.268 67.835 0.433 18522
8313 1 15 . 1 1 51 51 THR H H 63 8.319 8.319 7.612 0.707 18522
8314 1 15 . 1 1 52 52 VAL N N 64 113.826 113.826 115.135 -1.309 18522
8315 1 15 . 1 1 52 52 VAL HA H 64 3.950 3.950 4.583 -0.633 18522
8316 1 15 . 1 1 52 52 VAL C C 64 173.883 173.883 174.915 -1.032 18522
8317 1 15 . 1 1 52 52 VAL CA C 64 60.708 60.708 59.908 0.799 18522
8318 1 15 . 1 1 52 52 VAL CB C 64 33.079 33.079 30.397 2.682 18522
8319 1 15 . 1 1 52 52 VAL H H 64 8.147 8.147 7.439 0.708 18522
8320 1 15 . 1 1 53 53 ALA N N 65 123.521 123.521 124.444 -0.923 18522
8321 1 15 . 1 1 53 53 ALA HA H 65 4.414 4.414 4.435 -0.021 18522
8322 1 15 . 1 1 53 53 ALA C C 65 175.247 175.247 176.942 -1.695 18522
8323 1 15 . 1 1 53 53 ALA CA C 65 50.440 50.440 50.449 -0.009 18522
8324 1 15 . 1 1 53 53 ALA CB C 65 23.266 23.266 20.541 2.725 18522
8325 1 15 . 1 1 53 53 ALA H H 65 8.633 8.633 7.298 1.335 18522
8326 1 15 . 1 1 54 54 ALA N N 66 120.818 120.818 122.283 -1.465 18522
8327 1 15 . 1 1 54 54 ALA HA H 66 3.720 3.720 4.068 -0.348 18522
8328 1 15 . 1 1 54 54 ALA C C 66 178.411 178.411 177.374 1.037 18522
8329 1 15 . 1 1 54 54 ALA CA C 66 53.016 53.016 52.962 0.054 18522
8330 1 15 . 1 1 54 54 ALA CB C 66 17.840 17.840 17.506 0.334 18522
8331 1 15 . 1 1 54 54 ALA H H 66 8.451 8.451 8.584 -0.133 18522
8332 1 15 . 1 1 55 55 GLY N N 67 112.260 112.260 111.179 1.081 18522
8333 1 15 . 1 1 55 55 GLY C C 67 173.296 173.296 174.001 -0.705 18522
8334 1 15 . 1 1 55 55 GLY CA C 67 45.025 45.025 44.770 0.255 18522
8335 1 15 . 1 1 55 55 GLY H H 67 9.600 9.600 7.932 1.668 18522
8336 1 15 . 1 1 56 56 ASP N N 68 121.293 121.293 122.547 -1.254 18522
8337 1 15 . 1 1 56 56 ASP HA H 68 4.861 4.861 5.136 -0.275 18522
8338 1 15 . 1 1 56 56 ASP C C 68 174.937 174.937 174.773 0.164 18522
8339 1 15 . 1 1 56 56 ASP CA C 68 55.641 55.641 53.273 2.369 18522
8340 1 15 . 1 1 56 56 ASP CB C 68 40.696 40.696 42.889 -2.193 18522
8341 1 15 . 1 1 56 56 ASP H H 68 8.043 8.043 7.912 0.131 18522
8342 1 15 . 1 1 57 57 GLU N N 69 122.814 122.814 117.841 4.973 18522
8343 1 15 . 1 1 57 57 GLU C C 69 177.202 177.202 175.967 1.235 18522
8344 1 15 . 1 1 57 57 GLU CA C 69 54.472 54.472 54.559 -0.087 18522
8345 1 15 . 1 1 57 57 GLU CB C 69 32.800 32.800 33.507 -0.707 18522
8346 1 15 . 1 1 57 57 GLU H H 69 8.455 8.455 8.153 0.301 18522
8347 1 15 . 1 1 58 58 ILE N N 70 125.862 125.862 122.866 2.996 18522
8348 1 15 . 1 1 58 58 ILE HA H 70 4.526 4.526 4.542 -0.016 18522
8349 1 15 . 1 1 58 58 ILE C C 70 175.035 175.035 175.329 -0.294 18522
8350 1 15 . 1 1 58 58 ILE CA C 70 60.918 60.918 59.200 1.718 18522
8351 1 15 . 1 1 58 58 ILE CB C 70 39.236 39.236 38.167 1.069 18522
8352 1 15 . 1 1 58 58 ILE H H 70 8.619 8.619 8.699 -0.080 18522
8353 1 15 . 1 1 59 59 THR N N 71 115.507 115.507 121.590 -6.083 18522
8354 1 15 . 1 1 59 59 THR HA H 71 4.513 4.513 3.965 0.548 18522
8355 1 15 . 1 1 59 59 THR C C 71 176.425 176.425 173.803 2.622 18522
8356 1 15 . 1 1 59 59 THR CA C 71 61.158 61.158 61.846 -0.688 18522
8357 1 15 . 1 1 59 59 THR CB C 71 69.604 69.604 69.137 0.467 18522
8358 1 15 . 1 1 59 59 THR H H 71 9.242 9.242 9.109 0.133 18522
8359 1 15 . 1 1 60 60 GLY N N 72 111.789 111.789 108.288 3.501 18522
8360 1 15 . 1 1 60 60 GLY C C 72 170.981 170.981 171.490 -0.509 18522
8361 1 15 . 1 1 60 60 GLY CA C 72 46.554 46.554 44.856 1.698 18522
8362 1 15 . 1 1 60 60 GLY H H 72 7.883 7.883 7.740 0.143 18522
8363 1 15 . 1 1 61 61 VAL N N 73 119.277 119.277 115.403 3.874 18522
8364 1 15 . 1 1 61 61 VAL C C 73 175.951 175.951 176.543 -0.592 18522
8365 1 15 . 1 1 61 61 VAL CA C 73 60.982 60.982 58.605 2.377 18522
8366 1 15 . 1 1 61 61 VAL CB C 73 36.197 36.197 34.757 1.440 18522
8367 1 15 . 1 1 61 61 VAL H H 73 8.424 8.424 8.696 -0.272 18522
8368 1 15 . 1 1 62 62 ASN N N 74 127.731 127.731 123.073 4.658 18522
8369 1 15 . 1 1 62 62 ASN HA H 74 4.520 4.520 4.216 0.304 18522
8370 1 15 . 1 1 62 62 ASN C C 74 174.878 174.878 175.480 -0.602 18522
8371 1 15 . 1 1 62 62 ASN CA C 74 54.418 54.418 54.409 0.009 18522
8372 1 15 . 1 1 62 62 ASN CB C 74 36.655 36.655 38.317 -1.662 18522
8373 1 15 . 1 1 62 62 ASN H H 74 10.384 10.384 9.353 1.031 18522
8374 1 15 . 1 1 63 63 GLY N N 75 104.633 104.633 104.486 0.147 18522
8375 1 15 . 1 1 63 63 GLY C C 75 173.610 173.610 173.400 0.210 18522
8376 1 15 . 1 1 63 63 GLY CA C 75 45.261 45.261 45.120 0.141 18522
8377 1 15 . 1 1 63 63 GLY H H 75 8.926 8.926 8.463 0.463 18522
8378 1 15 . 1 1 64 64 ARG N N 76 120.451 120.451 120.643 -0.192 18522
8379 1 15 . 1 1 64 64 ARG HA H 76 4.501 4.501 4.610 -0.109 18522
8380 1 15 . 1 1 64 64 ARG C C 76 175.085 175.085 175.627 -0.542 18522
8381 1 15 . 1 1 64 64 ARG CA C 76 54.252 54.252 53.665 0.587 18522
8382 1 15 . 1 1 64 64 ARG CB C 76 31.482 31.482 32.020 -0.538 18522
8383 1 15 . 1 1 64 64 ARG H H 76 7.753 7.753 8.087 -0.334 18522
8384 1 15 . 1 1 65 65 SER N N 77 116.586 116.586 118.531 -1.945 18522
8385 1 15 . 1 1 65 65 SER HA H 77 4.483 4.483 4.366 0.117 18522
8386 1 15 . 1 1 65 65 SER C C 77 176.953 176.953 175.702 1.251 18522
8387 1 15 . 1 1 65 65 SER CA C 77 58.292 58.292 59.044 -0.751 18522
8388 1 15 . 1 1 65 65 SER CB C 77 63.643 63.643 63.433 0.210 18522
8389 1 15 . 1 1 65 65 SER H H 77 8.555 8.555 8.780 -0.225 18522
8390 1 15 . 1 1 66 66 ILE N N 78 116.618 116.618 120.218 -3.600 18522
8391 1 15 . 1 1 66 66 ILE HA H 78 4.420 4.420 4.109 0.311 18522
8392 1 15 . 1 1 66 66 ILE C C 78 175.072 175.072 177.047 -1.975 18522
8393 1 15 . 1 1 66 66 ILE CA C 78 59.122 59.122 61.949 -2.827 18522
8394 1 15 . 1 1 66 66 ILE CB C 78 36.758 36.758 37.455 -0.697 18522
8395 1 15 . 1 1 66 66 ILE H H 78 7.599 7.599 8.798 -1.199 18522
8396 1 15 . 1 1 67 67 LYS N N 79 123.287 123.287 121.798 1.489 18522
8397 1 15 . 1 1 67 67 LYS HA H 79 4.049 4.049 4.102 -0.053 18522
8398 1 15 . 1 1 67 67 LYS C C 79 178.333 178.333 178.102 0.231 18522
8399 1 15 . 1 1 67 67 LYS CA C 79 58.321 58.321 58.223 0.098 18522
8400 1 15 . 1 1 67 67 LYS CB C 79 31.635 31.635 31.891 -0.256 18522
8401 1 15 . 1 1 67 67 LYS H H 79 7.898 7.898 8.186 -0.288 18522
8402 1 15 . 1 1 68 68 GLY N N 80 114.933 114.933 107.886 7.047 18522
8403 1 15 . 1 1 68 68 GLY C C 80 174.385 174.385 175.007 -0.622 18522
8404 1 15 . 1 1 68 68 GLY CA C 80 45.518 45.518 45.993 -0.475 18522
8405 1 15 . 1 1 68 68 GLY H H 80 8.999 8.999 8.095 0.904 18522
8406 1 15 . 1 1 69 69 LYS N N 81 119.403 119.403 119.886 -0.483 18522
8407 1 15 . 1 1 69 69 LYS HA H 81 4.043 4.043 4.529 -0.486 18522
8408 1 15 . 1 1 69 69 LYS C C 81 177.064 177.064 175.588 1.476 18522
8409 1 15 . 1 1 69 69 LYS CA C 81 54.722 54.722 55.380 -0.658 18522
8410 1 15 . 1 1 69 69 LYS CB C 81 33.560 33.560 33.442 0.118 18522
8411 1 15 . 1 1 69 69 LYS H H 81 7.845 7.845 7.989 -0.144 18522
8412 1 15 . 1 1 70 70 THR N N 82 112.066 112.066 114.363 -2.297 18522
8413 1 15 . 1 1 70 70 THR HA H 82 4.666 4.666 4.584 0.082 18522
8414 1 15 . 1 1 70 70 THR C C 82 175.955 175.955 174.541 1.414 18522
8415 1 15 . 1 1 70 70 THR CA C 82 60.438 60.438 61.197 -0.759 18522
8416 1 15 . 1 1 70 70 THR CB C 82 71.629 71.629 72.207 -0.578 18522
8417 1 15 . 1 1 70 70 THR H H 82 9.153 9.153 7.910 1.243 18522
8418 1 15 . 1 1 71 71 LYS N N 83 118.730 118.730 124.931 -6.201 18522
8419 1 15 . 1 1 71 71 LYS HA H 83 3.870 3.870 3.929 -0.059 18522
8420 1 15 . 1 1 71 71 LYS C C 83 177.464 177.464 178.403 -0.939 18522
8421 1 15 . 1 1 71 71 LYS CA C 83 60.357 60.357 60.048 0.309 18522
8422 1 15 . 1 1 71 71 LYS CB C 83 31.350 31.350 31.802 -0.452 18522
8423 1 15 . 1 1 71 71 LYS H H 83 8.969 8.969 8.847 0.122 18522
8424 1 15 . 1 1 72 72 VAL N N 84 117.444 117.444 118.648 -1.204 18522
8425 1 15 . 1 1 72 72 VAL HA H 84 3.633 3.633 3.750 -0.117 18522
8426 1 15 . 1 1 72 72 VAL C C 84 178.315 178.315 177.205 1.110 18522
8427 1 15 . 1 1 72 72 VAL CA C 84 66.079 66.079 65.765 0.314 18522
8428 1 15 . 1 1 72 72 VAL CB C 84 32.091 32.091 31.261 0.830 18522
8429 1 15 . 1 1 72 72 VAL H H 84 7.631 7.631 8.332 -0.701 18522
8430 1 15 . 1 1 73 73 GLU N N 85 120.890 120.890 119.364 1.526 18522
8431 1 15 . 1 1 73 73 GLU HA H 85 3.964 3.964 4.246 -0.282 18522
8432 1 15 . 1 1 73 73 GLU C C 85 179.971 179.971 179.045 0.926 18522
8433 1 15 . 1 1 73 73 GLU CA C 85 59.316 59.316 58.793 0.523 18522
8434 1 15 . 1 1 73 73 GLU CB C 85 30.355 30.355 29.917 0.438 18522
8435 1 15 . 1 1 73 73 GLU H H 85 7.617 7.617 8.080 -0.463 18522
8436 1 15 . 1 1 74 74 VAL N N 86 121.246 121.246 121.455 -0.209 18522
8437 1 15 . 1 1 74 74 VAL HA H 86 3.630 3.630 3.815 -0.185 18522
8438 1 15 . 1 1 74 74 VAL C C 86 177.217 177.217 177.790 -0.573 18522
8439 1 15 . 1 1 74 74 VAL CA C 86 66.678 66.678 65.756 0.922 18522
8440 1 15 . 1 1 74 74 VAL CB C 86 31.307 31.307 31.403 -0.096 18522
8441 1 15 . 1 1 74 74 VAL H H 86 8.368 8.368 8.441 -0.073 18522
8442 1 15 . 1 1 75 75 ALA N N 87 122.148 122.148 121.233 0.915 18522
8443 1 15 . 1 1 75 75 ALA HA H 87 3.947 3.947 4.066 -0.119 18522
8444 1 15 . 1 1 75 75 ALA C C 87 179.545 179.545 178.927 0.618 18522
8445 1 15 . 1 1 75 75 ALA CA C 87 55.851 55.851 55.282 0.569 18522
8446 1 15 . 1 1 75 75 ALA CB C 87 18.491 18.491 18.348 0.143 18522
8447 1 15 . 1 1 75 75 ALA H H 87 8.577 8.577 8.714 -0.137 18522
8448 1 15 . 1 1 76 76 LYS N N 88 117.733 117.733 119.800 -2.067 18522
8449 1 15 . 1 1 76 76 LYS HA H 88 4.051 4.051 3.987 0.064 18522
8450 1 15 . 1 1 76 76 LYS CA C 88 59.393 59.393 59.494 -0.101 18522
8451 1 15 . 1 1 76 76 LYS CB C 88 32.058 32.058 32.329 -0.271 18522
8452 1 15 . 1 1 76 76 LYS H H 88 7.854 7.854 7.371 0.483 18522
8453 1 15 . 1 1 77 77 MET N N 89 117.676 117.676 117.585 0.091 18522
8454 1 15 . 1 1 77 77 MET HA H 89 4.048 4.048 4.077 -0.029 18522
8455 1 15 . 1 1 77 77 MET C C 89 178.791 178.791 178.438 0.353 18522
8456 1 15 . 1 1 77 77 MET CA C 89 59.128 59.128 58.252 0.876 18522
8457 1 15 . 1 1 77 77 MET CB C 89 33.801 33.801 31.573 2.228 18522
8458 1 15 . 1 1 77 77 MET H H 89 7.759 7.759 8.379 -0.620 18522
8459 1 15 . 1 1 78 78 ILE N N 90 117.305 117.305 117.947 -0.642 18522
8460 1 15 . 1 1 78 78 ILE HA H 90 3.590 3.590 3.696 -0.106 18522
8461 1 15 . 1 1 78 78 ILE C C 90 178.658 178.658 178.194 0.464 18522
8462 1 15 . 1 1 78 78 ILE CA C 90 65.482 65.482 64.557 0.925 18522
8463 1 15 . 1 1 78 78 ILE CB C 90 38.845 38.845 36.694 2.151 18522
8464 1 15 . 1 1 78 78 ILE H H 90 7.972 7.972 7.583 0.389 18522
8465 1 15 . 1 1 79 79 GLN N N 91 120.935 120.935 118.684 2.251 18522
8466 1 15 . 1 1 79 79 GLN HA H 91 3.998 3.998 4.287 -0.289 18522
8467 1 15 . 1 1 79 79 GLN C C 91 178.274 178.274 178.259 0.015 18522
8468 1 15 . 1 1 79 79 GLN CA C 91 59.151 59.151 57.898 1.253 18522
8469 1 15 . 1 1 79 79 GLN CB C 91 28.934 28.934 28.917 0.017 18522
8470 1 15 . 1 1 79 79 GLN H H 91 8.826 8.826 8.112 0.714 18522
8471 1 15 . 1 1 80 80 GLU N N 92 115.213 115.213 120.822 -5.609 18522
8472 1 15 . 1 1 80 80 GLU HA H 92 4.061 4.061 4.080 -0.019 18522
8473 1 15 . 1 1 80 80 GLU C C 92 176.824 176.824 178.395 -1.571 18522
8474 1 15 . 1 1 80 80 GLU CA C 92 58.006 58.006 59.033 -1.027 18522
8475 1 15 . 1 1 80 80 GLU CB C 92 29.890 29.890 29.525 0.365 18522
8476 1 15 . 1 1 80 80 GLU H H 92 8.020 8.020 8.396 -0.376 18522
8477 1 15 . 1 1 81 81 VAL N N 93 119.047 119.047 115.695 3.352 18522
8478 1 15 . 1 1 81 81 VAL HA H 93 3.930 3.930 3.841 0.089 18522
8479 1 15 . 1 1 81 81 VAL C C 93 176.016 176.016 176.725 -0.709 18522
8480 1 15 . 1 1 81 81 VAL CA C 93 63.153 63.153 64.400 -1.247 18522
8481 1 15 . 1 1 81 81 VAL CB C 93 32.154 32.154 31.881 0.273 18522
8482 1 15 . 1 1 81 81 VAL H H 93 7.073 7.073 7.462 -0.389 18522
8483 1 15 . 1 1 82 82 LYS N N 94 128.366 128.366 118.683 9.683 18522
8484 1 15 . 1 1 82 82 LYS C C 94 177.460 177.460 177.046 0.414 18522
8485 1 15 . 1 1 82 82 LYS CA C 94 55.753 55.753 57.290 -1.537 18522
8486 1 15 . 1 1 82 82 LYS CB C 94 32.332 32.332 31.906 0.426 18522
8487 1 15 . 1 1 82 82 LYS H H 94 8.762 8.762 7.458 1.304 18522
8488 1 15 . 1 1 83 83 GLY N N 95 112.528 112.528 113.205 -0.677 18522
8489 1 15 . 1 1 83 83 GLY C C 95 173.468 173.468 173.023 0.445 18522
8490 1 15 . 1 1 83 83 GLY CA C 95 46.243 46.243 45.422 0.821 18522
8491 1 15 . 1 1 83 83 GLY H H 95 8.673 8.673 8.917 -0.244 18522
8492 1 15 . 1 1 84 84 GLU N N 96 121.485 121.485 118.470 3.015 18522
8493 1 15 . 1 1 84 84 GLU HA H 96 4.749 4.749 4.940 -0.191 18522
8494 1 15 . 1 1 84 84 GLU C C 96 174.583 174.583 173.911 0.672 18522
8495 1 15 . 1 1 84 84 GLU CA C 96 55.821 55.821 54.686 1.135 18522
8496 1 15 . 1 1 84 84 GLU CB C 96 31.410 31.410 33.380 -1.970 18522
8497 1 15 . 1 1 84 84 GLU H H 96 8.297 8.297 7.201 1.096 18522
8498 1 15 . 1 1 85 85 VAL N N 97 120.501 120.501 111.895 8.606 18522
8499 1 15 . 1 1 85 85 VAL HA H 97 4.665 4.665 4.728 -0.063 18522
8500 1 15 . 1 1 85 85 VAL C C 97 173.047 173.047 173.785 -0.738 18522
8501 1 15 . 1 1 85 85 VAL CA C 97 60.114 60.114 60.095 0.019 18522
8502 1 15 . 1 1 85 85 VAL CB C 97 35.184 35.184 35.326 -0.142 18522
8503 1 15 . 1 1 85 85 VAL H H 97 9.096 9.096 8.445 0.651 18522
8504 1 15 . 1 1 86 86 THR N N 98 125.019 125.019 116.493 8.526 18522
8505 1 15 . 1 1 86 86 THR HA H 98 4.076 4.076 4.983 -0.907 18522
8506 1 15 . 1 1 86 86 THR C C 98 173.807 173.807 174.190 -0.383 18522
8507 1 15 . 1 1 86 86 THR CA C 98 61.735 61.735 60.688 1.047 18522
8508 1 15 . 1 1 86 86 THR CB C 98 69.531 69.531 69.679 -0.148 18522
8509 1 15 . 1 1 86 86 THR H H 98 9.352 9.352 8.229 1.123 18522
8510 1 15 . 1 1 87 87 ILE N N 99 128.383 128.383 122.934 5.449 18522
8511 1 15 . 1 1 87 87 ILE HA H 99 4.661 4.661 4.851 -0.190 18522
8512 1 15 . 1 1 87 87 ILE C C 99 174.614 174.614 174.352 0.262 18522
8513 1 15 . 1 1 87 87 ILE CA C 99 58.258 58.258 58.933 -0.675 18522
8514 1 15 . 1 1 87 87 ILE CB C 99 38.528 38.528 39.145 -0.617 18522
8515 1 15 . 1 1 87 87 ILE H H 99 9.329 9.329 8.304 1.025 18522
8516 1 15 . 1 1 88 88 HIS N N 100 128.279 128.279 125.419 2.860 18522
8517 1 15 . 1 1 88 88 HIS HA H 100 4.948 4.948 5.308 -0.360 18522
8518 1 15 . 1 1 88 88 HIS C C 100 174.787 174.787 173.573 1.214 18522
8519 1 15 . 1 1 88 88 HIS CA C 100 54.620 54.620 55.349 -0.729 18522
8520 1 15 . 1 1 88 88 HIS H H 100 8.647 8.647 8.360 0.287 18522
8521 1 15 . 1 1 89 89 TYR N N 101 121.320 121.320 125.971 -4.651 18522
8522 1 15 . 1 1 89 89 TYR HA H 101 5.947 5.947 4.598 1.349 18522
8523 1 15 . 1 1 89 89 TYR C C 101 173.769 173.769 172.991 0.778 18522
8524 1 15 . 1 1 89 89 TYR CA C 101 55.669 55.669 58.844 -3.175 18522
8525 1 15 . 1 1 89 89 TYR CB C 101 42.195 42.195 40.959 1.236 18522
8526 1 15 . 1 1 89 89 TYR H H 101 8.414 8.414 9.376 -0.962 18522
8527 1 15 . 1 1 90 90 ASN N N 102 116.679 116.679 118.109 -1.430 18522
8528 1 15 . 1 1 90 90 ASN HA H 102 5.335 5.335 5.407 -0.072 18522
8529 1 15 . 1 1 90 90 ASN C C 102 175.406 175.406 173.510 1.896 18522
8530 1 15 . 1 1 90 90 ASN CA C 102 51.961 51.961 52.603 -0.642 18522
8531 1 15 . 1 1 90 90 ASN CB C 102 41.800 41.800 41.708 0.092 18522
8532 1 15 . 1 1 90 90 ASN H H 102 9.282 9.282 7.959 1.323 18522
8533 1 15 . 1 1 91 91 LYS N N 103 124.129 124.129 119.924 4.205 18522
8534 1 15 . 1 1 91 91 LYS C C 103 176.678 176.678 175.481 1.197 18522
8535 1 15 . 1 1 91 91 LYS CA C 103 55.006 55.006 54.998 0.008 18522
8536 1 15 . 1 1 91 91 LYS H H 103 8.949 8.949 8.370 0.579 18522
8537 1 15 . 1 1 92 92 LEU N N 104 127.043 127.043 118.524 8.519 18522
8538 1 15 . 1 1 92 92 LEU HA H 104 4.425 4.425 4.643 -0.218 18522
8539 1 15 . 1 1 92 92 LEU CA C 104 55.060 55.060 54.999 0.061 18522
8540 1 15 . 1 1 92 92 LEU CB C 104 42.559 42.559 42.209 0.350 18522
8541 1 15 . 1 1 92 92 LEU H H 104 9.150 9.150 9.454 -0.304 18522
8542 1 15 . 1 1 93 93 GLN HA H 105 4.315 4.315 4.118 0.197 18522
8543 1 15 . 1 1 93 93 GLN C C 105 175.070 175.070 175.801 -0.731 18522
8544 1 15 . 1 1 93 93 GLN CA C 105 55.490 55.490 55.968 -0.478 18522
8545 1 15 . 1 1 93 93 GLN CB C 105 28.909 28.909 27.023 1.886 18522
8546 1 15 . 1 1 94 94 ALA N N 106 125.133 125.133 129.082 -3.949 18522
8547 1 15 . 1 1 94 94 ALA HA H 106 4.366 4.366 4.230 0.136 18522
8548 1 15 . 1 1 94 94 ALA C C 106 176.392 176.392 176.308 0.084 18522
8549 1 15 . 1 1 94 94 ALA CA C 106 51.723 51.723 51.659 0.064 18522
8550 1 15 . 1 1 94 94 ALA CB C 106 20.185 20.185 20.272 -0.087 18522
8551 1 15 . 1 1 94 94 ALA H H 106 8.226 8.226 8.259 -0.033 18522
8552 1 15 . 1 1 95 95 ASP N N 107 122.013 122.013 118.184 3.829 18522
8553 1 15 . 1 1 95 95 ASP HA H 107 4.413 4.413 5.025 -0.612 18522
8554 1 15 . 1 1 95 95 ASP C C 107 175.019 175.019 175.621 -0.602 18522
8555 1 15 . 1 1 95 95 ASP CA C 107 55.642 55.642 51.887 3.755 18522
8556 1 15 . 1 1 95 95 ASP CB C 107 41.266 41.266 42.145 -0.880 18522
8557 1 15 . 1 1 95 95 ASP H H 107 8.429 8.429 8.274 0.155 18522
8558 1 15 . 1 1 96 96 PRO HA H 108 4.207 4.207 3.965 0.242 18522
8559 1 15 . 1 1 96 96 PRO C C 108 178.840 178.840 178.327 0.513 18522
8560 1 15 . 1 1 96 96 PRO CA C 108 65.396 65.396 66.561 -1.165 18522
8561 1 15 . 1 1 96 96 PRO CB C 108 32.181 32.181 31.821 0.360 18522
8562 1 15 . 1 1 97 97 LYS N N 109 117.942 117.942 115.440 2.502 18522
8563 1 15 . 1 1 97 97 LYS HA H 109 4.143 4.143 4.039 0.104 18522
8564 1 15 . 1 1 97 97 LYS C C 109 178.099 178.099 178.624 -0.525 18522
8565 1 15 . 1 1 97 97 LYS CA C 109 58.167 58.167 59.154 -0.987 18522
8566 1 15 . 1 1 97 97 LYS CB C 109 31.649 31.649 31.520 0.129 18522
8567 1 15 . 1 1 97 97 LYS H H 109 8.335 8.335 8.484 -0.149 18522
8568 1 15 . 1 1 98 98 GLN N N 110 119.159 119.159 117.442 1.717 18522
8569 1 15 . 1 1 98 98 GLN HA H 110 4.130 4.130 4.307 -0.177 18522
8570 1 15 . 1 1 98 98 GLN C C 110 178.298 178.298 178.009 0.289 18522
8571 1 15 . 1 1 98 98 GLN CA C 110 57.660 57.660 57.309 0.351 18522
8572 1 15 . 1 1 98 98 GLN CB C 110 28.720 28.720 29.335 -0.615 18522
8573 1 15 . 1 1 98 98 GLN H H 110 7.985 7.985 8.052 -0.067 18522
8574 1 15 . 1 1 99 99 LEU N N 111 120.490 120.490 122.438 -1.948 18522
8575 1 15 . 1 1 99 99 LEU HA H 111 3.877 3.877 4.339 -0.462 18522
8576 1 15 . 1 1 99 99 LEU C C 111 177.729 177.729 178.363 -0.634 18522
8577 1 15 . 1 1 99 99 LEU CA C 111 57.049 57.049 56.986 0.063 18522
8578 1 15 . 1 1 99 99 LEU CB C 111 41.466 41.466 42.225 -0.759 18522
8579 1 15 . 1 1 99 99 LEU H H 111 7.994 7.994 8.261 -0.267 18522
8580 1 15 . 1 1 100 100 GLU N N 112 118.251 118.251 119.360 -1.109 18522
8581 1 15 . 1 1 100 100 GLU HA H 112 3.972 3.972 4.232 -0.260 18522
8582 1 15 . 1 1 100 100 GLU C C 112 178.402 178.402 177.999 0.403 18522
8583 1 15 . 1 1 100 100 GLU CA C 112 59.056 59.056 58.938 0.118 18522
8584 1 15 . 1 1 100 100 GLU CB C 112 29.732 29.732 29.169 0.563 18522
8585 1 15 . 1 1 100 100 GLU H H 112 7.760 7.760 8.224 -0.464 18522
8586 1 15 . 1 1 101 101 VAL N N 113 117.229 117.229 118.145 -0.916 18522
8587 1 15 . 1 1 101 101 VAL HA H 113 3.762 3.762 3.809 -0.047 18522
8588 1 15 . 1 1 101 101 VAL C C 113 178.107 178.107 177.448 0.659 18522
8589 1 15 . 1 1 101 101 VAL CA C 113 64.791 64.791 66.071 -1.280 18522
8590 1 15 . 1 1 101 101 VAL CB C 113 32.149 32.149 31.882 0.267 18522
8591 1 15 . 1 1 101 101 VAL H H 113 7.437 7.437 7.725 -0.288 18522
8592 1 15 . 1 1 102 102 LEU N N 114 122.124 122.124 119.045 3.079 18522
8593 1 15 . 1 1 102 102 LEU HA H 114 4.033 4.033 4.187 -0.154 18522
8594 1 15 . 1 1 102 102 LEU C C 114 178.506 178.506 176.988 1.518 18522
8595 1 15 . 1 1 102 102 LEU CA C 114 57.243 57.243 56.921 0.322 18522
8596 1 15 . 1 1 102 102 LEU CB C 114 42.028 42.028 42.406 -0.378 18522
8597 1 15 . 1 1 102 102 LEU H H 114 7.765 7.765 7.434 0.331 18522
8598 1 15 . 1 1 103 103 PHE N N 115 115.346 115.346 116.727 -1.381 18522
8599 1 15 . 1 1 103 103 PHE HA H 115 4.224 4.224 4.820 -0.596 18522
8600 1 15 . 1 1 103 103 PHE C C 115 175.621 175.621 174.639 0.982 18522
8601 1 15 . 1 1 103 103 PHE CA C 115 57.537 57.537 54.915 2.622 18522
8602 1 15 . 1 1 103 103 PHE CB C 115 38.057 38.057 39.062 -1.004 18522
8603 1 15 . 1 1 103 103 PHE H H 115 7.805 7.805 7.352 0.453 18522
8604 1 15 . 1 1 104 104 GLN N N 116 119.021 119.021 117.180 1.841 18522
8605 1 15 . 1 1 104 104 GLN HA H 116 4.407 4.407 3.747 0.660 18522
8606 1 15 . 1 1 104 104 GLN C C 116 176.402 176.402 175.425 0.977 18522
8607 1 15 . 1 1 104 104 GLN CA C 116 55.521 55.521 58.379 -2.858 18522
8608 1 15 . 1 1 104 104 GLN CB C 116 29.170 29.170 27.228 1.942 18522
8609 1 15 . 1 1 104 104 GLN H H 116 7.974 7.974 7.961 0.013 18522
8610 1 15 . 1 1 105 105 GLY N N 117 108.868 108.868 105.428 3.440 18522
8611 1 15 . 1 1 105 105 GLY CA C 117 45.124 45.124 45.310 -0.186 18522
8612 1 15 . 1 1 105 105 GLY H H 117 8.195 8.195 7.757 0.438 18522
8613 1 15 . 1 1 106 106 PRO HA H 118 4.490 4.490 4.494 -0.004 18522
8614 1 15 . 1 1 106 106 PRO C C 118 176.001 176.001 175.384 0.617 18522
8615 1 15 . 1 1 106 106 PRO CA C 118 63.523 63.523 63.009 0.514 18522
8616 1 15 . 1 1 106 106 PRO CB C 118 32.078 32.078 32.792 -0.714 18522
8617 1 15 . 1 1 107 107 GLN N N 119 126.950 126.950 122.640 4.310 18522
8618 1 15 . 1 1 107 107 GLN C C 119 181.211 181.211 175.007 6.204 18522
8619 1 15 . 1 1 107 107 GLN CA C 119 57.416 57.416 55.294 2.122 18522
8620 1 15 . 1 1 107 107 GLN H H 119 8.079 8.079 8.647 -0.568 18522
8621 1 15 . 1 1 111 111 ARG C C 123 174.608 174.608 175.954 -1.346 18522
8622 1 15 . 1 1 111 111 ARG CA C 123 55.099 55.099 55.502 -0.403 18522
8623 1 15 . 1 1 112 112 HIS N N 124 122.212 122.212 115.143 7.069 18522
8624 1 15 . 1 1 112 112 HIS HA H 124 4.718 4.718 3.969 0.749 18522
8625 1 15 . 1 1 112 112 HIS C C 124 176.040 176.040 173.336 2.704 18522
8626 1 15 . 1 1 112 112 HIS CA C 124 54.213 54.213 56.611 -2.398 18522
8627 1 15 . 1 1 112 112 HIS CB C 124 31.164 31.164 28.190 2.974 18522
8628 1 15 . 1 1 112 112 HIS H H 124 7.640 7.640 7.181 0.459 18522
8629 1 15 . 1 1 113 113 TRP C C 125 176.168 176.168 176.258 -0.090 18522
8630 1 15 . 1 1 114 114 LEU N N 126 121.893 121.893 119.994 1.899 18522
8631 1 15 . 1 1 114 114 LEU HA H 126 4.869 4.869 5.175 -0.306 18522
8632 1 15 . 1 1 114 114 LEU CA C 126 54.151 54.151 53.153 0.998 18522
8633 1 15 . 1 1 114 114 LEU CB C 126 45.144 45.144 45.430 -0.286 18522
8634 1 15 . 1 1 114 114 LEU H H 126 8.606 8.606 9.066 -0.460 18522
8635 1 15 . 1 1 115 115 LYS N N 127 125.850 125.850 118.784 7.066 18522
8636 1 15 . 1 1 115 115 LYS HA H 127 4.203 4.203 5.075 -0.872 18522
8637 1 15 . 1 1 115 115 LYS C C 127 175.564 175.564 174.760 0.804 18522
8638 1 15 . 1 1 115 115 LYS CA C 127 57.252 57.252 55.365 1.887 18522
8639 1 15 . 1 1 115 115 LYS CB C 127 33.406 33.406 35.237 -1.831 18522
8640 1 15 . 1 1 115 115 LYS H H 127 8.647 8.647 8.204 0.443 18522
8641 1 16 . 1 1 3 3 PRO C C 15 177.225 177.225 176.336 0.889 18522
8642 1 16 . 1 1 3 3 PRO CA C 15 63.508 63.508 62.480 1.028 18522
8643 1 16 . 1 1 3 3 PRO CB C 15 32.090 32.090 30.324 1.766 18522
8644 1 16 . 1 1 4 4 GLY N N 16 108.829 108.829 110.311 -1.482 18522
8645 1 16 . 1 1 4 4 GLY C C 16 173.398 173.398 174.018 -0.620 18522
8646 1 16 . 1 1 4 4 GLY CA C 16 45.128 45.128 44.798 0.330 18522
8647 1 16 . 1 1 4 4 GLY H H 16 8.489 8.489 8.136 0.353 18522
8648 1 16 . 1 1 5 5 ILE N N 17 121.763 121.763 122.189 -0.426 18522
8649 1 16 . 1 1 5 5 ILE HA H 17 4.554 4.554 4.642 -0.088 18522
8650 1 16 . 1 1 5 5 ILE C C 17 174.332 174.332 174.923 -0.591 18522
8651 1 16 . 1 1 5 5 ILE CA C 17 58.245 58.245 57.493 0.752 18522
8652 1 16 . 1 1 5 5 ILE CB C 17 38.762 38.762 39.493 -0.731 18522
8653 1 16 . 1 1 5 5 ILE H H 17 8.014 8.014 7.729 0.285 18522
8654 1 16 . 1 1 6 6 PRO C C 18 176.437 176.437 176.376 0.061 18522
8655 1 16 . 1 1 6 6 PRO CA C 18 62.667 62.667 64.629 -1.962 18522
8656 1 16 . 1 1 6 6 PRO CB C 18 32.469 32.469 32.103 0.366 18522
8657 1 16 . 1 1 7 7 VAL N N 19 123.849 123.849 118.246 5.603 18522
8658 1 16 . 1 1 7 7 VAL HA H 19 4.550 4.550 4.406 0.144 18522
8659 1 16 . 1 1 7 7 VAL C C 19 174.453 174.453 173.516 0.937 18522
8660 1 16 . 1 1 7 7 VAL CA C 19 59.846 59.846 59.400 0.446 18522
8661 1 16 . 1 1 7 7 VAL CB C 19 33.510 33.510 34.351 -0.841 18522
8662 1 16 . 1 1 7 7 VAL H H 19 8.754 8.754 7.795 0.959 18522
8663 1 16 . 1 1 8 8 PRO HA H 20 5.338 5.338 4.183 1.155 18522
8664 1 16 . 1 1 8 8 PRO C C 20 177.585 177.585 175.884 1.701 18522
8665 1 16 . 1 1 8 8 PRO CA C 20 62.406 62.406 62.631 -0.225 18522
8666 1 16 . 1 1 8 8 PRO CB C 20 32.891 32.891 31.295 1.596 18522
8667 1 16 . 1 1 9 9 GLY N N 21 108.426 108.426 111.359 -2.933 18522
8668 1 16 . 1 1 9 9 GLY C C 21 171.443 171.443 171.340 0.103 18522
8669 1 16 . 1 1 9 9 GLY CA C 21 44.581 44.581 43.558 1.023 18522
8670 1 16 . 1 1 9 9 GLY H H 21 8.258 8.258 7.924 0.334 18522
8671 1 16 . 1 1 10 10 LYS N N 22 117.372 117.372 118.691 -1.319 18522
8672 1 16 . 1 1 10 10 LYS HA H 22 4.039 4.039 5.448 -1.409 18522
8673 1 16 . 1 1 10 10 LYS C C 22 174.463 174.463 175.044 -0.581 18522
8674 1 16 . 1 1 10 10 LYS CA C 22 55.263 55.263 55.018 0.245 18522
8675 1 16 . 1 1 10 10 LYS CB C 22 35.227 35.227 35.814 -0.587 18522
8676 1 16 . 1 1 10 10 LYS H H 22 8.175 8.175 7.744 0.431 18522
8677 1 16 . 1 1 11 11 VAL N N 23 120.387 120.387 117.033 3.354 18522
8678 1 16 . 1 1 11 11 VAL HA H 23 4.708 4.708 4.684 0.024 18522
8679 1 16 . 1 1 11 11 VAL C C 23 171.873 171.873 173.605 -1.732 18522
8680 1 16 . 1 1 11 11 VAL CA C 23 59.866 59.866 59.813 0.053 18522
8681 1 16 . 1 1 11 11 VAL CB C 23 35.269 35.269 35.291 -0.022 18522
8682 1 16 . 1 1 11 11 VAL H H 23 8.862 8.862 8.328 0.534 18522
8683 1 16 . 1 1 12 12 THR N N 24 125.797 125.797 118.817 6.980 18522
8684 1 16 . 1 1 12 12 THR HA H 24 5.121 5.121 5.155 -0.034 18522
8685 1 16 . 1 1 12 12 THR C C 24 173.407 173.407 173.854 -0.447 18522
8686 1 16 . 1 1 12 12 THR CA C 24 62.115 62.115 60.492 1.623 18522
8687 1 16 . 1 1 12 12 THR CB C 24 69.606 69.606 69.412 0.194 18522
8688 1 16 . 1 1 12 12 THR H H 24 8.859 8.859 8.364 0.495 18522
8689 1 16 . 1 1 13 13 LEU N N 25 127.960 127.960 126.878 1.082 18522
8690 1 16 . 1 1 13 13 LEU HA H 25 4.809 4.809 4.852 -0.043 18522
8691 1 16 . 1 1 13 13 LEU C C 25 175.029 175.029 174.980 0.049 18522
8692 1 16 . 1 1 13 13 LEU CA C 25 52.623 52.623 53.124 -0.501 18522
8693 1 16 . 1 1 13 13 LEU CB C 25 46.242 46.242 45.568 0.674 18522
8694 1 16 . 1 1 13 13 LEU H H 25 9.258 9.258 8.440 0.818 18522
8695 1 16 . 1 1 14 14 GLN N N 26 120.858 120.858 117.324 3.534 18522
8696 1 16 . 1 1 14 14 GLN HA H 26 4.482 4.482 4.580 -0.098 18522
8697 1 16 . 1 1 14 14 GLN C C 26 174.515 174.515 174.783 -0.268 18522
8698 1 16 . 1 1 14 14 GLN CA C 26 54.576 54.576 54.236 0.340 18522
8699 1 16 . 1 1 14 14 GLN CB C 26 29.516 29.516 32.115 -2.599 18522
8700 1 16 . 1 1 14 14 GLN H H 26 8.530 8.530 8.328 0.202 18522
8701 1 16 . 1 1 15 15 LYS N N 27 119.583 119.583 122.466 -2.883 18522
8702 1 16 . 1 1 15 15 LYS HA H 27 4.180 4.180 4.324 -0.144 18522
8703 1 16 . 1 1 15 15 LYS C C 27 177.468 177.468 177.235 0.233 18522
8704 1 16 . 1 1 15 15 LYS CA C 27 55.956 55.956 56.715 -0.759 18522
8705 1 16 . 1 1 15 15 LYS CB C 27 34.099 34.099 32.528 1.571 18522
8706 1 16 . 1 1 15 15 LYS H H 27 8.099 8.099 8.173 -0.074 18522
8707 1 16 . 1 1 16 16 ASP N N 28 121.439 121.439 122.014 -0.575 18522
8708 1 16 . 1 1 16 16 ASP HA H 28 4.590 4.590 4.630 -0.040 18522
8709 1 16 . 1 1 16 16 ASP C C 28 178.392 178.392 177.808 0.584 18522
8710 1 16 . 1 1 16 16 ASP CA C 28 52.426 52.426 53.443 -1.016 18522
8711 1 16 . 1 1 16 16 ASP CB C 28 41.377 41.377 41.422 -0.045 18522
8712 1 16 . 1 1 16 16 ASP H H 28 8.888 8.888 8.572 0.316 18522
8713 1 16 . 1 1 17 17 ALA N N 29 119.578 119.578 120.417 -0.839 18522
8714 1 16 . 1 1 17 17 ALA HA H 29 4.188 4.188 4.135 0.053 18522
8715 1 16 . 1 1 17 17 ALA C C 29 178.763 178.763 178.441 0.322 18522
8716 1 16 . 1 1 17 17 ALA CA C 29 54.434 54.434 54.514 -0.080 18522
8717 1 16 . 1 1 17 17 ALA CB C 29 18.293 18.293 18.672 -0.379 18522
8718 1 16 . 1 1 17 17 ALA H H 29 8.392 8.392 8.423 -0.031 18522
8719 1 16 . 1 1 18 18 GLN N N 30 117.564 117.564 116.459 1.105 18522
8720 1 16 . 1 1 18 18 GLN HA H 30 4.399 4.399 4.299 0.100 18522
8721 1 16 . 1 1 18 18 GLN C C 30 175.168 175.168 175.560 -0.392 18522
8722 1 16 . 1 1 18 18 GLN CA C 30 55.339 55.339 55.005 0.334 18522
8723 1 16 . 1 1 18 18 GLN CB C 30 28.589 28.589 29.018 -0.429 18522
8724 1 16 . 1 1 18 18 GLN H H 30 8.353 8.353 8.443 -0.090 18522
8725 1 16 . 1 1 19 19 ASN N N 31 115.365 115.365 116.479 -1.114 18522
8726 1 16 . 1 1 19 19 ASN HA H 31 4.315 4.315 4.399 -0.084 18522
8727 1 16 . 1 1 19 19 ASN C C 31 174.043 174.043 173.601 0.442 18522
8728 1 16 . 1 1 19 19 ASN CA C 31 54.303 54.303 54.396 -0.093 18522
8729 1 16 . 1 1 19 19 ASN CB C 31 37.610 37.610 37.641 -0.031 18522
8730 1 16 . 1 1 19 19 ASN H H 31 8.521 8.521 7.907 0.614 18522
8731 1 16 . 1 1 20 20 LEU N N 32 118.660 118.660 112.887 5.773 18522
8732 1 16 . 1 1 20 20 LEU HA H 32 4.900 4.900 4.946 -0.046 18522
8733 1 16 . 1 1 20 20 LEU C C 32 178.117 178.117 176.299 1.818 18522
8734 1 16 . 1 1 20 20 LEU CA C 32 53.957 53.957 53.122 0.835 18522
8735 1 16 . 1 1 20 20 LEU CB C 32 44.774 44.774 43.598 1.176 18522
8736 1 16 . 1 1 20 20 LEU H H 32 8.155 8.155 8.349 -0.194 18522
8737 1 16 . 1 1 21 21 ILE N N 33 116.785 116.785 116.183 0.602 18522
8738 1 16 . 1 1 21 21 ILE HA H 33 4.674 4.674 4.419 0.255 18522
8739 1 16 . 1 1 21 21 ILE C C 33 176.185 176.185 176.601 -0.416 18522
8740 1 16 . 1 1 21 21 ILE CA C 33 62.602 62.602 61.327 1.275 18522
8741 1 16 . 1 1 21 21 ILE CB C 33 39.016 39.016 39.269 -0.253 18522
8742 1 16 . 1 1 21 21 ILE H H 33 11.488 11.488 8.372 3.116 18522
8743 1 16 . 1 1 22 22 GLY N N 34 111.234 111.234 108.360 2.874 18522
8744 1 16 . 1 1 22 22 GLY C C 34 173.993 173.993 173.608 0.385 18522
8745 1 16 . 1 1 22 22 GLY CA C 34 45.980 45.980 45.239 0.741 18522
8746 1 16 . 1 1 22 22 GLY H H 34 9.854 9.854 8.683 1.171 18522
8747 1 16 . 1 1 23 23 ILE N N 35 111.117 111.117 113.269 -2.152 18522
8748 1 16 . 1 1 23 23 ILE HA H 35 5.535 5.535 5.533 0.002 18522
8749 1 16 . 1 1 23 23 ILE C C 35 175.033 175.033 174.245 0.788 18522
8750 1 16 . 1 1 23 23 ILE CA C 35 58.415 58.415 57.822 0.593 18522
8751 1 16 . 1 1 23 23 ILE CB C 35 41.577 41.577 41.943 -0.366 18522
8752 1 16 . 1 1 23 23 ILE H H 35 7.835 7.835 7.156 0.679 18522
8753 1 16 . 1 1 24 24 SER N N 36 114.908 114.908 116.820 -1.912 18522
8754 1 16 . 1 1 24 24 SER HA H 36 4.232 4.232 5.085 -0.853 18522
8755 1 16 . 1 1 24 24 SER C C 36 174.735 174.735 172.945 1.790 18522
8756 1 16 . 1 1 24 24 SER CA C 36 56.121 56.121 57.183 -1.062 18522
8757 1 16 . 1 1 24 24 SER CB C 36 66.097 66.097 65.759 0.338 18522
8758 1 16 . 1 1 24 24 SER H H 36 8.623 8.623 8.245 0.378 18522
8759 1 16 . 1 1 25 25 ILE N N 37 117.739 117.739 125.259 -7.520 18522
8760 1 16 . 1 1 25 25 ILE C C 37 174.340 174.340 175.671 -1.331 18522
8761 1 16 . 1 1 25 25 ILE CA C 37 59.123 59.123 59.203 -0.080 18522
8762 1 16 . 1 1 25 25 ILE CB C 37 41.637 41.637 40.146 1.491 18522
8763 1 16 . 1 1 25 25 ILE H H 37 9.130 9.130 8.732 0.398 18522
8764 1 16 . 1 1 26 26 GLY N N 38 108.069 108.069 111.075 -3.006 18522
8765 1 16 . 1 1 26 26 GLY CA C 38 44.112 44.112 44.277 -0.165 18522
8766 1 16 . 1 1 26 26 GLY H H 38 8.841 8.841 9.113 -0.272 18522
8767 1 16 . 1 1 27 27 GLY N N 39 109.016 109.016 106.547 2.469 18522
8768 1 16 . 1 1 27 27 GLY C C 39 173.956 173.956 174.312 -0.356 18522
8769 1 16 . 1 1 27 27 GLY H H 39 8.187 8.187 8.372 -0.185 18522
8770 1 16 . 1 1 28 28 GLY N N 40 111.783 111.783 109.801 1.982 18522
8771 1 16 . 1 1 28 28 GLY C C 40 174.255 174.255 173.988 0.267 18522
8772 1 16 . 1 1 28 28 GLY CA C 40 47.098 47.098 45.356 1.742 18522
8773 1 16 . 1 1 28 28 GLY H H 40 8.275 8.275 8.244 0.031 18522
8774 1 16 . 1 1 29 29 ALA N N 41 123.128 123.128 123.805 -0.677 18522
8775 1 16 . 1 1 29 29 ALA HA H 41 4.559 4.559 4.179 0.380 18522
8776 1 16 . 1 1 29 29 ALA CA C 41 51.073 51.073 54.349 -3.276 18522
8777 1 16 . 1 1 29 29 ALA CB C 41 21.926 21.926 18.955 2.971 18522
8778 1 16 . 1 1 29 29 ALA H H 41 8.012 8.012 8.287 -0.275 18522
8779 1 16 . 1 1 31 31 TYR HA H 43 4.549 4.549 4.431 0.118 18522
8780 1 16 . 1 1 31 31 TYR CA C 43 57.147 57.147 56.441 0.705 18522
8781 1 16 . 1 1 31 31 TYR CB C 43 37.495 37.495 38.193 -0.698 18522
8782 1 16 . 1 1 32 32 CYS N N 44 119.332 119.332 118.124 1.208 18522
8783 1 16 . 1 1 32 32 CYS HA H 44 4.859 4.859 4.252 0.607 18522
8784 1 16 . 1 1 32 32 CYS CA C 44 57.406 57.406 58.024 -0.618 18522
8785 1 16 . 1 1 32 32 CYS CB C 44 27.673 27.673 26.923 0.750 18522
8786 1 16 . 1 1 32 32 CYS H H 44 7.504 7.504 7.960 -0.456 18522
8787 1 16 . 1 1 33 33 PRO HA H 45 4.413 4.413 4.488 -0.075 18522
8788 1 16 . 1 1 33 33 PRO CA C 45 64.885 64.885 64.307 0.578 18522
8789 1 16 . 1 1 33 33 PRO CB C 45 32.318 32.318 32.254 0.064 18522
8790 1 16 . 1 1 34 34 CYS N N 46 117.327 117.327 114.906 2.421 18522
8791 1 16 . 1 1 34 34 CYS C C 46 172.064 172.064 174.488 -2.424 18522
8792 1 16 . 1 1 34 34 CYS CA C 46 60.066 60.066 58.202 1.864 18522
8793 1 16 . 1 1 34 34 CYS CB C 46 28.715 28.715 31.505 -2.790 18522
8794 1 16 . 1 1 34 34 CYS H H 46 7.973 7.973 7.893 0.080 18522
8795 1 16 . 1 1 35 35 LEU N N 47 124.270 124.270 116.295 7.975 18522
8796 1 16 . 1 1 35 35 LEU HA H 47 4.928 4.928 4.624 0.304 18522
8797 1 16 . 1 1 35 35 LEU C C 47 175.076 175.076 174.573 0.503 18522
8798 1 16 . 1 1 35 35 LEU CA C 47 53.278 53.278 56.121 -2.843 18522
8799 1 16 . 1 1 35 35 LEU CB C 47 44.321 44.321 42.013 2.308 18522
8800 1 16 . 1 1 35 35 LEU H H 47 8.629 8.629 9.216 -0.587 18522
8801 1 16 . 1 1 36 36 TYR N N 48 119.326 119.326 120.216 -0.890 18522
8802 1 16 . 1 1 36 36 TYR HA H 48 5.255 5.255 5.011 0.244 18522
8803 1 16 . 1 1 36 36 TYR C C 48 175.766 175.766 175.768 -0.002 18522
8804 1 16 . 1 1 36 36 TYR CA C 48 56.696 56.696 59.178 -2.482 18522
8805 1 16 . 1 1 36 36 TYR CB C 48 42.590 42.590 39.377 3.213 18522
8806 1 16 . 1 1 36 36 TYR H H 48 8.761 8.761 7.721 1.040 18522
8807 1 16 . 1 1 37 37 ILE N N 49 120.259 120.259 122.618 -2.359 18522
8808 1 16 . 1 1 37 37 ILE HA H 49 4.215 4.215 4.729 -0.514 18522
8809 1 16 . 1 1 37 37 ILE C C 49 177.429 177.429 175.862 1.567 18522
8810 1 16 . 1 1 37 37 ILE CA C 49 62.456 62.456 59.460 2.996 18522
8811 1 16 . 1 1 37 37 ILE CB C 49 37.352 37.352 38.828 -1.476 18522
8812 1 16 . 1 1 37 37 ILE H H 49 8.959 8.959 8.806 0.153 18522
8813 1 16 . 1 1 38 38 VAL HA H 50 3.937 3.937 3.863 0.074 18522
8814 1 16 . 1 1 38 38 VAL C C 50 174.408 174.408 175.381 -0.973 18522
8815 1 16 . 1 1 38 38 VAL CA C 50 62.259 62.259 64.440 -2.181 18522
8816 1 16 . 1 1 38 38 VAL CB C 50 31.584 31.584 32.342 -0.758 18522
8817 1 16 . 1 1 39 39 GLN N N 51 116.821 116.821 114.406 2.415 18522
8818 1 16 . 1 1 39 39 GLN HA H 51 4.103 4.103 4.445 -0.342 18522
8819 1 16 . 1 1 39 39 GLN C C 51 172.856 172.856 172.889 -0.033 18522
8820 1 16 . 1 1 39 39 GLN CA C 51 55.127 55.127 55.244 -0.117 18522
8821 1 16 . 1 1 39 39 GLN CB C 51 32.376 32.376 31.930 0.445 18522
8822 1 16 . 1 1 39 39 GLN H H 51 6.967 6.967 7.534 -0.567 18522
8823 1 16 . 1 1 40 40 VAL N N 52 123.482 123.482 119.376 4.106 18522
8824 1 16 . 1 1 40 40 VAL HA H 52 4.277 4.277 5.066 -0.789 18522
8825 1 16 . 1 1 40 40 VAL C C 52 176.198 176.198 174.104 2.094 18522
8826 1 16 . 1 1 40 40 VAL CA C 52 61.574 61.574 59.549 2.025 18522
8827 1 16 . 1 1 40 40 VAL CB C 52 32.875 32.875 35.299 -2.424 18522
8828 1 16 . 1 1 40 40 VAL H H 52 8.447 8.447 8.149 0.298 18522
8829 1 16 . 1 1 41 41 PHE N N 53 128.296 128.296 122.307 5.989 18522
8830 1 16 . 1 1 41 41 PHE HA H 53 4.400 4.400 4.813 -0.413 18522
8831 1 16 . 1 1 41 41 PHE C C 53 175.299 175.299 175.903 -0.604 18522
8832 1 16 . 1 1 41 41 PHE CA C 53 58.494 58.494 57.221 1.273 18522
8833 1 16 . 1 1 41 41 PHE CB C 53 39.561 39.561 40.709 -1.148 18522
8834 1 16 . 1 1 41 41 PHE H H 53 8.707 8.707 8.537 0.170 18522
8835 1 16 . 1 1 42 42 ASP N N 54 122.696 122.696 123.589 -0.893 18522
8836 1 16 . 1 1 42 42 ASP HA H 54 4.272 4.272 4.340 -0.068 18522
8837 1 16 . 1 1 42 42 ASP C C 54 176.837 176.837 176.465 0.372 18522
8838 1 16 . 1 1 42 42 ASP CA C 54 55.291 55.291 56.650 -1.359 18522
8839 1 16 . 1 1 42 42 ASP CB C 54 41.093 41.093 40.989 0.103 18522
8840 1 16 . 1 1 42 42 ASP H H 54 8.901 8.901 9.024 -0.123 18522
8841 1 16 . 1 1 43 43 ASN N N 55 113.923 113.923 113.215 0.708 18522
8842 1 16 . 1 1 43 43 ASN HA H 55 4.258 4.258 4.781 -0.523 18522
8843 1 16 . 1 1 43 43 ASN C C 55 173.714 173.714 175.289 -1.575 18522
8844 1 16 . 1 1 43 43 ASN CA C 55 54.958 54.958 52.988 1.970 18522
8845 1 16 . 1 1 43 43 ASN CB C 55 37.150 37.150 39.512 -2.362 18522
8846 1 16 . 1 1 43 43 ASN H H 55 9.319 9.319 8.031 1.288 18522
8847 1 16 . 1 1 44 44 THR N N 56 108.020 108.020 115.294 -7.274 18522
8848 1 16 . 1 1 44 44 THR HA H 56 5.377 5.377 4.802 0.575 18522
8849 1 16 . 1 1 44 44 THR CA C 56 59.712 59.712 60.196 -0.484 18522
8850 1 16 . 1 1 44 44 THR CB C 56 69.529 69.529 70.019 -0.490 18522
8851 1 16 . 1 1 44 44 THR H H 56 7.149 7.149 8.005 -0.856 18522
8852 1 16 . 1 1 45 45 PRO HA H 57 4.304 4.304 4.107 0.197 18522
8853 1 16 . 1 1 45 45 PRO C C 57 180.141 180.141 178.034 2.107 18522
8854 1 16 . 1 1 45 45 PRO CA C 57 66.090 66.090 65.821 0.269 18522
8855 1 16 . 1 1 45 45 PRO CB C 57 33.194 33.194 31.514 1.680 18522
8856 1 16 . 1 1 46 46 ALA N N 58 116.854 116.854 119.600 -2.746 18522
8857 1 16 . 1 1 46 46 ALA HA H 58 4.035 4.035 4.018 0.017 18522
8858 1 16 . 1 1 46 46 ALA C C 58 180.647 180.647 179.590 1.057 18522
8859 1 16 . 1 1 46 46 ALA CA C 58 55.195 55.195 55.210 -0.015 18522
8860 1 16 . 1 1 46 46 ALA CB C 58 18.880 18.880 18.146 0.734 18522
8861 1 16 . 1 1 46 46 ALA H H 58 8.938 8.938 7.816 1.122 18522
8862 1 16 . 1 1 47 47 ALA N N 59 123.250 123.250 120.573 2.677 18522
8863 1 16 . 1 1 47 47 ALA HA H 59 4.030 4.030 4.074 -0.044 18522
8864 1 16 . 1 1 47 47 ALA C C 59 179.852 179.852 179.912 -0.060 18522
8865 1 16 . 1 1 47 47 ALA CA C 59 54.939 54.939 54.654 0.285 18522
8866 1 16 . 1 1 47 47 ALA CB C 59 19.688 19.688 18.863 0.825 18522
8867 1 16 . 1 1 47 47 ALA H H 59 7.658 7.658 7.414 0.244 18522
8868 1 16 . 1 1 48 48 LEU N N 60 118.654 118.654 119.302 -0.648 18522
8869 1 16 . 1 1 48 48 LEU HA H 60 4.026 4.026 4.176 -0.150 18522
8870 1 16 . 1 1 48 48 LEU C C 60 179.238 179.238 178.428 0.810 18522
8871 1 16 . 1 1 48 48 LEU CA C 60 57.261 57.261 58.109 -0.848 18522
8872 1 16 . 1 1 48 48 LEU CB C 60 41.445 41.445 41.329 0.116 18522
8873 1 16 . 1 1 48 48 LEU H H 60 8.636 8.636 8.501 0.135 18522
8874 1 16 . 1 1 49 49 ASP N N 61 117.382 117.382 118.165 -0.783 18522
8875 1 16 . 1 1 49 49 ASP HA H 61 4.421 4.421 4.606 -0.185 18522
8876 1 16 . 1 1 49 49 ASP C C 61 177.668 177.668 178.333 -0.665 18522
8877 1 16 . 1 1 49 49 ASP CA C 61 57.087 57.087 54.551 2.536 18522
8878 1 16 . 1 1 49 49 ASP CB C 61 44.478 44.478 41.260 3.218 18522
8879 1 16 . 1 1 49 49 ASP H H 61 7.665 7.665 7.936 -0.271 18522
8880 1 16 . 1 1 50 50 GLY N N 62 103.228 103.228 108.408 -5.180 18522
8881 1 16 . 1 1 50 50 GLY C C 62 174.776 174.776 174.813 -0.037 18522
8882 1 16 . 1 1 50 50 GLY CA C 62 46.533 46.533 46.262 0.271 18522
8883 1 16 . 1 1 50 50 GLY H H 62 7.216 7.216 7.784 -0.568 18522
8884 1 16 . 1 1 51 51 THR N N 63 117.230 117.230 112.594 4.636 18522
8885 1 16 . 1 1 51 51 THR HA H 63 3.907 3.907 3.901 0.006 18522
8886 1 16 . 1 1 51 51 THR C C 63 175.961 175.961 173.546 2.415 18522
8887 1 16 . 1 1 51 51 THR CA C 63 66.478 66.478 62.814 3.664 18522
8888 1 16 . 1 1 51 51 THR CB C 63 68.268 68.268 66.551 1.717 18522
8889 1 16 . 1 1 51 51 THR H H 63 8.319 8.319 7.723 0.596 18522
8890 1 16 . 1 1 52 52 VAL N N 64 113.826 113.826 114.373 -0.547 18522
8891 1 16 . 1 1 52 52 VAL HA H 64 3.950 3.950 4.389 -0.439 18522
8892 1 16 . 1 1 52 52 VAL C C 64 173.883 173.883 174.582 -0.699 18522
8893 1 16 . 1 1 52 52 VAL CA C 64 60.708 60.708 59.818 0.890 18522
8894 1 16 . 1 1 52 52 VAL CB C 64 33.079 33.079 30.927 2.152 18522
8895 1 16 . 1 1 52 52 VAL H H 64 8.147 8.147 7.461 0.686 18522
8896 1 16 . 1 1 53 53 ALA N N 65 123.521 123.521 123.553 -0.032 18522
8897 1 16 . 1 1 53 53 ALA HA H 65 4.414 4.414 4.387 0.027 18522
8898 1 16 . 1 1 53 53 ALA C C 65 175.247 175.247 176.638 -1.391 18522
8899 1 16 . 1 1 53 53 ALA CA C 65 50.440 50.440 50.988 -0.548 18522
8900 1 16 . 1 1 53 53 ALA CB C 65 23.266 23.266 20.151 3.115 18522
8901 1 16 . 1 1 53 53 ALA H H 65 8.633 8.633 7.451 1.182 18522
8902 1 16 . 1 1 54 54 ALA N N 66 120.818 120.818 122.235 -1.417 18522
8903 1 16 . 1 1 54 54 ALA HA H 66 3.720 3.720 4.048 -0.328 18522
8904 1 16 . 1 1 54 54 ALA C C 66 178.411 178.411 178.648 -0.237 18522
8905 1 16 . 1 1 54 54 ALA CA C 66 53.016 53.016 53.522 -0.506 18522
8906 1 16 . 1 1 54 54 ALA CB C 66 17.840 17.840 17.484 0.356 18522
8907 1 16 . 1 1 54 54 ALA H H 66 8.451 8.451 8.239 0.212 18522
8908 1 16 . 1 1 55 55 GLY N N 67 112.260 112.260 113.430 -1.170 18522
8909 1 16 . 1 1 55 55 GLY C C 67 173.296 173.296 174.237 -0.941 18522
8910 1 16 . 1 1 55 55 GLY CA C 67 45.025 45.025 44.802 0.223 18522
8911 1 16 . 1 1 55 55 GLY H H 67 9.600 9.600 9.320 0.280 18522
8912 1 16 . 1 1 56 56 ASP N N 68 121.293 121.293 123.207 -1.914 18522
8913 1 16 . 1 1 56 56 ASP HA H 68 4.861 4.861 4.821 0.040 18522
8914 1 16 . 1 1 56 56 ASP C C 68 174.937 174.937 174.795 0.142 18522
8915 1 16 . 1 1 56 56 ASP CA C 68 55.641 55.641 55.499 0.142 18522
8916 1 16 . 1 1 56 56 ASP CB C 68 40.696 40.696 42.314 -1.618 18522
8917 1 16 . 1 1 56 56 ASP H H 68 8.043 8.043 8.097 -0.054 18522
8918 1 16 . 1 1 57 57 GLU N N 69 122.814 122.814 119.802 3.012 18522
8919 1 16 . 1 1 57 57 GLU C C 69 177.202 177.202 176.000 1.202 18522
8920 1 16 . 1 1 57 57 GLU CA C 69 54.472 54.472 55.562 -1.090 18522
8921 1 16 . 1 1 57 57 GLU CB C 69 32.800 32.800 31.153 1.647 18522
8922 1 16 . 1 1 57 57 GLU H H 69 8.455 8.455 8.117 0.338 18522
8923 1 16 . 1 1 58 58 ILE N N 70 125.862 125.862 127.656 -1.794 18522
8924 1 16 . 1 1 58 58 ILE HA H 70 4.526 4.526 4.534 -0.008 18522
8925 1 16 . 1 1 58 58 ILE C C 70 175.035 175.035 175.864 -0.829 18522
8926 1 16 . 1 1 58 58 ILE CA C 70 60.918 60.918 60.293 0.625 18522
8927 1 16 . 1 1 58 58 ILE CB C 70 39.236 39.236 37.642 1.594 18522
8928 1 16 . 1 1 58 58 ILE H H 70 8.619 8.619 9.192 -0.573 18522
8929 1 16 . 1 1 59 59 THR N N 71 115.507 115.507 122.224 -6.717 18522
8930 1 16 . 1 1 59 59 THR HA H 71 4.513 4.513 4.324 0.189 18522
8931 1 16 . 1 1 59 59 THR C C 71 176.425 176.425 174.596 1.829 18522
8932 1 16 . 1 1 59 59 THR CA C 71 61.158 61.158 62.989 -1.831 18522
8933 1 16 . 1 1 59 59 THR CB C 71 69.604 69.604 69.388 0.216 18522
8934 1 16 . 1 1 59 59 THR H H 71 9.242 9.242 8.387 0.855 18522
8935 1 16 . 1 1 60 60 GLY N N 72 111.789 111.789 108.408 3.381 18522
8936 1 16 . 1 1 60 60 GLY C C 72 170.981 170.981 171.665 -0.684 18522
8937 1 16 . 1 1 60 60 GLY CA C 72 46.554 46.554 45.477 1.077 18522
8938 1 16 . 1 1 60 60 GLY H H 72 7.883 7.883 7.804 0.079 18522
8939 1 16 . 1 1 61 61 VAL N N 73 119.277 119.277 116.857 2.420 18522
8940 1 16 . 1 1 61 61 VAL C C 73 175.951 175.951 175.990 -0.039 18522
8941 1 16 . 1 1 61 61 VAL CA C 73 60.982 60.982 60.005 0.977 18522
8942 1 16 . 1 1 61 61 VAL CB C 73 36.197 36.197 34.132 2.065 18522
8943 1 16 . 1 1 61 61 VAL H H 73 8.424 8.424 8.477 -0.053 18522
8944 1 16 . 1 1 62 62 ASN N N 74 127.731 127.731 123.968 3.763 18522
8945 1 16 . 1 1 62 62 ASN HA H 74 4.520 4.520 4.337 0.183 18522
8946 1 16 . 1 1 62 62 ASN C C 74 174.878 174.878 175.317 -0.439 18522
8947 1 16 . 1 1 62 62 ASN CA C 74 54.418 54.418 54.593 -0.175 18522
8948 1 16 . 1 1 62 62 ASN CB C 74 36.655 36.655 38.057 -1.402 18522
8949 1 16 . 1 1 62 62 ASN H H 74 10.384 10.384 9.423 0.961 18522
8950 1 16 . 1 1 63 63 GLY N N 75 104.633 104.633 104.041 0.592 18522
8951 1 16 . 1 1 63 63 GLY C C 75 173.610 173.610 173.200 0.410 18522
8952 1 16 . 1 1 63 63 GLY CA C 75 45.261 45.261 44.912 0.349 18522
8953 1 16 . 1 1 63 63 GLY H H 75 8.926 8.926 8.596 0.330 18522
8954 1 16 . 1 1 64 64 ARG N N 76 120.451 120.451 121.360 -0.909 18522
8955 1 16 . 1 1 64 64 ARG HA H 76 4.501 4.501 4.575 -0.074 18522
8956 1 16 . 1 1 64 64 ARG C C 76 175.085 175.085 175.529 -0.444 18522
8957 1 16 . 1 1 64 64 ARG CA C 76 54.252 54.252 54.167 0.085 18522
8958 1 16 . 1 1 64 64 ARG CB C 76 31.482 31.482 31.526 -0.044 18522
8959 1 16 . 1 1 64 64 ARG H H 76 7.753 7.753 8.094 -0.341 18522
8960 1 16 . 1 1 65 65 SER N N 77 116.586 116.586 118.937 -2.351 18522
8961 1 16 . 1 1 65 65 SER HA H 77 4.483 4.483 4.432 0.051 18522
8962 1 16 . 1 1 65 65 SER C C 77 176.953 176.953 176.363 0.590 18522
8963 1 16 . 1 1 65 65 SER CA C 77 58.292 58.292 59.908 -1.616 18522
8964 1 16 . 1 1 65 65 SER CB C 77 63.643 63.643 63.533 0.110 18522
8965 1 16 . 1 1 65 65 SER H H 77 8.555 8.555 8.840 -0.285 18522
8966 1 16 . 1 1 66 66 ILE N N 78 116.618 116.618 122.333 -5.715 18522
8967 1 16 . 1 1 66 66 ILE HA H 78 4.420 4.420 4.184 0.236 18522
8968 1 16 . 1 1 66 66 ILE C C 78 175.072 175.072 176.875 -1.803 18522
8969 1 16 . 1 1 66 66 ILE CA C 78 59.122 59.122 61.596 -2.474 18522
8970 1 16 . 1 1 66 66 ILE CB C 78 36.758 36.758 37.142 -0.384 18522
8971 1 16 . 1 1 66 66 ILE H H 78 7.599 7.599 8.490 -0.891 18522
8972 1 16 . 1 1 67 67 LYS N N 79 123.287 123.287 122.222 1.065 18522
8973 1 16 . 1 1 67 67 LYS HA H 79 4.049 4.049 4.089 -0.040 18522
8974 1 16 . 1 1 67 67 LYS C C 79 178.333 178.333 177.992 0.341 18522
8975 1 16 . 1 1 67 67 LYS CA C 79 58.321 58.321 58.308 0.013 18522
8976 1 16 . 1 1 67 67 LYS CB C 79 31.635 31.635 31.859 -0.224 18522
8977 1 16 . 1 1 67 67 LYS H H 79 7.898 7.898 8.275 -0.377 18522
8978 1 16 . 1 1 68 68 GLY N N 80 114.933 114.933 107.306 7.627 18522
8979 1 16 . 1 1 68 68 GLY C C 80 174.385 174.385 174.577 -0.192 18522
8980 1 16 . 1 1 68 68 GLY CA C 80 45.518 45.518 45.720 -0.202 18522
8981 1 16 . 1 1 68 68 GLY H H 80 8.999 8.999 8.005 0.994 18522
8982 1 16 . 1 1 69 69 LYS N N 81 119.403 119.403 118.461 0.942 18522
8983 1 16 . 1 1 69 69 LYS HA H 81 4.043 4.043 4.636 -0.593 18522
8984 1 16 . 1 1 69 69 LYS C C 81 177.064 177.064 174.692 2.372 18522
8985 1 16 . 1 1 69 69 LYS CA C 81 54.722 54.722 55.190 -0.468 18522
8986 1 16 . 1 1 69 69 LYS CB C 81 33.560 33.560 33.188 0.372 18522
8987 1 16 . 1 1 69 69 LYS H H 81 7.845 7.845 8.026 -0.181 18522
8988 1 16 . 1 1 70 70 THR N N 82 112.066 112.066 108.849 3.217 18522
8989 1 16 . 1 1 70 70 THR HA H 82 4.666 4.666 4.796 -0.130 18522
8990 1 16 . 1 1 70 70 THR C C 82 175.955 175.955 175.713 0.242 18522
8991 1 16 . 1 1 70 70 THR CA C 82 60.438 60.438 60.523 -0.085 18522
8992 1 16 . 1 1 70 70 THR CB C 82 71.629 71.629 72.961 -1.332 18522
8993 1 16 . 1 1 70 70 THR H H 82 9.153 9.153 7.792 1.361 18522
8994 1 16 . 1 1 71 71 LYS N N 83 118.730 118.730 122.057 -3.327 18522
8995 1 16 . 1 1 71 71 LYS HA H 83 3.870 3.870 3.939 -0.069 18522
8996 1 16 . 1 1 71 71 LYS C C 83 177.464 177.464 178.469 -1.005 18522
8997 1 16 . 1 1 71 71 LYS CA C 83 60.357 60.357 60.058 0.299 18522
8998 1 16 . 1 1 71 71 LYS CB C 83 31.350 31.350 31.439 -0.090 18522
8999 1 16 . 1 1 71 71 LYS H H 83 8.969 8.969 8.207 0.762 18522
9000 1 16 . 1 1 72 72 VAL N N 84 117.444 117.444 118.938 -1.494 18522
9001 1 16 . 1 1 72 72 VAL HA H 84 3.633 3.633 3.653 -0.020 18522
9002 1 16 . 1 1 72 72 VAL C C 84 178.315 178.315 177.615 0.700 18522
9003 1 16 . 1 1 72 72 VAL CA C 84 66.079 66.079 65.825 0.254 18522
9004 1 16 . 1 1 72 72 VAL CB C 84 32.091 32.091 31.584 0.507 18522
9005 1 16 . 1 1 72 72 VAL H H 84 7.631 7.631 8.343 -0.712 18522
9006 1 16 . 1 1 73 73 GLU N N 85 120.890 120.890 119.129 1.761 18522
9007 1 16 . 1 1 73 73 GLU HA H 85 3.964 3.964 4.116 -0.152 18522
9008 1 16 . 1 1 73 73 GLU C C 85 179.971 179.971 178.851 1.120 18522
9009 1 16 . 1 1 73 73 GLU CA C 85 59.316 59.316 59.295 0.021 18522
9010 1 16 . 1 1 73 73 GLU CB C 85 30.355 30.355 29.686 0.669 18522
9011 1 16 . 1 1 73 73 GLU H H 85 7.617 7.617 7.595 0.022 18522
9012 1 16 . 1 1 74 74 VAL N N 86 121.246 121.246 118.777 2.469 18522
9013 1 16 . 1 1 74 74 VAL HA H 86 3.630 3.630 3.787 -0.157 18522
9014 1 16 . 1 1 74 74 VAL C C 86 177.217 177.217 177.580 -0.363 18522
9015 1 16 . 1 1 74 74 VAL CA C 86 66.678 66.678 65.867 0.811 18522
9016 1 16 . 1 1 74 74 VAL CB C 86 31.307 31.307 30.681 0.626 18522
9017 1 16 . 1 1 74 74 VAL H H 86 8.368 8.368 8.315 0.053 18522
9018 1 16 . 1 1 75 75 ALA N N 87 122.148 122.148 122.630 -0.482 18522
9019 1 16 . 1 1 75 75 ALA HA H 87 3.947 3.947 3.917 0.030 18522
9020 1 16 . 1 1 75 75 ALA C C 87 179.545 179.545 179.248 0.297 18522
9021 1 16 . 1 1 75 75 ALA CA C 87 55.851 55.851 55.485 0.366 18522
9022 1 16 . 1 1 75 75 ALA CB C 87 18.491 18.491 17.883 0.608 18522
9023 1 16 . 1 1 75 75 ALA H H 87 8.577 8.577 8.453 0.124 18522
9024 1 16 . 1 1 76 76 LYS N N 88 117.733 117.733 119.126 -1.393 18522
9025 1 16 . 1 1 76 76 LYS HA H 88 4.051 4.051 3.991 0.060 18522
9026 1 16 . 1 1 76 76 LYS CA C 88 59.393 59.393 59.367 0.026 18522
9027 1 16 . 1 1 76 76 LYS CB C 88 32.058 32.058 32.263 -0.205 18522
9028 1 16 . 1 1 76 76 LYS H H 88 7.854 7.854 7.387 0.467 18522
9029 1 16 . 1 1 77 77 MET N N 89 117.676 117.676 118.233 -0.557 18522
9030 1 16 . 1 1 77 77 MET HA H 89 4.048 4.048 4.045 0.003 18522
9031 1 16 . 1 1 77 77 MET C C 89 178.791 178.791 178.935 -0.144 18522
9032 1 16 . 1 1 77 77 MET CA C 89 59.128 59.128 59.614 -0.486 18522
9033 1 16 . 1 1 77 77 MET CB C 89 33.801 33.801 32.591 1.210 18522
9034 1 16 . 1 1 77 77 MET H H 89 7.759 7.759 8.103 -0.344 18522
9035 1 16 . 1 1 78 78 ILE N N 90 117.305 117.305 119.793 -2.488 18522
9036 1 16 . 1 1 78 78 ILE HA H 90 3.590 3.590 3.634 -0.044 18522
9037 1 16 . 1 1 78 78 ILE C C 90 178.658 178.658 178.444 0.214 18522
9038 1 16 . 1 1 78 78 ILE CA C 90 65.482 65.482 65.287 0.195 18522
9039 1 16 . 1 1 78 78 ILE CB C 90 38.845 38.845 37.824 1.021 18522
9040 1 16 . 1 1 78 78 ILE H H 90 7.972 7.972 8.334 -0.362 18522
9041 1 16 . 1 1 79 79 GLN N N 91 120.935 120.935 119.142 1.793 18522
9042 1 16 . 1 1 79 79 GLN HA H 91 3.998 3.998 4.001 -0.003 18522
9043 1 16 . 1 1 79 79 GLN C C 91 178.274 178.274 178.492 -0.218 18522
9044 1 16 . 1 1 79 79 GLN CA C 91 59.151 59.151 58.534 0.617 18522
9045 1 16 . 1 1 79 79 GLN CB C 91 28.934 28.934 28.791 0.143 18522
9046 1 16 . 1 1 79 79 GLN H H 91 8.826 8.826 8.337 0.489 18522
9047 1 16 . 1 1 80 80 GLU N N 92 115.213 115.213 120.398 -5.185 18522
9048 1 16 . 1 1 80 80 GLU HA H 92 4.061 4.061 4.143 -0.082 18522
9049 1 16 . 1 1 80 80 GLU C C 92 176.824 176.824 178.996 -2.172 18522
9050 1 16 . 1 1 80 80 GLU CA C 92 58.006 58.006 59.224 -1.218 18522
9051 1 16 . 1 1 80 80 GLU CB C 92 29.890 29.890 29.873 0.016 18522
9052 1 16 . 1 1 80 80 GLU H H 92 8.020 8.020 8.507 -0.487 18522
9053 1 16 . 1 1 81 81 VAL N N 93 119.047 119.047 117.058 1.989 18522
9054 1 16 . 1 1 81 81 VAL HA H 93 3.930 3.930 4.142 -0.212 18522
9055 1 16 . 1 1 81 81 VAL C C 93 176.016 176.016 174.908 1.108 18522
9056 1 16 . 1 1 81 81 VAL CA C 93 63.153 63.153 61.121 2.032 18522
9057 1 16 . 1 1 81 81 VAL CB C 93 32.154 32.154 29.259 2.895 18522
9058 1 16 . 1 1 81 81 VAL H H 93 7.073 7.073 7.559 -0.486 18522
9059 1 16 . 1 1 82 82 LYS N N 94 128.366 128.366 119.846 8.520 18522
9060 1 16 . 1 1 82 82 LYS C C 94 177.460 177.460 177.610 -0.150 18522
9061 1 16 . 1 1 82 82 LYS CA C 94 55.753 55.753 57.551 -1.798 18522
9062 1 16 . 1 1 82 82 LYS CB C 94 32.332 32.332 32.164 0.168 18522
9063 1 16 . 1 1 82 82 LYS H H 94 8.762 8.762 7.871 0.891 18522
9064 1 16 . 1 1 83 83 GLY N N 95 112.528 112.528 112.580 -0.052 18522
9065 1 16 . 1 1 83 83 GLY C C 95 173.468 173.468 173.700 -0.232 18522
9066 1 16 . 1 1 83 83 GLY CA C 95 46.243 46.243 44.878 1.365 18522
9067 1 16 . 1 1 83 83 GLY H H 95 8.673 8.673 8.965 -0.292 18522
9068 1 16 . 1 1 84 84 GLU N N 96 121.485 121.485 119.555 1.930 18522
9069 1 16 . 1 1 84 84 GLU HA H 96 4.749 4.749 5.077 -0.328 18522
9070 1 16 . 1 1 84 84 GLU C C 96 174.583 174.583 174.167 0.416 18522
9071 1 16 . 1 1 84 84 GLU CA C 96 55.821 55.821 54.776 1.045 18522
9072 1 16 . 1 1 84 84 GLU CB C 96 31.410 31.410 34.002 -2.592 18522
9073 1 16 . 1 1 84 84 GLU H H 96 8.297 8.297 7.744 0.553 18522
9074 1 16 . 1 1 85 85 VAL N N 97 120.501 120.501 111.913 8.588 18522
9075 1 16 . 1 1 85 85 VAL HA H 97 4.665 4.665 4.648 0.017 18522
9076 1 16 . 1 1 85 85 VAL C C 97 173.047 173.047 173.879 -0.832 18522
9077 1 16 . 1 1 85 85 VAL CA C 97 60.114 60.114 60.355 -0.241 18522
9078 1 16 . 1 1 85 85 VAL CB C 97 35.184 35.184 35.248 -0.064 18522
9079 1 16 . 1 1 85 85 VAL H H 97 9.096 9.096 8.482 0.614 18522
9080 1 16 . 1 1 86 86 THR N N 98 125.019 125.019 120.024 4.995 18522
9081 1 16 . 1 1 86 86 THR HA H 98 4.076 4.076 5.184 -1.108 18522
9082 1 16 . 1 1 86 86 THR C C 98 173.807 173.807 173.573 0.234 18522
9083 1 16 . 1 1 86 86 THR CA C 98 61.735 61.735 61.840 -0.105 18522
9084 1 16 . 1 1 86 86 THR CB C 98 69.531 69.531 70.444 -0.913 18522
9085 1 16 . 1 1 86 86 THR H H 98 9.352 9.352 8.281 1.071 18522
9086 1 16 . 1 1 87 87 ILE N N 99 128.383 128.383 123.943 4.440 18522
9087 1 16 . 1 1 87 87 ILE HA H 99 4.661 4.661 4.725 -0.064 18522
9088 1 16 . 1 1 87 87 ILE C C 99 174.614 174.614 174.162 0.452 18522
9089 1 16 . 1 1 87 87 ILE CA C 99 58.258 58.258 59.173 -0.915 18522
9090 1 16 . 1 1 87 87 ILE CB C 99 38.528 38.528 38.976 -0.448 18522
9091 1 16 . 1 1 87 87 ILE H H 99 9.329 9.329 9.074 0.255 18522
9092 1 16 . 1 1 88 88 HIS N N 100 128.279 128.279 128.024 0.255 18522
9093 1 16 . 1 1 88 88 HIS HA H 100 4.948 4.948 5.400 -0.452 18522
9094 1 16 . 1 1 88 88 HIS C C 100 174.787 174.787 174.521 0.266 18522
9095 1 16 . 1 1 88 88 HIS CA C 100 54.620 54.620 53.560 1.060 18522
9096 1 16 . 1 1 88 88 HIS H H 100 8.647 8.647 8.962 -0.315 18522
9097 1 16 . 1 1 89 89 TYR N N 101 121.320 121.320 124.011 -2.691 18522
9098 1 16 . 1 1 89 89 TYR HA H 101 5.947 5.947 5.336 0.611 18522
9099 1 16 . 1 1 89 89 TYR C C 101 173.769 173.769 173.501 0.268 18522
9100 1 16 . 1 1 89 89 TYR CA C 101 55.669 55.669 54.588 1.081 18522
9101 1 16 . 1 1 89 89 TYR CB C 101 42.195 42.195 40.954 1.241 18522
9102 1 16 . 1 1 89 89 TYR H H 101 8.414 8.414 8.415 -0.001 18522
9103 1 16 . 1 1 90 90 ASN N N 102 116.679 116.679 116.481 0.198 18522
9104 1 16 . 1 1 90 90 ASN HA H 102 5.335 5.335 5.145 0.190 18522
9105 1 16 . 1 1 90 90 ASN C C 102 175.406 175.406 174.710 0.696 18522
9106 1 16 . 1 1 90 90 ASN CA C 102 51.961 51.961 51.521 0.440 18522
9107 1 16 . 1 1 90 90 ASN CB C 102 41.800 41.800 41.994 -0.194 18522
9108 1 16 . 1 1 90 90 ASN H H 102 9.282 9.282 8.739 0.543 18522
9109 1 16 . 1 1 91 91 LYS N N 103 124.129 124.129 119.737 4.392 18522
9110 1 16 . 1 1 91 91 LYS C C 103 176.678 176.678 177.517 -0.839 18522
9111 1 16 . 1 1 91 91 LYS CA C 103 55.006 55.006 56.108 -1.102 18522
9112 1 16 . 1 1 91 91 LYS H H 103 8.949 8.949 8.596 0.353 18522
9113 1 16 . 1 1 92 92 LEU N N 104 127.043 127.043 118.493 8.550 18522
9114 1 16 . 1 1 92 92 LEU HA H 104 4.425 4.425 3.926 0.499 18522
9115 1 16 . 1 1 92 92 LEU CA C 104 55.060 55.060 57.323 -2.263 18522
9116 1 16 . 1 1 92 92 LEU CB C 104 42.559 42.559 40.426 2.133 18522
9117 1 16 . 1 1 92 92 LEU H H 104 9.150 9.150 8.034 1.116 18522
9118 1 16 . 1 1 93 93 GLN HA H 105 4.315 4.315 4.528 -0.213 18522
9119 1 16 . 1 1 93 93 GLN C C 105 175.070 175.070 174.045 1.025 18522
9120 1 16 . 1 1 93 93 GLN CA C 105 55.490 55.490 55.709 -0.219 18522
9121 1 16 . 1 1 93 93 GLN CB C 105 28.909 28.909 29.654 -0.745 18522
9122 1 16 . 1 1 94 94 ALA N N 106 125.133 125.133 125.388 -0.255 18522
9123 1 16 . 1 1 94 94 ALA HA H 106 4.366 4.366 4.840 -0.474 18522
9124 1 16 . 1 1 94 94 ALA C C 106 176.392 176.392 174.687 1.705 18522
9125 1 16 . 1 1 94 94 ALA CA C 106 51.723 51.723 51.752 -0.028 18522
9126 1 16 . 1 1 94 94 ALA CB C 106 20.185 20.185 22.593 -2.408 18522
9127 1 16 . 1 1 94 94 ALA H H 106 8.226 8.226 7.951 0.275 18522
9128 1 16 . 1 1 95 95 ASP N N 107 122.013 122.013 118.114 3.899 18522
9129 1 16 . 1 1 95 95 ASP HA H 107 4.413 4.413 5.030 -0.617 18522
9130 1 16 . 1 1 95 95 ASP C C 107 175.019 175.019 174.123 0.896 18522
9131 1 16 . 1 1 95 95 ASP CA C 107 55.642 55.642 52.986 2.655 18522
9132 1 16 . 1 1 95 95 ASP CB C 107 41.266 41.266 42.591 -1.325 18522
9133 1 16 . 1 1 95 95 ASP H H 107 8.429 8.429 8.269 0.160 18522
9134 1 16 . 1 1 96 96 PRO HA H 108 4.207 4.207 3.750 0.457 18522
9135 1 16 . 1 1 96 96 PRO C C 108 178.840 178.840 178.004 0.836 18522
9136 1 16 . 1 1 96 96 PRO CA C 108 65.396 65.396 65.703 -0.307 18522
9137 1 16 . 1 1 96 96 PRO CB C 108 32.181 32.181 31.704 0.477 18522
9138 1 16 . 1 1 97 97 LYS N N 109 117.942 117.942 115.422 2.520 18522
9139 1 16 . 1 1 97 97 LYS HA H 109 4.143 4.143 3.977 0.166 18522
9140 1 16 . 1 1 97 97 LYS C C 109 178.099 178.099 179.208 -1.109 18522
9141 1 16 . 1 1 97 97 LYS CA C 109 58.167 58.167 59.051 -0.884 18522
9142 1 16 . 1 1 97 97 LYS CB C 109 31.649 31.649 31.593 0.056 18522
9143 1 16 . 1 1 97 97 LYS H H 109 8.335 8.335 8.718 -0.383 18522
9144 1 16 . 1 1 98 98 GLN N N 110 119.159 119.159 118.290 0.869 18522
9145 1 16 . 1 1 98 98 GLN HA H 110 4.130 4.130 4.261 -0.131 18522
9146 1 16 . 1 1 98 98 GLN C C 110 178.298 178.298 178.346 -0.048 18522
9147 1 16 . 1 1 98 98 GLN CA C 110 57.660 57.660 56.982 0.678 18522
9148 1 16 . 1 1 98 98 GLN CB C 110 28.720 28.720 28.632 0.088 18522
9149 1 16 . 1 1 98 98 GLN H H 110 7.985 7.985 7.947 0.038 18522
9150 1 16 . 1 1 99 99 LEU N N 111 120.490 120.490 122.424 -1.934 18522
9151 1 16 . 1 1 99 99 LEU HA H 111 3.877 3.877 4.184 -0.307 18522
9152 1 16 . 1 1 99 99 LEU C C 111 177.729 177.729 178.335 -0.606 18522
9153 1 16 . 1 1 99 99 LEU CA C 111 57.049 57.049 57.817 -0.768 18522
9154 1 16 . 1 1 99 99 LEU CB C 111 41.466 41.466 41.516 -0.050 18522
9155 1 16 . 1 1 99 99 LEU H H 111 7.994 7.994 8.429 -0.435 18522
9156 1 16 . 1 1 100 100 GLU N N 112 118.251 118.251 117.380 0.871 18522
9157 1 16 . 1 1 100 100 GLU HA H 112 3.972 3.972 4.056 -0.084 18522
9158 1 16 . 1 1 100 100 GLU C C 112 178.402 178.402 178.029 0.373 18522
9159 1 16 . 1 1 100 100 GLU CA C 112 59.056 59.056 58.801 0.255 18522
9160 1 16 . 1 1 100 100 GLU CB C 112 29.732 29.732 29.007 0.725 18522
9161 1 16 . 1 1 100 100 GLU H H 112 7.760 7.760 7.738 0.022 18522
9162 1 16 . 1 1 101 101 VAL N N 113 117.229 117.229 118.468 -1.239 18522
9163 1 16 . 1 1 101 101 VAL HA H 113 3.762 3.762 3.840 -0.078 18522
9164 1 16 . 1 1 101 101 VAL C C 113 178.107 178.107 178.153 -0.046 18522
9165 1 16 . 1 1 101 101 VAL CA C 113 64.791 64.791 65.046 -0.255 18522
9166 1 16 . 1 1 101 101 VAL CB C 113 32.149 32.149 31.921 0.228 18522
9167 1 16 . 1 1 101 101 VAL H H 113 7.437 7.437 7.355 0.082 18522
9168 1 16 . 1 1 102 102 LEU N N 114 122.124 122.124 121.025 1.099 18522
9169 1 16 . 1 1 102 102 LEU HA H 114 4.033 4.033 4.162 -0.129 18522
9170 1 16 . 1 1 102 102 LEU C C 114 178.506 178.506 177.439 1.067 18522
9171 1 16 . 1 1 102 102 LEU CA C 114 57.243 57.243 57.375 -0.132 18522
9172 1 16 . 1 1 102 102 LEU CB C 114 42.028 42.028 42.704 -0.676 18522
9173 1 16 . 1 1 102 102 LEU H H 114 7.765 7.765 7.574 0.191 18522
9174 1 16 . 1 1 103 103 PHE N N 115 115.346 115.346 118.674 -3.328 18522
9175 1 16 . 1 1 103 103 PHE HA H 115 4.224 4.224 4.817 -0.593 18522
9176 1 16 . 1 1 103 103 PHE C C 115 175.621 175.621 175.059 0.562 18522
9177 1 16 . 1 1 103 103 PHE CA C 115 57.537 57.537 56.508 1.029 18522
9178 1 16 . 1 1 103 103 PHE CB C 115 38.057 38.057 38.809 -0.752 18522
9179 1 16 . 1 1 103 103 PHE H H 115 7.805 7.805 7.728 0.077 18522
9180 1 16 . 1 1 104 104 GLN N N 116 119.021 119.021 119.579 -0.558 18522
9181 1 16 . 1 1 104 104 GLN HA H 116 4.407 4.407 3.820 0.587 18522
9182 1 16 . 1 1 104 104 GLN C C 116 176.402 176.402 175.302 1.100 18522
9183 1 16 . 1 1 104 104 GLN CA C 116 55.521 55.521 58.617 -3.095 18522
9184 1 16 . 1 1 104 104 GLN CB C 116 29.170 29.170 27.303 1.867 18522
9185 1 16 . 1 1 104 104 GLN H H 116 7.974 7.974 7.853 0.121 18522
9186 1 16 . 1 1 105 105 GLY N N 117 108.868 108.868 105.178 3.690 18522
9187 1 16 . 1 1 105 105 GLY CA C 117 45.124 45.124 45.688 -0.563 18522
9188 1 16 . 1 1 105 105 GLY H H 117 8.195 8.195 8.161 0.034 18522
9189 1 16 . 1 1 106 106 PRO HA H 118 4.490 4.490 4.440 0.050 18522
9190 1 16 . 1 1 106 106 PRO C C 118 176.001 176.001 176.513 -0.512 18522
9191 1 16 . 1 1 106 106 PRO CA C 118 63.523 63.523 63.461 0.062 18522
9192 1 16 . 1 1 106 106 PRO CB C 118 32.078 32.078 31.748 0.330 18522
9193 1 16 . 1 1 107 107 GLN N N 119 126.950 126.950 123.789 3.161 18522
9194 1 16 . 1 1 107 107 GLN C C 119 181.211 181.211 174.717 6.494 18522
9195 1 16 . 1 1 107 107 GLN CA C 119 57.416 57.416 55.388 2.028 18522
9196 1 16 . 1 1 107 107 GLN H H 119 8.079 8.079 8.297 -0.218 18522
9197 1 16 . 1 1 111 111 ARG C C 123 174.608 174.608 174.907 -0.299 18522
9198 1 16 . 1 1 111 111 ARG CA C 123 55.099 55.099 56.178 -1.079 18522
9199 1 16 . 1 1 112 112 HIS N N 124 122.212 122.212 120.171 2.041 18522
9200 1 16 . 1 1 112 112 HIS HA H 124 4.718 4.718 4.861 -0.143 18522
9201 1 16 . 1 1 112 112 HIS C C 124 176.040 176.040 174.141 1.899 18522
9202 1 16 . 1 1 112 112 HIS CA C 124 54.213 54.213 54.630 -0.417 18522
9203 1 16 . 1 1 112 112 HIS CB C 124 31.164 31.164 28.255 2.909 18522
9204 1 16 . 1 1 112 112 HIS H H 124 7.640 7.640 7.974 -0.334 18522
9205 1 16 . 1 1 113 113 TRP C C 125 176.168 176.168 173.966 2.202 18522
9206 1 16 . 1 1 114 114 LEU N N 126 121.893 121.893 120.619 1.274 18522
9207 1 16 . 1 1 114 114 LEU HA H 126 4.869 4.869 4.584 0.285 18522
9208 1 16 . 1 1 114 114 LEU CA C 126 54.151 54.151 53.181 0.970 18522
9209 1 16 . 1 1 114 114 LEU CB C 126 45.144 45.144 45.197 -0.053 18522
9210 1 16 . 1 1 114 114 LEU H H 126 8.606 8.606 8.271 0.335 18522
9211 1 16 . 1 1 115 115 LYS N N 127 125.850 125.850 120.554 5.296 18522
9212 1 16 . 1 1 115 115 LYS HA H 127 4.203 4.203 5.180 -0.977 18522
9213 1 16 . 1 1 115 115 LYS C C 127 175.564 175.564 174.499 1.065 18522
9214 1 16 . 1 1 115 115 LYS CA C 127 57.252 57.252 55.283 1.969 18522
9215 1 16 . 1 1 115 115 LYS CB C 127 33.406 33.406 34.813 -1.407 18522
9216 1 16 . 1 1 115 115 LYS H H 127 8.647 8.647 8.166 0.481 18522
9217 1 17 . 1 1 3 3 PRO C C 15 177.225 177.225 176.830 0.395 18522
9218 1 17 . 1 1 3 3 PRO CA C 15 63.508 63.508 63.272 0.236 18522
9219 1 17 . 1 1 3 3 PRO CB C 15 32.090 32.090 32.290 -0.200 18522
9220 1 17 . 1 1 4 4 GLY N N 16 108.829 108.829 108.635 0.194 18522
9221 1 17 . 1 1 4 4 GLY C C 16 173.398 173.398 173.926 -0.528 18522
9222 1 17 . 1 1 4 4 GLY CA C 16 45.128 45.128 44.296 0.832 18522
9223 1 17 . 1 1 4 4 GLY H H 16 8.489 8.489 7.907 0.582 18522
9224 1 17 . 1 1 5 5 ILE N N 17 121.763 121.763 121.654 0.109 18522
9225 1 17 . 1 1 5 5 ILE HA H 17 4.554 4.554 4.634 -0.080 18522
9226 1 17 . 1 1 5 5 ILE C C 17 174.332 174.332 174.791 -0.459 18522
9227 1 17 . 1 1 5 5 ILE CA C 17 58.245 58.245 58.168 0.077 18522
9228 1 17 . 1 1 5 5 ILE CB C 17 38.762 38.762 38.284 0.478 18522
9229 1 17 . 1 1 5 5 ILE H H 17 8.014 8.014 8.244 -0.230 18522
9230 1 17 . 1 1 6 6 PRO C C 18 176.437 176.437 176.440 -0.003 18522
9231 1 17 . 1 1 6 6 PRO CA C 18 62.667 62.667 64.391 -1.724 18522
9232 1 17 . 1 1 6 6 PRO CB C 18 32.469 32.469 31.720 0.749 18522
9233 1 17 . 1 1 7 7 VAL N N 19 123.849 123.849 115.245 8.604 18522
9234 1 17 . 1 1 7 7 VAL HA H 19 4.550 4.550 4.474 0.076 18522
9235 1 17 . 1 1 7 7 VAL C C 19 174.453 174.453 173.352 1.101 18522
9236 1 17 . 1 1 7 7 VAL CA C 19 59.846 59.846 58.194 1.652 18522
9237 1 17 . 1 1 7 7 VAL CB C 19 33.510 33.510 30.885 2.625 18522
9238 1 17 . 1 1 7 7 VAL H H 19 8.754 8.754 7.800 0.954 18522
9239 1 17 . 1 1 8 8 PRO HA H 20 5.338 5.338 4.210 1.128 18522
9240 1 17 . 1 1 8 8 PRO C C 20 177.585 177.585 176.684 0.901 18522
9241 1 17 . 1 1 8 8 PRO CA C 20 62.406 62.406 63.147 -0.741 18522
9242 1 17 . 1 1 8 8 PRO CB C 20 32.891 32.891 31.677 1.214 18522
9243 1 17 . 1 1 9 9 GLY N N 21 108.426 108.426 111.281 -2.855 18522
9244 1 17 . 1 1 9 9 GLY C C 21 171.443 171.443 171.271 0.172 18522
9245 1 17 . 1 1 9 9 GLY CA C 21 44.581 44.581 44.418 0.163 18522
9246 1 17 . 1 1 9 9 GLY H H 21 8.258 8.258 7.885 0.373 18522
9247 1 17 . 1 1 10 10 LYS N N 22 117.372 117.372 121.131 -3.759 18522
9248 1 17 . 1 1 10 10 LYS HA H 22 4.039 4.039 5.280 -1.241 18522
9249 1 17 . 1 1 10 10 LYS C C 22 174.463 174.463 174.609 -0.146 18522
9250 1 17 . 1 1 10 10 LYS CA C 22 55.263 55.263 55.213 0.050 18522
9251 1 17 . 1 1 10 10 LYS CB C 22 35.227 35.227 35.276 -0.049 18522
9252 1 17 . 1 1 10 10 LYS H H 22 8.175 8.175 8.076 0.099 18522
9253 1 17 . 1 1 11 11 VAL N N 23 120.387 120.387 123.329 -2.942 18522
9254 1 17 . 1 1 11 11 VAL HA H 23 4.708 4.708 4.521 0.187 18522
9255 1 17 . 1 1 11 11 VAL C C 23 171.873 171.873 173.720 -1.847 18522
9256 1 17 . 1 1 11 11 VAL CA C 23 59.866 59.866 60.066 -0.200 18522
9257 1 17 . 1 1 11 11 VAL CB C 23 35.269 35.269 35.783 -0.514 18522
9258 1 17 . 1 1 11 11 VAL H H 23 8.862 8.862 8.326 0.536 18522
9259 1 17 . 1 1 12 12 THR N N 24 125.797 125.797 121.392 4.405 18522
9260 1 17 . 1 1 12 12 THR HA H 24 5.121 5.121 4.959 0.162 18522
9261 1 17 . 1 1 12 12 THR C C 24 173.407 173.407 173.759 -0.352 18522
9262 1 17 . 1 1 12 12 THR CA C 24 62.115 62.115 60.315 1.800 18522
9263 1 17 . 1 1 12 12 THR CB C 24 69.606 69.606 68.899 0.707 18522
9264 1 17 . 1 1 12 12 THR H H 24 8.859 8.859 8.338 0.521 18522
9265 1 17 . 1 1 13 13 LEU N N 25 127.960 127.960 127.065 0.895 18522
9266 1 17 . 1 1 13 13 LEU HA H 25 4.809 4.809 4.847 -0.038 18522
9267 1 17 . 1 1 13 13 LEU C C 25 175.029 175.029 175.187 -0.158 18522
9268 1 17 . 1 1 13 13 LEU CA C 25 52.623 52.623 52.914 -0.291 18522
9269 1 17 . 1 1 13 13 LEU CB C 25 46.242 46.242 45.494 0.748 18522
9270 1 17 . 1 1 13 13 LEU H H 25 9.258 9.258 8.183 1.075 18522
9271 1 17 . 1 1 14 14 GLN N N 26 120.858 120.858 117.359 3.499 18522
9272 1 17 . 1 1 14 14 GLN HA H 26 4.482 4.482 4.607 -0.125 18522
9273 1 17 . 1 1 14 14 GLN C C 26 174.515 174.515 175.443 -0.928 18522
9274 1 17 . 1 1 14 14 GLN CA C 26 54.576 54.576 54.389 0.187 18522
9275 1 17 . 1 1 14 14 GLN CB C 26 29.516 29.516 31.643 -2.127 18522
9276 1 17 . 1 1 14 14 GLN H H 26 8.530 8.530 8.360 0.170 18522
9277 1 17 . 1 1 15 15 LYS N N 27 119.583 119.583 122.772 -3.189 18522
9278 1 17 . 1 1 15 15 LYS HA H 27 4.180 4.180 4.301 -0.121 18522
9279 1 17 . 1 1 15 15 LYS C C 27 177.468 177.468 176.792 0.676 18522
9280 1 17 . 1 1 15 15 LYS CA C 27 55.956 55.956 56.597 -0.641 18522
9281 1 17 . 1 1 15 15 LYS CB C 27 34.099 34.099 32.450 1.649 18522
9282 1 17 . 1 1 15 15 LYS H H 27 8.099 8.099 8.121 -0.022 18522
9283 1 17 . 1 1 16 16 ASP N N 28 121.439 121.439 121.513 -0.074 18522
9284 1 17 . 1 1 16 16 ASP HA H 28 4.590 4.590 4.641 -0.051 18522
9285 1 17 . 1 1 16 16 ASP C C 28 178.392 178.392 177.775 0.617 18522
9286 1 17 . 1 1 16 16 ASP CA C 28 52.426 52.426 53.480 -1.054 18522
9287 1 17 . 1 1 16 16 ASP CB C 28 41.377 41.377 42.694 -1.317 18522
9288 1 17 . 1 1 16 16 ASP H H 28 8.888 8.888 8.530 0.358 18522
9289 1 17 . 1 1 17 17 ALA N N 29 119.578 119.578 123.650 -4.072 18522
9290 1 17 . 1 1 17 17 ALA HA H 29 4.188 4.188 4.087 0.101 18522
9291 1 17 . 1 1 17 17 ALA C C 29 178.763 178.763 178.286 0.477 18522
9292 1 17 . 1 1 17 17 ALA CA C 29 54.434 54.434 54.578 -0.144 18522
9293 1 17 . 1 1 17 17 ALA CB C 29 18.293 18.293 18.727 -0.434 18522
9294 1 17 . 1 1 17 17 ALA H H 29 8.392 8.392 8.691 -0.299 18522
9295 1 17 . 1 1 18 18 GLN N N 30 117.564 117.564 116.695 0.869 18522
9296 1 17 . 1 1 18 18 GLN HA H 30 4.399 4.399 4.361 0.038 18522
9297 1 17 . 1 1 18 18 GLN C C 30 175.168 175.168 175.512 -0.344 18522
9298 1 17 . 1 1 18 18 GLN CA C 30 55.339 55.339 55.194 0.145 18522
9299 1 17 . 1 1 18 18 GLN CB C 30 28.589 28.589 29.340 -0.751 18522
9300 1 17 . 1 1 18 18 GLN H H 30 8.353 8.353 7.829 0.524 18522
9301 1 17 . 1 1 19 19 ASN N N 31 115.365 115.365 116.606 -1.241 18522
9302 1 17 . 1 1 19 19 ASN HA H 31 4.315 4.315 4.390 -0.075 18522
9303 1 17 . 1 1 19 19 ASN C C 31 174.043 174.043 172.854 1.189 18522
9304 1 17 . 1 1 19 19 ASN CA C 31 54.303 54.303 54.406 -0.102 18522
9305 1 17 . 1 1 19 19 ASN CB C 31 37.610 37.610 37.651 -0.041 18522
9306 1 17 . 1 1 19 19 ASN H H 31 8.521 8.521 8.299 0.222 18522
9307 1 17 . 1 1 20 20 LEU N N 32 118.660 118.660 111.141 7.519 18522
9308 1 17 . 1 1 20 20 LEU HA H 32 4.900 4.900 4.833 0.067 18522
9309 1 17 . 1 1 20 20 LEU C C 32 178.117 178.117 176.633 1.484 18522
9310 1 17 . 1 1 20 20 LEU CA C 32 53.957 53.957 53.274 0.683 18522
9311 1 17 . 1 1 20 20 LEU CB C 32 44.774 44.774 43.538 1.236 18522
9312 1 17 . 1 1 20 20 LEU H H 32 8.155 8.155 7.358 0.797 18522
9313 1 17 . 1 1 21 21 ILE N N 33 116.785 116.785 115.393 1.392 18522
9314 1 17 . 1 1 21 21 ILE HA H 33 4.674 4.674 4.549 0.125 18522
9315 1 17 . 1 1 21 21 ILE C C 33 176.185 176.185 176.537 -0.352 18522
9316 1 17 . 1 1 21 21 ILE CA C 33 62.602 62.602 61.360 1.242 18522
9317 1 17 . 1 1 21 21 ILE CB C 33 39.016 39.016 39.177 -0.161 18522
9318 1 17 . 1 1 21 21 ILE H H 33 11.488 11.488 8.059 3.429 18522
9319 1 17 . 1 1 22 22 GLY N N 34 111.234 111.234 107.985 3.249 18522
9320 1 17 . 1 1 22 22 GLY C C 34 173.993 173.993 173.661 0.332 18522
9321 1 17 . 1 1 22 22 GLY CA C 34 45.980 45.980 45.027 0.953 18522
9322 1 17 . 1 1 22 22 GLY H H 34 9.854 9.854 8.037 1.817 18522
9323 1 17 . 1 1 23 23 ILE N N 35 111.117 111.117 114.786 -3.669 18522
9324 1 17 . 1 1 23 23 ILE HA H 35 5.535 5.535 5.395 0.140 18522
9325 1 17 . 1 1 23 23 ILE C C 35 175.033 175.033 174.535 0.498 18522
9326 1 17 . 1 1 23 23 ILE CA C 35 58.415 58.415 57.958 0.457 18522
9327 1 17 . 1 1 23 23 ILE CB C 35 41.577 41.577 41.237 0.340 18522
9328 1 17 . 1 1 23 23 ILE H H 35 7.835 7.835 7.427 0.408 18522
9329 1 17 . 1 1 24 24 SER N N 36 114.908 114.908 115.726 -0.818 18522
9330 1 17 . 1 1 24 24 SER HA H 36 4.232 4.232 4.912 -0.680 18522
9331 1 17 . 1 1 24 24 SER C C 36 174.735 174.735 172.841 1.894 18522
9332 1 17 . 1 1 24 24 SER CA C 36 56.121 56.121 57.404 -1.283 18522
9333 1 17 . 1 1 24 24 SER CB C 36 66.097 66.097 65.830 0.267 18522
9334 1 17 . 1 1 24 24 SER H H 36 8.623 8.623 8.404 0.219 18522
9335 1 17 . 1 1 25 25 ILE N N 37 117.739 117.739 125.283 -7.544 18522
9336 1 17 . 1 1 25 25 ILE C C 37 174.340 174.340 176.151 -1.811 18522
9337 1 17 . 1 1 25 25 ILE CA C 37 59.123 59.123 58.498 0.625 18522
9338 1 17 . 1 1 25 25 ILE CB C 37 41.637 41.637 38.947 2.690 18522
9339 1 17 . 1 1 25 25 ILE H H 37 9.130 9.130 8.945 0.185 18522
9340 1 17 . 1 1 26 26 GLY N N 38 108.069 108.069 114.597 -6.528 18522
9341 1 17 . 1 1 26 26 GLY CA C 38 44.112 44.112 44.087 0.025 18522
9342 1 17 . 1 1 26 26 GLY H H 38 8.841 8.841 9.163 -0.322 18522
9343 1 17 . 1 1 27 27 GLY N N 39 109.016 109.016 108.651 0.365 18522
9344 1 17 . 1 1 27 27 GLY C C 39 173.956 173.956 175.167 -1.211 18522
9345 1 17 . 1 1 27 27 GLY H H 39 8.187 8.187 8.470 -0.283 18522
9346 1 17 . 1 1 28 28 GLY N N 40 111.783 111.783 109.310 2.473 18522
9347 1 17 . 1 1 28 28 GLY C C 40 174.255 174.255 173.501 0.754 18522
9348 1 17 . 1 1 28 28 GLY CA C 40 47.098 47.098 45.605 1.494 18522
9349 1 17 . 1 1 28 28 GLY H H 40 8.275 8.275 8.783 -0.508 18522
9350 1 17 . 1 1 29 29 ALA N N 41 123.128 123.128 120.734 2.394 18522
9351 1 17 . 1 1 29 29 ALA HA H 41 4.559 4.559 4.696 -0.137 18522
9352 1 17 . 1 1 29 29 ALA CA C 41 51.073 51.073 51.342 -0.268 18522
9353 1 17 . 1 1 29 29 ALA CB C 41 21.926 21.926 20.337 1.589 18522
9354 1 17 . 1 1 29 29 ALA H H 41 8.012 8.012 7.278 0.734 18522
9355 1 17 . 1 1 31 31 TYR HA H 43 4.549 4.549 4.452 0.097 18522
9356 1 17 . 1 1 31 31 TYR CA C 43 57.147 57.147 60.831 -3.683 18522
9357 1 17 . 1 1 31 31 TYR CB C 43 37.495 37.495 38.760 -1.265 18522
9358 1 17 . 1 1 32 32 CYS N N 44 119.332 119.332 116.820 2.512 18522
9359 1 17 . 1 1 32 32 CYS HA H 44 4.859 4.859 4.801 0.058 18522
9360 1 17 . 1 1 32 32 CYS CA C 44 57.406 57.406 55.961 1.445 18522
9361 1 17 . 1 1 32 32 CYS CB C 44 27.673 27.673 28.132 -0.459 18522
9362 1 17 . 1 1 32 32 CYS H H 44 7.504 7.504 8.377 -0.873 18522
9363 1 17 . 1 1 33 33 PRO HA H 45 4.413 4.413 4.604 -0.191 18522
9364 1 17 . 1 1 33 33 PRO CA C 45 64.885 64.885 62.949 1.936 18522
9365 1 17 . 1 1 33 33 PRO CB C 45 32.318 32.318 29.843 2.475 18522
9366 1 17 . 1 1 34 34 CYS N N 46 117.327 117.327 119.703 -2.376 18522
9367 1 17 . 1 1 34 34 CYS C C 46 172.064 172.064 173.341 -1.277 18522
9368 1 17 . 1 1 34 34 CYS CA C 46 60.066 60.066 58.087 1.979 18522
9369 1 17 . 1 1 34 34 CYS CB C 46 28.715 28.715 31.186 -2.471 18522
9370 1 17 . 1 1 34 34 CYS H H 46 7.973 7.973 8.174 -0.201 18522
9371 1 17 . 1 1 35 35 LEU N N 47 124.270 124.270 121.737 2.533 18522
9372 1 17 . 1 1 35 35 LEU HA H 47 4.928 4.928 4.399 0.529 18522
9373 1 17 . 1 1 35 35 LEU C C 47 175.076 175.076 175.387 -0.311 18522
9374 1 17 . 1 1 35 35 LEU CA C 47 53.278 53.278 55.153 -1.875 18522
9375 1 17 . 1 1 35 35 LEU CB C 47 44.321 44.321 42.385 1.936 18522
9376 1 17 . 1 1 35 35 LEU H H 47 8.629 8.629 8.396 0.233 18522
9377 1 17 . 1 1 36 36 TYR N N 48 119.326 119.326 116.785 2.541 18522
9378 1 17 . 1 1 36 36 TYR HA H 48 5.255 5.255 4.827 0.428 18522
9379 1 17 . 1 1 36 36 TYR C C 48 175.766 175.766 176.630 -0.864 18522
9380 1 17 . 1 1 36 36 TYR CA C 48 56.696 56.696 59.537 -2.841 18522
9381 1 17 . 1 1 36 36 TYR CB C 48 42.590 42.590 38.721 3.869 18522
9382 1 17 . 1 1 36 36 TYR H H 48 8.761 8.761 7.457 1.304 18522
9383 1 17 . 1 1 37 37 ILE N N 49 120.259 120.259 123.097 -2.838 18522
9384 1 17 . 1 1 37 37 ILE HA H 49 4.215 4.215 4.623 -0.408 18522
9385 1 17 . 1 1 37 37 ILE C C 49 177.429 177.429 175.650 1.779 18522
9386 1 17 . 1 1 37 37 ILE CA C 49 62.456 62.456 59.447 3.009 18522
9387 1 17 . 1 1 37 37 ILE CB C 49 37.352 37.352 37.531 -0.179 18522
9388 1 17 . 1 1 37 37 ILE H H 49 8.959 8.959 8.993 -0.034 18522
9389 1 17 . 1 1 38 38 VAL HA H 50 3.937 3.937 3.820 0.117 18522
9390 1 17 . 1 1 38 38 VAL C C 50 174.408 174.408 175.452 -1.044 18522
9391 1 17 . 1 1 38 38 VAL CA C 50 62.259 62.259 64.417 -2.158 18522
9392 1 17 . 1 1 38 38 VAL CB C 50 31.584 31.584 32.310 -0.726 18522
9393 1 17 . 1 1 39 39 GLN N N 51 116.821 116.821 114.952 1.869 18522
9394 1 17 . 1 1 39 39 GLN HA H 51 4.103 4.103 4.437 -0.334 18522
9395 1 17 . 1 1 39 39 GLN C C 51 172.856 172.856 172.811 0.045 18522
9396 1 17 . 1 1 39 39 GLN CA C 51 55.127 55.127 55.135 -0.008 18522
9397 1 17 . 1 1 39 39 GLN CB C 51 32.376 32.376 32.111 0.265 18522
9398 1 17 . 1 1 39 39 GLN H H 51 6.967 6.967 7.478 -0.511 18522
9399 1 17 . 1 1 40 40 VAL N N 52 123.482 123.482 119.458 4.024 18522
9400 1 17 . 1 1 40 40 VAL HA H 52 4.277 4.277 4.962 -0.685 18522
9401 1 17 . 1 1 40 40 VAL C C 52 176.198 176.198 173.949 2.249 18522
9402 1 17 . 1 1 40 40 VAL CA C 52 61.574 61.574 59.566 2.008 18522
9403 1 17 . 1 1 40 40 VAL CB C 52 32.875 32.875 35.229 -2.354 18522
9404 1 17 . 1 1 40 40 VAL H H 52 8.447 8.447 8.116 0.331 18522
9405 1 17 . 1 1 41 41 PHE N N 53 128.296 128.296 122.163 6.133 18522
9406 1 17 . 1 1 41 41 PHE HA H 53 4.400 4.400 4.831 -0.431 18522
9407 1 17 . 1 1 41 41 PHE C C 53 175.299 175.299 175.970 -0.671 18522
9408 1 17 . 1 1 41 41 PHE CA C 53 58.494 58.494 57.169 1.325 18522
9409 1 17 . 1 1 41 41 PHE CB C 53 39.561 39.561 40.828 -1.267 18522
9410 1 17 . 1 1 41 41 PHE H H 53 8.707 8.707 8.474 0.233 18522
9411 1 17 . 1 1 42 42 ASP N N 54 122.696 122.696 123.760 -1.064 18522
9412 1 17 . 1 1 42 42 ASP HA H 54 4.272 4.272 4.273 -0.001 18522
9413 1 17 . 1 1 42 42 ASP C C 54 176.837 176.837 176.382 0.455 18522
9414 1 17 . 1 1 42 42 ASP CA C 54 55.291 55.291 57.095 -1.804 18522
9415 1 17 . 1 1 42 42 ASP CB C 54 41.093 41.093 41.042 0.051 18522
9416 1 17 . 1 1 42 42 ASP H H 54 8.901 8.901 9.022 -0.121 18522
9417 1 17 . 1 1 43 43 ASN N N 55 113.923 113.923 112.991 0.932 18522
9418 1 17 . 1 1 43 43 ASN HA H 55 4.258 4.258 4.778 -0.520 18522
9419 1 17 . 1 1 43 43 ASN C C 55 173.714 173.714 175.305 -1.591 18522
9420 1 17 . 1 1 43 43 ASN CA C 55 54.958 54.958 53.002 1.956 18522
9421 1 17 . 1 1 43 43 ASN CB C 55 37.150 37.150 39.345 -2.195 18522
9422 1 17 . 1 1 43 43 ASN H H 55 9.319 9.319 8.107 1.212 18522
9423 1 17 . 1 1 44 44 THR N N 56 108.020 108.020 114.174 -6.154 18522
9424 1 17 . 1 1 44 44 THR HA H 56 5.377 5.377 4.932 0.445 18522
9425 1 17 . 1 1 44 44 THR CA C 56 59.712 59.712 59.681 0.031 18522
9426 1 17 . 1 1 44 44 THR CB C 56 69.529 69.529 70.210 -0.681 18522
9427 1 17 . 1 1 44 44 THR H H 56 7.149 7.149 8.005 -0.856 18522
9428 1 17 . 1 1 45 45 PRO HA H 57 4.304 4.304 4.098 0.206 18522
9429 1 17 . 1 1 45 45 PRO C C 57 180.141 180.141 178.116 2.025 18522
9430 1 17 . 1 1 45 45 PRO CA C 57 66.090 66.090 65.693 0.397 18522
9431 1 17 . 1 1 45 45 PRO CB C 57 33.194 33.194 31.461 1.733 18522
9432 1 17 . 1 1 46 46 ALA N N 58 116.854 116.854 120.148 -3.294 18522
9433 1 17 . 1 1 46 46 ALA HA H 58 4.035 4.035 4.000 0.035 18522
9434 1 17 . 1 1 46 46 ALA C C 58 180.647 180.647 179.493 1.154 18522
9435 1 17 . 1 1 46 46 ALA CA C 58 55.195 55.195 55.271 -0.076 18522
9436 1 17 . 1 1 46 46 ALA CB C 58 18.880 18.880 18.121 0.759 18522
9437 1 17 . 1 1 46 46 ALA H H 58 8.938 8.938 7.831 1.107 18522
9438 1 17 . 1 1 47 47 ALA N N 59 123.250 123.250 121.102 2.148 18522
9439 1 17 . 1 1 47 47 ALA HA H 59 4.030 4.030 4.152 -0.122 18522
9440 1 17 . 1 1 47 47 ALA C C 59 179.852 179.852 179.695 0.157 18522
9441 1 17 . 1 1 47 47 ALA CA C 59 54.939 54.939 54.516 0.423 18522
9442 1 17 . 1 1 47 47 ALA CB C 59 19.688 19.688 18.452 1.236 18522
9443 1 17 . 1 1 47 47 ALA H H 59 7.658 7.658 7.438 0.220 18522
9444 1 17 . 1 1 48 48 LEU N N 60 118.654 118.654 119.527 -0.873 18522
9445 1 17 . 1 1 48 48 LEU HA H 60 4.026 4.026 4.123 -0.097 18522
9446 1 17 . 1 1 48 48 LEU C C 60 179.238 179.238 178.618 0.620 18522
9447 1 17 . 1 1 48 48 LEU CA C 60 57.261 57.261 58.072 -0.811 18522
9448 1 17 . 1 1 48 48 LEU CB C 60 41.445 41.445 40.894 0.551 18522
9449 1 17 . 1 1 48 48 LEU H H 60 8.636 8.636 8.402 0.234 18522
9450 1 17 . 1 1 49 49 ASP N N 61 117.382 117.382 116.832 0.550 18522
9451 1 17 . 1 1 49 49 ASP HA H 61 4.421 4.421 4.656 -0.235 18522
9452 1 17 . 1 1 49 49 ASP C C 61 177.668 177.668 177.969 -0.301 18522
9453 1 17 . 1 1 49 49 ASP CA C 61 57.087 57.087 54.869 2.218 18522
9454 1 17 . 1 1 49 49 ASP CB C 61 44.478 44.478 41.849 2.629 18522
9455 1 17 . 1 1 49 49 ASP H H 61 7.665 7.665 7.878 -0.213 18522
9456 1 17 . 1 1 50 50 GLY N N 62 103.228 103.228 108.427 -5.199 18522
9457 1 17 . 1 1 50 50 GLY C C 62 174.776 174.776 175.144 -0.368 18522
9458 1 17 . 1 1 50 50 GLY CA C 62 46.533 46.533 46.084 0.449 18522
9459 1 17 . 1 1 50 50 GLY H H 62 7.216 7.216 8.493 -1.277 18522
9460 1 17 . 1 1 51 51 THR N N 63 117.230 117.230 110.732 6.498 18522
9461 1 17 . 1 1 51 51 THR HA H 63 3.907 3.907 3.807 0.100 18522
9462 1 17 . 1 1 51 51 THR C C 63 175.961 175.961 174.819 1.142 18522
9463 1 17 . 1 1 51 51 THR CA C 63 66.478 66.478 63.150 3.328 18522
9464 1 17 . 1 1 51 51 THR CB C 63 68.268 68.268 66.680 1.587 18522
9465 1 17 . 1 1 51 51 THR H H 63 8.319 8.319 7.936 0.383 18522
9466 1 17 . 1 1 52 52 VAL N N 64 113.826 113.826 116.319 -2.493 18522
9467 1 17 . 1 1 52 52 VAL HA H 64 3.950 3.950 3.981 -0.031 18522
9468 1 17 . 1 1 52 52 VAL C C 64 173.883 173.883 174.711 -0.828 18522
9469 1 17 . 1 1 52 52 VAL CA C 64 60.708 60.708 60.169 0.540 18522
9470 1 17 . 1 1 52 52 VAL CB C 64 33.079 33.079 30.080 2.999 18522
9471 1 17 . 1 1 52 52 VAL H H 64 8.147 8.147 7.354 0.793 18522
9472 1 17 . 1 1 53 53 ALA N N 65 123.521 123.521 124.199 -0.678 18522
9473 1 17 . 1 1 53 53 ALA HA H 65 4.414 4.414 4.303 0.111 18522
9474 1 17 . 1 1 53 53 ALA C C 65 175.247 175.247 176.954 -1.707 18522
9475 1 17 . 1 1 53 53 ALA CA C 65 50.440 50.440 50.810 -0.370 18522
9476 1 17 . 1 1 53 53 ALA CB C 65 23.266 23.266 19.925 3.341 18522
9477 1 17 . 1 1 53 53 ALA H H 65 8.633 8.633 7.135 1.498 18522
9478 1 17 . 1 1 54 54 ALA N N 66 120.818 120.818 121.455 -0.637 18522
9479 1 17 . 1 1 54 54 ALA HA H 66 3.720 3.720 4.235 -0.515 18522
9480 1 17 . 1 1 54 54 ALA C C 66 178.411 178.411 178.879 -0.468 18522
9481 1 17 . 1 1 54 54 ALA CA C 66 53.016 53.016 53.146 -0.130 18522
9482 1 17 . 1 1 54 54 ALA CB C 66 17.840 17.840 18.289 -0.449 18522
9483 1 17 . 1 1 54 54 ALA H H 66 8.451 8.451 8.110 0.341 18522
9484 1 17 . 1 1 55 55 GLY N N 67 112.260 112.260 112.853 -0.593 18522
9485 1 17 . 1 1 55 55 GLY C C 67 173.296 173.296 174.115 -0.819 18522
9486 1 17 . 1 1 55 55 GLY CA C 67 45.025 45.025 44.753 0.272 18522
9487 1 17 . 1 1 55 55 GLY H H 67 9.600 9.600 8.771 0.829 18522
9488 1 17 . 1 1 56 56 ASP N N 68 121.293 121.293 121.495 -0.202 18522
9489 1 17 . 1 1 56 56 ASP HA H 68 4.861 4.861 4.969 -0.108 18522
9490 1 17 . 1 1 56 56 ASP C C 68 174.937 174.937 174.638 0.299 18522
9491 1 17 . 1 1 56 56 ASP CA C 68 55.641 55.641 53.862 1.779 18522
9492 1 17 . 1 1 56 56 ASP CB C 68 40.696 40.696 42.858 -2.162 18522
9493 1 17 . 1 1 56 56 ASP H H 68 8.043 8.043 7.520 0.523 18522
9494 1 17 . 1 1 57 57 GLU N N 69 122.814 122.814 118.184 4.630 18522
9495 1 17 . 1 1 57 57 GLU C C 69 177.202 177.202 175.751 1.451 18522
9496 1 17 . 1 1 57 57 GLU CA C 69 54.472 54.472 54.336 0.136 18522
9497 1 17 . 1 1 57 57 GLU CB C 69 32.800 32.800 32.826 -0.026 18522
9498 1 17 . 1 1 57 57 GLU H H 69 8.455 8.455 8.831 -0.376 18522
9499 1 17 . 1 1 58 58 ILE N N 70 125.862 125.862 123.737 2.125 18522
9500 1 17 . 1 1 58 58 ILE HA H 70 4.526 4.526 4.606 -0.080 18522
9501 1 17 . 1 1 58 58 ILE C C 70 175.035 175.035 175.809 -0.774 18522
9502 1 17 . 1 1 58 58 ILE CA C 70 60.918 60.918 59.319 1.599 18522
9503 1 17 . 1 1 58 58 ILE CB C 70 39.236 39.236 36.597 2.639 18522
9504 1 17 . 1 1 58 58 ILE H H 70 8.619 8.619 8.281 0.338 18522
9505 1 17 . 1 1 59 59 THR N N 71 115.507 115.507 121.302 -5.795 18522
9506 1 17 . 1 1 59 59 THR HA H 71 4.513 4.513 4.557 -0.044 18522
9507 1 17 . 1 1 59 59 THR C C 71 176.425 176.425 173.778 2.647 18522
9508 1 17 . 1 1 59 59 THR CA C 71 61.158 61.158 61.275 -0.117 18522
9509 1 17 . 1 1 59 59 THR CB C 71 69.604 69.604 70.320 -0.716 18522
9510 1 17 . 1 1 59 59 THR H H 71 9.242 9.242 9.051 0.191 18522
9511 1 17 . 1 1 60 60 GLY N N 72 111.789 111.789 108.628 3.161 18522
9512 1 17 . 1 1 60 60 GLY C C 72 170.981 170.981 171.739 -0.758 18522
9513 1 17 . 1 1 60 60 GLY CA C 72 46.554 46.554 45.581 0.973 18522
9514 1 17 . 1 1 60 60 GLY H H 72 7.883 7.883 7.640 0.243 18522
9515 1 17 . 1 1 61 61 VAL N N 73 119.277 119.277 118.502 0.775 18522
9516 1 17 . 1 1 61 61 VAL C C 73 175.951 175.951 175.726 0.225 18522
9517 1 17 . 1 1 61 61 VAL CA C 73 60.982 60.982 59.097 1.885 18522
9518 1 17 . 1 1 61 61 VAL CB C 73 36.197 36.197 34.823 1.374 18522
9519 1 17 . 1 1 61 61 VAL H H 73 8.424 8.424 8.080 0.344 18522
9520 1 17 . 1 1 62 62 ASN N N 74 127.731 127.731 123.279 4.452 18522
9521 1 17 . 1 1 62 62 ASN HA H 74 4.520 4.520 4.253 0.267 18522
9522 1 17 . 1 1 62 62 ASN C C 74 174.878 174.878 175.441 -0.563 18522
9523 1 17 . 1 1 62 62 ASN CA C 74 54.418 54.418 54.308 0.110 18522
9524 1 17 . 1 1 62 62 ASN CB C 74 36.655 36.655 38.211 -1.556 18522
9525 1 17 . 1 1 62 62 ASN H H 74 10.384 10.384 8.786 1.598 18522
9526 1 17 . 1 1 63 63 GLY N N 75 104.633 104.633 104.321 0.312 18522
9527 1 17 . 1 1 63 63 GLY C C 75 173.610 173.610 173.694 -0.084 18522
9528 1 17 . 1 1 63 63 GLY CA C 75 45.261 45.261 45.086 0.175 18522
9529 1 17 . 1 1 63 63 GLY H H 75 8.926 8.926 8.106 0.820 18522
9530 1 17 . 1 1 64 64 ARG N N 76 120.451 120.451 118.936 1.515 18522
9531 1 17 . 1 1 64 64 ARG HA H 76 4.501 4.501 4.674 -0.173 18522
9532 1 17 . 1 1 64 64 ARG C C 76 175.085 175.085 174.884 0.201 18522
9533 1 17 . 1 1 64 64 ARG CA C 76 54.252 54.252 53.406 0.846 18522
9534 1 17 . 1 1 64 64 ARG CB C 76 31.482 31.482 32.472 -0.990 18522
9535 1 17 . 1 1 64 64 ARG H H 76 7.753 7.753 8.050 -0.297 18522
9536 1 17 . 1 1 65 65 SER N N 77 116.586 116.586 113.609 2.977 18522
9537 1 17 . 1 1 65 65 SER HA H 77 4.483 4.483 4.564 -0.081 18522
9538 1 17 . 1 1 65 65 SER C C 77 176.953 176.953 175.957 0.996 18522
9539 1 17 . 1 1 65 65 SER CA C 77 58.292 58.292 58.043 0.249 18522
9540 1 17 . 1 1 65 65 SER CB C 77 63.643 63.643 64.027 -0.384 18522
9541 1 17 . 1 1 65 65 SER H H 77 8.555 8.555 8.428 0.127 18522
9542 1 17 . 1 1 66 66 ILE N N 78 116.618 116.618 116.765 -0.147 18522
9543 1 17 . 1 1 66 66 ILE HA H 78 4.420 4.420 4.482 -0.062 18522
9544 1 17 . 1 1 66 66 ILE C C 78 175.072 175.072 176.665 -1.593 18522
9545 1 17 . 1 1 66 66 ILE CA C 78 59.122 59.122 60.892 -1.770 18522
9546 1 17 . 1 1 66 66 ILE CB C 78 36.758 36.758 37.787 -1.029 18522
9547 1 17 . 1 1 66 66 ILE H H 78 7.599 7.599 8.301 -0.702 18522
9548 1 17 . 1 1 67 67 LYS N N 79 123.287 123.287 123.620 -0.333 18522
9549 1 17 . 1 1 67 67 LYS HA H 79 4.049 4.049 4.219 -0.170 18522
9550 1 17 . 1 1 67 67 LYS C C 79 178.333 178.333 178.194 0.139 18522
9551 1 17 . 1 1 67 67 LYS CA C 79 58.321 58.321 58.788 -0.468 18522
9552 1 17 . 1 1 67 67 LYS CB C 79 31.635 31.635 31.761 -0.126 18522
9553 1 17 . 1 1 67 67 LYS H H 79 7.898 7.898 7.601 0.297 18522
9554 1 17 . 1 1 68 68 GLY N N 80 114.933 114.933 105.007 9.926 18522
9555 1 17 . 1 1 68 68 GLY C C 80 174.385 174.385 174.706 -0.321 18522
9556 1 17 . 1 1 68 68 GLY CA C 80 45.518 45.518 45.842 -0.324 18522
9557 1 17 . 1 1 68 68 GLY H H 80 8.999 8.999 8.399 0.600 18522
9558 1 17 . 1 1 69 69 LYS N N 81 119.403 119.403 117.662 1.741 18522
9559 1 17 . 1 1 69 69 LYS HA H 81 4.043 4.043 4.741 -0.698 18522
9560 1 17 . 1 1 69 69 LYS C C 81 177.064 177.064 174.893 2.171 18522
9561 1 17 . 1 1 69 69 LYS CA C 81 54.722 54.722 55.050 -0.328 18522
9562 1 17 . 1 1 69 69 LYS CB C 81 33.560 33.560 33.220 0.340 18522
9563 1 17 . 1 1 69 69 LYS H H 81 7.845 7.845 7.793 0.052 18522
9564 1 17 . 1 1 70 70 THR N N 82 112.066 112.066 113.713 -1.647 18522
9565 1 17 . 1 1 70 70 THR HA H 82 4.666 4.666 4.691 -0.025 18522
9566 1 17 . 1 1 70 70 THR C C 82 175.955 175.955 175.021 0.934 18522
9567 1 17 . 1 1 70 70 THR CA C 82 60.438 60.438 60.188 0.250 18522
9568 1 17 . 1 1 70 70 THR CB C 82 71.629 71.629 71.129 0.500 18522
9569 1 17 . 1 1 70 70 THR H H 82 9.153 9.153 7.808 1.345 18522
9570 1 17 . 1 1 71 71 LYS N N 83 118.730 118.730 122.872 -4.142 18522
9571 1 17 . 1 1 71 71 LYS HA H 83 3.870 3.870 3.884 -0.014 18522
9572 1 17 . 1 1 71 71 LYS C C 83 177.464 177.464 178.418 -0.954 18522
9573 1 17 . 1 1 71 71 LYS CA C 83 60.357 60.357 60.233 0.124 18522
9574 1 17 . 1 1 71 71 LYS CB C 83 31.350 31.350 31.515 -0.164 18522
9575 1 17 . 1 1 71 71 LYS H H 83 8.969 8.969 8.760 0.209 18522
9576 1 17 . 1 1 72 72 VAL N N 84 117.444 117.444 118.576 -1.132 18522
9577 1 17 . 1 1 72 72 VAL HA H 84 3.633 3.633 3.669 -0.036 18522
9578 1 17 . 1 1 72 72 VAL C C 84 178.315 178.315 177.438 0.877 18522
9579 1 17 . 1 1 72 72 VAL CA C 84 66.079 66.079 65.419 0.659 18522
9580 1 17 . 1 1 72 72 VAL CB C 84 32.091 32.091 31.741 0.349 18522
9581 1 17 . 1 1 72 72 VAL H H 84 7.631 7.631 8.240 -0.609 18522
9582 1 17 . 1 1 73 73 GLU N N 85 120.890 120.890 119.228 1.662 18522
9583 1 17 . 1 1 73 73 GLU HA H 85 3.964 3.964 3.957 0.007 18522
9584 1 17 . 1 1 73 73 GLU C C 85 179.971 179.971 178.865 1.106 18522
9585 1 17 . 1 1 73 73 GLU CA C 85 59.316 59.316 59.221 0.095 18522
9586 1 17 . 1 1 73 73 GLU CB C 85 30.355 30.355 29.677 0.678 18522
9587 1 17 . 1 1 73 73 GLU H H 85 7.617 7.617 7.500 0.117 18522
9588 1 17 . 1 1 74 74 VAL N N 86 121.246 121.246 118.273 2.973 18522
9589 1 17 . 1 1 74 74 VAL HA H 86 3.630 3.630 3.682 -0.052 18522
9590 1 17 . 1 1 74 74 VAL C C 86 177.217 177.217 177.724 -0.507 18522
9591 1 17 . 1 1 74 74 VAL CA C 86 66.678 66.678 66.337 0.341 18522
9592 1 17 . 1 1 74 74 VAL CB C 86 31.307 31.307 31.452 -0.145 18522
9593 1 17 . 1 1 74 74 VAL H H 86 8.368 8.368 8.344 0.024 18522
9594 1 17 . 1 1 75 75 ALA N N 87 122.148 122.148 122.075 0.073 18522
9595 1 17 . 1 1 75 75 ALA HA H 87 3.947 3.947 3.980 -0.033 18522
9596 1 17 . 1 1 75 75 ALA C C 87 179.545 179.545 179.079 0.466 18522
9597 1 17 . 1 1 75 75 ALA CA C 87 55.851 55.851 55.295 0.556 18522
9598 1 17 . 1 1 75 75 ALA CB C 87 18.491 18.491 18.026 0.465 18522
9599 1 17 . 1 1 75 75 ALA H H 87 8.577 8.577 8.176 0.401 18522
9600 1 17 . 1 1 76 76 LYS N N 88 117.733 117.733 120.193 -2.460 18522
9601 1 17 . 1 1 76 76 LYS HA H 88 4.051 4.051 4.178 -0.127 18522
9602 1 17 . 1 1 76 76 LYS CA C 88 59.393 59.393 59.133 0.260 18522
9603 1 17 . 1 1 76 76 LYS CB C 88 32.058 32.058 32.383 -0.325 18522
9604 1 17 . 1 1 76 76 LYS H H 88 7.854 7.854 7.467 0.387 18522
9605 1 17 . 1 1 77 77 MET N N 89 117.676 117.676 117.255 0.421 18522
9606 1 17 . 1 1 77 77 MET HA H 89 4.048 4.048 4.120 -0.072 18522
9607 1 17 . 1 1 77 77 MET C C 89 178.791 178.791 178.805 -0.014 18522
9608 1 17 . 1 1 77 77 MET CA C 89 59.128 59.128 57.992 1.137 18522
9609 1 17 . 1 1 77 77 MET CB C 89 33.801 33.801 31.671 2.130 18522
9610 1 17 . 1 1 77 77 MET H H 89 7.759 7.759 8.383 -0.624 18522
9611 1 17 . 1 1 78 78 ILE N N 90 117.305 117.305 119.371 -2.066 18522
9612 1 17 . 1 1 78 78 ILE HA H 90 3.590 3.590 3.621 -0.031 18522
9613 1 17 . 1 1 78 78 ILE C C 90 178.658 178.658 177.888 0.770 18522
9614 1 17 . 1 1 78 78 ILE CA C 90 65.482 65.482 65.384 0.098 18522
9615 1 17 . 1 1 78 78 ILE CB C 90 38.845 38.845 37.822 1.023 18522
9616 1 17 . 1 1 78 78 ILE H H 90 7.972 7.972 7.957 0.015 18522
9617 1 17 . 1 1 79 79 GLN N N 91 120.935 120.935 118.543 2.392 18522
9618 1 17 . 1 1 79 79 GLN HA H 91 3.998 3.998 4.239 -0.241 18522
9619 1 17 . 1 1 79 79 GLN C C 91 178.274 178.274 177.451 0.823 18522
9620 1 17 . 1 1 79 79 GLN CA C 91 59.151 59.151 57.889 1.262 18522
9621 1 17 . 1 1 79 79 GLN CB C 91 28.934 28.934 28.827 0.107 18522
9622 1 17 . 1 1 79 79 GLN H H 91 8.826 8.826 8.107 0.719 18522
9623 1 17 . 1 1 80 80 GLU N N 92 115.213 115.213 120.446 -5.233 18522
9624 1 17 . 1 1 80 80 GLU HA H 92 4.061 4.061 4.070 -0.009 18522
9625 1 17 . 1 1 80 80 GLU C C 92 176.824 176.824 178.379 -1.555 18522
9626 1 17 . 1 1 80 80 GLU CA C 92 58.006 58.006 59.143 -1.137 18522
9627 1 17 . 1 1 80 80 GLU CB C 92 29.890 29.890 29.917 -0.027 18522
9628 1 17 . 1 1 80 80 GLU H H 92 8.020 8.020 8.349 -0.329 18522
9629 1 17 . 1 1 81 81 VAL N N 93 119.047 119.047 114.465 4.582 18522
9630 1 17 . 1 1 81 81 VAL HA H 93 3.930 3.930 3.820 0.110 18522
9631 1 17 . 1 1 81 81 VAL C C 93 176.016 176.016 176.113 -0.097 18522
9632 1 17 . 1 1 81 81 VAL CA C 93 63.153 63.153 64.001 -0.848 18522
9633 1 17 . 1 1 81 81 VAL CB C 93 32.154 32.154 31.508 0.646 18522
9634 1 17 . 1 1 81 81 VAL H H 93 7.073 7.073 7.434 -0.361 18522
9635 1 17 . 1 1 82 82 LYS N N 94 128.366 128.366 115.356 13.010 18522
9636 1 17 . 1 1 82 82 LYS C C 94 177.460 177.460 177.669 -0.209 18522
9637 1 17 . 1 1 82 82 LYS CA C 94 55.753 55.753 57.405 -1.652 18522
9638 1 17 . 1 1 82 82 LYS CB C 94 32.332 32.332 31.414 0.918 18522
9639 1 17 . 1 1 82 82 LYS H H 94 8.762 8.762 7.226 1.536 18522
9640 1 17 . 1 1 83 83 GLY N N 95 112.528 112.528 109.552 2.976 18522
9641 1 17 . 1 1 83 83 GLY C C 95 173.468 173.468 173.462 0.006 18522
9642 1 17 . 1 1 83 83 GLY CA C 95 46.243 46.243 45.532 0.711 18522
9643 1 17 . 1 1 83 83 GLY H H 95 8.673 8.673 8.791 -0.118 18522
9644 1 17 . 1 1 84 84 GLU N N 96 121.485 121.485 121.403 0.082 18522
9645 1 17 . 1 1 84 84 GLU HA H 96 4.749 4.749 5.040 -0.291 18522
9646 1 17 . 1 1 84 84 GLU C C 96 174.583 174.583 174.643 -0.060 18522
9647 1 17 . 1 1 84 84 GLU CA C 96 55.821 55.821 54.467 1.354 18522
9648 1 17 . 1 1 84 84 GLU CB C 96 31.410 31.410 33.665 -2.255 18522
9649 1 17 . 1 1 84 84 GLU H H 96 8.297 8.297 7.971 0.326 18522
9650 1 17 . 1 1 85 85 VAL N N 97 120.501 120.501 112.373 8.128 18522
9651 1 17 . 1 1 85 85 VAL HA H 97 4.665 4.665 4.598 0.067 18522
9652 1 17 . 1 1 85 85 VAL C C 97 173.047 173.047 174.108 -1.061 18522
9653 1 17 . 1 1 85 85 VAL CA C 97 60.114 60.114 60.255 -0.141 18522
9654 1 17 . 1 1 85 85 VAL CB C 97 35.184 35.184 35.415 -0.231 18522
9655 1 17 . 1 1 85 85 VAL H H 97 9.096 9.096 8.515 0.581 18522
9656 1 17 . 1 1 86 86 THR N N 98 125.019 125.019 119.538 5.481 18522
9657 1 17 . 1 1 86 86 THR HA H 98 4.076 4.076 4.992 -0.916 18522
9658 1 17 . 1 1 86 86 THR C C 98 173.807 173.807 173.902 -0.095 18522
9659 1 17 . 1 1 86 86 THR CA C 98 61.735 61.735 61.938 -0.203 18522
9660 1 17 . 1 1 86 86 THR CB C 98 69.531 69.531 69.356 0.175 18522
9661 1 17 . 1 1 86 86 THR H H 98 9.352 9.352 8.266 1.086 18522
9662 1 17 . 1 1 87 87 ILE N N 99 128.383 128.383 123.778 4.605 18522
9663 1 17 . 1 1 87 87 ILE HA H 99 4.661 4.661 4.664 -0.003 18522
9664 1 17 . 1 1 87 87 ILE C C 99 174.614 174.614 174.723 -0.109 18522
9665 1 17 . 1 1 87 87 ILE CA C 99 58.258 58.258 59.240 -0.982 18522
9666 1 17 . 1 1 87 87 ILE CB C 99 38.528 38.528 38.539 -0.011 18522
9667 1 17 . 1 1 87 87 ILE H H 99 9.329 9.329 8.697 0.632 18522
9668 1 17 . 1 1 88 88 HIS N N 100 128.279 128.279 125.480 2.799 18522
9669 1 17 . 1 1 88 88 HIS HA H 100 4.948 4.948 5.472 -0.524 18522
9670 1 17 . 1 1 88 88 HIS C C 100 174.787 174.787 174.935 -0.148 18522
9671 1 17 . 1 1 88 88 HIS CA C 100 54.620 54.620 53.786 0.834 18522
9672 1 17 . 1 1 88 88 HIS H H 100 8.647 8.647 8.562 0.085 18522
9673 1 17 . 1 1 89 89 TYR N N 101 121.320 121.320 123.638 -2.318 18522
9674 1 17 . 1 1 89 89 TYR HA H 101 5.947 5.947 5.480 0.467 18522
9675 1 17 . 1 1 89 89 TYR C C 101 173.769 173.769 173.325 0.444 18522
9676 1 17 . 1 1 89 89 TYR CA C 101 55.669 55.669 55.379 0.290 18522
9677 1 17 . 1 1 89 89 TYR CB C 101 42.195 42.195 41.176 1.019 18522
9678 1 17 . 1 1 89 89 TYR H H 101 8.414 8.414 8.880 -0.466 18522
9679 1 17 . 1 1 90 90 ASN N N 102 116.679 116.679 116.627 0.052 18522
9680 1 17 . 1 1 90 90 ASN HA H 102 5.335 5.335 5.309 0.026 18522
9681 1 17 . 1 1 90 90 ASN C C 102 175.406 175.406 173.967 1.439 18522
9682 1 17 . 1 1 90 90 ASN CA C 102 51.961 51.961 51.295 0.666 18522
9683 1 17 . 1 1 90 90 ASN CB C 102 41.800 41.800 41.767 0.033 18522
9684 1 17 . 1 1 90 90 ASN H H 102 9.282 9.282 8.941 0.341 18522
9685 1 17 . 1 1 91 91 LYS N N 103 124.129 124.129 119.324 4.805 18522
9686 1 17 . 1 1 91 91 LYS C C 103 176.678 176.678 174.863 1.815 18522
9687 1 17 . 1 1 91 91 LYS CA C 103 55.006 55.006 55.867 -0.861 18522
9688 1 17 . 1 1 91 91 LYS H H 103 8.949 8.949 8.603 0.346 18522
9689 1 17 . 1 1 92 92 LEU N N 104 127.043 127.043 118.185 8.858 18522
9690 1 17 . 1 1 92 92 LEU HA H 104 4.425 4.425 4.514 -0.089 18522
9691 1 17 . 1 1 92 92 LEU CA C 104 55.060 55.060 53.946 1.114 18522
9692 1 17 . 1 1 92 92 LEU CB C 104 42.559 42.559 44.204 -1.645 18522
9693 1 17 . 1 1 92 92 LEU H H 104 9.150 9.150 7.442 1.708 18522
9694 1 17 . 1 1 93 93 GLN HA H 105 4.315 4.315 4.156 0.159 18522
9695 1 17 . 1 1 93 93 GLN C C 105 175.070 175.070 175.776 -0.706 18522
9696 1 17 . 1 1 93 93 GLN CA C 105 55.490 55.490 55.326 0.164 18522
9697 1 17 . 1 1 93 93 GLN CB C 105 28.909 28.909 29.075 -0.166 18522
9698 1 17 . 1 1 94 94 ALA N N 106 125.133 125.133 121.455 3.678 18522
9699 1 17 . 1 1 94 94 ALA HA H 106 4.366 4.366 4.217 0.149 18522
9700 1 17 . 1 1 94 94 ALA C C 106 176.392 176.392 175.613 0.779 18522
9701 1 17 . 1 1 94 94 ALA CA C 106 51.723 51.723 52.292 -0.569 18522
9702 1 17 . 1 1 94 94 ALA CB C 106 20.185 20.185 18.745 1.440 18522
9703 1 17 . 1 1 94 94 ALA H H 106 8.226 8.226 7.859 0.367 18522
9704 1 17 . 1 1 95 95 ASP N N 107 122.013 122.013 118.381 3.632 18522
9705 1 17 . 1 1 95 95 ASP HA H 107 4.413 4.413 4.951 -0.538 18522
9706 1 17 . 1 1 95 95 ASP C C 107 175.019 175.019 175.295 -0.276 18522
9707 1 17 . 1 1 95 95 ASP CA C 107 55.642 55.642 51.126 4.516 18522
9708 1 17 . 1 1 95 95 ASP CB C 107 41.266 41.266 42.576 -1.310 18522
9709 1 17 . 1 1 95 95 ASP H H 107 8.429 8.429 8.181 0.248 18522
9710 1 17 . 1 1 96 96 PRO HA H 108 4.207 4.207 3.984 0.223 18522
9711 1 17 . 1 1 96 96 PRO C C 108 178.840 178.840 177.981 0.859 18522
9712 1 17 . 1 1 96 96 PRO CA C 108 65.396 65.396 66.057 -0.661 18522
9713 1 17 . 1 1 96 96 PRO CB C 108 32.181 32.181 31.778 0.403 18522
9714 1 17 . 1 1 97 97 LYS N N 109 117.942 117.942 115.141 2.801 18522
9715 1 17 . 1 1 97 97 LYS HA H 109 4.143 4.143 3.992 0.151 18522
9716 1 17 . 1 1 97 97 LYS C C 109 178.099 178.099 179.220 -1.121 18522
9717 1 17 . 1 1 97 97 LYS CA C 109 58.167 58.167 59.092 -0.924 18522
9718 1 17 . 1 1 97 97 LYS CB C 109 31.649 31.649 31.658 -0.009 18522
9719 1 17 . 1 1 97 97 LYS H H 109 8.335 8.335 7.912 0.423 18522
9720 1 17 . 1 1 98 98 GLN N N 110 119.159 119.159 117.929 1.230 18522
9721 1 17 . 1 1 98 98 GLN HA H 110 4.130 4.130 4.308 -0.178 18522
9722 1 17 . 1 1 98 98 GLN C C 110 178.298 178.298 178.246 0.052 18522
9723 1 17 . 1 1 98 98 GLN CA C 110 57.660 57.660 57.536 0.124 18522
9724 1 17 . 1 1 98 98 GLN CB C 110 28.720 28.720 29.369 -0.649 18522
9725 1 17 . 1 1 98 98 GLN H H 110 7.985 7.985 8.163 -0.178 18522
9726 1 17 . 1 1 99 99 LEU N N 111 120.490 120.490 122.962 -2.472 18522
9727 1 17 . 1 1 99 99 LEU HA H 111 3.877 3.877 4.250 -0.373 18522
9728 1 17 . 1 1 99 99 LEU C C 111 177.729 177.729 178.248 -0.519 18522
9729 1 17 . 1 1 99 99 LEU CA C 111 57.049 57.049 57.814 -0.765 18522
9730 1 17 . 1 1 99 99 LEU CB C 111 41.466 41.466 41.982 -0.516 18522
9731 1 17 . 1 1 99 99 LEU H H 111 7.994 7.994 8.426 -0.432 18522
9732 1 17 . 1 1 100 100 GLU N N 112 118.251 118.251 118.986 -0.735 18522
9733 1 17 . 1 1 100 100 GLU HA H 112 3.972 3.972 4.066 -0.094 18522
9734 1 17 . 1 1 100 100 GLU C C 112 178.402 178.402 178.935 -0.533 18522
9735 1 17 . 1 1 100 100 GLU CA C 112 59.056 59.056 59.285 -0.229 18522
9736 1 17 . 1 1 100 100 GLU CB C 112 29.732 29.732 28.835 0.897 18522
9737 1 17 . 1 1 100 100 GLU H H 112 7.760 7.760 8.220 -0.460 18522
9738 1 17 . 1 1 101 101 VAL N N 113 117.229 117.229 120.384 -3.155 18522
9739 1 17 . 1 1 101 101 VAL HA H 113 3.762 3.762 3.728 0.034 18522
9740 1 17 . 1 1 101 101 VAL C C 113 178.107 178.107 177.516 0.591 18522
9741 1 17 . 1 1 101 101 VAL CA C 113 64.791 64.791 66.317 -1.526 18522
9742 1 17 . 1 1 101 101 VAL CB C 113 32.149 32.149 31.671 0.478 18522
9743 1 17 . 1 1 101 101 VAL H H 113 7.437 7.437 7.413 0.024 18522
9744 1 17 . 1 1 102 102 LEU N N 114 122.124 122.124 117.044 5.080 18522
9745 1 17 . 1 1 102 102 LEU HA H 114 4.033 4.033 4.200 -0.167 18522
9746 1 17 . 1 1 102 102 LEU C C 114 178.506 178.506 178.528 -0.022 18522
9747 1 17 . 1 1 102 102 LEU CA C 114 57.243 57.243 56.598 0.645 18522
9748 1 17 . 1 1 102 102 LEU CB C 114 42.028 42.028 42.031 -0.003 18522
9749 1 17 . 1 1 102 102 LEU H H 114 7.765 7.765 7.319 0.446 18522
9750 1 17 . 1 1 103 103 PHE N N 115 115.346 115.346 120.335 -4.989 18522
9751 1 17 . 1 1 103 103 PHE HA H 115 4.224 4.224 4.292 -0.068 18522
9752 1 17 . 1 1 103 103 PHE C C 115 175.621 175.621 176.374 -0.753 18522
9753 1 17 . 1 1 103 103 PHE CA C 115 57.537 57.537 60.598 -3.061 18522
9754 1 17 . 1 1 103 103 PHE CB C 115 38.057 38.057 40.181 -2.124 18522
9755 1 17 . 1 1 103 103 PHE H H 115 7.805 7.805 7.674 0.131 18522
9756 1 17 . 1 1 104 104 GLN N N 116 119.021 119.021 118.628 0.393 18522
9757 1 17 . 1 1 104 104 GLN HA H 116 4.407 4.407 4.240 0.167 18522
9758 1 17 . 1 1 104 104 GLN C C 116 176.402 176.402 175.233 1.169 18522
9759 1 17 . 1 1 104 104 GLN CA C 116 55.521 55.521 56.443 -0.922 18522
9760 1 17 . 1 1 104 104 GLN CB C 116 29.170 29.170 26.871 2.299 18522
9761 1 17 . 1 1 104 104 GLN H H 116 7.974 7.974 8.278 -0.304 18522
9762 1 17 . 1 1 105 105 GLY N N 117 108.868 108.868 107.642 1.226 18522
9763 1 17 . 1 1 105 105 GLY CA C 117 45.124 45.124 46.214 -1.090 18522
9764 1 17 . 1 1 105 105 GLY H H 117 8.195 8.195 8.434 -0.239 18522
9765 1 17 . 1 1 106 106 PRO HA H 118 4.490 4.490 4.337 0.153 18522
9766 1 17 . 1 1 106 106 PRO C C 118 176.001 176.001 176.856 -0.855 18522
9767 1 17 . 1 1 106 106 PRO CA C 118 63.523 63.523 63.613 -0.090 18522
9768 1 17 . 1 1 106 106 PRO CB C 118 32.078 32.078 32.217 -0.139 18522
9769 1 17 . 1 1 107 107 GLN N N 119 126.950 126.950 115.607 11.343 18522
9770 1 17 . 1 1 107 107 GLN C C 119 181.211 181.211 177.687 3.524 18522
9771 1 17 . 1 1 107 107 GLN CA C 119 57.416 57.416 57.526 -0.110 18522
9772 1 17 . 1 1 107 107 GLN H H 119 8.079 8.079 8.288 -0.209 18522
9773 1 17 . 1 1 111 111 ARG C C 123 174.608 174.608 174.956 -0.348 18522
9774 1 17 . 1 1 111 111 ARG CA C 123 55.099 55.099 57.118 -2.019 18522
9775 1 17 . 1 1 112 112 HIS N N 124 122.212 122.212 115.722 6.490 18522
9776 1 17 . 1 1 112 112 HIS HA H 124 4.718 4.718 4.082 0.636 18522
9777 1 17 . 1 1 112 112 HIS C C 124 176.040 176.040 174.978 1.062 18522
9778 1 17 . 1 1 112 112 HIS CA C 124 54.213 54.213 56.594 -2.381 18522
9779 1 17 . 1 1 112 112 HIS CB C 124 31.164 31.164 29.304 1.860 18522
9780 1 17 . 1 1 112 112 HIS H H 124 7.640 7.640 8.526 -0.886 18522
9781 1 17 . 1 1 113 113 TRP C C 125 176.168 176.168 174.751 1.417 18522
9782 1 17 . 1 1 114 114 LEU N N 126 121.893 121.893 122.514 -0.621 18522
9783 1 17 . 1 1 114 114 LEU HA H 126 4.869 4.869 4.834 0.035 18522
9784 1 17 . 1 1 114 114 LEU CA C 126 54.151 54.151 53.511 0.640 18522
9785 1 17 . 1 1 114 114 LEU CB C 126 45.144 45.144 45.577 -0.433 18522
9786 1 17 . 1 1 114 114 LEU H H 126 8.606 8.606 8.387 0.219 18522
9787 1 17 . 1 1 115 115 LYS N N 127 125.850 125.850 122.350 3.500 18522
9788 1 17 . 1 1 115 115 LYS HA H 127 4.203 4.203 4.700 -0.497 18522
9789 1 17 . 1 1 115 115 LYS C C 127 175.564 175.564 173.924 1.640 18522
9790 1 17 . 1 1 115 115 LYS CA C 127 57.252 57.252 55.995 1.258 18522
9791 1 17 . 1 1 115 115 LYS CB C 127 33.406 33.406 34.964 -1.558 18522
9792 1 17 . 1 1 115 115 LYS H H 127 8.647 8.647 8.182 0.465 18522
9793 1 18 . 1 1 3 3 PRO C C 15 177.225 177.225 177.555 -0.330 18522
9794 1 18 . 1 1 3 3 PRO CA C 15 63.508 63.508 62.564 0.944 18522
9795 1 18 . 1 1 3 3 PRO CB C 15 32.090 32.090 32.536 -0.446 18522
9796 1 18 . 1 1 4 4 GLY N N 16 108.829 108.829 110.161 -1.332 18522
9797 1 18 . 1 1 4 4 GLY C C 16 173.398 173.398 173.593 -0.195 18522
9798 1 18 . 1 1 4 4 GLY CA C 16 45.128 45.128 44.575 0.553 18522
9799 1 18 . 1 1 4 4 GLY H H 16 8.489 8.489 8.464 0.025 18522
9800 1 18 . 1 1 5 5 ILE N N 17 121.763 121.763 118.549 3.214 18522
9801 1 18 . 1 1 5 5 ILE HA H 17 4.554 4.554 4.795 -0.241 18522
9802 1 18 . 1 1 5 5 ILE C C 17 174.332 174.332 174.112 0.220 18522
9803 1 18 . 1 1 5 5 ILE CA C 17 58.245 58.245 57.746 0.499 18522
9804 1 18 . 1 1 5 5 ILE CB C 17 38.762 38.762 40.630 -1.867 18522
9805 1 18 . 1 1 5 5 ILE H H 17 8.014 8.014 7.622 0.392 18522
9806 1 18 . 1 1 6 6 PRO C C 18 176.437 176.437 176.286 0.151 18522
9807 1 18 . 1 1 6 6 PRO CA C 18 62.667 62.667 64.778 -2.111 18522
9808 1 18 . 1 1 6 6 PRO CB C 18 32.469 32.469 31.953 0.516 18522
9809 1 18 . 1 1 7 7 VAL N N 19 123.849 123.849 119.045 4.804 18522
9810 1 18 . 1 1 7 7 VAL HA H 19 4.550 4.550 4.383 0.167 18522
9811 1 18 . 1 1 7 7 VAL C C 19 174.453 174.453 173.382 1.071 18522
9812 1 18 . 1 1 7 7 VAL CA C 19 59.846 59.846 59.596 0.249 18522
9813 1 18 . 1 1 7 7 VAL CB C 19 33.510 33.510 32.102 1.409 18522
9814 1 18 . 1 1 7 7 VAL H H 19 8.754 8.754 7.880 0.874 18522
9815 1 18 . 1 1 8 8 PRO HA H 20 5.338 5.338 4.577 0.761 18522
9816 1 18 . 1 1 8 8 PRO C C 20 177.585 177.585 176.392 1.193 18522
9817 1 18 . 1 1 8 8 PRO CA C 20 62.406 62.406 61.726 0.680 18522
9818 1 18 . 1 1 8 8 PRO CB C 20 32.891 32.891 31.877 1.014 18522
9819 1 18 . 1 1 9 9 GLY N N 21 108.426 108.426 113.056 -4.630 18522
9820 1 18 . 1 1 9 9 GLY C C 21 171.443 171.443 172.962 -1.519 18522
9821 1 18 . 1 1 9 9 GLY CA C 21 44.581 44.581 44.546 0.035 18522
9822 1 18 . 1 1 9 9 GLY H H 21 8.258 8.258 7.718 0.540 18522
9823 1 18 . 1 1 10 10 LYS N N 22 117.372 117.372 118.912 -1.540 18522
9824 1 18 . 1 1 10 10 LYS HA H 22 4.039 4.039 3.867 0.172 18522
9825 1 18 . 1 1 10 10 LYS C C 22 174.463 174.463 175.466 -1.003 18522
9826 1 18 . 1 1 10 10 LYS CA C 22 55.263 55.263 57.172 -1.909 18522
9827 1 18 . 1 1 10 10 LYS CB C 22 35.227 35.227 31.317 3.910 18522
9828 1 18 . 1 1 10 10 LYS H H 22 8.175 8.175 8.160 0.015 18522
9829 1 18 . 1 1 11 11 VAL N N 23 120.387 120.387 118.070 2.317 18522
9830 1 18 . 1 1 11 11 VAL HA H 23 4.708 4.708 4.520 0.188 18522
9831 1 18 . 1 1 11 11 VAL C C 23 171.873 171.873 174.376 -2.503 18522
9832 1 18 . 1 1 11 11 VAL CA C 23 59.866 59.866 59.962 -0.096 18522
9833 1 18 . 1 1 11 11 VAL CB C 23 35.269 35.269 35.304 -0.035 18522
9834 1 18 . 1 1 11 11 VAL H H 23 8.862 8.862 7.925 0.937 18522
9835 1 18 . 1 1 12 12 THR N N 24 125.797 125.797 117.771 8.026 18522
9836 1 18 . 1 1 12 12 THR HA H 24 5.121 5.121 4.595 0.526 18522
9837 1 18 . 1 1 12 12 THR C C 24 173.407 173.407 173.334 0.073 18522
9838 1 18 . 1 1 12 12 THR CA C 24 62.115 62.115 60.405 1.710 18522
9839 1 18 . 1 1 12 12 THR CB C 24 69.606 69.606 69.877 -0.271 18522
9840 1 18 . 1 1 12 12 THR H H 24 8.859 8.859 8.251 0.608 18522
9841 1 18 . 1 1 13 13 LEU N N 25 127.960 127.960 127.088 0.872 18522
9842 1 18 . 1 1 13 13 LEU HA H 25 4.809 4.809 4.817 -0.008 18522
9843 1 18 . 1 1 13 13 LEU C C 25 175.029 175.029 175.092 -0.063 18522
9844 1 18 . 1 1 13 13 LEU CA C 25 52.623 52.623 52.500 0.123 18522
9845 1 18 . 1 1 13 13 LEU CB C 25 46.242 46.242 45.179 1.063 18522
9846 1 18 . 1 1 13 13 LEU H H 25 9.258 9.258 8.089 1.169 18522
9847 1 18 . 1 1 14 14 GLN N N 26 120.858 120.858 117.289 3.569 18522
9848 1 18 . 1 1 14 14 GLN HA H 26 4.482 4.482 4.411 0.071 18522
9849 1 18 . 1 1 14 14 GLN C C 26 174.515 174.515 174.955 -0.440 18522
9850 1 18 . 1 1 14 14 GLN CA C 26 54.576 54.576 54.298 0.278 18522
9851 1 18 . 1 1 14 14 GLN CB C 26 29.516 29.516 31.937 -2.421 18522
9852 1 18 . 1 1 14 14 GLN H H 26 8.530 8.530 8.109 0.421 18522
9853 1 18 . 1 1 15 15 LYS N N 27 119.583 119.583 121.575 -1.992 18522
9854 1 18 . 1 1 15 15 LYS HA H 27 4.180 4.180 4.285 -0.105 18522
9855 1 18 . 1 1 15 15 LYS C C 27 177.468 177.468 176.918 0.550 18522
9856 1 18 . 1 1 15 15 LYS CA C 27 55.956 55.956 57.237 -1.281 18522
9857 1 18 . 1 1 15 15 LYS CB C 27 34.099 34.099 32.375 1.724 18522
9858 1 18 . 1 1 15 15 LYS H H 27 8.099 8.099 8.444 -0.345 18522
9859 1 18 . 1 1 16 16 ASP N N 28 121.439 121.439 121.686 -0.247 18522
9860 1 18 . 1 1 16 16 ASP HA H 28 4.590 4.590 4.630 -0.040 18522
9861 1 18 . 1 1 16 16 ASP C C 28 178.392 178.392 177.801 0.591 18522
9862 1 18 . 1 1 16 16 ASP CA C 28 52.426 52.426 53.570 -1.144 18522
9863 1 18 . 1 1 16 16 ASP CB C 28 41.377 41.377 42.715 -1.338 18522
9864 1 18 . 1 1 16 16 ASP H H 28 8.888 8.888 8.634 0.254 18522
9865 1 18 . 1 1 17 17 ALA N N 29 119.578 119.578 123.507 -3.929 18522
9866 1 18 . 1 1 17 17 ALA HA H 29 4.188 4.188 4.068 0.120 18522
9867 1 18 . 1 1 17 17 ALA C C 29 178.763 178.763 178.236 0.527 18522
9868 1 18 . 1 1 17 17 ALA CA C 29 54.434 54.434 54.531 -0.097 18522
9869 1 18 . 1 1 17 17 ALA CB C 29 18.293 18.293 18.761 -0.468 18522
9870 1 18 . 1 1 17 17 ALA H H 29 8.392 8.392 8.710 -0.318 18522
9871 1 18 . 1 1 18 18 GLN N N 30 117.564 117.564 118.365 -0.801 18522
9872 1 18 . 1 1 18 18 GLN HA H 30 4.399 4.399 4.368 0.031 18522
9873 1 18 . 1 1 18 18 GLN C C 30 175.168 175.168 175.341 -0.173 18522
9874 1 18 . 1 1 18 18 GLN CA C 30 55.339 55.339 54.804 0.535 18522
9875 1 18 . 1 1 18 18 GLN CB C 30 28.589 28.589 28.943 -0.354 18522
9876 1 18 . 1 1 18 18 GLN H H 30 8.353 8.353 7.981 0.372 18522
9877 1 18 . 1 1 19 19 ASN N N 31 115.365 115.365 115.377 -0.012 18522
9878 1 18 . 1 1 19 19 ASN HA H 31 4.315 4.315 4.353 -0.038 18522
9879 1 18 . 1 1 19 19 ASN C C 31 174.043 174.043 172.902 1.141 18522
9880 1 18 . 1 1 19 19 ASN CA C 31 54.303 54.303 54.477 -0.174 18522
9881 1 18 . 1 1 19 19 ASN CB C 31 37.610 37.610 37.405 0.205 18522
9882 1 18 . 1 1 19 19 ASN H H 31 8.521 8.521 8.228 0.293 18522
9883 1 18 . 1 1 20 20 LEU N N 32 118.660 118.660 111.360 7.300 18522
9884 1 18 . 1 1 20 20 LEU HA H 32 4.900 4.900 4.836 0.064 18522
9885 1 18 . 1 1 20 20 LEU C C 32 178.117 178.117 176.654 1.463 18522
9886 1 18 . 1 1 20 20 LEU CA C 32 53.957 53.957 53.135 0.823 18522
9887 1 18 . 1 1 20 20 LEU CB C 32 44.774 44.774 43.900 0.874 18522
9888 1 18 . 1 1 20 20 LEU H H 32 8.155 8.155 7.361 0.794 18522
9889 1 18 . 1 1 21 21 ILE N N 33 116.785 116.785 116.551 0.234 18522
9890 1 18 . 1 1 21 21 ILE HA H 33 4.674 4.674 4.384 0.290 18522
9891 1 18 . 1 1 21 21 ILE C C 33 176.185 176.185 176.425 -0.240 18522
9892 1 18 . 1 1 21 21 ILE CA C 33 62.602 62.602 61.469 1.133 18522
9893 1 18 . 1 1 21 21 ILE CB C 33 39.016 39.016 39.279 -0.263 18522
9894 1 18 . 1 1 21 21 ILE H H 33 11.488 11.488 8.376 3.112 18522
9895 1 18 . 1 1 22 22 GLY N N 34 111.234 111.234 108.611 2.623 18522
9896 1 18 . 1 1 22 22 GLY C C 34 173.993 173.993 173.377 0.616 18522
9897 1 18 . 1 1 22 22 GLY CA C 34 45.980 45.980 45.230 0.750 18522
9898 1 18 . 1 1 22 22 GLY H H 34 9.854 9.854 8.699 1.155 18522
9899 1 18 . 1 1 23 23 ILE N N 35 111.117 111.117 113.318 -2.201 18522
9900 1 18 . 1 1 23 23 ILE HA H 35 5.535 5.535 5.328 0.207 18522
9901 1 18 . 1 1 23 23 ILE C C 35 175.033 175.033 173.856 1.177 18522
9902 1 18 . 1 1 23 23 ILE CA C 35 58.415 58.415 57.870 0.545 18522
9903 1 18 . 1 1 23 23 ILE CB C 35 41.577 41.577 42.009 -0.432 18522
9904 1 18 . 1 1 23 23 ILE H H 35 7.835 7.835 7.217 0.618 18522
9905 1 18 . 1 1 24 24 SER N N 36 114.908 114.908 116.081 -1.173 18522
9906 1 18 . 1 1 24 24 SER HA H 36 4.232 4.232 5.298 -1.066 18522
9907 1 18 . 1 1 24 24 SER C C 36 174.735 174.735 172.995 1.740 18522
9908 1 18 . 1 1 24 24 SER CA C 36 56.121 56.121 57.158 -1.037 18522
9909 1 18 . 1 1 24 24 SER CB C 36 66.097 66.097 66.132 -0.035 18522
9910 1 18 . 1 1 24 24 SER H H 36 8.623 8.623 8.388 0.235 18522
9911 1 18 . 1 1 25 25 ILE N N 37 117.739 117.739 126.113 -8.374 18522
9912 1 18 . 1 1 25 25 ILE C C 37 174.340 174.340 175.970 -1.630 18522
9913 1 18 . 1 1 25 25 ILE CA C 37 59.123 59.123 59.070 0.053 18522
9914 1 18 . 1 1 25 25 ILE CB C 37 41.637 41.637 38.468 3.169 18522
9915 1 18 . 1 1 25 25 ILE H H 37 9.130 9.130 8.365 0.765 18522
9916 1 18 . 1 1 26 26 GLY N N 38 108.069 108.069 115.057 -6.988 18522
9917 1 18 . 1 1 26 26 GLY CA C 38 44.112 44.112 44.194 -0.082 18522
9918 1 18 . 1 1 26 26 GLY H H 38 8.841 8.841 9.080 -0.239 18522
9919 1 18 . 1 1 27 27 GLY N N 39 109.016 109.016 106.625 2.391 18522
9920 1 18 . 1 1 27 27 GLY C C 39 173.956 173.956 174.067 -0.111 18522
9921 1 18 . 1 1 27 27 GLY H H 39 8.187 8.187 8.213 -0.026 18522
9922 1 18 . 1 1 28 28 GLY N N 40 111.783 111.783 108.837 2.946 18522
9923 1 18 . 1 1 28 28 GLY C C 40 174.255 174.255 172.515 1.740 18522
9924 1 18 . 1 1 28 28 GLY CA C 40 47.098 47.098 44.385 2.713 18522
9925 1 18 . 1 1 28 28 GLY H H 40 8.275 8.275 7.877 0.398 18522
9926 1 18 . 1 1 29 29 ALA N N 41 123.128 123.128 120.227 2.901 18522
9927 1 18 . 1 1 29 29 ALA HA H 41 4.559 4.559 4.152 0.407 18522
9928 1 18 . 1 1 29 29 ALA CA C 41 51.073 51.073 52.758 -1.685 18522
9929 1 18 . 1 1 29 29 ALA CB C 41 21.926 21.926 19.573 2.353 18522
9930 1 18 . 1 1 29 29 ALA H H 41 8.012 8.012 7.673 0.339 18522
9931 1 18 . 1 1 31 31 TYR HA H 43 4.549 4.549 4.798 -0.249 18522
9932 1 18 . 1 1 31 31 TYR CA C 43 57.147 57.147 57.938 -0.791 18522
9933 1 18 . 1 1 31 31 TYR CB C 43 37.495 37.495 39.146 -1.651 18522
9934 1 18 . 1 1 32 32 CYS N N 44 119.332 119.332 117.823 1.509 18522
9935 1 18 . 1 1 32 32 CYS HA H 44 4.859 4.859 4.676 0.183 18522
9936 1 18 . 1 1 32 32 CYS CA C 44 57.406 57.406 59.350 -1.944 18522
9937 1 18 . 1 1 32 32 CYS CB C 44 27.673 27.673 27.438 0.235 18522
9938 1 18 . 1 1 32 32 CYS H H 44 7.504 7.504 7.908 -0.404 18522
9939 1 18 . 1 1 33 33 PRO HA H 45 4.413 4.413 4.483 -0.070 18522
9940 1 18 . 1 1 33 33 PRO CA C 45 64.885 64.885 62.218 2.667 18522
9941 1 18 . 1 1 33 33 PRO CB C 45 32.318 32.318 32.090 0.228 18522
9942 1 18 . 1 1 34 34 CYS N N 46 117.327 117.327 119.327 -2.000 18522
9943 1 18 . 1 1 34 34 CYS C C 46 172.064 172.064 174.524 -2.460 18522
9944 1 18 . 1 1 34 34 CYS CA C 46 60.066 60.066 58.279 1.788 18522
9945 1 18 . 1 1 34 34 CYS CB C 46 28.715 28.715 28.551 0.164 18522
9946 1 18 . 1 1 34 34 CYS H H 46 7.973 7.973 8.362 -0.389 18522
9947 1 18 . 1 1 35 35 LEU N N 47 124.270 124.270 123.797 0.473 18522
9948 1 18 . 1 1 35 35 LEU HA H 47 4.928 4.928 4.104 0.824 18522
9949 1 18 . 1 1 35 35 LEU C C 47 175.076 175.076 176.944 -1.868 18522
9950 1 18 . 1 1 35 35 LEU CA C 47 53.278 53.278 54.953 -1.675 18522
9951 1 18 . 1 1 35 35 LEU CB C 47 44.321 44.321 42.410 1.911 18522
9952 1 18 . 1 1 35 35 LEU H H 47 8.629 8.629 8.293 0.336 18522
9953 1 18 . 1 1 36 36 TYR N N 48 119.326 119.326 118.773 0.553 18522
9954 1 18 . 1 1 36 36 TYR HA H 48 5.255 5.255 4.138 1.117 18522
9955 1 18 . 1 1 36 36 TYR C C 48 175.766 175.766 176.028 -0.262 18522
9956 1 18 . 1 1 36 36 TYR CA C 48 56.696 56.696 61.607 -4.911 18522
9957 1 18 . 1 1 36 36 TYR CB C 48 42.590 42.590 36.645 5.945 18522
9958 1 18 . 1 1 36 36 TYR H H 48 8.761 8.761 8.096 0.665 18522
9959 1 18 . 1 1 37 37 ILE N N 49 120.259 120.259 121.878 -1.619 18522
9960 1 18 . 1 1 37 37 ILE HA H 49 4.215 4.215 4.615 -0.400 18522
9961 1 18 . 1 1 37 37 ILE C C 49 177.429 177.429 176.915 0.514 18522
9962 1 18 . 1 1 37 37 ILE CA C 49 62.456 62.456 60.897 1.559 18522
9963 1 18 . 1 1 37 37 ILE CB C 49 37.352 37.352 38.726 -1.374 18522
9964 1 18 . 1 1 37 37 ILE H H 49 8.959 8.959 7.818 1.141 18522
9965 1 18 . 1 1 38 38 VAL HA H 50 3.937 3.937 4.201 -0.264 18522
9966 1 18 . 1 1 38 38 VAL C C 50 174.408 174.408 174.968 -0.560 18522
9967 1 18 . 1 1 38 38 VAL CA C 50 62.259 62.259 61.770 0.489 18522
9968 1 18 . 1 1 38 38 VAL CB C 50 31.584 31.584 32.354 -0.770 18522
9969 1 18 . 1 1 39 39 GLN N N 51 116.821 116.821 117.832 -1.011 18522
9970 1 18 . 1 1 39 39 GLN HA H 51 4.103 4.103 4.350 -0.247 18522
9971 1 18 . 1 1 39 39 GLN C C 51 172.856 172.856 172.900 -0.044 18522
9972 1 18 . 1 1 39 39 GLN CA C 51 55.127 55.127 55.120 0.007 18522
9973 1 18 . 1 1 39 39 GLN CB C 51 32.376 32.376 32.208 0.168 18522
9974 1 18 . 1 1 39 39 GLN H H 51 6.967 6.967 7.325 -0.358 18522
9975 1 18 . 1 1 40 40 VAL N N 52 123.482 123.482 121.877 1.605 18522
9976 1 18 . 1 1 40 40 VAL HA H 52 4.277 4.277 4.629 -0.352 18522
9977 1 18 . 1 1 40 40 VAL C C 52 176.198 176.198 174.299 1.899 18522
9978 1 18 . 1 1 40 40 VAL CA C 52 61.574 61.574 59.597 1.977 18522
9979 1 18 . 1 1 40 40 VAL CB C 52 32.875 32.875 34.710 -1.835 18522
9980 1 18 . 1 1 40 40 VAL H H 52 8.447 8.447 8.121 0.326 18522
9981 1 18 . 1 1 41 41 PHE N N 53 128.296 128.296 124.440 3.856 18522
9982 1 18 . 1 1 41 41 PHE HA H 53 4.400 4.400 4.744 -0.344 18522
9983 1 18 . 1 1 41 41 PHE C C 53 175.299 175.299 175.029 0.270 18522
9984 1 18 . 1 1 41 41 PHE CA C 53 58.494 58.494 58.086 0.408 18522
9985 1 18 . 1 1 41 41 PHE CB C 53 39.561 39.561 39.666 -0.105 18522
9986 1 18 . 1 1 41 41 PHE H H 53 8.707 8.707 8.193 0.514 18522
9987 1 18 . 1 1 42 42 ASP N N 54 122.696 122.696 117.506 5.190 18522
9988 1 18 . 1 1 42 42 ASP HA H 54 4.272 4.272 4.692 -0.420 18522
9989 1 18 . 1 1 42 42 ASP C C 54 176.837 176.837 175.890 0.947 18522
9990 1 18 . 1 1 42 42 ASP CA C 54 55.291 55.291 55.144 0.147 18522
9991 1 18 . 1 1 42 42 ASP CB C 54 41.093 41.093 42.637 -1.544 18522
9992 1 18 . 1 1 42 42 ASP H H 54 8.901 8.901 8.401 0.500 18522
9993 1 18 . 1 1 43 43 ASN N N 55 113.923 113.923 117.738 -3.815 18522
9994 1 18 . 1 1 43 43 ASN HA H 55 4.258 4.258 4.795 -0.537 18522
9995 1 18 . 1 1 43 43 ASN C C 55 173.714 173.714 174.365 -0.651 18522
9996 1 18 . 1 1 43 43 ASN CA C 55 54.958 54.958 53.370 1.588 18522
9997 1 18 . 1 1 43 43 ASN CB C 55 37.150 37.150 39.325 -2.175 18522
9998 1 18 . 1 1 43 43 ASN H H 55 9.319 9.319 8.267 1.052 18522
9999 1 18 . 1 1 44 44 THR N N 56 108.020 108.020 111.079 -3.059 18522
10000 1 18 . 1 1 44 44 THR HA H 56 5.377 5.377 4.842 0.535 18522
10001 1 18 . 1 1 44 44 THR CA C 56 59.712 59.712 59.356 0.356 18522
10002 1 18 . 1 1 44 44 THR CB C 56 69.529 69.529 70.148 -0.619 18522
10003 1 18 . 1 1 44 44 THR H H 56 7.149 7.149 7.535 -0.386 18522
10004 1 18 . 1 1 45 45 PRO HA H 57 4.304 4.304 4.112 0.192 18522
10005 1 18 . 1 1 45 45 PRO C C 57 180.141 180.141 178.124 2.017 18522
10006 1 18 . 1 1 45 45 PRO CA C 57 66.090 66.090 65.573 0.517 18522
10007 1 18 . 1 1 45 45 PRO CB C 57 33.194 33.194 31.456 1.738 18522
10008 1 18 . 1 1 46 46 ALA N N 58 116.854 116.854 120.169 -3.315 18522
10009 1 18 . 1 1 46 46 ALA HA H 58 4.035 4.035 3.978 0.057 18522
10010 1 18 . 1 1 46 46 ALA C C 58 180.647 180.647 179.285 1.362 18522
10011 1 18 . 1 1 46 46 ALA CA C 58 55.195 55.195 55.356 -0.161 18522
10012 1 18 . 1 1 46 46 ALA CB C 58 18.880 18.880 18.083 0.797 18522
10013 1 18 . 1 1 46 46 ALA H H 58 8.938 8.938 7.701 1.237 18522
10014 1 18 . 1 1 47 47 ALA N N 59 123.250 123.250 120.829 2.421 18522
10015 1 18 . 1 1 47 47 ALA HA H 59 4.030 4.030 4.045 -0.015 18522
10016 1 18 . 1 1 47 47 ALA C C 59 179.852 179.852 179.496 0.356 18522
10017 1 18 . 1 1 47 47 ALA CA C 59 54.939 54.939 54.532 0.406 18522
10018 1 18 . 1 1 47 47 ALA CB C 59 19.688 19.688 18.589 1.099 18522
10019 1 18 . 1 1 47 47 ALA H H 59 7.658 7.658 7.457 0.201 18522
10020 1 18 . 1 1 48 48 LEU N N 60 118.654 118.654 119.009 -0.355 18522
10021 1 18 . 1 1 48 48 LEU HA H 60 4.026 4.026 4.116 -0.090 18522
10022 1 18 . 1 1 48 48 LEU C C 60 179.238 179.238 178.277 0.961 18522
10023 1 18 . 1 1 48 48 LEU CA C 60 57.261 57.261 58.032 -0.771 18522
10024 1 18 . 1 1 48 48 LEU CB C 60 41.445 41.445 41.027 0.418 18522
10025 1 18 . 1 1 48 48 LEU H H 60 8.636 8.636 8.494 0.142 18522
10026 1 18 . 1 1 49 49 ASP N N 61 117.382 117.382 118.212 -0.830 18522
10027 1 18 . 1 1 49 49 ASP HA H 61 4.421 4.421 4.647 -0.226 18522
10028 1 18 . 1 1 49 49 ASP C C 61 177.668 177.668 177.771 -0.103 18522
10029 1 18 . 1 1 49 49 ASP CA C 61 57.087 57.087 55.434 1.653 18522
10030 1 18 . 1 1 49 49 ASP CB C 61 44.478 44.478 42.363 2.115 18522
10031 1 18 . 1 1 49 49 ASP H H 61 7.665 7.665 7.785 -0.120 18522
10032 1 18 . 1 1 50 50 GLY N N 62 103.228 103.228 108.131 -4.903 18522
10033 1 18 . 1 1 50 50 GLY C C 62 174.776 174.776 175.386 -0.610 18522
10034 1 18 . 1 1 50 50 GLY CA C 62 46.533 46.533 46.314 0.219 18522
10035 1 18 . 1 1 50 50 GLY H H 62 7.216 7.216 8.407 -1.191 18522
10036 1 18 . 1 1 51 51 THR N N 63 117.230 117.230 111.393 5.837 18522
10037 1 18 . 1 1 51 51 THR HA H 63 3.907 3.907 4.131 -0.224 18522
10038 1 18 . 1 1 51 51 THR C C 63 175.961 175.961 174.364 1.597 18522
10039 1 18 . 1 1 51 51 THR CA C 63 66.478 66.478 62.478 3.999 18522
10040 1 18 . 1 1 51 51 THR CB C 63 68.268 68.268 69.383 -1.115 18522
10041 1 18 . 1 1 51 51 THR H H 63 8.319 8.319 8.199 0.120 18522
10042 1 18 . 1 1 52 52 VAL N N 64 113.826 113.826 124.233 -10.407 18522
10043 1 18 . 1 1 52 52 VAL HA H 64 3.950 3.950 3.691 0.259 18522
10044 1 18 . 1 1 52 52 VAL C C 64 173.883 173.883 175.003 -1.120 18522
10045 1 18 . 1 1 52 52 VAL CA C 64 60.708 60.708 61.890 -1.182 18522
10046 1 18 . 1 1 52 52 VAL CB C 64 33.079 33.079 29.943 3.136 18522
10047 1 18 . 1 1 52 52 VAL H H 64 8.147 8.147 7.690 0.457 18522
10048 1 18 . 1 1 53 53 ALA N N 65 123.521 123.521 124.829 -1.308 18522
10049 1 18 . 1 1 53 53 ALA HA H 65 4.414 4.414 4.384 0.030 18522
10050 1 18 . 1 1 53 53 ALA C C 65 175.247 175.247 176.367 -1.120 18522
10051 1 18 . 1 1 53 53 ALA CA C 65 50.440 50.440 50.985 -0.545 18522
10052 1 18 . 1 1 53 53 ALA CB C 65 23.266 23.266 20.920 2.346 18522
10053 1 18 . 1 1 53 53 ALA H H 65 8.633 8.633 7.845 0.788 18522
10054 1 18 . 1 1 54 54 ALA N N 66 120.818 120.818 122.412 -1.594 18522
10055 1 18 . 1 1 54 54 ALA HA H 66 3.720 3.720 3.848 -0.128 18522
10056 1 18 . 1 1 54 54 ALA C C 66 178.411 178.411 177.632 0.779 18522
10057 1 18 . 1 1 54 54 ALA CA C 66 53.016 53.016 53.266 -0.250 18522
10058 1 18 . 1 1 54 54 ALA CB C 66 17.840 17.840 17.983 -0.143 18522
10059 1 18 . 1 1 54 54 ALA H H 66 8.451 8.451 8.417 0.034 18522
10060 1 18 . 1 1 55 55 GLY N N 67 112.260 112.260 113.536 -1.276 18522
10061 1 18 . 1 1 55 55 GLY C C 67 173.296 173.296 173.885 -0.589 18522
10062 1 18 . 1 1 55 55 GLY CA C 67 45.025 45.025 44.633 0.392 18522
10063 1 18 . 1 1 55 55 GLY H H 67 9.600 9.600 8.326 1.274 18522
10064 1 18 . 1 1 56 56 ASP N N 68 121.293 121.293 122.730 -1.437 18522
10065 1 18 . 1 1 56 56 ASP HA H 68 4.861 4.861 4.653 0.208 18522
10066 1 18 . 1 1 56 56 ASP C C 68 174.937 174.937 175.469 -0.532 18522
10067 1 18 . 1 1 56 56 ASP CA C 68 55.641 55.641 54.843 0.798 18522
10068 1 18 . 1 1 56 56 ASP CB C 68 40.696 40.696 41.706 -1.010 18522
10069 1 18 . 1 1 56 56 ASP H H 68 8.043 8.043 7.646 0.397 18522
10070 1 18 . 1 1 57 57 GLU N N 69 122.814 122.814 123.428 -0.614 18522
10071 1 18 . 1 1 57 57 GLU C C 69 177.202 177.202 176.561 0.641 18522
10072 1 18 . 1 1 57 57 GLU CA C 69 54.472 54.472 55.554 -1.082 18522
10073 1 18 . 1 1 57 57 GLU CB C 69 32.800 32.800 29.501 3.299 18522
10074 1 18 . 1 1 57 57 GLU H H 69 8.455 8.455 8.489 -0.034 18522
10075 1 18 . 1 1 58 58 ILE N N 70 125.862 125.862 126.152 -0.290 18522
10076 1 18 . 1 1 58 58 ILE HA H 70 4.526 4.526 4.302 0.224 18522
10077 1 18 . 1 1 58 58 ILE C C 70 175.035 175.035 175.807 -0.772 18522
10078 1 18 . 1 1 58 58 ILE CA C 70 60.918 60.918 62.017 -1.099 18522
10079 1 18 . 1 1 58 58 ILE CB C 70 39.236 39.236 37.531 1.705 18522
10080 1 18 . 1 1 58 58 ILE H H 70 8.619 8.619 8.230 0.389 18522
10081 1 18 . 1 1 59 59 THR N N 71 115.507 115.507 122.892 -7.385 18522
10082 1 18 . 1 1 59 59 THR HA H 71 4.513 4.513 3.824 0.689 18522
10083 1 18 . 1 1 59 59 THR C C 71 176.425 176.425 173.785 2.640 18522
10084 1 18 . 1 1 59 59 THR CA C 71 61.158 61.158 61.000 0.158 18522
10085 1 18 . 1 1 59 59 THR CB C 71 69.604 69.604 69.466 0.138 18522
10086 1 18 . 1 1 59 59 THR H H 71 9.242 9.242 8.367 0.875 18522
10087 1 18 . 1 1 60 60 GLY N N 72 111.789 111.789 109.626 2.163 18522
10088 1 18 . 1 1 60 60 GLY C C 72 170.981 170.981 171.903 -0.922 18522
10089 1 18 . 1 1 60 60 GLY CA C 72 46.554 46.554 44.604 1.950 18522
10090 1 18 . 1 1 60 60 GLY H H 72 7.883 7.883 7.883 -0.000 18522
10091 1 18 . 1 1 61 61 VAL N N 73 119.277 119.277 123.742 -4.465 18522
10092 1 18 . 1 1 61 61 VAL C C 73 175.951 175.951 175.504 0.447 18522
10093 1 18 . 1 1 61 61 VAL CA C 73 60.982 60.982 60.315 0.667 18522
10094 1 18 . 1 1 61 61 VAL CB C 73 36.197 36.197 33.944 2.253 18522
10095 1 18 . 1 1 61 61 VAL H H 73 8.424 8.424 8.868 -0.444 18522
10096 1 18 . 1 1 62 62 ASN N N 74 127.731 127.731 126.938 0.793 18522
10097 1 18 . 1 1 62 62 ASN HA H 74 4.520 4.520 4.411 0.109 18522
10098 1 18 . 1 1 62 62 ASN C C 74 174.878 174.878 174.582 0.296 18522
10099 1 18 . 1 1 62 62 ASN CA C 74 54.418 54.418 54.674 -0.256 18522
10100 1 18 . 1 1 62 62 ASN CB C 74 36.655 36.655 36.721 -0.066 18522
10101 1 18 . 1 1 62 62 ASN H H 74 10.384 10.384 8.979 1.405 18522
10102 1 18 . 1 1 63 63 GLY N N 75 104.633 104.633 103.037 1.596 18522
10103 1 18 . 1 1 63 63 GLY C C 75 173.610 173.610 172.970 0.640 18522
10104 1 18 . 1 1 63 63 GLY CA C 75 45.261 45.261 44.542 0.719 18522
10105 1 18 . 1 1 63 63 GLY H H 75 8.926 8.926 7.968 0.958 18522
10106 1 18 . 1 1 64 64 ARG N N 76 120.451 120.451 120.977 -0.526 18522
10107 1 18 . 1 1 64 64 ARG HA H 76 4.501 4.501 4.558 -0.057 18522
10108 1 18 . 1 1 64 64 ARG C C 76 175.085 175.085 175.488 -0.403 18522
10109 1 18 . 1 1 64 64 ARG CA C 76 54.252 54.252 53.812 0.440 18522
10110 1 18 . 1 1 64 64 ARG CB C 76 31.482 31.482 32.020 -0.538 18522
10111 1 18 . 1 1 64 64 ARG H H 76 7.753 7.753 7.907 -0.154 18522
10112 1 18 . 1 1 65 65 SER N N 77 116.586 116.586 118.599 -2.013 18522
10113 1 18 . 1 1 65 65 SER HA H 77 4.483 4.483 4.624 -0.141 18522
10114 1 18 . 1 1 65 65 SER C C 77 176.953 176.953 176.259 0.694 18522
10115 1 18 . 1 1 65 65 SER CA C 77 58.292 58.292 58.855 -0.563 18522
10116 1 18 . 1 1 65 65 SER CB C 77 63.643 63.643 63.306 0.337 18522
10117 1 18 . 1 1 65 65 SER H H 77 8.555 8.555 8.898 -0.343 18522
10118 1 18 . 1 1 66 66 ILE N N 78 116.618 116.618 122.265 -5.647 18522
10119 1 18 . 1 1 66 66 ILE HA H 78 4.420 4.420 4.155 0.265 18522
10120 1 18 . 1 1 66 66 ILE C C 78 175.072 175.072 177.276 -2.204 18522
10121 1 18 . 1 1 66 66 ILE CA C 78 59.122 59.122 61.790 -2.668 18522
10122 1 18 . 1 1 66 66 ILE CB C 78 36.758 36.758 37.044 -0.286 18522
10123 1 18 . 1 1 66 66 ILE H H 78 7.599 7.599 8.683 -1.084 18522
10124 1 18 . 1 1 67 67 LYS N N 79 123.287 123.287 122.633 0.654 18522
10125 1 18 . 1 1 67 67 LYS HA H 79 4.049 4.049 4.114 -0.065 18522
10126 1 18 . 1 1 67 67 LYS C C 79 178.333 178.333 178.122 0.211 18522
10127 1 18 . 1 1 67 67 LYS CA C 79 58.321 58.321 58.854 -0.533 18522
10128 1 18 . 1 1 67 67 LYS CB C 79 31.635 31.635 31.996 -0.361 18522
10129 1 18 . 1 1 67 67 LYS H H 79 7.898 7.898 8.349 -0.451 18522
10130 1 18 . 1 1 68 68 GLY N N 80 114.933 114.933 106.104 8.829 18522
10131 1 18 . 1 1 68 68 GLY C C 80 174.385 174.385 174.877 -0.492 18522
10132 1 18 . 1 1 68 68 GLY CA C 80 45.518 45.518 45.571 -0.053 18522
10133 1 18 . 1 1 68 68 GLY H H 80 8.999 8.999 8.365 0.634 18522
10134 1 18 . 1 1 69 69 LYS N N 81 119.403 119.403 120.156 -0.753 18522
10135 1 18 . 1 1 69 69 LYS HA H 81 4.043 4.043 4.590 -0.547 18522
10136 1 18 . 1 1 69 69 LYS C C 81 177.064 177.064 176.096 0.968 18522
10137 1 18 . 1 1 69 69 LYS CA C 81 54.722 54.722 55.380 -0.658 18522
10138 1 18 . 1 1 69 69 LYS CB C 81 33.560 33.560 33.806 -0.246 18522
10139 1 18 . 1 1 69 69 LYS H H 81 7.845 7.845 7.795 0.050 18522
10140 1 18 . 1 1 70 70 THR N N 82 112.066 112.066 111.184 0.882 18522
10141 1 18 . 1 1 70 70 THR HA H 82 4.666 4.666 4.505 0.161 18522
10142 1 18 . 1 1 70 70 THR C C 82 175.955 175.955 173.932 2.023 18522
10143 1 18 . 1 1 70 70 THR CA C 82 60.438 60.438 60.894 -0.456 18522
10144 1 18 . 1 1 70 70 THR CB C 82 71.629 71.629 69.436 2.193 18522
10145 1 18 . 1 1 70 70 THR H H 82 9.153 9.153 7.730 1.423 18522
10146 1 18 . 1 1 71 71 LYS N N 83 118.730 118.730 122.846 -4.116 18522
10147 1 18 . 1 1 71 71 LYS HA H 83 3.870 3.870 4.025 -0.155 18522
10148 1 18 . 1 1 71 71 LYS C C 83 177.464 177.464 178.087 -0.623 18522
10149 1 18 . 1 1 71 71 LYS CA C 83 60.357 60.357 59.899 0.458 18522
10150 1 18 . 1 1 71 71 LYS CB C 83 31.350 31.350 32.315 -0.965 18522
10151 1 18 . 1 1 71 71 LYS H H 83 8.969 8.969 8.789 0.180 18522
10152 1 18 . 1 1 72 72 VAL N N 84 117.444 117.444 119.050 -1.606 18522
10153 1 18 . 1 1 72 72 VAL HA H 84 3.633 3.633 3.767 -0.134 18522
10154 1 18 . 1 1 72 72 VAL C C 84 178.315 178.315 177.524 0.791 18522
10155 1 18 . 1 1 72 72 VAL CA C 84 66.079 66.079 65.430 0.649 18522
10156 1 18 . 1 1 72 72 VAL CB C 84 32.091 32.091 31.804 0.287 18522
10157 1 18 . 1 1 72 72 VAL H H 84 7.631 7.631 8.326 -0.695 18522
10158 1 18 . 1 1 73 73 GLU N N 85 120.890 120.890 119.086 1.804 18522
10159 1 18 . 1 1 73 73 GLU HA H 85 3.964 3.964 4.105 -0.141 18522
10160 1 18 . 1 1 73 73 GLU C C 85 179.971 179.971 178.991 0.980 18522
10161 1 18 . 1 1 73 73 GLU CA C 85 59.316 59.316 59.641 -0.325 18522
10162 1 18 . 1 1 73 73 GLU CB C 85 30.355 30.355 29.570 0.784 18522
10163 1 18 . 1 1 73 73 GLU H H 85 7.617 7.617 7.545 0.072 18522
10164 1 18 . 1 1 74 74 VAL N N 86 121.246 121.246 118.523 2.723 18522
10165 1 18 . 1 1 74 74 VAL HA H 86 3.630 3.630 3.657 -0.027 18522
10166 1 18 . 1 1 74 74 VAL C C 86 177.217 177.217 177.512 -0.295 18522
10167 1 18 . 1 1 74 74 VAL CA C 86 66.678 66.678 66.222 0.456 18522
10168 1 18 . 1 1 74 74 VAL CB C 86 31.307 31.307 30.511 0.796 18522
10169 1 18 . 1 1 74 74 VAL H H 86 8.368 8.368 8.518 -0.150 18522
10170 1 18 . 1 1 75 75 ALA N N 87 122.148 122.148 122.409 -0.261 18522
10171 1 18 . 1 1 75 75 ALA HA H 87 3.947 3.947 3.910 0.037 18522
10172 1 18 . 1 1 75 75 ALA C C 87 179.545 179.545 179.344 0.201 18522
10173 1 18 . 1 1 75 75 ALA CA C 87 55.851 55.851 55.471 0.380 18522
10174 1 18 . 1 1 75 75 ALA CB C 87 18.491 18.491 17.948 0.543 18522
10175 1 18 . 1 1 75 75 ALA H H 87 8.577 8.577 7.784 0.793 18522
10176 1 18 . 1 1 76 76 LYS N N 88 117.733 117.733 119.225 -1.492 18522
10177 1 18 . 1 1 76 76 LYS HA H 88 4.051 4.051 4.005 0.046 18522
10178 1 18 . 1 1 76 76 LYS CA C 88 59.393 59.393 59.408 -0.015 18522
10179 1 18 . 1 1 76 76 LYS CB C 88 32.058 32.058 32.423 -0.365 18522
10180 1 18 . 1 1 76 76 LYS H H 88 7.854 7.854 7.323 0.531 18522
10181 1 18 . 1 1 77 77 MET N N 89 117.676 117.676 118.359 -0.683 18522
10182 1 18 . 1 1 77 77 MET HA H 89 4.048 4.048 4.122 -0.074 18522
10183 1 18 . 1 1 77 77 MET C C 89 178.791 178.791 178.905 -0.114 18522
10184 1 18 . 1 1 77 77 MET CA C 89 59.128 59.128 57.947 1.181 18522
10185 1 18 . 1 1 77 77 MET CB C 89 33.801 33.801 31.623 2.178 18522
10186 1 18 . 1 1 77 77 MET H H 89 7.759 7.759 8.398 -0.639 18522
10187 1 18 . 1 1 78 78 ILE N N 90 117.305 117.305 119.853 -2.548 18522
10188 1 18 . 1 1 78 78 ILE HA H 90 3.590 3.590 3.966 -0.376 18522
10189 1 18 . 1 1 78 78 ILE C C 90 178.658 178.658 178.797 -0.139 18522
10190 1 18 . 1 1 78 78 ILE CA C 90 65.482 65.482 64.198 1.284 18522
10191 1 18 . 1 1 78 78 ILE CB C 90 38.845 38.845 36.769 2.076 18522
10192 1 18 . 1 1 78 78 ILE H H 90 7.972 7.972 8.638 -0.666 18522
10193 1 18 . 1 1 79 79 GLN N N 91 120.935 120.935 118.398 2.537 18522
10194 1 18 . 1 1 79 79 GLN HA H 91 3.998 3.998 4.196 -0.198 18522
10195 1 18 . 1 1 79 79 GLN C C 91 178.274 178.274 178.739 -0.465 18522
10196 1 18 . 1 1 79 79 GLN CA C 91 59.151 59.151 58.349 0.802 18522
10197 1 18 . 1 1 79 79 GLN CB C 91 28.934 28.934 28.675 0.259 18522
10198 1 18 . 1 1 79 79 GLN H H 91 8.826 8.826 8.287 0.539 18522
10199 1 18 . 1 1 80 80 GLU N N 92 115.213 115.213 120.222 -5.009 18522
10200 1 18 . 1 1 80 80 GLU HA H 92 4.061 4.061 4.154 -0.093 18522
10201 1 18 . 1 1 80 80 GLU C C 92 176.824 176.824 178.674 -1.850 18522
10202 1 18 . 1 1 80 80 GLU CA C 92 58.006 58.006 59.095 -1.089 18522
10203 1 18 . 1 1 80 80 GLU CB C 92 29.890 29.890 29.909 -0.019 18522
10204 1 18 . 1 1 80 80 GLU H H 92 8.020 8.020 8.296 -0.276 18522
10205 1 18 . 1 1 81 81 VAL N N 93 119.047 119.047 117.586 1.461 18522
10206 1 18 . 1 1 81 81 VAL HA H 93 3.930 3.930 4.109 -0.179 18522
10207 1 18 . 1 1 81 81 VAL C C 93 176.016 176.016 174.972 1.044 18522
10208 1 18 . 1 1 81 81 VAL CA C 93 63.153 63.153 61.135 2.018 18522
10209 1 18 . 1 1 81 81 VAL CB C 93 32.154 32.154 29.098 3.056 18522
10210 1 18 . 1 1 81 81 VAL H H 93 7.073 7.073 7.458 -0.385 18522
10211 1 18 . 1 1 82 82 LYS N N 94 128.366 128.366 122.700 5.666 18522
10212 1 18 . 1 1 82 82 LYS C C 94 177.460 177.460 177.582 -0.122 18522
10213 1 18 . 1 1 82 82 LYS CA C 94 55.753 55.753 57.994 -2.241 18522
10214 1 18 . 1 1 82 82 LYS CB C 94 32.332 32.332 32.211 0.121 18522
10215 1 18 . 1 1 82 82 LYS H H 94 8.762 8.762 8.170 0.592 18522
10216 1 18 . 1 1 83 83 GLY N N 95 112.528 112.528 111.079 1.449 18522
10217 1 18 . 1 1 83 83 GLY C C 95 173.468 173.468 173.581 -0.113 18522
10218 1 18 . 1 1 83 83 GLY CA C 95 46.243 46.243 44.946 1.297 18522
10219 1 18 . 1 1 83 83 GLY H H 95 8.673 8.673 8.626 0.047 18522
10220 1 18 . 1 1 84 84 GLU N N 96 121.485 121.485 120.218 1.267 18522
10221 1 18 . 1 1 84 84 GLU HA H 96 4.749 4.749 5.153 -0.404 18522
10222 1 18 . 1 1 84 84 GLU C C 96 174.583 174.583 174.258 0.325 18522
10223 1 18 . 1 1 84 84 GLU CA C 96 55.821 55.821 54.390 1.431 18522
10224 1 18 . 1 1 84 84 GLU CB C 96 31.410 31.410 33.513 -2.103 18522
10225 1 18 . 1 1 84 84 GLU H H 96 8.297 8.297 7.789 0.508 18522
10226 1 18 . 1 1 85 85 VAL N N 97 120.501 120.501 118.838 1.663 18522
10227 1 18 . 1 1 85 85 VAL HA H 97 4.665 4.665 4.367 0.298 18522
10228 1 18 . 1 1 85 85 VAL C C 97 173.047 173.047 174.488 -1.441 18522
10229 1 18 . 1 1 85 85 VAL CA C 97 60.114 60.114 62.179 -2.065 18522
10230 1 18 . 1 1 85 85 VAL CB C 97 35.184 35.184 36.559 -1.375 18522
10231 1 18 . 1 1 85 85 VAL H H 97 9.096 9.096 8.297 0.799 18522
10232 1 18 . 1 1 86 86 THR N N 98 125.019 125.019 123.933 1.086 18522
10233 1 18 . 1 1 86 86 THR HA H 98 4.076 4.076 4.785 -0.709 18522
10234 1 18 . 1 1 86 86 THR C C 98 173.807 173.807 172.724 1.083 18522
10235 1 18 . 1 1 86 86 THR CA C 98 61.735 61.735 61.967 -0.232 18522
10236 1 18 . 1 1 86 86 THR CB C 98 69.531 69.531 70.127 -0.596 18522
10237 1 18 . 1 1 86 86 THR H H 98 9.352 9.352 8.692 0.660 18522
10238 1 18 . 1 1 87 87 ILE N N 99 128.383 128.383 123.285 5.098 18522
10239 1 18 . 1 1 87 87 ILE HA H 99 4.661 4.661 4.674 -0.013 18522
10240 1 18 . 1 1 87 87 ILE C C 99 174.614 174.614 174.197 0.417 18522
10241 1 18 . 1 1 87 87 ILE CA C 99 58.258 58.258 58.727 -0.469 18522
10242 1 18 . 1 1 87 87 ILE CB C 99 38.528 38.528 38.251 0.278 18522
10243 1 18 . 1 1 87 87 ILE H H 99 9.329 9.329 8.505 0.824 18522
10244 1 18 . 1 1 88 88 HIS N N 100 128.279 128.279 127.726 0.553 18522
10245 1 18 . 1 1 88 88 HIS HA H 100 4.948 4.948 5.224 -0.276 18522
10246 1 18 . 1 1 88 88 HIS C C 100 174.787 174.787 174.161 0.626 18522
10247 1 18 . 1 1 88 88 HIS CA C 100 54.620 54.620 54.367 0.253 18522
10248 1 18 . 1 1 88 88 HIS H H 100 8.647 8.647 8.255 0.392 18522
10249 1 18 . 1 1 89 89 TYR N N 101 121.320 121.320 121.514 -0.194 18522
10250 1 18 . 1 1 89 89 TYR HA H 101 5.947 5.947 5.261 0.686 18522
10251 1 18 . 1 1 89 89 TYR C C 101 173.769 173.769 173.421 0.348 18522
10252 1 18 . 1 1 89 89 TYR CA C 101 55.669 55.669 55.440 0.229 18522
10253 1 18 . 1 1 89 89 TYR CB C 101 42.195 42.195 41.519 0.676 18522
10254 1 18 . 1 1 89 89 TYR H H 101 8.414 8.414 8.597 -0.183 18522
10255 1 18 . 1 1 90 90 ASN N N 102 116.679 116.679 117.240 -0.561 18522
10256 1 18 . 1 1 90 90 ASN HA H 102 5.335 5.335 5.031 0.304 18522
10257 1 18 . 1 1 90 90 ASN C C 102 175.406 175.406 174.063 1.343 18522
10258 1 18 . 1 1 90 90 ASN CA C 102 51.961 51.961 52.015 -0.054 18522
10259 1 18 . 1 1 90 90 ASN CB C 102 41.800 41.800 43.649 -1.849 18522
10260 1 18 . 1 1 90 90 ASN H H 102 9.282 9.282 8.735 0.547 18522
10261 1 18 . 1 1 91 91 LYS N N 103 124.129 124.129 119.059 5.070 18522
10262 1 18 . 1 1 91 91 LYS C C 103 176.678 176.678 178.301 -1.623 18522
10263 1 18 . 1 1 91 91 LYS CA C 103 55.006 55.006 55.369 -0.363 18522
10264 1 18 . 1 1 91 91 LYS H H 103 8.949 8.949 8.419 0.530 18522
10265 1 18 . 1 1 92 92 LEU N N 104 127.043 127.043 115.817 11.226 18522
10266 1 18 . 1 1 92 92 LEU HA H 104 4.425 4.425 3.832 0.593 18522
10267 1 18 . 1 1 92 92 LEU CA C 104 55.060 55.060 57.038 -1.978 18522
10268 1 18 . 1 1 92 92 LEU CB C 104 42.559 42.559 40.411 2.147 18522
10269 1 18 . 1 1 92 92 LEU H H 104 9.150 9.150 8.808 0.342 18522
10270 1 18 . 1 1 93 93 GLN HA H 105 4.315 4.315 3.935 0.380 18522
10271 1 18 . 1 1 93 93 GLN C C 105 175.070 175.070 175.549 -0.479 18522
10272 1 18 . 1 1 93 93 GLN CA C 105 55.490 55.490 56.540 -1.050 18522
10273 1 18 . 1 1 93 93 GLN CB C 105 28.909 28.909 26.867 2.042 18522
10274 1 18 . 1 1 94 94 ALA N N 106 125.133 125.133 118.142 6.991 18522
10275 1 18 . 1 1 94 94 ALA HA H 106 4.366 4.366 3.927 0.439 18522
10276 1 18 . 1 1 94 94 ALA C C 106 176.392 176.392 174.722 1.670 18522
10277 1 18 . 1 1 94 94 ALA CA C 106 51.723 51.723 53.360 -1.637 18522
10278 1 18 . 1 1 94 94 ALA CB C 106 20.185 20.185 18.686 1.499 18522
10279 1 18 . 1 1 94 94 ALA H H 106 8.226 8.226 8.214 0.012 18522
10280 1 18 . 1 1 95 95 ASP N N 107 122.013 122.013 120.278 1.735 18522
10281 1 18 . 1 1 95 95 ASP HA H 107 4.413 4.413 4.939 -0.526 18522
10282 1 18 . 1 1 95 95 ASP C C 107 175.019 175.019 175.321 -0.302 18522
10283 1 18 . 1 1 95 95 ASP CA C 107 55.642 55.642 51.890 3.752 18522
10284 1 18 . 1 1 95 95 ASP CB C 107 41.266 41.266 43.031 -1.765 18522
10285 1 18 . 1 1 95 95 ASP H H 107 8.429 8.429 8.025 0.404 18522
10286 1 18 . 1 1 96 96 PRO HA H 108 4.207 4.207 3.845 0.362 18522
10287 1 18 . 1 1 96 96 PRO C C 108 178.840 178.840 178.044 0.796 18522
10288 1 18 . 1 1 96 96 PRO CA C 108 65.396 65.396 66.170 -0.774 18522
10289 1 18 . 1 1 96 96 PRO CB C 108 32.181 32.181 31.718 0.463 18522
10290 1 18 . 1 1 97 97 LYS N N 109 117.942 117.942 116.029 1.913 18522
10291 1 18 . 1 1 97 97 LYS HA H 109 4.143 4.143 3.999 0.144 18522
10292 1 18 . 1 1 97 97 LYS C C 109 178.099 178.099 179.102 -1.003 18522
10293 1 18 . 1 1 97 97 LYS CA C 109 58.167 58.167 59.320 -1.153 18522
10294 1 18 . 1 1 97 97 LYS CB C 109 31.649 31.649 31.135 0.514 18522
10295 1 18 . 1 1 97 97 LYS H H 109 8.335 8.335 8.576 -0.241 18522
10296 1 18 . 1 1 98 98 GLN N N 110 119.159 119.159 118.862 0.297 18522
10297 1 18 . 1 1 98 98 GLN HA H 110 4.130 4.130 4.202 -0.072 18522
10298 1 18 . 1 1 98 98 GLN C C 110 178.298 178.298 178.434 -0.136 18522
10299 1 18 . 1 1 98 98 GLN CA C 110 57.660 57.660 57.980 -0.320 18522
10300 1 18 . 1 1 98 98 GLN CB C 110 28.720 28.720 29.106 -0.386 18522
10301 1 18 . 1 1 98 98 GLN H H 110 7.985 7.985 8.104 -0.119 18522
10302 1 18 . 1 1 99 99 LEU N N 111 120.490 120.490 122.987 -2.497 18522
10303 1 18 . 1 1 99 99 LEU HA H 111 3.877 3.877 4.179 -0.302 18522
10304 1 18 . 1 1 99 99 LEU C C 111 177.729 177.729 178.654 -0.925 18522
10305 1 18 . 1 1 99 99 LEU CA C 111 57.049 57.049 58.069 -1.020 18522
10306 1 18 . 1 1 99 99 LEU CB C 111 41.466 41.466 41.881 -0.415 18522
10307 1 18 . 1 1 99 99 LEU H H 111 7.994 7.994 8.525 -0.531 18522
10308 1 18 . 1 1 100 100 GLU N N 112 118.251 118.251 118.494 -0.243 18522
10309 1 18 . 1 1 100 100 GLU HA H 112 3.972 3.972 4.127 -0.155 18522
10310 1 18 . 1 1 100 100 GLU C C 112 178.402 178.402 179.268 -0.866 18522
10311 1 18 . 1 1 100 100 GLU CA C 112 59.056 59.056 59.220 -0.164 18522
10312 1 18 . 1 1 100 100 GLU CB C 112 29.732 29.732 29.093 0.639 18522
10313 1 18 . 1 1 100 100 GLU H H 112 7.760 7.760 8.228 -0.468 18522
10314 1 18 . 1 1 101 101 VAL N N 113 117.229 117.229 120.163 -2.934 18522
10315 1 18 . 1 1 101 101 VAL HA H 113 3.762 3.762 3.781 -0.019 18522
10316 1 18 . 1 1 101 101 VAL C C 113 178.107 178.107 178.055 0.052 18522
10317 1 18 . 1 1 101 101 VAL CA C 113 64.791 64.791 66.397 -1.606 18522
10318 1 18 . 1 1 101 101 VAL CB C 113 32.149 32.149 31.570 0.579 18522
10319 1 18 . 1 1 101 101 VAL H H 113 7.437 7.437 7.295 0.142 18522
10320 1 18 . 1 1 102 102 LEU N N 114 122.124 122.124 120.308 1.816 18522
10321 1 18 . 1 1 102 102 LEU HA H 114 4.033 4.033 4.137 -0.104 18522
10322 1 18 . 1 1 102 102 LEU C C 114 178.506 178.506 178.321 0.185 18522
10323 1 18 . 1 1 102 102 LEU CA C 114 57.243 57.243 57.653 -0.409 18522
10324 1 18 . 1 1 102 102 LEU CB C 114 42.028 42.028 42.246 -0.218 18522
10325 1 18 . 1 1 102 102 LEU H H 114 7.765 7.765 7.764 0.001 18522
10326 1 18 . 1 1 103 103 PHE N N 115 115.346 115.346 119.114 -3.768 18522
10327 1 18 . 1 1 103 103 PHE HA H 115 4.224 4.224 4.289 -0.065 18522
10328 1 18 . 1 1 103 103 PHE C C 115 175.621 175.621 176.502 -0.881 18522
10329 1 18 . 1 1 103 103 PHE CA C 115 57.537 57.537 58.981 -1.444 18522
10330 1 18 . 1 1 103 103 PHE CB C 115 38.057 38.057 39.790 -1.733 18522
10331 1 18 . 1 1 103 103 PHE H H 115 7.805 7.805 8.195 -0.390 18522
10332 1 18 . 1 1 104 104 GLN N N 116 119.021 119.021 118.344 0.677 18522
10333 1 18 . 1 1 104 104 GLN HA H 116 4.407 4.407 3.948 0.459 18522
10334 1 18 . 1 1 104 104 GLN C C 116 176.402 176.402 175.576 0.826 18522
10335 1 18 . 1 1 104 104 GLN CA C 116 55.521 55.521 57.774 -2.253 18522
10336 1 18 . 1 1 104 104 GLN CB C 116 29.170 29.170 27.695 1.475 18522
10337 1 18 . 1 1 104 104 GLN H H 116 7.974 7.974 7.902 0.072 18522
10338 1 18 . 1 1 105 105 GLY N N 117 108.868 108.868 109.329 -0.461 18522
10339 1 18 . 1 1 105 105 GLY CA C 117 45.124 45.124 44.340 0.784 18522
10340 1 18 . 1 1 105 105 GLY H H 117 8.195 8.195 7.586 0.609 18522
10341 1 18 . 1 1 106 106 PRO HA H 118 4.490 4.490 4.353 0.137 18522
10342 1 18 . 1 1 106 106 PRO C C 118 176.001 176.001 176.460 -0.459 18522
10343 1 18 . 1 1 106 106 PRO CA C 118 63.523 63.523 62.797 0.726 18522
10344 1 18 . 1 1 106 106 PRO CB C 118 32.078 32.078 32.392 -0.314 18522
10345 1 18 . 1 1 107 107 GLN N N 119 126.950 126.950 118.823 8.127 18522
10346 1 18 . 1 1 107 107 GLN C C 119 181.211 181.211 175.374 5.837 18522
10347 1 18 . 1 1 107 107 GLN CA C 119 57.416 57.416 56.174 1.242 18522
10348 1 18 . 1 1 107 107 GLN H H 119 8.079 8.079 8.517 -0.438 18522
10349 1 18 . 1 1 111 111 ARG C C 123 174.608 174.608 175.338 -0.730 18522
10350 1 18 . 1 1 111 111 ARG CA C 123 55.099 55.099 56.332 -1.233 18522
10351 1 18 . 1 1 112 112 HIS N N 124 122.212 122.212 123.126 -0.914 18522
10352 1 18 . 1 1 112 112 HIS HA H 124 4.718 4.718 4.797 -0.079 18522
10353 1 18 . 1 1 112 112 HIS C C 124 176.040 176.040 173.181 2.859 18522
10354 1 18 . 1 1 112 112 HIS CA C 124 54.213 54.213 54.395 -0.182 18522
10355 1 18 . 1 1 112 112 HIS CB C 124 31.164 31.164 30.640 0.523 18522
10356 1 18 . 1 1 112 112 HIS H H 124 7.640 7.640 8.162 -0.522 18522
10357 1 18 . 1 1 113 113 TRP C C 125 176.168 176.168 174.382 1.786 18522
10358 1 18 . 1 1 114 114 LEU N N 126 121.893 121.893 119.387 2.506 18522
10359 1 18 . 1 1 114 114 LEU HA H 126 4.869 4.869 4.739 0.130 18522
10360 1 18 . 1 1 114 114 LEU CA C 126 54.151 54.151 53.492 0.659 18522
10361 1 18 . 1 1 114 114 LEU CB C 126 45.144 45.144 43.972 1.172 18522
10362 1 18 . 1 1 114 114 LEU H H 126 8.606 8.606 8.680 -0.074 18522
10363 1 18 . 1 1 115 115 LYS N N 127 125.850 125.850 119.540 6.310 18522
10364 1 18 . 1 1 115 115 LYS HA H 127 4.203 4.203 5.065 -0.862 18522
10365 1 18 . 1 1 115 115 LYS C C 127 175.564 175.564 174.688 0.876 18522
10366 1 18 . 1 1 115 115 LYS CA C 127 57.252 57.252 55.067 2.185 18522
10367 1 18 . 1 1 115 115 LYS CB C 127 33.406 33.406 33.830 -0.424 18522
10368 1 18 . 1 1 115 115 LYS H H 127 8.647 8.647 8.095 0.552 18522
10369 1 19 . 1 1 3 3 PRO C C 15 177.225 177.225 177.161 0.064 18522
10370 1 19 . 1 1 3 3 PRO CA C 15 63.508 63.508 63.130 0.378 18522
10371 1 19 . 1 1 3 3 PRO CB C 15 32.090 32.090 32.116 -0.026 18522
10372 1 19 . 1 1 4 4 GLY N N 16 108.829 108.829 107.874 0.955 18522
10373 1 19 . 1 1 4 4 GLY C C 16 173.398 173.398 174.309 -0.911 18522
10374 1 19 . 1 1 4 4 GLY CA C 16 45.128 45.128 44.798 0.330 18522
10375 1 19 . 1 1 4 4 GLY H H 16 8.489 8.489 8.158 0.331 18522
10376 1 19 . 1 1 5 5 ILE N N 17 121.763 121.763 119.675 2.088 18522
10377 1 19 . 1 1 5 5 ILE HA H 17 4.554 4.554 4.518 0.036 18522
10378 1 19 . 1 1 5 5 ILE C C 17 174.332 174.332 175.191 -0.859 18522
10379 1 19 . 1 1 5 5 ILE CA C 17 58.245 58.245 58.585 -0.340 18522
10380 1 19 . 1 1 5 5 ILE CB C 17 38.762 38.762 38.206 0.556 18522
10381 1 19 . 1 1 5 5 ILE H H 17 8.014 8.014 7.712 0.302 18522
10382 1 19 . 1 1 6 6 PRO C C 18 176.437 176.437 176.513 -0.076 18522
10383 1 19 . 1 1 6 6 PRO CA C 18 62.667 62.667 64.340 -1.673 18522
10384 1 19 . 1 1 6 6 PRO CB C 18 32.469 32.469 31.927 0.543 18522
10385 1 19 . 1 1 7 7 VAL N N 19 123.849 123.849 118.525 5.324 18522
10386 1 19 . 1 1 7 7 VAL HA H 19 4.550 4.550 4.528 0.022 18522
10387 1 19 . 1 1 7 7 VAL C C 19 174.453 174.453 173.875 0.578 18522
10388 1 19 . 1 1 7 7 VAL CA C 19 59.846 59.846 58.806 1.040 18522
10389 1 19 . 1 1 7 7 VAL CB C 19 33.510 33.510 33.122 0.388 18522
10390 1 19 . 1 1 7 7 VAL H H 19 8.754 8.754 7.924 0.830 18522
10391 1 19 . 1 1 8 8 PRO HA H 20 5.338 5.338 4.687 0.651 18522
10392 1 19 . 1 1 8 8 PRO C C 20 177.585 177.585 176.495 1.090 18522
10393 1 19 . 1 1 8 8 PRO CA C 20 62.406 62.406 62.560 -0.154 18522
10394 1 19 . 1 1 8 8 PRO CB C 20 32.891 32.891 32.174 0.717 18522
10395 1 19 . 1 1 9 9 GLY N N 21 108.426 108.426 110.902 -2.476 18522
10396 1 19 . 1 1 9 9 GLY C C 21 171.443 171.443 172.219 -0.776 18522
10397 1 19 . 1 1 9 9 GLY CA C 21 44.581 44.581 45.211 -0.630 18522
10398 1 19 . 1 1 9 9 GLY H H 21 8.258 8.258 8.262 -0.004 18522
10399 1 19 . 1 1 10 10 LYS N N 22 117.372 117.372 121.208 -3.836 18522
10400 1 19 . 1 1 10 10 LYS HA H 22 4.039 4.039 5.149 -1.111 18522
10401 1 19 . 1 1 10 10 LYS C C 22 174.463 174.463 174.551 -0.088 18522
10402 1 19 . 1 1 10 10 LYS CA C 22 55.263 55.263 55.184 0.079 18522
10403 1 19 . 1 1 10 10 LYS CB C 22 35.227 35.227 34.963 0.264 18522
10404 1 19 . 1 1 10 10 LYS H H 22 8.175 8.175 8.208 -0.033 18522
10405 1 19 . 1 1 11 11 VAL N N 23 120.387 120.387 116.760 3.627 18522
10406 1 19 . 1 1 11 11 VAL HA H 23 4.708 4.708 4.584 0.124 18522
10407 1 19 . 1 1 11 11 VAL C C 23 171.873 171.873 173.948 -2.075 18522
10408 1 19 . 1 1 11 11 VAL CA C 23 59.866 59.866 59.664 0.202 18522
10409 1 19 . 1 1 11 11 VAL CB C 23 35.269 35.269 35.188 0.081 18522
10410 1 19 . 1 1 11 11 VAL H H 23 8.862 8.862 8.217 0.645 18522
10411 1 19 . 1 1 12 12 THR N N 24 125.797 125.797 118.273 7.524 18522
10412 1 19 . 1 1 12 12 THR HA H 24 5.121 5.121 4.992 0.129 18522
10413 1 19 . 1 1 12 12 THR C C 24 173.407 173.407 173.412 -0.005 18522
10414 1 19 . 1 1 12 12 THR CA C 24 62.115 62.115 60.346 1.769 18522
10415 1 19 . 1 1 12 12 THR CB C 24 69.606 69.606 69.839 -0.233 18522
10416 1 19 . 1 1 12 12 THR H H 24 8.859 8.859 8.234 0.625 18522
10417 1 19 . 1 1 13 13 LEU N N 25 127.960 127.960 126.397 1.563 18522
10418 1 19 . 1 1 13 13 LEU HA H 25 4.809 4.809 4.828 -0.019 18522
10419 1 19 . 1 1 13 13 LEU C C 25 175.029 175.029 175.141 -0.112 18522
10420 1 19 . 1 1 13 13 LEU CA C 25 52.623 52.623 52.541 0.082 18522
10421 1 19 . 1 1 13 13 LEU CB C 25 46.242 46.242 45.519 0.723 18522
10422 1 19 . 1 1 13 13 LEU H H 25 9.258 9.258 8.114 1.144 18522
10423 1 19 . 1 1 14 14 GLN N N 26 120.858 120.858 117.956 2.902 18522
10424 1 19 . 1 1 14 14 GLN HA H 26 4.482 4.482 4.571 -0.089 18522
10425 1 19 . 1 1 14 14 GLN C C 26 174.515 174.515 175.026 -0.511 18522
10426 1 19 . 1 1 14 14 GLN CA C 26 54.576 54.576 54.179 0.397 18522
10427 1 19 . 1 1 14 14 GLN CB C 26 29.516 29.516 31.744 -2.228 18522
10428 1 19 . 1 1 14 14 GLN H H 26 8.530 8.530 8.331 0.199 18522
10429 1 19 . 1 1 15 15 LYS N N 27 119.583 119.583 122.802 -3.219 18522
10430 1 19 . 1 1 15 15 LYS HA H 27 4.180 4.180 4.150 0.030 18522
10431 1 19 . 1 1 15 15 LYS C C 27 177.468 177.468 176.954 0.514 18522
10432 1 19 . 1 1 15 15 LYS CA C 27 55.956 55.956 56.977 -1.021 18522
10433 1 19 . 1 1 15 15 LYS CB C 27 34.099 34.099 32.448 1.651 18522
10434 1 19 . 1 1 15 15 LYS H H 27 8.099 8.099 8.057 0.042 18522
10435 1 19 . 1 1 16 16 ASP N N 28 121.439 121.439 122.281 -0.842 18522
10436 1 19 . 1 1 16 16 ASP HA H 28 4.590 4.590 4.578 0.012 18522
10437 1 19 . 1 1 16 16 ASP C C 28 178.392 178.392 177.969 0.423 18522
10438 1 19 . 1 1 16 16 ASP CA C 28 52.426 52.426 53.824 -1.397 18522
10439 1 19 . 1 1 16 16 ASP CB C 28 41.377 41.377 42.380 -1.003 18522
10440 1 19 . 1 1 16 16 ASP H H 28 8.888 8.888 8.525 0.363 18522
10441 1 19 . 1 1 17 17 ALA N N 29 119.578 119.578 123.668 -4.090 18522
10442 1 19 . 1 1 17 17 ALA HA H 29 4.188 4.188 4.040 0.148 18522
10443 1 19 . 1 1 17 17 ALA C C 29 178.763 178.763 178.308 0.455 18522
10444 1 19 . 1 1 17 17 ALA CA C 29 54.434 54.434 54.582 -0.148 18522
10445 1 19 . 1 1 17 17 ALA CB C 29 18.293 18.293 18.775 -0.482 18522
10446 1 19 . 1 1 17 17 ALA H H 29 8.392 8.392 8.663 -0.271 18522
10447 1 19 . 1 1 18 18 GLN N N 30 117.564 117.564 117.099 0.465 18522
10448 1 19 . 1 1 18 18 GLN HA H 30 4.399 4.399 4.312 0.087 18522
10449 1 19 . 1 1 18 18 GLN C C 30 175.168 175.168 175.620 -0.452 18522
10450 1 19 . 1 1 18 18 GLN CA C 30 55.339 55.339 55.059 0.280 18522
10451 1 19 . 1 1 18 18 GLN CB C 30 28.589 28.589 29.099 -0.510 18522
10452 1 19 . 1 1 18 18 GLN H H 30 8.353 8.353 8.041 0.312 18522
10453 1 19 . 1 1 19 19 ASN N N 31 115.365 115.365 115.446 -0.081 18522
10454 1 19 . 1 1 19 19 ASN HA H 31 4.315 4.315 4.397 -0.082 18522
10455 1 19 . 1 1 19 19 ASN C C 31 174.043 174.043 173.227 0.816 18522
10456 1 19 . 1 1 19 19 ASN CA C 31 54.303 54.303 54.608 -0.305 18522
10457 1 19 . 1 1 19 19 ASN CB C 31 37.610 37.610 37.667 -0.057 18522
10458 1 19 . 1 1 19 19 ASN H H 31 8.521 8.521 8.232 0.289 18522
10459 1 19 . 1 1 20 20 LEU N N 32 118.660 118.660 110.675 7.985 18522
10460 1 19 . 1 1 20 20 LEU HA H 32 4.900 4.900 4.910 -0.010 18522
10461 1 19 . 1 1 20 20 LEU C C 32 178.117 178.117 177.210 0.907 18522
10462 1 19 . 1 1 20 20 LEU CA C 32 53.957 53.957 52.691 1.266 18522
10463 1 19 . 1 1 20 20 LEU CB C 32 44.774 44.774 44.138 0.636 18522
10464 1 19 . 1 1 20 20 LEU H H 32 8.155 8.155 7.297 0.858 18522
10465 1 19 . 1 1 21 21 ILE N N 33 116.785 116.785 115.262 1.523 18522
10466 1 19 . 1 1 21 21 ILE HA H 33 4.674 4.674 4.503 0.171 18522
10467 1 19 . 1 1 21 21 ILE C C 33 176.185 176.185 176.423 -0.238 18522
10468 1 19 . 1 1 21 21 ILE CA C 33 62.602 62.602 61.211 1.391 18522
10469 1 19 . 1 1 21 21 ILE CB C 33 39.016 39.016 39.130 -0.114 18522
10470 1 19 . 1 1 21 21 ILE H H 33 11.488 11.488 7.797 3.691 18522
10471 1 19 . 1 1 22 22 GLY N N 34 111.234 111.234 108.593 2.641 18522
10472 1 19 . 1 1 22 22 GLY C C 34 173.993 173.993 173.753 0.240 18522
10473 1 19 . 1 1 22 22 GLY CA C 34 45.980 45.980 45.064 0.916 18522
10474 1 19 . 1 1 22 22 GLY H H 34 9.854 9.854 7.777 2.077 18522
10475 1 19 . 1 1 23 23 ILE N N 35 111.117 111.117 114.193 -3.076 18522
10476 1 19 . 1 1 23 23 ILE HA H 35 5.535 5.535 5.559 -0.024 18522
10477 1 19 . 1 1 23 23 ILE C C 35 175.033 175.033 174.471 0.562 18522
10478 1 19 . 1 1 23 23 ILE CA C 35 58.415 58.415 57.859 0.555 18522
10479 1 19 . 1 1 23 23 ILE CB C 35 41.577 41.577 41.567 0.010 18522
10480 1 19 . 1 1 23 23 ILE H H 35 7.835 7.835 7.537 0.298 18522
10481 1 19 . 1 1 24 24 SER N N 36 114.908 114.908 115.283 -0.375 18522
10482 1 19 . 1 1 24 24 SER HA H 36 4.232 4.232 5.245 -1.013 18522
10483 1 19 . 1 1 24 24 SER C C 36 174.735 174.735 172.555 2.180 18522
10484 1 19 . 1 1 24 24 SER CA C 36 56.121 56.121 57.918 -1.797 18522
10485 1 19 . 1 1 24 24 SER CB C 36 66.097 66.097 65.407 0.690 18522
10486 1 19 . 1 1 24 24 SER H H 36 8.623 8.623 8.458 0.165 18522
10487 1 19 . 1 1 25 25 ILE N N 37 117.739 117.739 126.543 -8.804 18522
10488 1 19 . 1 1 25 25 ILE C C 37 174.340 174.340 173.913 0.427 18522
10489 1 19 . 1 1 25 25 ILE CA C 37 59.123 59.123 58.785 0.338 18522
10490 1 19 . 1 1 25 25 ILE CB C 37 41.637 41.637 40.967 0.670 18522
10491 1 19 . 1 1 25 25 ILE H H 37 9.130 9.130 8.893 0.237 18522
10492 1 19 . 1 1 26 26 GLY N N 38 108.069 108.069 116.482 -8.413 18522
10493 1 19 . 1 1 26 26 GLY CA C 38 44.112 44.112 43.797 0.315 18522
10494 1 19 . 1 1 26 26 GLY H H 38 8.841 8.841 8.829 0.012 18522
10495 1 19 . 1 1 27 27 GLY N N 39 109.016 109.016 107.524 1.492 18522
10496 1 19 . 1 1 27 27 GLY C C 39 173.956 173.956 172.988 0.968 18522
10497 1 19 . 1 1 27 27 GLY H H 39 8.187 8.187 8.420 -0.233 18522
10498 1 19 . 1 1 28 28 GLY N N 40 111.783 111.783 107.011 4.772 18522
10499 1 19 . 1 1 28 28 GLY C C 40 174.255 174.255 172.192 2.063 18522
10500 1 19 . 1 1 28 28 GLY CA C 40 47.098 47.098 45.609 1.489 18522
10501 1 19 . 1 1 28 28 GLY H H 40 8.275 8.275 7.544 0.731 18522
10502 1 19 . 1 1 29 29 ALA N N 41 123.128 123.128 125.441 -2.313 18522
10503 1 19 . 1 1 29 29 ALA HA H 41 4.559 4.559 4.549 0.010 18522
10504 1 19 . 1 1 29 29 ALA CA C 41 51.073 51.073 50.846 0.227 18522
10505 1 19 . 1 1 29 29 ALA CB C 41 21.926 21.926 21.244 0.682 18522
10506 1 19 . 1 1 29 29 ALA H H 41 8.012 8.012 7.640 0.372 18522
10507 1 19 . 1 1 31 31 TYR HA H 43 4.549 4.549 4.230 0.319 18522
10508 1 19 . 1 1 31 31 TYR CA C 43 57.147 57.147 59.836 -2.689 18522
10509 1 19 . 1 1 31 31 TYR CB C 43 37.495 37.495 38.114 -0.619 18522
10510 1 19 . 1 1 32 32 CYS N N 44 119.332 119.332 117.618 1.714 18522
10511 1 19 . 1 1 32 32 CYS HA H 44 4.859 4.859 3.595 1.264 18522
10512 1 19 . 1 1 32 32 CYS CA C 44 57.406 57.406 54.615 2.791 18522
10513 1 19 . 1 1 32 32 CYS CB C 44 27.673 27.673 27.599 0.074 18522
10514 1 19 . 1 1 32 32 CYS H H 44 7.504 7.504 7.031 0.473 18522
10515 1 19 . 1 1 33 33 PRO HA H 45 4.413 4.413 4.152 0.261 18522
10516 1 19 . 1 1 33 33 PRO CA C 45 64.885 64.885 62.467 2.418 18522
10517 1 19 . 1 1 33 33 PRO CB C 45 32.318 32.318 32.072 0.246 18522
10518 1 19 . 1 1 34 34 CYS N N 46 117.327 117.327 114.823 2.504 18522
10519 1 19 . 1 1 34 34 CYS C C 46 172.064 172.064 174.528 -2.464 18522
10520 1 19 . 1 1 34 34 CYS CA C 46 60.066 60.066 60.437 -0.370 18522
10521 1 19 . 1 1 34 34 CYS CB C 46 28.715 28.715 27.863 0.852 18522
10522 1 19 . 1 1 34 34 CYS H H 46 7.973 7.973 8.210 -0.237 18522
10523 1 19 . 1 1 35 35 LEU N N 47 124.270 124.270 121.865 2.405 18522
10524 1 19 . 1 1 35 35 LEU HA H 47 4.928 4.928 4.643 0.285 18522
10525 1 19 . 1 1 35 35 LEU C C 47 175.076 175.076 175.508 -0.432 18522
10526 1 19 . 1 1 35 35 LEU CA C 47 53.278 53.278 55.082 -1.804 18522
10527 1 19 . 1 1 35 35 LEU CB C 47 44.321 44.321 43.672 0.649 18522
10528 1 19 . 1 1 35 35 LEU H H 47 8.629 8.629 8.156 0.473 18522
10529 1 19 . 1 1 36 36 TYR N N 48 119.326 119.326 112.145 7.181 18522
10530 1 19 . 1 1 36 36 TYR HA H 48 5.255 5.255 5.015 0.240 18522
10531 1 19 . 1 1 36 36 TYR C C 48 175.766 175.766 173.425 2.341 18522
10532 1 19 . 1 1 36 36 TYR CA C 48 56.696 56.696 55.944 0.752 18522
10533 1 19 . 1 1 36 36 TYR CB C 48 42.590 42.590 40.468 2.122 18522
10534 1 19 . 1 1 36 36 TYR H H 48 8.761 8.761 7.483 1.278 18522
10535 1 19 . 1 1 37 37 ILE N N 49 120.259 120.259 121.215 -0.956 18522
10536 1 19 . 1 1 37 37 ILE HA H 49 4.215 4.215 4.409 -0.194 18522
10537 1 19 . 1 1 37 37 ILE C C 49 177.429 177.429 175.529 1.900 18522
10538 1 19 . 1 1 37 37 ILE CA C 49 62.456 62.456 60.722 1.734 18522
10539 1 19 . 1 1 37 37 ILE CB C 49 37.352 37.352 38.796 -1.444 18522
10540 1 19 . 1 1 37 37 ILE H H 49 8.959 8.959 9.080 -0.121 18522
10541 1 19 . 1 1 38 38 VAL HA H 50 3.937 3.937 4.198 -0.261 18522
10542 1 19 . 1 1 38 38 VAL C C 50 174.408 174.408 175.067 -0.659 18522
10543 1 19 . 1 1 38 38 VAL CA C 50 62.259 62.259 62.932 -0.673 18522
10544 1 19 . 1 1 38 38 VAL CB C 50 31.584 31.584 32.238 -0.654 18522
10545 1 19 . 1 1 39 39 GLN N N 51 116.821 116.821 119.137 -2.316 18522
10546 1 19 . 1 1 39 39 GLN HA H 51 4.103 4.103 4.427 -0.324 18522
10547 1 19 . 1 1 39 39 GLN C C 51 172.856 172.856 173.039 -0.183 18522
10548 1 19 . 1 1 39 39 GLN CA C 51 55.127 55.127 55.132 -0.005 18522
10549 1 19 . 1 1 39 39 GLN CB C 51 32.376 32.376 32.389 -0.014 18522
10550 1 19 . 1 1 39 39 GLN H H 51 6.967 6.967 7.538 -0.571 18522
10551 1 19 . 1 1 40 40 VAL N N 52 123.482 123.482 122.646 0.836 18522
10552 1 19 . 1 1 40 40 VAL HA H 52 4.277 4.277 4.969 -0.692 18522
10553 1 19 . 1 1 40 40 VAL C C 52 176.198 176.198 174.553 1.645 18522
10554 1 19 . 1 1 40 40 VAL CA C 52 61.574 61.574 59.892 1.683 18522
10555 1 19 . 1 1 40 40 VAL CB C 52 32.875 32.875 35.023 -2.148 18522
10556 1 19 . 1 1 40 40 VAL H H 52 8.447 8.447 8.116 0.331 18522
10557 1 19 . 1 1 41 41 PHE N N 53 128.296 128.296 124.285 4.011 18522
10558 1 19 . 1 1 41 41 PHE HA H 53 4.400 4.400 4.670 -0.270 18522
10559 1 19 . 1 1 41 41 PHE C C 53 175.299 175.299 175.180 0.119 18522
10560 1 19 . 1 1 41 41 PHE CA C 53 58.494 58.494 58.517 -0.023 18522
10561 1 19 . 1 1 41 41 PHE CB C 53 39.561 39.561 39.814 -0.253 18522
10562 1 19 . 1 1 41 41 PHE H H 53 8.707 8.707 8.452 0.255 18522
10563 1 19 . 1 1 42 42 ASP N N 54 122.696 122.696 115.729 6.967 18522
10564 1 19 . 1 1 42 42 ASP HA H 54 4.272 4.272 4.668 -0.396 18522
10565 1 19 . 1 1 42 42 ASP C C 54 176.837 176.837 176.004 0.833 18522
10566 1 19 . 1 1 42 42 ASP CA C 54 55.291 55.291 55.118 0.173 18522
10567 1 19 . 1 1 42 42 ASP CB C 54 41.093 41.093 42.465 -1.372 18522
10568 1 19 . 1 1 42 42 ASP H H 54 8.901 8.901 8.465 0.436 18522
10569 1 19 . 1 1 43 43 ASN N N 55 113.923 113.923 116.820 -2.897 18522
10570 1 19 . 1 1 43 43 ASN HA H 55 4.258 4.258 4.864 -0.606 18522
10571 1 19 . 1 1 43 43 ASN C C 55 173.714 173.714 174.707 -0.993 18522
10572 1 19 . 1 1 43 43 ASN CA C 55 54.958 54.958 53.471 1.487 18522
10573 1 19 . 1 1 43 43 ASN CB C 55 37.150 37.150 39.543 -2.393 18522
10574 1 19 . 1 1 43 43 ASN H H 55 9.319 9.319 8.328 0.991 18522
10575 1 19 . 1 1 44 44 THR N N 56 108.020 108.020 110.593 -2.573 18522
10576 1 19 . 1 1 44 44 THR HA H 56 5.377 5.377 4.804 0.573 18522
10577 1 19 . 1 1 44 44 THR CA C 56 59.712 59.712 59.027 0.685 18522
10578 1 19 . 1 1 44 44 THR CB C 56 69.529 69.529 70.064 -0.535 18522
10579 1 19 . 1 1 44 44 THR H H 56 7.149 7.149 7.499 -0.350 18522
10580 1 19 . 1 1 45 45 PRO HA H 57 4.304 4.304 4.068 0.236 18522
10581 1 19 . 1 1 45 45 PRO C C 57 180.141 180.141 177.889 2.252 18522
10582 1 19 . 1 1 45 45 PRO CA C 57 66.090 66.090 65.657 0.433 18522
10583 1 19 . 1 1 45 45 PRO CB C 57 33.194 33.194 31.458 1.736 18522
10584 1 19 . 1 1 46 46 ALA N N 58 116.854 116.854 119.439 -2.585 18522
10585 1 19 . 1 1 46 46 ALA HA H 58 4.035 4.035 4.049 -0.014 18522
10586 1 19 . 1 1 46 46 ALA C C 58 180.647 180.647 179.451 1.196 18522
10587 1 19 . 1 1 46 46 ALA CA C 58 55.195 55.195 55.222 -0.027 18522
10588 1 19 . 1 1 46 46 ALA CB C 58 18.880 18.880 18.133 0.747 18522
10589 1 19 . 1 1 46 46 ALA H H 58 8.938 8.938 7.776 1.162 18522
10590 1 19 . 1 1 47 47 ALA N N 59 123.250 123.250 121.104 2.146 18522
10591 1 19 . 1 1 47 47 ALA HA H 59 4.030 4.030 4.097 -0.067 18522
10592 1 19 . 1 1 47 47 ALA C C 59 179.852 179.852 179.734 0.118 18522
10593 1 19 . 1 1 47 47 ALA CA C 59 54.939 54.939 54.660 0.279 18522
10594 1 19 . 1 1 47 47 ALA CB C 59 19.688 19.688 18.789 0.899 18522
10595 1 19 . 1 1 47 47 ALA H H 59 7.658 7.658 7.406 0.252 18522
10596 1 19 . 1 1 48 48 LEU N N 60 118.654 118.654 118.493 0.161 18522
10597 1 19 . 1 1 48 48 LEU HA H 60 4.026 4.026 4.157 -0.131 18522
10598 1 19 . 1 1 48 48 LEU C C 60 179.238 179.238 178.178 1.060 18522
10599 1 19 . 1 1 48 48 LEU CA C 60 57.261 57.261 57.831 -0.570 18522
10600 1 19 . 1 1 48 48 LEU CB C 60 41.445 41.445 41.547 -0.102 18522
10601 1 19 . 1 1 48 48 LEU H H 60 8.636 8.636 8.451 0.185 18522
10602 1 19 . 1 1 49 49 ASP N N 61 117.382 117.382 119.259 -1.877 18522
10603 1 19 . 1 1 49 49 ASP HA H 61 4.421 4.421 4.617 -0.196 18522
10604 1 19 . 1 1 49 49 ASP C C 61 177.668 177.668 177.716 -0.048 18522
10605 1 19 . 1 1 49 49 ASP CA C 61 57.087 57.087 54.619 2.468 18522
10606 1 19 . 1 1 49 49 ASP CB C 61 44.478 44.478 41.688 2.790 18522
10607 1 19 . 1 1 49 49 ASP H H 61 7.665 7.665 7.737 -0.072 18522
10608 1 19 . 1 1 50 50 GLY N N 62 103.228 103.228 107.814 -4.586 18522
10609 1 19 . 1 1 50 50 GLY C C 62 174.776 174.776 175.086 -0.310 18522
10610 1 19 . 1 1 50 50 GLY CA C 62 46.533 46.533 45.574 0.959 18522
10611 1 19 . 1 1 50 50 GLY H H 62 7.216 7.216 7.877 -0.661 18522
10612 1 19 . 1 1 51 51 THR N N 63 117.230 117.230 114.317 2.913 18522
10613 1 19 . 1 1 51 51 THR HA H 63 3.907 3.907 3.938 -0.031 18522
10614 1 19 . 1 1 51 51 THR C C 63 175.961 175.961 174.974 0.987 18522
10615 1 19 . 1 1 51 51 THR CA C 63 66.478 66.478 62.907 3.571 18522
10616 1 19 . 1 1 51 51 THR CB C 63 68.268 68.268 68.242 0.026 18522
10617 1 19 . 1 1 51 51 THR H H 63 8.319 8.319 7.606 0.713 18522
10618 1 19 . 1 1 52 52 VAL N N 64 113.826 113.826 116.062 -2.236 18522
10619 1 19 . 1 1 52 52 VAL HA H 64 3.950 3.950 4.182 -0.232 18522
10620 1 19 . 1 1 52 52 VAL C C 64 173.883 173.883 174.618 -0.735 18522
10621 1 19 . 1 1 52 52 VAL CA C 64 60.708 60.708 60.208 0.500 18522
10622 1 19 . 1 1 52 52 VAL CB C 64 33.079 33.079 30.798 2.281 18522
10623 1 19 . 1 1 52 52 VAL H H 64 8.147 8.147 7.600 0.547 18522
10624 1 19 . 1 1 53 53 ALA N N 65 123.521 123.521 123.601 -0.080 18522
10625 1 19 . 1 1 53 53 ALA HA H 65 4.414 4.414 4.451 -0.037 18522
10626 1 19 . 1 1 53 53 ALA C C 65 175.247 175.247 176.666 -1.419 18522
10627 1 19 . 1 1 53 53 ALA CA C 65 50.440 50.440 50.880 -0.440 18522
10628 1 19 . 1 1 53 53 ALA CB C 65 23.266 23.266 20.489 2.777 18522
10629 1 19 . 1 1 53 53 ALA H H 65 8.633 8.633 7.526 1.107 18522
10630 1 19 . 1 1 54 54 ALA N N 66 120.818 120.818 123.205 -2.387 18522
10631 1 19 . 1 1 54 54 ALA HA H 66 3.720 3.720 4.116 -0.396 18522
10632 1 19 . 1 1 54 54 ALA C C 66 178.411 178.411 178.363 0.048 18522
10633 1 19 . 1 1 54 54 ALA CA C 66 53.016 53.016 53.371 -0.355 18522
10634 1 19 . 1 1 54 54 ALA CB C 66 17.840 17.840 17.837 0.003 18522
10635 1 19 . 1 1 54 54 ALA H H 66 8.451 8.451 8.484 -0.033 18522
10636 1 19 . 1 1 55 55 GLY N N 67 112.260 112.260 114.382 -2.122 18522
10637 1 19 . 1 1 55 55 GLY C C 67 173.296 173.296 174.163 -0.867 18522
10638 1 19 . 1 1 55 55 GLY CA C 67 45.025 45.025 44.688 0.337 18522
10639 1 19 . 1 1 55 55 GLY H H 67 9.600 9.600 9.114 0.486 18522
10640 1 19 . 1 1 56 56 ASP N N 68 121.293 121.293 123.689 -2.396 18522
10641 1 19 . 1 1 56 56 ASP HA H 68 4.861 4.861 4.658 0.203 18522
10642 1 19 . 1 1 56 56 ASP C C 68 174.937 174.937 174.514 0.423 18522
10643 1 19 . 1 1 56 56 ASP CA C 68 55.641 55.641 56.121 -0.480 18522
10644 1 19 . 1 1 56 56 ASP CB C 68 40.696 40.696 41.901 -1.204 18522
10645 1 19 . 1 1 56 56 ASP H H 68 8.043 8.043 7.778 0.265 18522
10646 1 19 . 1 1 57 57 GLU N N 69 122.814 122.814 123.135 -0.321 18522
10647 1 19 . 1 1 57 57 GLU C C 69 177.202 177.202 175.455 1.747 18522
10648 1 19 . 1 1 57 57 GLU CA C 69 54.472 54.472 55.480 -1.008 18522
10649 1 19 . 1 1 57 57 GLU CB C 69 32.800 32.800 31.909 0.891 18522
10650 1 19 . 1 1 57 57 GLU H H 69 8.455 8.455 8.480 -0.025 18522
10651 1 19 . 1 1 58 58 ILE N N 70 125.862 125.862 129.129 -3.267 18522
10652 1 19 . 1 1 58 58 ILE HA H 70 4.526 4.526 4.485 0.041 18522
10653 1 19 . 1 1 58 58 ILE C C 70 175.035 175.035 175.815 -0.780 18522
10654 1 19 . 1 1 58 58 ILE CA C 70 60.918 60.918 60.348 0.570 18522
10655 1 19 . 1 1 58 58 ILE CB C 70 39.236 39.236 37.598 1.638 18522
10656 1 19 . 1 1 58 58 ILE H H 70 8.619 8.619 8.226 0.393 18522
10657 1 19 . 1 1 59 59 THR N N 71 115.507 115.507 119.868 -4.361 18522
10658 1 19 . 1 1 59 59 THR HA H 71 4.513 4.513 4.483 0.030 18522
10659 1 19 . 1 1 59 59 THR C C 71 176.425 176.425 174.229 2.196 18522
10660 1 19 . 1 1 59 59 THR CA C 71 61.158 61.158 62.576 -1.418 18522
10661 1 19 . 1 1 59 59 THR CB C 71 69.604 69.604 70.275 -0.671 18522
10662 1 19 . 1 1 59 59 THR H H 71 9.242 9.242 7.960 1.282 18522
10663 1 19 . 1 1 60 60 GLY N N 72 111.789 111.789 108.198 3.591 18522
10664 1 19 . 1 1 60 60 GLY C C 72 170.981 170.981 171.320 -0.339 18522
10665 1 19 . 1 1 60 60 GLY CA C 72 46.554 46.554 45.282 1.272 18522
10666 1 19 . 1 1 60 60 GLY H H 72 7.883 7.883 7.313 0.570 18522
10667 1 19 . 1 1 61 61 VAL N N 73 119.277 119.277 120.493 -1.216 18522
10668 1 19 . 1 1 61 61 VAL C C 73 175.951 175.951 175.470 0.481 18522
10669 1 19 . 1 1 61 61 VAL CA C 73 60.982 60.982 59.577 1.405 18522
10670 1 19 . 1 1 61 61 VAL CB C 73 36.197 36.197 34.114 2.083 18522
10671 1 19 . 1 1 61 61 VAL H H 73 8.424 8.424 8.802 -0.378 18522
10672 1 19 . 1 1 62 62 ASN N N 74 127.731 127.731 127.397 0.334 18522
10673 1 19 . 1 1 62 62 ASN HA H 74 4.520 4.520 4.596 -0.076 18522
10674 1 19 . 1 1 62 62 ASN C C 74 174.878 174.878 175.115 -0.237 18522
10675 1 19 . 1 1 62 62 ASN CA C 74 54.418 54.418 54.496 -0.078 18522
10676 1 19 . 1 1 62 62 ASN CB C 74 36.655 36.655 37.364 -0.709 18522
10677 1 19 . 1 1 62 62 ASN H H 74 10.384 10.384 9.509 0.875 18522
10678 1 19 . 1 1 63 63 GLY N N 75 104.633 104.633 101.547 3.086 18522
10679 1 19 . 1 1 63 63 GLY C C 75 173.610 173.610 173.561 0.049 18522
10680 1 19 . 1 1 63 63 GLY CA C 75 45.261 45.261 44.740 0.521 18522
10681 1 19 . 1 1 63 63 GLY H H 75 8.926 8.926 8.641 0.285 18522
10682 1 19 . 1 1 64 64 ARG N N 76 120.451 120.451 121.800 -1.349 18522
10683 1 19 . 1 1 64 64 ARG HA H 76 4.501 4.501 4.677 -0.176 18522
10684 1 19 . 1 1 64 64 ARG C C 76 175.085 175.085 175.474 -0.389 18522
10685 1 19 . 1 1 64 64 ARG CA C 76 54.252 54.252 54.480 -0.228 18522
10686 1 19 . 1 1 64 64 ARG CB C 76 31.482 31.482 31.497 -0.015 18522
10687 1 19 . 1 1 64 64 ARG H H 76 7.753 7.753 8.026 -0.273 18522
10688 1 19 . 1 1 65 65 SER N N 77 116.586 116.586 118.942 -2.356 18522
10689 1 19 . 1 1 65 65 SER HA H 77 4.483 4.483 4.590 -0.107 18522
10690 1 19 . 1 1 65 65 SER C C 77 176.953 176.953 175.682 1.271 18522
10691 1 19 . 1 1 65 65 SER CA C 77 58.292 58.292 58.447 -0.155 18522
10692 1 19 . 1 1 65 65 SER CB C 77 63.643 63.643 63.583 0.060 18522
10693 1 19 . 1 1 65 65 SER H H 77 8.555 8.555 8.783 -0.228 18522
10694 1 19 . 1 1 66 66 ILE N N 78 116.618 116.618 115.674 0.944 18522
10695 1 19 . 1 1 66 66 ILE HA H 78 4.420 4.420 4.342 0.078 18522
10696 1 19 . 1 1 66 66 ILE C C 78 175.072 175.072 175.637 -0.565 18522
10697 1 19 . 1 1 66 66 ILE CA C 78 59.122 59.122 59.909 -0.787 18522
10698 1 19 . 1 1 66 66 ILE CB C 78 36.758 36.758 37.471 -0.713 18522
10699 1 19 . 1 1 66 66 ILE H H 78 7.599 7.599 7.781 -0.182 18522
10700 1 19 . 1 1 67 67 LYS N N 79 123.287 123.287 122.589 0.698 18522
10701 1 19 . 1 1 67 67 LYS HA H 79 4.049 4.049 4.023 0.026 18522
10702 1 19 . 1 1 67 67 LYS C C 79 178.333 178.333 176.576 1.757 18522
10703 1 19 . 1 1 67 67 LYS CA C 79 58.321 58.321 56.865 1.456 18522
10704 1 19 . 1 1 67 67 LYS CB C 79 31.635 31.635 30.171 1.464 18522
10705 1 19 . 1 1 67 67 LYS H H 79 7.898 7.898 7.971 -0.073 18522
10706 1 19 . 1 1 68 68 GLY N N 80 114.933 114.933 114.251 0.682 18522
10707 1 19 . 1 1 68 68 GLY C C 80 174.385 174.385 174.373 0.012 18522
10708 1 19 . 1 1 68 68 GLY CA C 80 45.518 45.518 45.097 0.421 18522
10709 1 19 . 1 1 68 68 GLY H H 80 8.999 8.999 7.996 1.003 18522
10710 1 19 . 1 1 69 69 LYS N N 81 119.403 119.403 123.254 -3.851 18522
10711 1 19 . 1 1 69 69 LYS HA H 81 4.043 4.043 4.437 -0.394 18522
10712 1 19 . 1 1 69 69 LYS C C 81 177.064 177.064 175.694 1.370 18522
10713 1 19 . 1 1 69 69 LYS CA C 81 54.722 54.722 55.767 -1.045 18522
10714 1 19 . 1 1 69 69 LYS CB C 81 33.560 33.560 33.200 0.360 18522
10715 1 19 . 1 1 69 69 LYS H H 81 7.845 7.845 7.791 0.054 18522
10716 1 19 . 1 1 70 70 THR N N 82 112.066 112.066 115.794 -3.728 18522
10717 1 19 . 1 1 70 70 THR HA H 82 4.666 4.666 4.510 0.156 18522
10718 1 19 . 1 1 70 70 THR C C 82 175.955 175.955 175.346 0.609 18522
10719 1 19 . 1 1 70 70 THR CA C 82 60.438 60.438 60.540 -0.102 18522
10720 1 19 . 1 1 70 70 THR CB C 82 71.629 71.629 71.991 -0.362 18522
10721 1 19 . 1 1 70 70 THR H H 82 9.153 9.153 8.068 1.085 18522
10722 1 19 . 1 1 71 71 LYS N N 83 118.730 118.730 125.247 -6.517 18522
10723 1 19 . 1 1 71 71 LYS HA H 83 3.870 3.870 3.926 -0.056 18522
10724 1 19 . 1 1 71 71 LYS C C 83 177.464 177.464 178.504 -1.040 18522
10725 1 19 . 1 1 71 71 LYS CA C 83 60.357 60.357 59.876 0.481 18522
10726 1 19 . 1 1 71 71 LYS CB C 83 31.350 31.350 31.553 -0.203 18522
10727 1 19 . 1 1 71 71 LYS H H 83 8.969 8.969 8.979 -0.010 18522
10728 1 19 . 1 1 72 72 VAL N N 84 117.444 117.444 118.683 -1.239 18522
10729 1 19 . 1 1 72 72 VAL HA H 84 3.633 3.633 3.729 -0.096 18522
10730 1 19 . 1 1 72 72 VAL C C 84 178.315 178.315 177.413 0.902 18522
10731 1 19 . 1 1 72 72 VAL CA C 84 66.079 66.079 65.873 0.206 18522
10732 1 19 . 1 1 72 72 VAL CB C 84 32.091 32.091 31.296 0.795 18522
10733 1 19 . 1 1 72 72 VAL H H 84 7.631 7.631 8.353 -0.722 18522
10734 1 19 . 1 1 73 73 GLU N N 85 120.890 120.890 118.753 2.137 18522
10735 1 19 . 1 1 73 73 GLU HA H 85 3.964 3.964 4.169 -0.205 18522
10736 1 19 . 1 1 73 73 GLU C C 85 179.971 179.971 178.620 1.351 18522
10737 1 19 . 1 1 73 73 GLU CA C 85 59.316 59.316 59.254 0.062 18522
10738 1 19 . 1 1 73 73 GLU CB C 85 30.355 30.355 29.696 0.659 18522
10739 1 19 . 1 1 73 73 GLU H H 85 7.617 7.617 8.357 -0.740 18522
10740 1 19 . 1 1 74 74 VAL N N 86 121.246 121.246 118.705 2.541 18522
10741 1 19 . 1 1 74 74 VAL HA H 86 3.630 3.630 3.995 -0.365 18522
10742 1 19 . 1 1 74 74 VAL C C 86 177.217 177.217 177.685 -0.468 18522
10743 1 19 . 1 1 74 74 VAL CA C 86 66.678 66.678 65.438 1.240 18522
10744 1 19 . 1 1 74 74 VAL CB C 86 31.307 31.307 31.178 0.129 18522
10745 1 19 . 1 1 74 74 VAL H H 86 8.368 8.368 7.416 0.952 18522
10746 1 19 . 1 1 75 75 ALA N N 87 122.148 122.148 122.037 0.111 18522
10747 1 19 . 1 1 75 75 ALA HA H 87 3.947 3.947 4.014 -0.067 18522
10748 1 19 . 1 1 75 75 ALA C C 87 179.545 179.545 179.156 0.389 18522
10749 1 19 . 1 1 75 75 ALA CA C 87 55.851 55.851 55.279 0.572 18522
10750 1 19 . 1 1 75 75 ALA CB C 87 18.491 18.491 17.996 0.495 18522
10751 1 19 . 1 1 75 75 ALA H H 87 8.577 8.577 8.209 0.368 18522
10752 1 19 . 1 1 76 76 LYS N N 88 117.733 117.733 119.573 -1.840 18522
10753 1 19 . 1 1 76 76 LYS HA H 88 4.051 4.051 3.995 0.056 18522
10754 1 19 . 1 1 76 76 LYS CA C 88 59.393 59.393 59.375 0.018 18522
10755 1 19 . 1 1 76 76 LYS CB C 88 32.058 32.058 32.266 -0.208 18522
10756 1 19 . 1 1 76 76 LYS H H 88 7.854 7.854 7.486 0.368 18522
10757 1 19 . 1 1 77 77 MET N N 89 117.676 117.676 118.896 -1.220 18522
10758 1 19 . 1 1 77 77 MET HA H 89 4.048 4.048 3.987 0.061 18522
10759 1 19 . 1 1 77 77 MET C C 89 178.791 178.791 178.756 0.035 18522
10760 1 19 . 1 1 77 77 MET CA C 89 59.128 59.128 59.374 -0.246 18522
10761 1 19 . 1 1 77 77 MET CB C 89 33.801 33.801 32.433 1.368 18522
10762 1 19 . 1 1 77 77 MET H H 89 7.759 7.759 8.438 -0.679 18522
10763 1 19 . 1 1 78 78 ILE N N 90 117.305 117.305 118.729 -1.424 18522
10764 1 19 . 1 1 78 78 ILE HA H 90 3.590 3.590 3.734 -0.144 18522
10765 1 19 . 1 1 78 78 ILE C C 90 178.658 178.658 178.901 -0.243 18522
10766 1 19 . 1 1 78 78 ILE CA C 90 65.482 65.482 64.002 1.480 18522
10767 1 19 . 1 1 78 78 ILE CB C 90 38.845 38.845 36.704 2.141 18522
10768 1 19 . 1 1 78 78 ILE H H 90 7.972 7.972 7.830 0.142 18522
10769 1 19 . 1 1 79 79 GLN N N 91 120.935 120.935 118.615 2.320 18522
10770 1 19 . 1 1 79 79 GLN HA H 91 3.998 3.998 4.064 -0.066 18522
10771 1 19 . 1 1 79 79 GLN C C 91 178.274 178.274 178.644 -0.370 18522
10772 1 19 . 1 1 79 79 GLN CA C 91 59.151 59.151 57.763 1.388 18522
10773 1 19 . 1 1 79 79 GLN CB C 91 28.934 28.934 28.297 0.637 18522
10774 1 19 . 1 1 79 79 GLN H H 91 8.826 8.826 8.283 0.543 18522
10775 1 19 . 1 1 80 80 GLU N N 92 115.213 115.213 119.580 -4.367 18522
10776 1 19 . 1 1 80 80 GLU HA H 92 4.061 4.061 4.110 -0.049 18522
10777 1 19 . 1 1 80 80 GLU C C 92 176.824 176.824 178.775 -1.951 18522
10778 1 19 . 1 1 80 80 GLU CA C 92 58.006 58.006 58.748 -0.742 18522
10779 1 19 . 1 1 80 80 GLU CB C 92 29.890 29.890 29.857 0.033 18522
10780 1 19 . 1 1 80 80 GLU H H 92 8.020 8.020 8.145 -0.125 18522
10781 1 19 . 1 1 81 81 VAL N N 93 119.047 119.047 115.087 3.960 18522
10782 1 19 . 1 1 81 81 VAL HA H 93 3.930 3.930 3.794 0.136 18522
10783 1 19 . 1 1 81 81 VAL C C 93 176.016 176.016 175.984 0.032 18522
10784 1 19 . 1 1 81 81 VAL CA C 93 63.153 63.153 63.661 -0.508 18522
10785 1 19 . 1 1 81 81 VAL CB C 93 32.154 32.154 32.197 -0.042 18522
10786 1 19 . 1 1 81 81 VAL H H 93 7.073 7.073 7.598 -0.525 18522
10787 1 19 . 1 1 82 82 LYS N N 94 128.366 128.366 116.981 11.385 18522
10788 1 19 . 1 1 82 82 LYS C C 94 177.460 177.460 177.398 0.062 18522
10789 1 19 . 1 1 82 82 LYS CA C 94 55.753 55.753 57.510 -1.757 18522
10790 1 19 . 1 1 82 82 LYS CB C 94 32.332 32.332 31.521 0.811 18522
10791 1 19 . 1 1 82 82 LYS H H 94 8.762 8.762 7.479 1.283 18522
10792 1 19 . 1 1 83 83 GLY N N 95 112.528 112.528 109.095 3.433 18522
10793 1 19 . 1 1 83 83 GLY C C 95 173.468 173.468 173.365 0.103 18522
10794 1 19 . 1 1 83 83 GLY CA C 95 46.243 46.243 45.373 0.869 18522
10795 1 19 . 1 1 83 83 GLY H H 95 8.673 8.673 8.878 -0.205 18522
10796 1 19 . 1 1 84 84 GLU N N 96 121.485 121.485 119.582 1.903 18522
10797 1 19 . 1 1 84 84 GLU HA H 96 4.749 4.749 4.977 -0.228 18522
10798 1 19 . 1 1 84 84 GLU C C 96 174.583 174.583 174.213 0.370 18522
10799 1 19 . 1 1 84 84 GLU CA C 96 55.821 55.821 55.018 0.803 18522
10800 1 19 . 1 1 84 84 GLU CB C 96 31.410 31.410 33.789 -2.379 18522
10801 1 19 . 1 1 84 84 GLU H H 96 8.297 8.297 7.714 0.583 18522
10802 1 19 . 1 1 85 85 VAL N N 97 120.501 120.501 111.923 8.578 18522
10803 1 19 . 1 1 85 85 VAL HA H 97 4.665 4.665 4.586 0.079 18522
10804 1 19 . 1 1 85 85 VAL C C 97 173.047 173.047 173.910 -0.863 18522
10805 1 19 . 1 1 85 85 VAL CA C 97 60.114 60.114 60.594 -0.480 18522
10806 1 19 . 1 1 85 85 VAL CB C 97 35.184 35.184 35.540 -0.356 18522
10807 1 19 . 1 1 85 85 VAL H H 97 9.096 9.096 8.523 0.573 18522
10808 1 19 . 1 1 86 86 THR N N 98 125.019 125.019 121.566 3.453 18522
10809 1 19 . 1 1 86 86 THR HA H 98 4.076 4.076 5.018 -0.942 18522
10810 1 19 . 1 1 86 86 THR C C 98 173.807 173.807 173.552 0.255 18522
10811 1 19 . 1 1 86 86 THR CA C 98 61.735 61.735 61.628 0.107 18522
10812 1 19 . 1 1 86 86 THR CB C 98 69.531 69.531 69.944 -0.413 18522
10813 1 19 . 1 1 86 86 THR H H 98 9.352 9.352 8.894 0.458 18522
10814 1 19 . 1 1 87 87 ILE N N 99 128.383 128.383 123.180 5.203 18522
10815 1 19 . 1 1 87 87 ILE HA H 99 4.661 4.661 4.442 0.219 18522
10816 1 19 . 1 1 87 87 ILE C C 99 174.614 174.614 174.220 0.394 18522
10817 1 19 . 1 1 87 87 ILE CA C 99 58.258 58.258 59.197 -0.939 18522
10818 1 19 . 1 1 87 87 ILE CB C 99 38.528 38.528 39.157 -0.629 18522
10819 1 19 . 1 1 87 87 ILE H H 99 9.329 9.329 8.393 0.936 18522
10820 1 19 . 1 1 88 88 HIS N N 100 128.279 128.279 121.839 6.440 18522
10821 1 19 . 1 1 88 88 HIS HA H 100 4.948 4.948 5.441 -0.493 18522
10822 1 19 . 1 1 88 88 HIS C C 100 174.787 174.787 174.296 0.491 18522
10823 1 19 . 1 1 88 88 HIS CA C 100 54.620 54.620 54.207 0.413 18522
10824 1 19 . 1 1 88 88 HIS H H 100 8.647 8.647 7.820 0.827 18522
10825 1 19 . 1 1 89 89 TYR N N 101 121.320 121.320 123.157 -1.837 18522
10826 1 19 . 1 1 89 89 TYR HA H 101 5.947 5.947 5.544 0.403 18522
10827 1 19 . 1 1 89 89 TYR C C 101 173.769 173.769 174.833 -1.064 18522
10828 1 19 . 1 1 89 89 TYR CA C 101 55.669 55.669 56.559 -0.890 18522
10829 1 19 . 1 1 89 89 TYR CB C 101 42.195 42.195 42.389 -0.194 18522
10830 1 19 . 1 1 89 89 TYR H H 101 8.414 8.414 9.377 -0.963 18522
10831 1 19 . 1 1 90 90 ASN N N 102 116.679 116.679 116.939 -0.260 18522
10832 1 19 . 1 1 90 90 ASN HA H 102 5.335 5.335 5.379 -0.044 18522
10833 1 19 . 1 1 90 90 ASN C C 102 175.406 175.406 174.195 1.211 18522
10834 1 19 . 1 1 90 90 ASN CA C 102 51.961 51.961 51.401 0.560 18522
10835 1 19 . 1 1 90 90 ASN CB C 102 41.800 41.800 41.909 -0.109 18522
10836 1 19 . 1 1 90 90 ASN H H 102 9.282 9.282 9.129 0.153 18522
10837 1 19 . 1 1 91 91 LYS N N 103 124.129 124.129 120.057 4.072 18522
10838 1 19 . 1 1 91 91 LYS C C 103 176.678 176.678 175.459 1.219 18522
10839 1 19 . 1 1 91 91 LYS CA C 103 55.006 55.006 55.880 -0.874 18522
10840 1 19 . 1 1 91 91 LYS H H 103 8.949 8.949 8.470 0.479 18522
10841 1 19 . 1 1 92 92 LEU N N 104 127.043 127.043 120.533 6.510 18522
10842 1 19 . 1 1 92 92 LEU HA H 104 4.425 4.425 4.756 -0.331 18522
10843 1 19 . 1 1 92 92 LEU CA C 104 55.060 55.060 54.582 0.478 18522
10844 1 19 . 1 1 92 92 LEU CB C 104 42.559 42.559 44.734 -2.175 18522
10845 1 19 . 1 1 92 92 LEU H H 104 9.150 9.150 8.081 1.069 18522
10846 1 19 . 1 1 93 93 GLN HA H 105 4.315 4.315 4.685 -0.370 18522
10847 1 19 . 1 1 93 93 GLN C C 105 175.070 175.070 175.224 -0.154 18522
10848 1 19 . 1 1 93 93 GLN CA C 105 55.490 55.490 54.637 0.853 18522
10849 1 19 . 1 1 93 93 GLN CB C 105 28.909 28.909 28.274 0.635 18522
10850 1 19 . 1 1 94 94 ALA N N 106 125.133 125.133 126.453 -1.320 18522
10851 1 19 . 1 1 94 94 ALA HA H 106 4.366 4.366 4.343 0.023 18522
10852 1 19 . 1 1 94 94 ALA C C 106 176.392 176.392 176.591 -0.199 18522
10853 1 19 . 1 1 94 94 ALA CA C 106 51.723 51.723 52.076 -0.353 18522
10854 1 19 . 1 1 94 94 ALA CB C 106 20.185 20.185 20.055 0.130 18522
10855 1 19 . 1 1 94 94 ALA H H 106 8.226 8.226 8.216 0.010 18522
10856 1 19 . 1 1 95 95 ASP N N 107 122.013 122.013 118.852 3.161 18522
10857 1 19 . 1 1 95 95 ASP HA H 107 4.413 4.413 4.827 -0.414 18522
10858 1 19 . 1 1 95 95 ASP C C 107 175.019 175.019 175.040 -0.021 18522
10859 1 19 . 1 1 95 95 ASP CA C 107 55.642 55.642 52.481 3.161 18522
10860 1 19 . 1 1 95 95 ASP CB C 107 41.266 41.266 42.660 -1.394 18522
10861 1 19 . 1 1 95 95 ASP H H 107 8.429 8.429 8.356 0.073 18522
10862 1 19 . 1 1 96 96 PRO HA H 108 4.207 4.207 4.032 0.175 18522
10863 1 19 . 1 1 96 96 PRO C C 108 178.840 178.840 178.240 0.600 18522
10864 1 19 . 1 1 96 96 PRO CA C 108 65.396 65.396 66.329 -0.933 18522
10865 1 19 . 1 1 96 96 PRO CB C 108 32.181 32.181 31.916 0.265 18522
10866 1 19 . 1 1 97 97 LYS N N 109 117.942 117.942 114.791 3.151 18522
10867 1 19 . 1 1 97 97 LYS HA H 109 4.143 4.143 4.083 0.060 18522
10868 1 19 . 1 1 97 97 LYS C C 109 178.099 178.099 178.767 -0.668 18522
10869 1 19 . 1 1 97 97 LYS CA C 109 58.167 58.167 59.054 -0.887 18522
10870 1 19 . 1 1 97 97 LYS CB C 109 31.649 31.649 31.480 0.169 18522
10871 1 19 . 1 1 97 97 LYS H H 109 8.335 8.335 8.337 -0.002 18522
10872 1 19 . 1 1 98 98 GLN N N 110 119.159 119.159 117.765 1.394 18522
10873 1 19 . 1 1 98 98 GLN HA H 110 4.130 4.130 4.329 -0.199 18522
10874 1 19 . 1 1 98 98 GLN C C 110 178.298 178.298 178.299 -0.001 18522
10875 1 19 . 1 1 98 98 GLN CA C 110 57.660 57.660 56.916 0.744 18522
10876 1 19 . 1 1 98 98 GLN CB C 110 28.720 28.720 28.904 -0.184 18522
10877 1 19 . 1 1 98 98 GLN H H 110 7.985 7.985 7.976 0.009 18522
10878 1 19 . 1 1 99 99 LEU N N 111 120.490 120.490 121.801 -1.311 18522
10879 1 19 . 1 1 99 99 LEU HA H 111 3.877 3.877 4.306 -0.429 18522
10880 1 19 . 1 1 99 99 LEU C C 111 177.729 177.729 178.100 -0.371 18522
10881 1 19 . 1 1 99 99 LEU CA C 111 57.049 57.049 57.448 -0.399 18522
10882 1 19 . 1 1 99 99 LEU CB C 111 41.466 41.466 41.911 -0.445 18522
10883 1 19 . 1 1 99 99 LEU H H 111 7.994 7.994 8.471 -0.477 18522
10884 1 19 . 1 1 100 100 GLU N N 112 118.251 118.251 117.894 0.357 18522
10885 1 19 . 1 1 100 100 GLU HA H 112 3.972 3.972 4.271 -0.299 18522
10886 1 19 . 1 1 100 100 GLU C C 112 178.402 178.402 177.946 0.456 18522
10887 1 19 . 1 1 100 100 GLU CA C 112 59.056 59.056 58.865 0.191 18522
10888 1 19 . 1 1 100 100 GLU CB C 112 29.732 29.732 29.055 0.677 18522
10889 1 19 . 1 1 100 100 GLU H H 112 7.760 7.760 8.023 -0.263 18522
10890 1 19 . 1 1 101 101 VAL N N 113 117.229 117.229 117.833 -0.604 18522
10891 1 19 . 1 1 101 101 VAL HA H 113 3.762 3.762 3.878 -0.116 18522
10892 1 19 . 1 1 101 101 VAL C C 113 178.107 178.107 177.647 0.460 18522
10893 1 19 . 1 1 101 101 VAL CA C 113 64.791 64.791 65.363 -0.572 18522
10894 1 19 . 1 1 101 101 VAL CB C 113 32.149 32.149 31.456 0.692 18522
10895 1 19 . 1 1 101 101 VAL H H 113 7.437 7.437 7.731 -0.294 18522
10896 1 19 . 1 1 102 102 LEU N N 114 122.124 122.124 119.917 2.207 18522
10897 1 19 . 1 1 102 102 LEU HA H 114 4.033 4.033 4.221 -0.188 18522
10898 1 19 . 1 1 102 102 LEU C C 114 178.506 178.506 178.426 0.080 18522
10899 1 19 . 1 1 102 102 LEU CA C 114 57.243 57.243 56.801 0.442 18522
10900 1 19 . 1 1 102 102 LEU CB C 114 42.028 42.028 42.130 -0.102 18522
10901 1 19 . 1 1 102 102 LEU H H 114 7.765 7.765 7.468 0.297 18522
10902 1 19 . 1 1 103 103 PHE N N 115 115.346 115.346 118.400 -3.054 18522
10903 1 19 . 1 1 103 103 PHE HA H 115 4.224 4.224 4.403 -0.179 18522
10904 1 19 . 1 1 103 103 PHE C C 115 175.621 175.621 176.056 -0.435 18522
10905 1 19 . 1 1 103 103 PHE CA C 115 57.537 57.537 59.007 -1.470 18522
10906 1 19 . 1 1 103 103 PHE CB C 115 38.057 38.057 39.314 -1.257 18522
10907 1 19 . 1 1 103 103 PHE H H 115 7.805 7.805 7.898 -0.093 18522
10908 1 19 . 1 1 104 104 GLN N N 116 119.021 119.021 117.755 1.266 18522
10909 1 19 . 1 1 104 104 GLN HA H 116 4.407 4.407 3.879 0.528 18522
10910 1 19 . 1 1 104 104 GLN C C 116 176.402 176.402 175.556 0.846 18522
10911 1 19 . 1 1 104 104 GLN CA C 116 55.521 55.521 58.429 -2.908 18522
10912 1 19 . 1 1 104 104 GLN CB C 116 29.170 29.170 27.301 1.869 18522
10913 1 19 . 1 1 104 104 GLN H H 116 7.974 7.974 7.582 0.392 18522
10914 1 19 . 1 1 105 105 GLY N N 117 108.868 108.868 104.222 4.646 18522
10915 1 19 . 1 1 105 105 GLY CA C 117 45.124 45.124 45.696 -0.571 18522
10916 1 19 . 1 1 105 105 GLY H H 117 8.195 8.195 7.981 0.214 18522
10917 1 19 . 1 1 106 106 PRO HA H 118 4.490 4.490 4.278 0.212 18522
10918 1 19 . 1 1 106 106 PRO C C 118 176.001 176.001 176.613 -0.612 18522
10919 1 19 . 1 1 106 106 PRO CA C 118 63.523 63.523 64.075 -0.552 18522
10920 1 19 . 1 1 106 106 PRO CB C 118 32.078 32.078 32.011 0.067 18522
10921 1 19 . 1 1 107 107 GLN N N 119 126.950 126.950 120.812 6.138 18522
10922 1 19 . 1 1 107 107 GLN C C 119 181.211 181.211 175.949 5.262 18522
10923 1 19 . 1 1 107 107 GLN CA C 119 57.416 57.416 56.826 0.590 18522
10924 1 19 . 1 1 107 107 GLN H H 119 8.079 8.079 8.351 -0.272 18522
10925 1 19 . 1 1 111 111 ARG C C 123 174.608 174.608 175.242 -0.634 18522
10926 1 19 . 1 1 111 111 ARG CA C 123 55.099 55.099 56.038 -0.939 18522
10927 1 19 . 1 1 112 112 HIS N N 124 122.212 122.212 120.365 1.847 18522
10928 1 19 . 1 1 112 112 HIS HA H 124 4.718 4.718 4.203 0.515 18522
10929 1 19 . 1 1 112 112 HIS C C 124 176.040 176.040 175.200 0.840 18522
10930 1 19 . 1 1 112 112 HIS CA C 124 54.213 54.213 55.267 -1.054 18522
10931 1 19 . 1 1 112 112 HIS CB C 124 31.164 31.164 30.427 0.737 18522
10932 1 19 . 1 1 112 112 HIS H H 124 7.640 7.640 8.117 -0.477 18522
10933 1 19 . 1 1 113 113 TRP C C 125 176.168 176.168 174.924 1.244 18522
10934 1 19 . 1 1 114 114 LEU N N 126 121.893 121.893 115.419 6.474 18522
10935 1 19 . 1 1 114 114 LEU HA H 126 4.869 4.869 4.998 -0.129 18522
10936 1 19 . 1 1 114 114 LEU CA C 126 54.151 54.151 53.599 0.552 18522
10937 1 19 . 1 1 114 114 LEU CB C 126 45.144 45.144 45.887 -0.743 18522
10938 1 19 . 1 1 114 114 LEU H H 126 8.606 8.606 8.731 -0.125 18522
10939 1 19 . 1 1 115 115 LYS N N 127 125.850 125.850 118.884 6.966 18522
10940 1 19 . 1 1 115 115 LYS HA H 127 4.203 4.203 5.002 -0.799 18522
10941 1 19 . 1 1 115 115 LYS C C 127 175.564 175.564 174.630 0.934 18522
10942 1 19 . 1 1 115 115 LYS CA C 127 57.252 57.252 55.381 1.871 18522
10943 1 19 . 1 1 115 115 LYS CB C 127 33.406 33.406 35.445 -2.039 18522
10944 1 19 . 1 1 115 115 LYS H H 127 8.647 8.647 8.242 0.405 18522
10945 1 20 . 1 1 3 3 PRO C C 15 177.225 177.225 176.890 0.335 18522
10946 1 20 . 1 1 3 3 PRO CA C 15 63.508 63.508 63.080 0.428 18522
10947 1 20 . 1 1 3 3 PRO CB C 15 32.090 32.090 32.344 -0.254 18522
10948 1 20 . 1 1 4 4 GLY N N 16 108.829 108.829 108.400 0.429 18522
10949 1 20 . 1 1 4 4 GLY C C 16 173.398 173.398 174.118 -0.720 18522
10950 1 20 . 1 1 4 4 GLY CA C 16 45.128 45.128 44.459 0.669 18522
10951 1 20 . 1 1 4 4 GLY H H 16 8.489 8.489 7.972 0.517 18522
10952 1 20 . 1 1 5 5 ILE N N 17 121.763 121.763 120.554 1.209 18522
10953 1 20 . 1 1 5 5 ILE HA H 17 4.554 4.554 4.587 -0.033 18522
10954 1 20 . 1 1 5 5 ILE C C 17 174.332 174.332 175.420 -1.088 18522
10955 1 20 . 1 1 5 5 ILE CA C 17 58.245 58.245 58.715 -0.470 18522
10956 1 20 . 1 1 5 5 ILE CB C 17 38.762 38.762 38.190 0.572 18522
10957 1 20 . 1 1 5 5 ILE H H 17 8.014 8.014 8.201 -0.187 18522
10958 1 20 . 1 1 6 6 PRO C C 18 176.437 176.437 176.333 0.104 18522
10959 1 20 . 1 1 6 6 PRO CA C 18 62.667 62.667 63.980 -1.313 18522
10960 1 20 . 1 1 6 6 PRO CB C 18 32.469 32.469 32.080 0.389 18522
10961 1 20 . 1 1 7 7 VAL N N 19 123.849 123.849 118.654 5.195 18522
10962 1 20 . 1 1 7 7 VAL HA H 19 4.550 4.550 4.594 -0.044 18522
10963 1 20 . 1 1 7 7 VAL C C 19 174.453 174.453 173.450 1.003 18522
10964 1 20 . 1 1 7 7 VAL CA C 19 59.846 59.846 59.323 0.523 18522
10965 1 20 . 1 1 7 7 VAL CB C 19 33.510 33.510 33.675 -0.165 18522
10966 1 20 . 1 1 7 7 VAL H H 19 8.754 8.754 7.977 0.777 18522
10967 1 20 . 1 1 8 8 PRO HA H 20 5.338 5.338 5.366 -0.028 18522
10968 1 20 . 1 1 8 8 PRO C C 20 177.585 177.585 176.325 1.260 18522
10969 1 20 . 1 1 8 8 PRO CA C 20 62.406 62.406 61.278 1.128 18522
10970 1 20 . 1 1 8 8 PRO CB C 20 32.891 32.891 32.797 0.094 18522
10971 1 20 . 1 1 9 9 GLY N N 21 108.426 108.426 108.596 -0.170 18522
10972 1 20 . 1 1 9 9 GLY C C 21 171.443 171.443 170.841 0.602 18522
10973 1 20 . 1 1 9 9 GLY CA C 21 44.581 44.581 45.203 -0.622 18522
10974 1 20 . 1 1 9 9 GLY H H 21 8.258 8.258 7.576 0.682 18522
10975 1 20 . 1 1 10 10 LYS N N 22 117.372 117.372 118.014 -0.642 18522
10976 1 20 . 1 1 10 10 LYS HA H 22 4.039 4.039 5.045 -1.006 18522
10977 1 20 . 1 1 10 10 LYS C C 22 174.463 174.463 175.038 -0.575 18522
10978 1 20 . 1 1 10 10 LYS CA C 22 55.263 55.263 54.469 0.794 18522
10979 1 20 . 1 1 10 10 LYS CB C 22 35.227 35.227 36.379 -1.152 18522
10980 1 20 . 1 1 10 10 LYS H H 22 8.175 8.175 7.875 0.300 18522
10981 1 20 . 1 1 11 11 VAL N N 23 120.387 120.387 116.455 3.932 18522
10982 1 20 . 1 1 11 11 VAL HA H 23 4.708 4.708 4.562 0.146 18522
10983 1 20 . 1 1 11 11 VAL C C 23 171.873 171.873 174.488 -2.615 18522
10984 1 20 . 1 1 11 11 VAL CA C 23 59.866 59.866 60.268 -0.402 18522
10985 1 20 . 1 1 11 11 VAL CB C 23 35.269 35.269 35.045 0.224 18522
10986 1 20 . 1 1 11 11 VAL H H 23 8.862 8.862 8.317 0.545 18522
10987 1 20 . 1 1 12 12 THR N N 24 125.797 125.797 121.336 4.461 18522
10988 1 20 . 1 1 12 12 THR HA H 24 5.121 5.121 4.947 0.174 18522
10989 1 20 . 1 1 12 12 THR C C 24 173.407 173.407 173.413 -0.006 18522
10990 1 20 . 1 1 12 12 THR CA C 24 62.115 62.115 60.717 1.398 18522
10991 1 20 . 1 1 12 12 THR CB C 24 69.606 69.606 68.992 0.614 18522
10992 1 20 . 1 1 12 12 THR H H 24 8.859 8.859 8.365 0.494 18522
10993 1 20 . 1 1 13 13 LEU N N 25 127.960 127.960 127.901 0.059 18522
10994 1 20 . 1 1 13 13 LEU HA H 25 4.809 4.809 4.864 -0.055 18522
10995 1 20 . 1 1 13 13 LEU C C 25 175.029 175.029 175.271 -0.242 18522
10996 1 20 . 1 1 13 13 LEU CA C 25 52.623 52.623 52.309 0.314 18522
10997 1 20 . 1 1 13 13 LEU CB C 25 46.242 46.242 44.882 1.360 18522
10998 1 20 . 1 1 13 13 LEU H H 25 9.258 9.258 8.083 1.175 18522
10999 1 20 . 1 1 14 14 GLN N N 26 120.858 120.858 117.698 3.160 18522
11000 1 20 . 1 1 14 14 GLN HA H 26 4.482 4.482 4.588 -0.106 18522
11001 1 20 . 1 1 14 14 GLN C C 26 174.515 174.515 175.002 -0.487 18522
11002 1 20 . 1 1 14 14 GLN CA C 26 54.576 54.576 54.309 0.267 18522
11003 1 20 . 1 1 14 14 GLN CB C 26 29.516 29.516 31.910 -2.394 18522
11004 1 20 . 1 1 14 14 GLN H H 26 8.530 8.530 8.321 0.209 18522
11005 1 20 . 1 1 15 15 LYS N N 27 119.583 119.583 122.911 -3.328 18522
11006 1 20 . 1 1 15 15 LYS HA H 27 4.180 4.180 4.212 -0.032 18522
11007 1 20 . 1 1 15 15 LYS C C 27 177.468 177.468 176.928 0.540 18522
11008 1 20 . 1 1 15 15 LYS CA C 27 55.956 55.956 57.073 -1.117 18522
11009 1 20 . 1 1 15 15 LYS CB C 27 34.099 34.099 32.555 1.544 18522
11010 1 20 . 1 1 15 15 LYS H H 27 8.099 8.099 8.058 0.041 18522
11011 1 20 . 1 1 16 16 ASP N N 28 121.439 121.439 122.800 -1.361 18522
11012 1 20 . 1 1 16 16 ASP HA H 28 4.590 4.590 4.608 -0.018 18522
11013 1 20 . 1 1 16 16 ASP C C 28 178.392 178.392 178.082 0.310 18522
11014 1 20 . 1 1 16 16 ASP CA C 28 52.426 52.426 54.203 -1.777 18522
11015 1 20 . 1 1 16 16 ASP CB C 28 41.377 41.377 42.572 -1.196 18522
11016 1 20 . 1 1 16 16 ASP H H 28 8.888 8.888 8.648 0.240 18522
11017 1 20 . 1 1 17 17 ALA N N 29 119.578 119.578 123.583 -4.005 18522
11018 1 20 . 1 1 17 17 ALA HA H 29 4.188 4.188 4.144 0.044 18522
11019 1 20 . 1 1 17 17 ALA C C 29 178.763 178.763 178.477 0.286 18522
11020 1 20 . 1 1 17 17 ALA CA C 29 54.434 54.434 54.317 0.117 18522
11021 1 20 . 1 1 17 17 ALA CB C 29 18.293 18.293 18.673 -0.380 18522
11022 1 20 . 1 1 17 17 ALA H H 29 8.392 8.392 8.592 -0.200 18522
11023 1 20 . 1 1 18 18 GLN N N 30 117.564 117.564 117.685 -0.121 18522
11024 1 20 . 1 1 18 18 GLN HA H 30 4.399 4.399 4.352 0.047 18522
11025 1 20 . 1 1 18 18 GLN C C 30 175.168 175.168 175.276 -0.108 18522
11026 1 20 . 1 1 18 18 GLN CA C 30 55.339 55.339 55.131 0.208 18522
11027 1 20 . 1 1 18 18 GLN CB C 30 28.589 28.589 29.185 -0.596 18522
11028 1 20 . 1 1 18 18 GLN H H 30 8.353 8.353 7.913 0.440 18522
11029 1 20 . 1 1 19 19 ASN N N 31 115.365 115.365 114.825 0.540 18522
11030 1 20 . 1 1 19 19 ASN HA H 31 4.315 4.315 4.422 -0.107 18522
11031 1 20 . 1 1 19 19 ASN C C 31 174.043 174.043 173.164 0.879 18522
11032 1 20 . 1 1 19 19 ASN CA C 31 54.303 54.303 54.589 -0.286 18522
11033 1 20 . 1 1 19 19 ASN CB C 31 37.610 37.610 37.360 0.250 18522
11034 1 20 . 1 1 19 19 ASN H H 31 8.521 8.521 8.242 0.279 18522
11035 1 20 . 1 1 20 20 LEU N N 32 118.660 118.660 112.958 5.702 18522
11036 1 20 . 1 1 20 20 LEU HA H 32 4.900 4.900 4.918 -0.018 18522
11037 1 20 . 1 1 20 20 LEU C C 32 178.117 178.117 176.773 1.344 18522
11038 1 20 . 1 1 20 20 LEU CA C 32 53.957 53.957 53.698 0.259 18522
11039 1 20 . 1 1 20 20 LEU CB C 32 44.774 44.774 43.107 1.667 18522
11040 1 20 . 1 1 20 20 LEU H H 32 8.155 8.155 7.422 0.733 18522
11041 1 20 . 1 1 21 21 ILE N N 33 116.785 116.785 116.226 0.559 18522
11042 1 20 . 1 1 21 21 ILE HA H 33 4.674 4.674 4.511 0.163 18522
11043 1 20 . 1 1 21 21 ILE C C 33 176.185 176.185 176.621 -0.436 18522
11044 1 20 . 1 1 21 21 ILE CA C 33 62.602 62.602 61.411 1.191 18522
11045 1 20 . 1 1 21 21 ILE CB C 33 39.016 39.016 38.766 0.250 18522
11046 1 20 . 1 1 21 21 ILE H H 33 11.488 11.488 7.783 3.705 18522
11047 1 20 . 1 1 22 22 GLY N N 34 111.234 111.234 107.855 3.379 18522
11048 1 20 . 1 1 22 22 GLY C C 34 173.993 173.993 174.368 -0.375 18522
11049 1 20 . 1 1 22 22 GLY CA C 34 45.980 45.980 45.023 0.957 18522
11050 1 20 . 1 1 22 22 GLY H H 34 9.854 9.854 7.617 2.237 18522
11051 1 20 . 1 1 23 23 ILE N N 35 111.117 111.117 114.848 -3.731 18522
11052 1 20 . 1 1 23 23 ILE HA H 35 5.535 5.535 5.148 0.387 18522
11053 1 20 . 1 1 23 23 ILE C C 35 175.033 175.033 174.103 0.930 18522
11054 1 20 . 1 1 23 23 ILE CA C 35 58.415 58.415 58.129 0.286 18522
11055 1 20 . 1 1 23 23 ILE CB C 35 41.577 41.577 41.736 -0.159 18522
11056 1 20 . 1 1 23 23 ILE H H 35 7.835 7.835 7.552 0.283 18522
11057 1 20 . 1 1 24 24 SER N N 36 114.908 114.908 116.050 -1.142 18522
11058 1 20 . 1 1 24 24 SER HA H 36 4.232 4.232 5.068 -0.836 18522
11059 1 20 . 1 1 24 24 SER C C 36 174.735 174.735 173.277 1.458 18522
11060 1 20 . 1 1 24 24 SER CA C 36 56.121 56.121 57.355 -1.234 18522
11061 1 20 . 1 1 24 24 SER CB C 36 66.097 66.097 64.808 1.289 18522
11062 1 20 . 1 1 24 24 SER H H 36 8.623 8.623 8.199 0.424 18522
11063 1 20 . 1 1 25 25 ILE N N 37 117.739 117.739 122.769 -5.030 18522
11064 1 20 . 1 1 25 25 ILE C C 37 174.340 174.340 175.380 -1.040 18522
11065 1 20 . 1 1 25 25 ILE CA C 37 59.123 59.123 59.161 -0.038 18522
11066 1 20 . 1 1 25 25 ILE CB C 37 41.637 41.637 41.450 0.187 18522
11067 1 20 . 1 1 25 25 ILE H H 37 9.130 9.130 8.654 0.476 18522
11068 1 20 . 1 1 26 26 GLY N N 38 108.069 108.069 106.735 1.334 18522
11069 1 20 . 1 1 26 26 GLY CA C 38 44.112 44.112 45.476 -1.364 18522
11070 1 20 . 1 1 26 26 GLY H H 38 8.841 8.841 7.649 1.192 18522
11071 1 20 . 1 1 27 27 GLY N N 39 109.016 109.016 109.592 -0.576 18522
11072 1 20 . 1 1 27 27 GLY C C 39 173.956 173.956 174.521 -0.565 18522
11073 1 20 . 1 1 27 27 GLY H H 39 8.187 8.187 8.177 0.010 18522
11074 1 20 . 1 1 28 28 GLY N N 40 111.783 111.783 108.448 3.335 18522
11075 1 20 . 1 1 28 28 GLY C C 40 174.255 174.255 175.218 -0.963 18522
11076 1 20 . 1 1 28 28 GLY CA C 40 47.098 47.098 46.788 0.311 18522
11077 1 20 . 1 1 28 28 GLY H H 40 8.275 8.275 8.151 0.124 18522
11078 1 20 . 1 1 29 29 ALA N N 41 123.128 123.128 121.287 1.841 18522
11079 1 20 . 1 1 29 29 ALA HA H 41 4.559 4.559 3.851 0.708 18522
11080 1 20 . 1 1 29 29 ALA CA C 41 51.073 51.073 53.953 -2.880 18522
11081 1 20 . 1 1 29 29 ALA CB C 41 21.926 21.926 17.327 4.599 18522
11082 1 20 . 1 1 29 29 ALA H H 41 8.012 8.012 8.224 -0.212 18522
11083 1 20 . 1 1 31 31 TYR HA H 43 4.549 4.549 4.155 0.394 18522
11084 1 20 . 1 1 31 31 TYR CA C 43 57.147 57.147 59.565 -2.418 18522
11085 1 20 . 1 1 31 31 TYR CB C 43 37.495 37.495 36.147 1.348 18522
11086 1 20 . 1 1 32 32 CYS N N 44 119.332 119.332 118.061 1.271 18522
11087 1 20 . 1 1 32 32 CYS HA H 44 4.859 4.859 4.692 0.167 18522
11088 1 20 . 1 1 32 32 CYS CA C 44 57.406 57.406 55.920 1.486 18522
11089 1 20 . 1 1 32 32 CYS CB C 44 27.673 27.673 29.024 -1.351 18522
11090 1 20 . 1 1 32 32 CYS H H 44 7.504 7.504 7.854 -0.350 18522
11091 1 20 . 1 1 33 33 PRO HA H 45 4.413 4.413 4.448 -0.035 18522
11092 1 20 . 1 1 33 33 PRO CA C 45 64.885 64.885 63.046 1.839 18522
11093 1 20 . 1 1 33 33 PRO CB C 45 32.318 32.318 31.922 0.396 18522
11094 1 20 . 1 1 34 34 CYS N N 46 117.327 117.327 113.585 3.742 18522
11095 1 20 . 1 1 34 34 CYS C C 46 172.064 172.064 174.512 -2.448 18522
11096 1 20 . 1 1 34 34 CYS CA C 46 60.066 60.066 59.811 0.255 18522
11097 1 20 . 1 1 34 34 CYS CB C 46 28.715 28.715 27.434 1.281 18522
11098 1 20 . 1 1 34 34 CYS H H 46 7.973 7.973 8.294 -0.321 18522
11099 1 20 . 1 1 35 35 LEU N N 47 124.270 124.270 123.159 1.111 18522
11100 1 20 . 1 1 35 35 LEU HA H 47 4.928 4.928 5.033 -0.105 18522
11101 1 20 . 1 1 35 35 LEU C C 47 175.076 175.076 176.559 -1.483 18522
11102 1 20 . 1 1 35 35 LEU CA C 47 53.278 53.278 54.168 -0.890 18522
11103 1 20 . 1 1 35 35 LEU CB C 47 44.321 44.321 44.434 -0.113 18522
11104 1 20 . 1 1 35 35 LEU H H 47 8.629 8.629 8.640 -0.011 18522
11105 1 20 . 1 1 36 36 TYR N N 48 119.326 119.326 114.767 4.559 18522
11106 1 20 . 1 1 36 36 TYR HA H 48 5.255 5.255 4.904 0.351 18522
11107 1 20 . 1 1 36 36 TYR C C 48 175.766 175.766 173.781 1.985 18522
11108 1 20 . 1 1 36 36 TYR CA C 48 56.696 56.696 55.674 1.022 18522
11109 1 20 . 1 1 36 36 TYR CB C 48 42.590 42.590 41.038 1.552 18522
11110 1 20 . 1 1 36 36 TYR H H 48 8.761 8.761 8.335 0.426 18522
11111 1 20 . 1 1 37 37 ILE N N 49 120.259 120.259 122.014 -1.755 18522
11112 1 20 . 1 1 37 37 ILE HA H 49 4.215 4.215 4.465 -0.250 18522
11113 1 20 . 1 1 37 37 ILE C C 49 177.429 177.429 175.392 2.037 18522
11114 1 20 . 1 1 37 37 ILE CA C 49 62.456 62.456 59.288 3.168 18522
11115 1 20 . 1 1 37 37 ILE CB C 49 37.352 37.352 39.617 -2.265 18522
11116 1 20 . 1 1 37 37 ILE H H 49 8.959 8.959 8.650 0.309 18522
11117 1 20 . 1 1 38 38 VAL HA H 50 3.937 3.937 3.901 0.036 18522
11118 1 20 . 1 1 38 38 VAL C C 50 174.408 174.408 175.350 -0.942 18522
11119 1 20 . 1 1 38 38 VAL CA C 50 62.259 62.259 63.787 -1.528 18522
11120 1 20 . 1 1 38 38 VAL CB C 50 31.584 31.584 32.512 -0.928 18522
11121 1 20 . 1 1 39 39 GLN N N 51 116.821 116.821 116.689 0.132 18522
11122 1 20 . 1 1 39 39 GLN HA H 51 4.103 4.103 4.464 -0.361 18522
11123 1 20 . 1 1 39 39 GLN C C 51 172.856 172.856 172.955 -0.099 18522
11124 1 20 . 1 1 39 39 GLN CA C 51 55.127 55.127 55.213 -0.086 18522
11125 1 20 . 1 1 39 39 GLN CB C 51 32.376 32.376 32.465 -0.089 18522
11126 1 20 . 1 1 39 39 GLN H H 51 6.967 6.967 7.560 -0.593 18522
11127 1 20 . 1 1 40 40 VAL N N 52 123.482 123.482 119.987 3.495 18522
11128 1 20 . 1 1 40 40 VAL HA H 52 4.277 4.277 4.601 -0.324 18522
11129 1 20 . 1 1 40 40 VAL C C 52 176.198 176.198 173.958 2.240 18522
11130 1 20 . 1 1 40 40 VAL CA C 52 61.574 61.574 59.567 2.007 18522
11131 1 20 . 1 1 40 40 VAL CB C 52 32.875 32.875 34.703 -1.828 18522
11132 1 20 . 1 1 40 40 VAL H H 52 8.447 8.447 8.201 0.246 18522
11133 1 20 . 1 1 41 41 PHE N N 53 128.296 128.296 124.705 3.591 18522
11134 1 20 . 1 1 41 41 PHE HA H 53 4.400 4.400 4.689 -0.289 18522
11135 1 20 . 1 1 41 41 PHE C C 53 175.299 175.299 175.242 0.057 18522
11136 1 20 . 1 1 41 41 PHE CA C 53 58.494 58.494 58.038 0.456 18522
11137 1 20 . 1 1 41 41 PHE CB C 53 39.561 39.561 39.573 -0.012 18522
11138 1 20 . 1 1 41 41 PHE H H 53 8.707 8.707 8.104 0.603 18522
11139 1 20 . 1 1 42 42 ASP N N 54 122.696 122.696 115.649 7.047 18522
11140 1 20 . 1 1 42 42 ASP HA H 54 4.272 4.272 4.664 -0.392 18522
11141 1 20 . 1 1 42 42 ASP C C 54 176.837 176.837 175.925 0.912 18522
11142 1 20 . 1 1 42 42 ASP CA C 54 55.291 55.291 54.858 0.433 18522
11143 1 20 . 1 1 42 42 ASP CB C 54 41.093 41.093 42.596 -1.503 18522
11144 1 20 . 1 1 42 42 ASP H H 54 8.901 8.901 8.455 0.446 18522
11145 1 20 . 1 1 43 43 ASN N N 55 113.923 113.923 116.780 -2.857 18522
11146 1 20 . 1 1 43 43 ASN HA H 55 4.258 4.258 4.818 -0.560 18522
11147 1 20 . 1 1 43 43 ASN C C 55 173.714 173.714 174.589 -0.875 18522
11148 1 20 . 1 1 43 43 ASN CA C 55 54.958 54.958 53.563 1.395 18522
11149 1 20 . 1 1 43 43 ASN CB C 55 37.150 37.150 39.404 -2.254 18522
11150 1 20 . 1 1 43 43 ASN H H 55 9.319 9.319 8.216 1.103 18522
11151 1 20 . 1 1 44 44 THR N N 56 108.020 108.020 110.737 -2.717 18522
11152 1 20 . 1 1 44 44 THR HA H 56 5.377 5.377 4.782 0.595 18522
11153 1 20 . 1 1 44 44 THR CA C 56 59.712 59.712 59.270 0.442 18522
11154 1 20 . 1 1 44 44 THR CB C 56 69.529 69.529 69.803 -0.274 18522
11155 1 20 . 1 1 44 44 THR H H 56 7.149 7.149 7.463 -0.314 18522
11156 1 20 . 1 1 45 45 PRO HA H 57 4.304 4.304 4.075 0.229 18522
11157 1 20 . 1 1 45 45 PRO C C 57 180.141 180.141 177.747 2.394 18522
11158 1 20 . 1 1 45 45 PRO CA C 57 66.090 66.090 65.616 0.474 18522
11159 1 20 . 1 1 45 45 PRO CB C 57 33.194 33.194 31.572 1.622 18522
11160 1 20 . 1 1 46 46 ALA N N 58 116.854 116.854 119.408 -2.554 18522
11161 1 20 . 1 1 46 46 ALA HA H 58 4.035 4.035 4.083 -0.048 18522
11162 1 20 . 1 1 46 46 ALA C C 58 180.647 180.647 180.021 0.626 18522
11163 1 20 . 1 1 46 46 ALA CA C 58 55.195 55.195 54.912 0.283 18522
11164 1 20 . 1 1 46 46 ALA CB C 58 18.880 18.880 18.123 0.757 18522
11165 1 20 . 1 1 46 46 ALA H H 58 8.938 8.938 7.834 1.104 18522
11166 1 20 . 1 1 47 47 ALA N N 59 123.250 123.250 121.806 1.444 18522
11167 1 20 . 1 1 47 47 ALA HA H 59 4.030 4.030 4.058 -0.028 18522
11168 1 20 . 1 1 47 47 ALA C C 59 179.852 179.852 179.541 0.311 18522
11169 1 20 . 1 1 47 47 ALA CA C 59 54.939 54.939 54.758 0.181 18522
11170 1 20 . 1 1 47 47 ALA CB C 59 19.688 19.688 18.724 0.964 18522
11171 1 20 . 1 1 47 47 ALA H H 59 7.658 7.658 7.445 0.213 18522
11172 1 20 . 1 1 48 48 LEU N N 60 118.654 118.654 119.112 -0.458 18522
11173 1 20 . 1 1 48 48 LEU HA H 60 4.026 4.026 4.205 -0.179 18522
11174 1 20 . 1 1 48 48 LEU C C 60 179.238 179.238 177.851 1.387 18522
11175 1 20 . 1 1 48 48 LEU CA C 60 57.261 57.261 57.882 -0.621 18522
11176 1 20 . 1 1 48 48 LEU CB C 60 41.445 41.445 40.371 1.074 18522
11177 1 20 . 1 1 48 48 LEU H H 60 8.636 8.636 8.548 0.088 18522
11178 1 20 . 1 1 49 49 ASP N N 61 117.382 117.382 119.603 -2.221 18522
11179 1 20 . 1 1 49 49 ASP HA H 61 4.421 4.421 4.634 -0.213 18522
11180 1 20 . 1 1 49 49 ASP C C 61 177.668 177.668 177.515 0.153 18522
11181 1 20 . 1 1 49 49 ASP CA C 61 57.087 57.087 54.560 2.527 18522
11182 1 20 . 1 1 49 49 ASP CB C 61 44.478 44.478 41.681 2.797 18522
11183 1 20 . 1 1 49 49 ASP H H 61 7.665 7.665 7.828 -0.163 18522
11184 1 20 . 1 1 50 50 GLY N N 62 103.228 103.228 107.720 -4.492 18522
11185 1 20 . 1 1 50 50 GLY C C 62 174.776 174.776 174.953 -0.177 18522
11186 1 20 . 1 1 50 50 GLY CA C 62 46.533 46.533 46.096 0.437 18522
11187 1 20 . 1 1 50 50 GLY H H 62 7.216 7.216 7.620 -0.404 18522
11188 1 20 . 1 1 51 51 THR N N 63 117.230 117.230 109.171 8.059 18522
11189 1 20 . 1 1 51 51 THR HA H 63 3.907 3.907 3.851 0.056 18522
11190 1 20 . 1 1 51 51 THR C C 63 175.961 175.961 174.284 1.677 18522
11191 1 20 . 1 1 51 51 THR CA C 63 66.478 66.478 62.576 3.902 18522
11192 1 20 . 1 1 51 51 THR CB C 63 68.268 68.268 67.412 0.856 18522
11193 1 20 . 1 1 51 51 THR H H 63 8.319 8.319 7.662 0.657 18522
11194 1 20 . 1 1 52 52 VAL N N 64 113.826 113.826 116.060 -2.234 18522
11195 1 20 . 1 1 52 52 VAL HA H 64 3.950 3.950 4.395 -0.445 18522
11196 1 20 . 1 1 52 52 VAL C C 64 173.883 173.883 174.789 -0.906 18522
11197 1 20 . 1 1 52 52 VAL CA C 64 60.708 60.708 60.373 0.335 18522
11198 1 20 . 1 1 52 52 VAL CB C 64 33.079 33.079 30.681 2.398 18522
11199 1 20 . 1 1 52 52 VAL H H 64 8.147 8.147 7.217 0.930 18522
11200 1 20 . 1 1 53 53 ALA N N 65 123.521 123.521 123.215 0.306 18522
11201 1 20 . 1 1 53 53 ALA HA H 65 4.414 4.414 4.457 -0.043 18522
11202 1 20 . 1 1 53 53 ALA C C 65 175.247 175.247 176.599 -1.352 18522
11203 1 20 . 1 1 53 53 ALA CA C 65 50.440 50.440 50.590 -0.150 18522
11204 1 20 . 1 1 53 53 ALA CB C 65 23.266 23.266 20.375 2.891 18522
11205 1 20 . 1 1 53 53 ALA H H 65 8.633 8.633 7.501 1.132 18522
11206 1 20 . 1 1 54 54 ALA N N 66 120.818 120.818 122.231 -1.413 18522
11207 1 20 . 1 1 54 54 ALA HA H 66 3.720 3.720 3.819 -0.099 18522
11208 1 20 . 1 1 54 54 ALA C C 66 178.411 178.411 178.318 0.093 18522
11209 1 20 . 1 1 54 54 ALA CA C 66 53.016 53.016 53.114 -0.098 18522
11210 1 20 . 1 1 54 54 ALA CB C 66 17.840 17.840 18.383 -0.543 18522
11211 1 20 . 1 1 54 54 ALA H H 66 8.451 8.451 8.345 0.106 18522
11212 1 20 . 1 1 55 55 GLY N N 67 112.260 112.260 112.573 -0.313 18522
11213 1 20 . 1 1 55 55 GLY C C 67 173.296 173.296 173.860 -0.564 18522
11214 1 20 . 1 1 55 55 GLY CA C 67 45.025 45.025 44.754 0.271 18522
11215 1 20 . 1 1 55 55 GLY H H 67 9.600 9.600 8.495 1.105 18522
11216 1 20 . 1 1 56 56 ASP N N 68 121.293 121.293 121.454 -0.161 18522
11217 1 20 . 1 1 56 56 ASP HA H 68 4.861 4.861 5.100 -0.239 18522
11218 1 20 . 1 1 56 56 ASP C C 68 174.937 174.937 175.013 -0.076 18522
11219 1 20 . 1 1 56 56 ASP CA C 68 55.641 55.641 53.207 2.434 18522
11220 1 20 . 1 1 56 56 ASP CB C 68 40.696 40.696 42.906 -2.210 18522
11221 1 20 . 1 1 56 56 ASP H H 68 8.043 8.043 7.526 0.517 18522
11222 1 20 . 1 1 57 57 GLU N N 69 122.814 122.814 117.988 4.826 18522
11223 1 20 . 1 1 57 57 GLU C C 69 177.202 177.202 174.642 2.560 18522
11224 1 20 . 1 1 57 57 GLU CA C 69 54.472 54.472 55.224 -0.752 18522
11225 1 20 . 1 1 57 57 GLU CB C 69 32.800 32.800 34.076 -1.276 18522
11226 1 20 . 1 1 57 57 GLU H H 69 8.455 8.455 8.098 0.357 18522
11227 1 20 . 1 1 58 58 ILE N N 70 125.862 125.862 120.750 5.112 18522
11228 1 20 . 1 1 58 58 ILE HA H 70 4.526 4.526 4.522 0.004 18522
11229 1 20 . 1 1 58 58 ILE C C 70 175.035 175.035 175.087 -0.052 18522
11230 1 20 . 1 1 58 58 ILE CA C 70 60.918 60.918 59.618 1.300 18522
11231 1 20 . 1 1 58 58 ILE CB C 70 39.236 39.236 40.321 -1.085 18522
11232 1 20 . 1 1 58 58 ILE H H 70 8.619 8.619 8.123 0.496 18522
11233 1 20 . 1 1 59 59 THR N N 71 115.507 115.507 118.450 -2.943 18522
11234 1 20 . 1 1 59 59 THR HA H 71 4.513 4.513 4.661 -0.148 18522
11235 1 20 . 1 1 59 59 THR C C 71 176.425 176.425 173.751 2.674 18522
11236 1 20 . 1 1 59 59 THR CA C 71 61.158 61.158 61.365 -0.207 18522
11237 1 20 . 1 1 59 59 THR CB C 71 69.604 69.604 70.500 -0.896 18522
11238 1 20 . 1 1 59 59 THR H H 71 9.242 9.242 9.162 0.080 18522
11239 1 20 . 1 1 60 60 GLY N N 72 111.789 111.789 108.639 3.150 18522
11240 1 20 . 1 1 60 60 GLY C C 72 170.981 170.981 171.448 -0.467 18522
11241 1 20 . 1 1 60 60 GLY CA C 72 46.554 46.554 45.479 1.075 18522
11242 1 20 . 1 1 60 60 GLY H H 72 7.883 7.883 7.719 0.164 18522
11243 1 20 . 1 1 61 61 VAL N N 73 119.277 119.277 120.627 -1.350 18522
11244 1 20 . 1 1 61 61 VAL C C 73 175.951 175.951 175.392 0.559 18522
11245 1 20 . 1 1 61 61 VAL CA C 73 60.982 60.982 59.372 1.610 18522
11246 1 20 . 1 1 61 61 VAL CB C 73 36.197 36.197 33.453 2.744 18522
11247 1 20 . 1 1 61 61 VAL H H 73 8.424 8.424 8.953 -0.529 18522
11248 1 20 . 1 1 62 62 ASN N N 74 127.731 127.731 127.862 -0.131 18522
11249 1 20 . 1 1 62 62 ASN HA H 74 4.520 4.520 4.530 -0.010 18522
11250 1 20 . 1 1 62 62 ASN C C 74 174.878 174.878 174.867 0.011 18522
11251 1 20 . 1 1 62 62 ASN CA C 74 54.418 54.418 54.110 0.308 18522
11252 1 20 . 1 1 62 62 ASN CB C 74 36.655 36.655 37.536 -0.881 18522
11253 1 20 . 1 1 62 62 ASN H H 74 10.384 10.384 8.918 1.466 18522
11254 1 20 . 1 1 63 63 GLY N N 75 104.633 104.633 103.840 0.793 18522
11255 1 20 . 1 1 63 63 GLY C C 75 173.610 173.610 173.199 0.411 18522
11256 1 20 . 1 1 63 63 GLY CA C 75 45.261 45.261 44.936 0.325 18522
11257 1 20 . 1 1 63 63 GLY H H 75 8.926 8.926 8.215 0.711 18522
11258 1 20 . 1 1 64 64 ARG N N 76 120.451 120.451 121.418 -0.967 18522
11259 1 20 . 1 1 64 64 ARG HA H 76 4.501 4.501 4.587 -0.086 18522
11260 1 20 . 1 1 64 64 ARG C C 76 175.085 175.085 175.633 -0.548 18522
11261 1 20 . 1 1 64 64 ARG CA C 76 54.252 54.252 54.502 -0.249 18522
11262 1 20 . 1 1 64 64 ARG CB C 76 31.482 31.482 31.671 -0.189 18522
11263 1 20 . 1 1 64 64 ARG H H 76 7.753 7.753 7.940 -0.187 18522
11264 1 20 . 1 1 65 65 SER N N 77 116.586 116.586 118.574 -1.988 18522
11265 1 20 . 1 1 65 65 SER HA H 77 4.483 4.483 4.565 -0.082 18522
11266 1 20 . 1 1 65 65 SER C C 77 176.953 176.953 176.042 0.911 18522
11267 1 20 . 1 1 65 65 SER CA C 77 58.292 58.292 59.015 -0.723 18522
11268 1 20 . 1 1 65 65 SER CB C 77 63.643 63.643 63.687 -0.044 18522
11269 1 20 . 1 1 65 65 SER H H 77 8.555 8.555 8.802 -0.247 18522
11270 1 20 . 1 1 66 66 ILE N N 78 116.618 116.618 120.982 -4.364 18522
11271 1 20 . 1 1 66 66 ILE HA H 78 4.420 4.420 4.278 0.142 18522
11272 1 20 . 1 1 66 66 ILE C C 78 175.072 175.072 177.371 -2.299 18522
11273 1 20 . 1 1 66 66 ILE CA C 78 59.122 59.122 61.318 -2.196 18522
11274 1 20 . 1 1 66 66 ILE CB C 78 36.758 36.758 37.240 -0.482 18522
11275 1 20 . 1 1 66 66 ILE H H 78 7.599 7.599 8.050 -0.451 18522
11276 1 20 . 1 1 67 67 LYS N N 79 123.287 123.287 122.552 0.735 18522
11277 1 20 . 1 1 67 67 LYS HA H 79 4.049 4.049 4.010 0.039 18522
11278 1 20 . 1 1 67 67 LYS C C 79 178.333 178.333 177.770 0.563 18522
11279 1 20 . 1 1 67 67 LYS CA C 79 58.321 58.321 58.551 -0.230 18522
11280 1 20 . 1 1 67 67 LYS CB C 79 31.635 31.635 32.118 -0.483 18522
11281 1 20 . 1 1 67 67 LYS H H 79 7.898 7.898 8.577 -0.679 18522
11282 1 20 . 1 1 68 68 GLY N N 80 114.933 114.933 106.692 8.241 18522
11283 1 20 . 1 1 68 68 GLY C C 80 174.385 174.385 174.663 -0.278 18522
11284 1 20 . 1 1 68 68 GLY CA C 80 45.518 45.518 45.779 -0.261 18522
11285 1 20 . 1 1 68 68 GLY H H 80 8.999 8.999 8.550 0.449 18522
11286 1 20 . 1 1 69 69 LYS N N 81 119.403 119.403 119.163 0.240 18522
11287 1 20 . 1 1 69 69 LYS HA H 81 4.043 4.043 4.583 -0.540 18522
11288 1 20 . 1 1 69 69 LYS C C 81 177.064 177.064 174.760 2.304 18522
11289 1 20 . 1 1 69 69 LYS CA C 81 54.722 54.722 54.950 -0.228 18522
11290 1 20 . 1 1 69 69 LYS CB C 81 33.560 33.560 33.461 0.099 18522
11291 1 20 . 1 1 69 69 LYS H H 81 7.845 7.845 7.883 -0.038 18522
11292 1 20 . 1 1 70 70 THR N N 82 112.066 112.066 110.178 1.888 18522
11293 1 20 . 1 1 70 70 THR HA H 82 4.666 4.666 4.624 0.042 18522
11294 1 20 . 1 1 70 70 THR C C 82 175.955 175.955 175.556 0.399 18522
11295 1 20 . 1 1 70 70 THR CA C 82 60.438 60.438 60.281 0.157 18522
11296 1 20 . 1 1 70 70 THR CB C 82 71.629 71.629 72.562 -0.933 18522
11297 1 20 . 1 1 70 70 THR H H 82 9.153 9.153 7.935 1.218 18522
11298 1 20 . 1 1 71 71 LYS N N 83 118.730 118.730 123.604 -4.874 18522
11299 1 20 . 1 1 71 71 LYS HA H 83 3.870 3.870 3.899 -0.029 18522
11300 1 20 . 1 1 71 71 LYS C C 83 177.464 177.464 178.517 -1.053 18522
11301 1 20 . 1 1 71 71 LYS CA C 83 60.357 60.357 59.542 0.815 18522
11302 1 20 . 1 1 71 71 LYS CB C 83 31.350 31.350 31.499 -0.149 18522
11303 1 20 . 1 1 71 71 LYS H H 83 8.969 8.969 8.694 0.275 18522
11304 1 20 . 1 1 72 72 VAL N N 84 117.444 117.444 119.220 -1.776 18522
11305 1 20 . 1 1 72 72 VAL HA H 84 3.633 3.633 3.731 -0.098 18522
11306 1 20 . 1 1 72 72 VAL C C 84 178.315 178.315 177.144 1.171 18522
11307 1 20 . 1 1 72 72 VAL CA C 84 66.079 66.079 65.825 0.254 18522
11308 1 20 . 1 1 72 72 VAL CB C 84 32.091 32.091 31.707 0.384 18522
11309 1 20 . 1 1 72 72 VAL H H 84 7.631 7.631 8.212 -0.581 18522
11310 1 20 . 1 1 73 73 GLU N N 85 120.890 120.890 119.237 1.653 18522
11311 1 20 . 1 1 73 73 GLU HA H 85 3.964 3.964 4.050 -0.086 18522
11312 1 20 . 1 1 73 73 GLU C C 85 179.971 179.971 178.942 1.029 18522
11313 1 20 . 1 1 73 73 GLU CA C 85 59.316 59.316 59.536 -0.220 18522
11314 1 20 . 1 1 73 73 GLU CB C 85 30.355 30.355 29.700 0.655 18522
11315 1 20 . 1 1 73 73 GLU H H 85 7.617 7.617 7.655 -0.038 18522
11316 1 20 . 1 1 74 74 VAL N N 86 121.246 121.246 118.521 2.725 18522
11317 1 20 . 1 1 74 74 VAL HA H 86 3.630 3.630 3.734 -0.104 18522
11318 1 20 . 1 1 74 74 VAL C C 86 177.217 177.217 177.585 -0.368 18522
11319 1 20 . 1 1 74 74 VAL CA C 86 66.678 66.678 66.137 0.541 18522
11320 1 20 . 1 1 74 74 VAL CB C 86 31.307 31.307 31.045 0.262 18522
11321 1 20 . 1 1 74 74 VAL H H 86 8.368 8.368 8.167 0.201 18522
11322 1 20 . 1 1 75 75 ALA N N 87 122.148 122.148 122.549 -0.401 18522
11323 1 20 . 1 1 75 75 ALA HA H 87 3.947 3.947 3.951 -0.004 18522
11324 1 20 . 1 1 75 75 ALA C C 87 179.545 179.545 179.258 0.287 18522
11325 1 20 . 1 1 75 75 ALA CA C 87 55.851 55.851 55.457 0.394 18522
11326 1 20 . 1 1 75 75 ALA CB C 87 18.491 18.491 17.919 0.572 18522
11327 1 20 . 1 1 75 75 ALA H H 87 8.577 8.577 8.273 0.304 18522
11328 1 20 . 1 1 76 76 LYS N N 88 117.733 117.733 119.217 -1.484 18522
11329 1 20 . 1 1 76 76 LYS HA H 88 4.051 4.051 4.010 0.041 18522
11330 1 20 . 1 1 76 76 LYS CA C 88 59.393 59.393 59.378 0.015 18522
11331 1 20 . 1 1 76 76 LYS CB C 88 32.058 32.058 32.331 -0.273 18522
11332 1 20 . 1 1 76 76 LYS H H 88 7.854 7.854 7.516 0.338 18522
11333 1 20 . 1 1 77 77 MET N N 89 117.676 117.676 119.078 -1.402 18522
11334 1 20 . 1 1 77 77 MET HA H 89 4.048 4.048 4.040 0.008 18522
11335 1 20 . 1 1 77 77 MET C C 89 178.791 178.791 178.825 -0.034 18522
11336 1 20 . 1 1 77 77 MET CA C 89 59.128 59.128 59.355 -0.227 18522
11337 1 20 . 1 1 77 77 MET CB C 89 33.801 33.801 32.508 1.293 18522
11338 1 20 . 1 1 77 77 MET H H 89 7.759 7.759 8.268 -0.509 18522
11339 1 20 . 1 1 78 78 ILE N N 90 117.305 117.305 119.152 -1.847 18522
11340 1 20 . 1 1 78 78 ILE HA H 90 3.590 3.590 3.704 -0.114 18522
11341 1 20 . 1 1 78 78 ILE C C 90 178.658 178.658 178.099 0.559 18522
11342 1 20 . 1 1 78 78 ILE CA C 90 65.482 65.482 64.564 0.918 18522
11343 1 20 . 1 1 78 78 ILE CB C 90 38.845 38.845 37.024 1.821 18522
11344 1 20 . 1 1 78 78 ILE H H 90 7.972 7.972 8.369 -0.397 18522
11345 1 20 . 1 1 79 79 GLN N N 91 120.935 120.935 117.972 2.963 18522
11346 1 20 . 1 1 79 79 GLN HA H 91 3.998 3.998 4.341 -0.343 18522
11347 1 20 . 1 1 79 79 GLN C C 91 178.274 178.274 178.712 -0.438 18522
11348 1 20 . 1 1 79 79 GLN CA C 91 59.151 59.151 57.919 1.232 18522
11349 1 20 . 1 1 79 79 GLN CB C 91 28.934 28.934 28.771 0.163 18522
11350 1 20 . 1 1 79 79 GLN H H 91 8.826 8.826 7.997 0.829 18522
11351 1 20 . 1 1 80 80 GLU N N 92 115.213 115.213 122.265 -7.052 18522
11352 1 20 . 1 1 80 80 GLU HA H 92 4.061 4.061 4.098 -0.037 18522
11353 1 20 . 1 1 80 80 GLU C C 92 176.824 176.824 178.559 -1.735 18522
11354 1 20 . 1 1 80 80 GLU CA C 92 58.006 58.006 59.137 -1.131 18522
11355 1 20 . 1 1 80 80 GLU CB C 92 29.890 29.890 29.438 0.452 18522
11356 1 20 . 1 1 80 80 GLU H H 92 8.020 8.020 8.463 -0.443 18522
11357 1 20 . 1 1 81 81 VAL N N 93 119.047 119.047 116.332 2.715 18522
11358 1 20 . 1 1 81 81 VAL HA H 93 3.930 3.930 3.744 0.186 18522
11359 1 20 . 1 1 81 81 VAL C C 93 176.016 176.016 175.501 0.515 18522
11360 1 20 . 1 1 81 81 VAL CA C 93 63.153 63.153 64.105 -0.952 18522
11361 1 20 . 1 1 81 81 VAL CB C 93 32.154 32.154 31.891 0.263 18522
11362 1 20 . 1 1 81 81 VAL H H 93 7.073 7.073 7.574 -0.501 18522
11363 1 20 . 1 1 82 82 LYS N N 94 128.366 128.366 118.499 9.867 18522
11364 1 20 . 1 1 82 82 LYS C C 94 177.460 177.460 176.577 0.883 18522
11365 1 20 . 1 1 82 82 LYS CA C 94 55.753 55.753 57.237 -1.484 18522
11366 1 20 . 1 1 82 82 LYS CB C 94 32.332 32.332 31.907 0.425 18522
11367 1 20 . 1 1 82 82 LYS H H 94 8.762 8.762 7.685 1.077 18522
11368 1 20 . 1 1 83 83 GLY N N 95 112.528 112.528 112.771 -0.243 18522
11369 1 20 . 1 1 83 83 GLY C C 95 173.468 173.468 173.118 0.350 18522
11370 1 20 . 1 1 83 83 GLY CA C 95 46.243 46.243 45.062 1.181 18522
11371 1 20 . 1 1 83 83 GLY H H 95 8.673 8.673 8.850 -0.177 18522
11372 1 20 . 1 1 84 84 GLU N N 96 121.485 121.485 120.864 0.621 18522
11373 1 20 . 1 1 84 84 GLU HA H 96 4.749 4.749 5.034 -0.285 18522
11374 1 20 . 1 1 84 84 GLU C C 96 174.583 174.583 174.428 0.155 18522
11375 1 20 . 1 1 84 84 GLU CA C 96 55.821 55.821 54.772 1.049 18522
11376 1 20 . 1 1 84 84 GLU CB C 96 31.410 31.410 33.879 -2.469 18522
11377 1 20 . 1 1 84 84 GLU H H 96 8.297 8.297 7.496 0.801 18522
11378 1 20 . 1 1 85 85 VAL N N 97 120.501 120.501 111.591 8.910 18522
11379 1 20 . 1 1 85 85 VAL HA H 97 4.665 4.665 4.737 -0.072 18522
11380 1 20 . 1 1 85 85 VAL C C 97 173.047 173.047 173.919 -0.872 18522
11381 1 20 . 1 1 85 85 VAL CA C 97 60.114 60.114 59.822 0.292 18522
11382 1 20 . 1 1 85 85 VAL CB C 97 35.184 35.184 35.130 0.054 18522
11383 1 20 . 1 1 85 85 VAL H H 97 9.096 9.096 8.622 0.474 18522
11384 1 20 . 1 1 86 86 THR N N 98 125.019 125.019 115.140 9.879 18522
11385 1 20 . 1 1 86 86 THR HA H 98 4.076 4.076 5.123 -1.047 18522
11386 1 20 . 1 1 86 86 THR C C 98 173.807 173.807 174.494 -0.687 18522
11387 1 20 . 1 1 86 86 THR CA C 98 61.735 61.735 60.229 1.506 18522
11388 1 20 . 1 1 86 86 THR CB C 98 69.531 69.531 69.801 -0.270 18522
11389 1 20 . 1 1 86 86 THR H H 98 9.352 9.352 8.051 1.301 18522
11390 1 20 . 1 1 87 87 ILE N N 99 128.383 128.383 122.541 5.842 18522
11391 1 20 . 1 1 87 87 ILE HA H 99 4.661 4.661 4.497 0.164 18522
11392 1 20 . 1 1 87 87 ILE C C 99 174.614 174.614 174.722 -0.108 18522
11393 1 20 . 1 1 87 87 ILE CA C 99 58.258 58.258 59.301 -1.043 18522
11394 1 20 . 1 1 87 87 ILE CB C 99 38.528 38.528 37.589 0.939 18522
11395 1 20 . 1 1 87 87 ILE H H 99 9.329 9.329 8.370 0.959 18522
11396 1 20 . 1 1 88 88 HIS N N 100 128.279 128.279 127.970 0.309 18522
11397 1 20 . 1 1 88 88 HIS HA H 100 4.948 4.948 5.187 -0.239 18522
11398 1 20 . 1 1 88 88 HIS C C 100 174.787 174.787 175.304 -0.517 18522
11399 1 20 . 1 1 88 88 HIS CA C 100 54.620 54.620 55.400 -0.780 18522
11400 1 20 . 1 1 88 88 HIS H H 100 8.647 8.647 8.301 0.346 18522
11401 1 20 . 1 1 89 89 TYR N N 101 121.320 121.320 122.817 -1.497 18522
11402 1 20 . 1 1 89 89 TYR HA H 101 5.947 5.947 4.952 0.995 18522
11403 1 20 . 1 1 89 89 TYR C C 101 173.769 173.769 173.252 0.517 18522
11404 1 20 . 1 1 89 89 TYR CA C 101 55.669 55.669 55.454 0.215 18522
11405 1 20 . 1 1 89 89 TYR CB C 101 42.195 42.195 40.699 1.496 18522
11406 1 20 . 1 1 89 89 TYR H H 101 8.414 8.414 8.732 -0.318 18522
11407 1 20 . 1 1 90 90 ASN N N 102 116.679 116.679 116.303 0.376 18522
11408 1 20 . 1 1 90 90 ASN HA H 102 5.335 5.335 5.833 -0.498 18522
11409 1 20 . 1 1 90 90 ASN C C 102 175.406 175.406 174.242 1.164 18522
11410 1 20 . 1 1 90 90 ASN CA C 102 51.961 51.961 52.610 -0.649 18522
11411 1 20 . 1 1 90 90 ASN CB C 102 41.800 41.800 42.673 -0.873 18522
11412 1 20 . 1 1 90 90 ASN H H 102 9.282 9.282 8.779 0.503 18522
11413 1 20 . 1 1 91 91 LYS N N 103 124.129 124.129 121.462 2.667 18522
11414 1 20 . 1 1 91 91 LYS C C 103 176.678 176.678 175.552 1.126 18522
11415 1 20 . 1 1 91 91 LYS CA C 103 55.006 55.006 54.964 0.042 18522
11416 1 20 . 1 1 91 91 LYS H H 103 8.949 8.949 8.176 0.773 18522
11417 1 20 . 1 1 92 92 LEU N N 104 127.043 127.043 120.690 6.353 18522
11418 1 20 . 1 1 92 92 LEU HA H 104 4.425 4.425 4.676 -0.251 18522
11419 1 20 . 1 1 92 92 LEU CA C 104 55.060 55.060 54.922 0.138 18522
11420 1 20 . 1 1 92 92 LEU CB C 104 42.559 42.559 44.042 -1.483 18522
11421 1 20 . 1 1 92 92 LEU H H 104 9.150 9.150 8.213 0.937 18522
11422 1 20 . 1 1 93 93 GLN HA H 105 4.315 4.315 4.613 -0.298 18522
11423 1 20 . 1 1 93 93 GLN C C 105 175.070 175.070 174.897 0.173 18522
11424 1 20 . 1 1 93 93 GLN CA C 105 55.490 55.490 55.131 0.359 18522
11425 1 20 . 1 1 93 93 GLN CB C 105 28.909 28.909 29.634 -0.725 18522
11426 1 20 . 1 1 94 94 ALA N N 106 125.133 125.133 127.255 -2.122 18522
11427 1 20 . 1 1 94 94 ALA HA H 106 4.366 4.366 4.551 -0.185 18522
11428 1 20 . 1 1 94 94 ALA C C 106 176.392 176.392 176.227 0.165 18522
11429 1 20 . 1 1 94 94 ALA CA C 106 51.723 51.723 51.696 0.027 18522
11430 1 20 . 1 1 94 94 ALA CB C 106 20.185 20.185 19.849 0.336 18522
11431 1 20 . 1 1 94 94 ALA H H 106 8.226 8.226 8.346 -0.120 18522
11432 1 20 . 1 1 95 95 ASP N N 107 122.013 122.013 118.202 3.811 18522
11433 1 20 . 1 1 95 95 ASP HA H 107 4.413 4.413 4.812 -0.399 18522
11434 1 20 . 1 1 95 95 ASP C C 107 175.019 175.019 174.791 0.228 18522
11435 1 20 . 1 1 95 95 ASP CA C 107 55.642 55.642 52.436 3.206 18522
11436 1 20 . 1 1 95 95 ASP CB C 107 41.266 41.266 42.903 -1.637 18522
11437 1 20 . 1 1 95 95 ASP H H 107 8.429 8.429 8.305 0.124 18522
11438 1 20 . 1 1 96 96 PRO HA H 108 4.207 4.207 4.057 0.150 18522
11439 1 20 . 1 1 96 96 PRO C C 108 178.840 178.840 178.382 0.458 18522
11440 1 20 . 1 1 96 96 PRO CA C 108 65.396 65.396 66.318 -0.922 18522
11441 1 20 . 1 1 96 96 PRO CB C 108 32.181 32.181 31.572 0.609 18522
11442 1 20 . 1 1 97 97 LYS N N 109 117.942 117.942 115.968 1.974 18522
11443 1 20 . 1 1 97 97 LYS HA H 109 4.143 4.143 3.999 0.144 18522
11444 1 20 . 1 1 97 97 LYS C C 109 178.099 178.099 179.010 -0.911 18522
11445 1 20 . 1 1 97 97 LYS CA C 109 58.167 58.167 59.333 -1.166 18522
11446 1 20 . 1 1 97 97 LYS CB C 109 31.649 31.649 31.517 0.133 18522
11447 1 20 . 1 1 97 97 LYS H H 109 8.335 8.335 8.499 -0.164 18522
11448 1 20 . 1 1 98 98 GLN N N 110 119.159 119.159 117.467 1.692 18522
11449 1 20 . 1 1 98 98 GLN HA H 110 4.130 4.130 4.282 -0.152 18522
11450 1 20 . 1 1 98 98 GLN C C 110 178.298 178.298 177.990 0.308 18522
11451 1 20 . 1 1 98 98 GLN CA C 110 57.660 57.660 56.880 0.780 18522
11452 1 20 . 1 1 98 98 GLN CB C 110 28.720 28.720 28.400 0.320 18522
11453 1 20 . 1 1 98 98 GLN H H 110 7.985 7.985 8.013 -0.028 18522
11454 1 20 . 1 1 99 99 LEU N N 111 120.490 120.490 121.402 -0.912 18522
11455 1 20 . 1 1 99 99 LEU HA H 111 3.877 3.877 4.433 -0.556 18522
11456 1 20 . 1 1 99 99 LEU C C 111 177.729 177.729 177.971 -0.242 18522
11457 1 20 . 1 1 99 99 LEU CA C 111 57.049 57.049 57.258 -0.209 18522
11458 1 20 . 1 1 99 99 LEU CB C 111 41.466 41.466 42.197 -0.731 18522
11459 1 20 . 1 1 99 99 LEU H H 111 7.994 7.994 8.237 -0.243 18522
11460 1 20 . 1 1 100 100 GLU N N 112 118.251 118.251 119.527 -1.276 18522
11461 1 20 . 1 1 100 100 GLU HA H 112 3.972 3.972 4.171 -0.199 18522
11462 1 20 . 1 1 100 100 GLU C C 112 178.402 178.402 179.072 -0.670 18522
11463 1 20 . 1 1 100 100 GLU CA C 112 59.056 59.056 59.323 -0.267 18522
11464 1 20 . 1 1 100 100 GLU CB C 112 29.732 29.732 29.151 0.581 18522
11465 1 20 . 1 1 100 100 GLU H H 112 7.760 7.760 8.650 -0.890 18522
11466 1 20 . 1 1 101 101 VAL N N 113 117.229 117.229 120.303 -3.074 18522
11467 1 20 . 1 1 101 101 VAL HA H 113 3.762 3.762 3.888 -0.126 18522
11468 1 20 . 1 1 101 101 VAL C C 113 178.107 178.107 177.233 0.874 18522
11469 1 20 . 1 1 101 101 VAL CA C 113 64.791 64.791 65.215 -0.424 18522
11470 1 20 . 1 1 101 101 VAL CB C 113 32.149 32.149 31.650 0.499 18522
11471 1 20 . 1 1 101 101 VAL H H 113 7.437 7.437 7.639 -0.202 18522
11472 1 20 . 1 1 102 102 LEU N N 114 122.124 122.124 119.464 2.660 18522
11473 1 20 . 1 1 102 102 LEU HA H 114 4.033 4.033 4.132 -0.099 18522
11474 1 20 . 1 1 102 102 LEU C C 114 178.506 178.506 177.802 0.704 18522
11475 1 20 . 1 1 102 102 LEU CA C 114 57.243 57.243 56.972 0.271 18522
11476 1 20 . 1 1 102 102 LEU CB C 114 42.028 42.028 42.301 -0.273 18522
11477 1 20 . 1 1 102 102 LEU H H 114 7.765 7.765 7.290 0.475 18522
11478 1 20 . 1 1 103 103 PHE N N 115 115.346 115.346 117.957 -2.611 18522
11479 1 20 . 1 1 103 103 PHE HA H 115 4.224 4.224 4.395 -0.171 18522
11480 1 20 . 1 1 103 103 PHE C C 115 175.621 175.621 176.276 -0.655 18522
11481 1 20 . 1 1 103 103 PHE CA C 115 57.537 57.537 59.203 -1.667 18522
11482 1 20 . 1 1 103 103 PHE CB C 115 38.057 38.057 40.797 -2.740 18522
11483 1 20 . 1 1 103 103 PHE H H 115 7.805 7.805 7.599 0.206 18522
11484 1 20 . 1 1 104 104 GLN N N 116 119.021 119.021 119.193 -0.172 18522
11485 1 20 . 1 1 104 104 GLN HA H 116 4.407 4.407 4.119 0.288 18522
11486 1 20 . 1 1 104 104 GLN C C 116 176.402 176.402 174.280 2.122 18522
11487 1 20 . 1 1 104 104 GLN CA C 116 55.521 55.521 56.697 -1.175 18522
11488 1 20 . 1 1 104 104 GLN CB C 116 29.170 29.170 27.480 1.690 18522
11489 1 20 . 1 1 104 104 GLN H H 116 7.974 7.974 8.615 -0.641 18522
11490 1 20 . 1 1 105 105 GLY N N 117 108.868 108.868 111.256 -2.388 18522
11491 1 20 . 1 1 105 105 GLY CA C 117 45.124 45.124 45.206 -0.082 18522
11492 1 20 . 1 1 105 105 GLY H H 117 8.195 8.195 8.587 -0.392 18522
11493 1 20 . 1 1 106 106 PRO HA H 118 4.490 4.490 4.448 0.042 18522
11494 1 20 . 1 1 106 106 PRO C C 118 176.001 176.001 176.709 -0.708 18522
11495 1 20 . 1 1 106 106 PRO CA C 118 63.523 63.523 63.639 -0.116 18522
11496 1 20 . 1 1 106 106 PRO CB C 118 32.078 32.078 32.176 -0.098 18522
11497 1 20 . 1 1 107 107 GLN N N 119 126.950 126.950 115.938 11.012 18522
11498 1 20 . 1 1 107 107 GLN C C 119 181.211 181.211 174.702 6.509 18522
11499 1 20 . 1 1 107 107 GLN CA C 119 57.416 57.416 57.142 0.275 18522
11500 1 20 . 1 1 107 107 GLN H H 119 8.079 8.079 8.746 -0.667 18522
11501 1 20 . 1 1 111 111 ARG C C 123 174.608 174.608 174.330 0.278 18522
11502 1 20 . 1 1 111 111 ARG CA C 123 55.099 55.099 53.679 1.419 18522
11503 1 20 . 1 1 112 112 HIS N N 124 122.212 122.212 120.874 1.338 18522
11504 1 20 . 1 1 112 112 HIS HA H 124 4.718 4.718 4.181 0.537 18522
11505 1 20 . 1 1 112 112 HIS C C 124 176.040 176.040 174.926 1.114 18522
11506 1 20 . 1 1 112 112 HIS CA C 124 54.213 54.213 56.414 -2.201 18522
11507 1 20 . 1 1 112 112 HIS CB C 124 31.164 31.164 30.045 1.119 18522
11508 1 20 . 1 1 112 112 HIS H H 124 7.640 7.640 8.427 -0.787 18522
11509 1 20 . 1 1 113 113 TRP C C 125 176.168 176.168 175.607 0.561 18522
11510 1 20 . 1 1 114 114 LEU N N 126 121.893 121.893 120.293 1.600 18522
11511 1 20 . 1 1 114 114 LEU HA H 126 4.869 4.869 4.728 0.141 18522
11512 1 20 . 1 1 114 114 LEU CA C 126 54.151 54.151 53.672 0.479 18522
11513 1 20 . 1 1 114 114 LEU CB C 126 45.144 45.144 44.118 1.026 18522
11514 1 20 . 1 1 114 114 LEU H H 126 8.606 8.606 9.091 -0.485 18522
11515 1 20 . 1 1 115 115 LYS N N 127 125.850 125.850 121.774 4.076 18522
11516 1 20 . 1 1 115 115 LYS HA H 127 4.203 4.203 4.810 -0.607 18522
11517 1 20 . 1 1 115 115 LYS C C 127 175.564 175.564 174.312 1.252 18522
11518 1 20 . 1 1 115 115 LYS CA C 127 57.252 57.252 55.405 1.847 18522
11519 1 20 . 1 1 115 115 LYS CB C 127 33.406 33.406 34.920 -1.514 18522
11520 1 20 . 1 1 115 115 LYS H H 127 8.647 8.647 8.204 0.443 18522
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 97 3.393 -0.315 3.396 18522
2 1 1 "Average Difference" HA 109 0.407 0.016 0.408 18522
3 1 1 "Average Difference" C 99 1.172 -0.224 1.156 18522
4 1 1 "Average Difference" CA 107 1.360 -0.087 1.364 18522
5 1 1 "Average Difference" CB 91 1.508 -0.260 1.494 18522
6 1 1 "Average Difference" HN 97 0.610 -0.224 0.571 18522
7 1 2 "Average Difference" N 97 3.653 -0.637 3.615 18522
8 1 2 "Average Difference" HA 109 0.378 -0.002 0.379 18522
9 1 2 "Average Difference" C 99 1.241 -0.212 1.229 18522
10 1 2 "Average Difference" CA 107 1.319 -0.123 1.319 18522
11 1 2 "Average Difference" CB 91 1.413 -0.320 1.384 18522
12 1 2 "Average Difference" HN 97 0.710 -0.304 0.645 18522
13 1 3 "Average Difference" N 97 3.717 -0.897 3.626 18522
14 1 3 "Average Difference" HA 109 0.463 -0.035 0.464 18522
15 1 3 "Average Difference" C 99 1.309 -0.169 1.304 18522
16 1 3 "Average Difference" CA 107 1.337 -0.103 1.340 18522
17 1 3 "Average Difference" CB 91 1.459 -0.295 1.437 18522
18 1 3 "Average Difference" HN 97 0.660 -0.253 0.613 18522
19 1 4 "Average Difference" N 97 3.720 -0.878 3.634 18522
20 1 4 "Average Difference" HA 109 0.414 -0.014 0.416 18522
21 1 4 "Average Difference" C 99 1.258 -0.218 1.245 18522
22 1 4 "Average Difference" CA 107 1.342 -0.091 1.345 18522
23 1 4 "Average Difference" CB 91 1.532 -0.259 1.518 18522
24 1 4 "Average Difference" HN 97 0.667 -0.253 0.621 18522
25 1 5 "Average Difference" N 97 3.737 -0.670 3.695 18522
26 1 5 "Average Difference" HA 109 0.423 0.025 0.424 18522
27 1 5 "Average Difference" C 99 1.187 -0.210 1.174 18522
28 1 5 "Average Difference" CA 107 1.359 -0.077 1.363 18522
29 1 5 "Average Difference" CB 91 1.387 -0.179 1.383 18522
30 1 5 "Average Difference" HN 97 0.695 -0.253 0.651 18522
31 1 6 "Average Difference" N 97 3.871 -0.643 3.837 18522
32 1 6 "Average Difference" HA 109 0.383 0.039 0.383 18522
33 1 6 "Average Difference" C 99 1.198 -0.271 1.173 18522
34 1 6 "Average Difference" CA 107 1.132 -0.182 1.123 18522
35 1 6 "Average Difference" CB 91 1.194 -0.132 1.193 18522
36 1 6 "Average Difference" HN 97 0.655 -0.256 0.606 18522
37 1 7 "Average Difference" N 97 3.601 -0.774 3.535 18522
38 1 7 "Average Difference" HA 109 0.386 0.006 0.388 18522
39 1 7 "Average Difference" C 99 1.157 -0.222 1.141 18522
40 1 7 "Average Difference" CA 107 1.306 -0.189 1.298 18522
41 1 7 "Average Difference" CB 91 1.531 -0.217 1.524 18522
42 1 7 "Average Difference" HN 97 0.668 -0.297 0.602 18522
43 1 8 "Average Difference" N 97 3.969 -0.693 3.928 18522
44 1 8 "Average Difference" HA 109 0.342 0.063 0.337 18522
45 1 8 "Average Difference" C 99 1.195 -0.211 1.183 18522
46 1 8 "Average Difference" CA 107 1.150 -0.132 1.148 18522
47 1 8 "Average Difference" CB 91 1.201 -0.167 1.196 18522
48 1 8 "Average Difference" HN 97 0.686 -0.251 0.642 18522
49 1 9 "Average Difference" N 97 4.062 -0.776 4.008 18522
50 1 9 "Average Difference" HA 109 0.411 -0.032 0.411 18522
51 1 9 "Average Difference" C 99 1.153 -0.187 1.143 18522
52 1 9 "Average Difference" CA 107 1.398 0.023 1.404 18522
53 1 9 "Average Difference" CB 91 1.445 -0.344 1.411 18522
54 1 9 "Average Difference" HN 97 0.707 -0.278 0.654 18522
55 1 10 "Average Difference" N 97 4.021 -0.873 3.946 18522
56 1 10 "Average Difference" HA 109 0.424 0.005 0.426 18522
57 1 10 "Average Difference" C 99 1.186 -0.194 1.176 18522
58 1 10 "Average Difference" CA 107 1.314 0.003 1.320 18522
59 1 10 "Average Difference" CB 91 1.523 -0.319 1.497 18522
60 1 10 "Average Difference" HN 97 0.741 -0.250 0.701 18522
61 1 11 "Average Difference" N 97 3.866 -0.621 3.835 18522
62 1 11 "Average Difference" HA 109 0.390 0.012 0.391 18522
63 1 11 "Average Difference" C 99 1.106 -0.054 1.110 18522
64 1 11 "Average Difference" CA 107 1.265 -0.054 1.270 18522
65 1 11 "Average Difference" CB 91 1.428 -0.271 1.410 18522
66 1 11 "Average Difference" HN 97 0.685 -0.256 0.638 18522
67 1 12 "Average Difference" N 97 4.099 -0.929 4.014 18522
68 1 12 "Average Difference" HA 109 0.410 -0.028 0.411 18522
69 1 12 "Average Difference" C 99 1.252 -0.107 1.254 18522
70 1 12 "Average Difference" CA 107 1.402 -0.005 1.409 18522
71 1 12 "Average Difference" CB 91 1.444 -0.237 1.432 18522
72 1 12 "Average Difference" HN 97 0.706 -0.312 0.636 18522
73 1 13 "Average Difference" N 97 3.570 -0.896 3.473 18522
74 1 13 "Average Difference" HA 109 0.373 0.041 0.372 18522
75 1 13 "Average Difference" C 99 1.077 -0.244 1.055 18522
76 1 13 "Average Difference" CA 107 1.114 -0.158 1.108 18522
77 1 13 "Average Difference" CB 91 1.421 -0.329 1.390 18522
78 1 13 "Average Difference" HN 97 0.702 -0.307 0.634 18522
79 1 14 "Average Difference" N 97 3.681 -0.661 3.640 18522
80 1 14 "Average Difference" HA 109 0.382 0.013 0.384 18522
81 1 14 "Average Difference" C 99 1.235 -0.259 1.213 18522
82 1 14 "Average Difference" CA 107 1.285 -0.089 1.288 18522
83 1 14 "Average Difference" CB 91 1.406 -0.226 1.395 18522
84 1 14 "Average Difference" HN 97 0.650 -0.220 0.615 18522
85 1 15 "Average Difference" N 97 4.058 -1.021 3.948 18522
86 1 15 "Average Difference" HA 109 0.452 0.038 0.453 18522
87 1 15 "Average Difference" C 99 1.283 -0.200 1.274 18522
88 1 15 "Average Difference" CA 107 1.428 -0.100 1.431 18522
89 1 15 "Average Difference" CB 91 1.403 -0.295 1.379 18522
90 1 15 "Average Difference" HN 97 0.728 -0.246 0.688 18522
91 1 16 "Average Difference" N 97 3.479 -0.752 3.415 18522
92 1 16 "Average Difference" HA 109 0.432 0.060 0.429 18522
93 1 16 "Average Difference" C 99 1.195 -0.243 1.176 18522
94 1 16 "Average Difference" CA 107 1.246 -0.078 1.249 18522
95 1 16 "Average Difference" CB 91 1.363 -0.236 1.350 18522
96 1 16 "Average Difference" HN 97 0.625 -0.216 0.589 18522
97 1 17 "Average Difference" N 97 4.040 -1.023 3.929 18522
98 1 17 "Average Difference" HA 109 0.376 0.029 0.377 18522
99 1 17 "Average Difference" C 99 1.040 -0.158 1.034 18522
100 1 17 "Average Difference" CA 107 1.287 -0.125 1.287 18522
101 1 17 "Average Difference" CB 91 1.367 -0.233 1.355 18522
102 1 17 "Average Difference" HN 97 0.728 -0.275 0.678 18522
103 1 18 "Average Difference" N 97 3.707 -0.313 3.713 18522
104 1 18 "Average Difference" HA 109 0.403 -0.046 0.402 18522
105 1 18 "Average Difference" C 99 1.218 -0.183 1.210 18522
106 1 18 "Average Difference" CA 107 1.324 -0.028 1.330 18522
107 1 18 "Average Difference" CB 91 1.528 -0.377 1.489 18522
108 1 18 "Average Difference" HN 97 0.669 -0.261 0.619 18522
109 1 19 "Average Difference" N 97 3.789 -0.750 3.734 18522
110 1 19 "Average Difference" HA 109 0.405 0.037 0.406 18522
111 1 19 "Average Difference" C 99 1.089 -0.259 1.063 18522
112 1 19 "Average Difference" CA 107 1.120 -0.161 1.113 18522
113 1 19 "Average Difference" CB 91 1.081 -0.120 1.080 18522
114 1 19 "Average Difference" HN 97 0.700 -0.293 0.639 18522
115 1 20 "Average Difference" N 97 3.630 -0.946 3.522 18522
116 1 20 "Average Difference" HA 109 0.365 0.036 0.365 18522
117 1 20 "Average Difference" C 99 1.240 -0.253 1.220 18522
118 1 20 "Average Difference" CA 107 1.154 -0.162 1.148 18522
119 1 20 "Average Difference" CB 91 1.283 -0.107 1.286 18522
120 1 20 "Average Difference" HN 97 0.727 -0.275 0.676 18522
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 18522
_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 3 3 PRO C C 15 177.225 177.225 177.037 0.188 18522
2 1 . 1 1 3 3 PRO CA C 15 63.508 63.508 62.893 0.615 18522
3 1 . 1 1 3 3 PRO CB C 15 32.090 32.090 31.534 0.556 18522
4 1 . 1 1 4 4 GLY N N 16 108.829 108.829 109.757 -0.928 18522
5 1 . 1 1 4 4 GLY C C 16 173.398 173.398 174.218 -0.820 18522
6 1 . 1 1 4 4 GLY CA C 16 45.128 45.128 44.955 0.173 18522
7 1 . 1 1 4 4 GLY H H 16 8.489 8.489 8.171 0.318 18522
8 1 . 1 1 5 5 ILE N N 17 121.763 121.763 119.583 2.180 18522
9 1 . 1 1 5 5 ILE HA H 17 4.554 4.554 4.628 -0.074 18522
10 1 . 1 1 5 5 ILE C C 17 174.332 174.332 174.778 -0.446 18522
11 1 . 1 1 5 5 ILE CA C 17 58.245 58.245 58.300 -0.055 18522
12 1 . 1 1 5 5 ILE CB C 17 38.762 38.762 38.273 0.489 18522
13 1 . 1 1 5 5 ILE H H 17 8.014 8.014 7.801 0.213 18522
14 1 . 1 1 6 6 PRO C C 18 176.437 176.437 176.334 0.103 18522
15 1 . 1 1 6 6 PRO CA C 18 62.667 62.667 63.996 -1.329 18522
16 1 . 1 1 6 6 PRO CB C 18 32.469 32.469 32.025 0.444 18522
17 1 . 1 1 7 7 VAL N N 19 123.849 123.849 117.525 6.324 18522
18 1 . 1 1 7 7 VAL HA H 19 4.550 4.550 4.391 0.159 18522
19 1 . 1 1 7 7 VAL C C 19 174.453 174.453 173.832 0.621 18522
20 1 . 1 1 7 7 VAL CA C 19 59.846 59.846 59.392 0.454 18522
21 1 . 1 1 7 7 VAL CB C 19 33.510 33.510 32.095 1.415 18522
22 1 . 1 1 7 7 VAL H H 19 8.754 8.754 7.909 0.845 18522
23 1 . 1 1 8 8 PRO HA H 20 5.338 5.338 4.818 0.520 18522
24 1 . 1 1 8 8 PRO C C 20 177.585 177.585 176.601 0.984 18522
25 1 . 1 1 8 8 PRO CA C 20 62.406 62.406 62.190 0.216 18522
26 1 . 1 1 8 8 PRO CB C 20 32.891 32.891 32.134 0.757 18522
27 1 . 1 1 9 9 GLY N N 21 108.426 108.426 111.104 -2.678 18522
28 1 . 1 1 9 9 GLY C C 21 171.443 171.443 171.894 -0.451 18522
29 1 . 1 1 9 9 GLY CA C 21 44.581 44.581 44.482 0.099 18522
30 1 . 1 1 9 9 GLY H H 21 8.258 8.258 8.315 -0.057 18522
31 1 . 1 1 10 10 LYS N N 22 117.372 117.372 120.924 -3.552 18522
32 1 . 1 1 10 10 LYS HA H 22 4.039 4.039 4.972 -0.933 18522
33 1 . 1 1 10 10 LYS C C 22 174.463 174.463 174.720 -0.257 18522
34 1 . 1 1 10 10 LYS CA C 22 55.263 55.263 55.237 0.026 18522
35 1 . 1 1 10 10 LYS CB C 22 35.227 35.227 34.748 0.479 18522
36 1 . 1 1 10 10 LYS H H 22 8.175 8.175 8.019 0.156 18522
37 1 . 1 1 11 11 VAL N N 23 120.387 120.387 118.495 1.892 18522
38 1 . 1 1 11 11 VAL HA H 23 4.708 4.708 4.557 0.151 18522
39 1 . 1 1 11 11 VAL C C 23 171.873 171.873 174.078 -2.205 18522
40 1 . 1 1 11 11 VAL CA C 23 59.866 59.866 60.083 -0.217 18522
41 1 . 1 1 11 11 VAL CB C 23 35.269 35.269 35.436 -0.167 18522
42 1 . 1 1 11 11 VAL H H 23 8.862 8.862 8.262 0.600 18522
43 1 . 1 1 12 12 THR N N 24 125.797 125.797 119.799 5.998 18522
44 1 . 1 1 12 12 THR HA H 24 5.121 5.121 4.888 0.233 18522
45 1 . 1 1 12 12 THR C C 24 173.407 173.407 173.527 -0.120 18522
46 1 . 1 1 12 12 THR CA C 24 62.115 62.115 60.482 1.633 18522
47 1 . 1 1 12 12 THR CB C 24 69.606 69.606 69.299 0.307 18522
48 1 . 1 1 12 12 THR H H 24 8.859 8.859 8.314 0.545 18522
49 1 . 1 1 13 13 LEU N N 25 127.960 127.960 127.121 0.839 18522
50 1 . 1 1 13 13 LEU HA H 25 4.809 4.809 4.854 -0.045 18522
51 1 . 1 1 13 13 LEU C C 25 175.029 175.029 175.244 -0.215 18522
52 1 . 1 1 13 13 LEU CA C 25 52.623 52.623 52.633 -0.010 18522
53 1 . 1 1 13 13 LEU CB C 25 46.242 46.242 45.134 1.108 18522
54 1 . 1 1 13 13 LEU H H 25 9.258 9.258 8.236 1.022 18522
55 1 . 1 1 14 14 GLN N N 26 120.858 120.858 117.272 3.586 18522
56 1 . 1 1 14 14 GLN HA H 26 4.482 4.482 4.568 -0.086 18522
57 1 . 1 1 14 14 GLN C C 26 174.515 174.515 175.147 -0.632 18522
58 1 . 1 1 14 14 GLN CA C 26 54.576 54.576 54.215 0.361 18522
59 1 . 1 1 14 14 GLN CB C 26 29.516 29.516 31.860 -2.344 18522
60 1 . 1 1 14 14 GLN H H 26 8.530 8.530 8.299 0.231 18522
61 1 . 1 1 15 15 LYS N N 27 119.583 119.583 122.306 -2.723 18522
62 1 . 1 1 15 15 LYS HA H 27 4.180 4.180 4.262 -0.082 18522
63 1 . 1 1 15 15 LYS C C 27 177.468 177.468 176.952 0.516 18522
64 1 . 1 1 15 15 LYS CA C 27 55.956 55.956 56.883 -0.928 18522
65 1 . 1 1 15 15 LYS CB C 27 34.099 34.099 32.454 1.645 18522
66 1 . 1 1 15 15 LYS H H 27 8.099 8.099 8.201 -0.102 18522
67 1 . 1 1 16 16 ASP N N 28 121.439 121.439 122.134 -0.695 18522
68 1 . 1 1 16 16 ASP HA H 28 4.590 4.590 4.637 -0.047 18522
69 1 . 1 1 16 16 ASP C C 28 178.392 178.392 177.863 0.529 18522
70 1 . 1 1 16 16 ASP CA C 28 52.426 52.426 53.648 -1.222 18522
71 1 . 1 1 16 16 ASP CB C 28 41.377 41.377 42.461 -1.084 18522
72 1 . 1 1 16 16 ASP H H 28 8.888 8.888 8.603 0.285 18522
73 1 . 1 1 17 17 ALA N N 29 119.578 119.578 123.169 -3.591 18522
74 1 . 1 1 17 17 ALA HA H 29 4.188 4.188 4.105 0.083 18522
75 1 . 1 1 17 17 ALA C C 29 178.763 178.763 178.323 0.440 18522
76 1 . 1 1 17 17 ALA CA C 29 54.434 54.434 54.516 -0.082 18522
77 1 . 1 1 17 17 ALA CB C 29 18.293 18.293 18.686 -0.393 18522
78 1 . 1 1 17 17 ALA H H 29 8.392 8.392 8.639 -0.246 18522
79 1 . 1 1 18 18 GLN N N 30 117.564 117.564 117.238 0.326 18522
80 1 . 1 1 18 18 GLN HA H 30 4.399 4.399 4.333 0.066 18522
81 1 . 1 1 18 18 GLN C C 30 175.168 175.168 175.491 -0.323 18522
82 1 . 1 1 18 18 GLN CA C 30 55.339 55.339 55.083 0.256 18522
83 1 . 1 1 18 18 GLN CB C 30 28.589 28.589 29.166 -0.577 18522
84 1 . 1 1 18 18 GLN H H 30 8.353 8.353 7.975 0.378 18522
85 1 . 1 1 19 19 ASN N N 31 115.365 115.365 115.823 -0.458 18522
86 1 . 1 1 19 19 ASN HA H 31 4.315 4.315 4.392 -0.077 18522
87 1 . 1 1 19 19 ASN C C 31 174.043 174.043 173.082 0.961 18522
88 1 . 1 1 19 19 ASN CA C 31 54.303 54.303 54.489 -0.186 18522
89 1 . 1 1 19 19 ASN CB C 31 37.610 37.610 37.631 -0.021 18522
90 1 . 1 1 19 19 ASN H H 31 8.521 8.521 8.209 0.312 18522
91 1 . 1 1 20 20 LEU N N 32 118.660 118.660 111.861 6.799 18522
92 1 . 1 1 20 20 LEU HA H 32 4.900 4.900 4.891 0.009 18522
93 1 . 1 1 20 20 LEU C C 32 178.117 178.117 176.610 1.507 18522
94 1 . 1 1 20 20 LEU CA C 32 53.957 53.957 53.353 0.604 18522
95 1 . 1 1 20 20 LEU CB C 32 44.774 44.774 43.669 1.105 18522
96 1 . 1 1 20 20 LEU H H 32 8.155 8.155 7.508 0.647 18522
97 1 . 1 1 21 21 ILE N N 33 116.785 116.785 115.950 0.835 18522
98 1 . 1 1 21 21 ILE HA H 33 4.674 4.674 4.470 0.204 18522
99 1 . 1 1 21 21 ILE C C 33 176.185 176.185 176.580 -0.395 18522
100 1 . 1 1 21 21 ILE CA C 33 62.602 62.602 61.404 1.198 18522
101 1 . 1 1 21 21 ILE CB C 33 39.016 39.016 39.201 -0.185 18522
102 1 . 1 1 21 21 ILE H H 33 11.488 11.488 8.309 3.179 18522
103 1 . 1 1 22 22 GLY N N 34 111.234 111.234 108.343 2.891 18522
104 1 . 1 1 22 22 GLY C C 34 173.993 173.993 173.654 0.339 18522
105 1 . 1 1 22 22 GLY CA C 34 45.980 45.980 45.156 0.824 18522
106 1 . 1 1 22 22 GLY H H 34 9.854 9.854 8.460 1.394 18522
107 1 . 1 1 23 23 ILE N N 35 111.117 111.117 113.866 -2.749 18522
108 1 . 1 1 23 23 ILE HA H 35 5.535 5.535 5.326 0.209 18522
109 1 . 1 1 23 23 ILE C C 35 175.033 175.033 174.124 0.909 18522
110 1 . 1 1 23 23 ILE CA C 35 58.415 58.415 57.909 0.506 18522
111 1 . 1 1 23 23 ILE CB C 35 41.577 41.577 41.728 -0.151 18522
112 1 . 1 1 23 23 ILE H H 35 7.835 7.835 7.479 0.356 18522
113 1 . 1 1 24 24 SER N N 36 114.908 114.908 115.745 -0.837 18522
114 1 . 1 1 24 24 SER HA H 36 4.232 4.232 5.077 -0.845 18522
115 1 . 1 1 24 24 SER C C 36 174.735 174.735 172.904 1.831 18522
116 1 . 1 1 24 24 SER CA C 36 56.121 56.121 57.326 -1.205 18522
117 1 . 1 1 24 24 SER CB C 36 66.097 66.097 65.621 0.476 18522
118 1 . 1 1 24 24 SER H H 36 8.623 8.623 8.385 0.238 18522
119 1 . 1 1 25 25 ILE N N 37 117.739 117.739 124.818 -7.079 18522
120 1 . 1 1 25 25 ILE C C 37 174.340 174.340 175.280 -0.940 18522
121 1 . 1 1 25 25 ILE CA C 37 59.123 59.123 59.317 -0.194 18522
122 1 . 1 1 25 25 ILE CB C 37 41.637 41.637 40.579 1.058 18522
123 1 . 1 1 25 25 ILE H H 37 9.130 9.130 8.627 0.503 18522
124 1 . 1 1 26 26 GLY N N 38 108.069 108.069 112.836 -4.767 18522
125 1 . 1 1 26 26 GLY CA C 38 44.112 44.112 44.562 -0.450 18522
126 1 . 1 1 26 26 GLY H H 38 8.841 8.841 8.593 0.248 18522
127 1 . 1 1 27 27 GLY N N 39 109.016 109.016 108.254 0.762 18522
128 1 . 1 1 27 27 GLY C C 39 173.956 173.956 174.504 -0.548 18522
129 1 . 1 1 27 27 GLY H H 39 8.187 8.187 8.358 -0.171 18522
130 1 . 1 1 28 28 GLY N N 40 111.783 111.783 109.837 1.946 18522
131 1 . 1 1 28 28 GLY C C 40 174.255 174.255 173.637 0.618 18522
132 1 . 1 1 28 28 GLY CA C 40 47.098 47.098 45.233 1.865 18522
133 1 . 1 1 28 28 GLY H H 40 8.275 8.275 7.982 0.293 18522
134 1 . 1 1 29 29 ALA N N 41 123.128 123.128 122.402 0.726 18522
135 1 . 1 1 29 29 ALA HA H 41 4.559 4.559 4.330 0.229 18522
136 1 . 1 1 29 29 ALA CA C 41 51.073 51.073 52.743 -1.670 18522
137 1 . 1 1 29 29 ALA CB C 41 21.926 21.926 19.291 2.635 18522
138 1 . 1 1 29 29 ALA H H 41 8.012 8.012 8.004 0.008 18522
139 1 . 1 1 31 31 TYR HA H 43 4.549 4.549 4.429 0.120 18522
140 1 . 1 1 31 31 TYR CA C 43 57.147 57.147 59.247 -2.100 18522
141 1 . 1 1 31 31 TYR CB C 43 37.495 37.495 38.411 -0.916 18522
142 1 . 1 1 32 32 CYS N N 44 119.332 119.332 116.221 3.111 18522
143 1 . 1 1 32 32 CYS HA H 44 4.859 4.859 4.575 0.284 18522
144 1 . 1 1 32 32 CYS CA C 44 57.406 57.406 57.585 -0.179 18522
145 1 . 1 1 32 32 CYS CB C 44 27.673 27.673 27.561 0.112 18522
146 1 . 1 1 32 32 CYS H H 44 7.504 7.504 7.982 -0.478 18522
147 1 . 1 1 33 33 PRO HA H 45 4.413 4.413 4.528 -0.115 18522
148 1 . 1 1 33 33 PRO CA C 45 64.885 64.885 63.259 1.626 18522
149 1 . 1 1 33 33 PRO CB C 45 32.318 32.318 32.030 0.288 18522
150 1 . 1 1 34 34 CYS N N 46 117.327 117.327 116.036 1.291 18522
151 1 . 1 1 34 34 CYS C C 46 172.064 172.064 174.747 -2.683 18522
152 1 . 1 1 34 34 CYS CA C 46 60.066 60.066 59.416 0.650 18522
153 1 . 1 1 34 34 CYS CB C 46 28.715 28.715 29.079 -0.364 18522
154 1 . 1 1 34 34 CYS H H 46 7.973 7.973 8.154 -0.181 18522
155 1 . 1 1 35 35 LEU N N 47 124.270 124.270 118.081 6.189 18522
156 1 . 1 1 35 35 LEU HA H 47 4.928 4.928 4.306 0.622 18522
157 1 . 1 1 35 35 LEU C C 47 175.076 175.076 176.417 -1.341 18522
158 1 . 1 1 35 35 LEU CA C 47 53.278 53.278 55.987 -2.709 18522
159 1 . 1 1 35 35 LEU CB C 47 44.321 44.321 41.747 2.574 18522
160 1 . 1 1 35 35 LEU H H 47 8.629 8.629 8.481 0.148 18522
161 1 . 1 1 36 36 TYR N N 48 119.326 119.326 114.539 4.787 18522
162 1 . 1 1 36 36 TYR HA H 48 5.255 5.255 4.512 0.743 18522
163 1 . 1 1 36 36 TYR C C 48 175.766 175.766 175.525 0.241 18522
164 1 . 1 1 36 36 TYR CA C 48 56.696 56.696 59.438 -2.742 18522
165 1 . 1 1 36 36 TYR CB C 48 42.590 42.590 38.138 4.452 18522
166 1 . 1 1 36 36 TYR H H 48 8.761 8.761 7.905 0.856 18522
167 1 . 1 1 37 37 ILE N N 49 120.259 120.259 122.058 -1.799 18522
168 1 . 1 1 37 37 ILE HA H 49 4.215 4.215 4.512 -0.297 18522
169 1 . 1 1 37 37 ILE C C 49 177.429 177.429 176.156 1.273 18522
170 1 . 1 1 37 37 ILE CA C 49 62.456 62.456 60.431 2.025 18522
171 1 . 1 1 37 37 ILE CB C 49 37.352 37.352 38.196 -0.844 18522
172 1 . 1 1 37 37 ILE H H 49 8.959 8.959 8.218 0.741 18522
173 1 . 1 1 38 38 VAL HA H 50 3.937 3.937 4.095 -0.158 18522
174 1 . 1 1 38 38 VAL C C 50 174.408 174.408 175.327 -0.919 18522
175 1 . 1 1 38 38 VAL CA C 50 62.259 62.259 63.146 -0.887 18522
176 1 . 1 1 38 38 VAL CB C 50 31.584 31.584 32.364 -0.780 18522
177 1 . 1 1 39 39 GLN N N 51 116.821 116.821 117.271 -0.450 18522
178 1 . 1 1 39 39 GLN HA H 51 4.103 4.103 4.447 -0.344 18522
179 1 . 1 1 39 39 GLN C C 51 172.856 172.856 172.973 -0.117 18522
180 1 . 1 1 39 39 GLN CA C 51 55.127 55.127 55.161 -0.034 18522
181 1 . 1 1 39 39 GLN CB C 51 32.376 32.376 32.422 -0.046 18522
182 1 . 1 1 39 39 GLN H H 51 6.967 6.967 7.499 -0.532 18522
183 1 . 1 1 40 40 VAL N N 52 123.482 123.482 120.848 2.634 18522
184 1 . 1 1 40 40 VAL HA H 52 4.277 4.277 4.754 -0.477 18522
185 1 . 1 1 40 40 VAL C C 52 176.198 176.198 174.191 2.007 18522
186 1 . 1 1 40 40 VAL CA C 52 61.574 61.574 59.667 1.908 18522
187 1 . 1 1 40 40 VAL CB C 52 32.875 32.875 35.056 -2.181 18522
188 1 . 1 1 40 40 VAL H H 52 8.447 8.447 8.145 0.302 18522
189 1 . 1 1 41 41 PHE N N 53 128.296 128.296 123.527 4.769 18522
190 1 . 1 1 41 41 PHE HA H 53 4.400 4.400 4.754 -0.354 18522
191 1 . 1 1 41 41 PHE C C 53 175.299 175.299 175.503 -0.204 18522
192 1 . 1 1 41 41 PHE CA C 53 58.494 58.494 57.648 0.846 18522
193 1 . 1 1 41 41 PHE CB C 53 39.561 39.561 40.076 -0.515 18522
194 1 . 1 1 41 41 PHE H H 53 8.707 8.707 8.329 0.378 18522
195 1 . 1 1 42 42 ASP N N 54 122.696 122.696 119.087 3.609 18522
196 1 . 1 1 42 42 ASP HA H 54 4.272 4.272 4.529 -0.257 18522
197 1 . 1 1 42 42 ASP C C 54 176.837 176.837 176.158 0.679 18522
198 1 . 1 1 42 42 ASP CA C 54 55.291 55.291 55.801 -0.510 18522
199 1 . 1 1 42 42 ASP CB C 54 41.093 41.093 41.933 -0.840 18522
200 1 . 1 1 42 42 ASP H H 54 8.901 8.901 8.680 0.221 18522
201 1 . 1 1 43 43 ASN N N 55 113.923 113.923 115.422 -1.499 18522
202 1 . 1 1 43 43 ASN HA H 55 4.258 4.258 4.810 -0.552 18522
203 1 . 1 1 43 43 ASN C C 55 173.714 173.714 174.867 -1.153 18522
204 1 . 1 1 43 43 ASN CA C 55 54.958 54.958 53.305 1.653 18522
205 1 . 1 1 43 43 ASN CB C 55 37.150 37.150 39.428 -2.279 18522
206 1 . 1 1 43 43 ASN H H 55 9.319 9.319 8.196 1.123 18522
207 1 . 1 1 44 44 THR N N 56 108.020 108.020 111.970 -3.950 18522
208 1 . 1 1 44 44 THR HA H 56 5.377 5.377 4.865 0.512 18522
209 1 . 1 1 44 44 THR CA C 56 59.712 59.712 59.310 0.402 18522
210 1 . 1 1 44 44 THR CB C 56 69.529 69.529 70.145 -0.616 18522
211 1 . 1 1 44 44 THR H H 56 7.149 7.149 7.661 -0.512 18522
212 1 . 1 1 45 45 PRO HA H 57 4.304 4.304 4.086 0.218 18522
213 1 . 1 1 45 45 PRO C C 57 180.141 180.141 178.014 2.127 18522
214 1 . 1 1 45 45 PRO CA C 57 66.090 66.090 65.658 0.432 18522
215 1 . 1 1 45 45 PRO CB C 57 33.194 33.194 31.466 1.728 18522
216 1 . 1 1 46 46 ALA N N 58 116.854 116.854 119.766 -2.912 18522
217 1 . 1 1 46 46 ALA HA H 58 4.035 4.035 4.014 0.021 18522
218 1 . 1 1 46 46 ALA C C 58 180.647 180.647 179.472 1.175 18522
219 1 . 1 1 46 46 ALA CA C 58 55.195 55.195 55.213 -0.018 18522
220 1 . 1 1 46 46 ALA CB C 58 18.880 18.880 18.122 0.758 18522
221 1 . 1 1 46 46 ALA H H 58 8.938 8.938 7.841 1.097 18522
222 1 . 1 1 47 47 ALA N N 59 123.250 123.250 120.939 2.311 18522
223 1 . 1 1 47 47 ALA HA H 59 4.030 4.030 4.093 -0.063 18522
224 1 . 1 1 47 47 ALA C C 59 179.852 179.852 179.711 0.141 18522
225 1 . 1 1 47 47 ALA CA C 59 54.939 54.939 54.568 0.371 18522
226 1 . 1 1 47 47 ALA CB C 59 19.688 19.688 18.665 1.023 18522
227 1 . 1 1 47 47 ALA H H 59 7.658 7.658 7.424 0.234 18522
228 1 . 1 1 48 48 LEU N N 60 118.654 118.654 119.229 -0.575 18522
229 1 . 1 1 48 48 LEU HA H 60 4.026 4.026 4.146 -0.120 18522
230 1 . 1 1 48 48 LEU C C 60 179.238 179.238 178.359 0.879 18522
231 1 . 1 1 48 48 LEU CA C 60 57.261 57.261 58.019 -0.758 18522
232 1 . 1 1 48 48 LEU CB C 60 41.445 41.445 41.140 0.305 18522
233 1 . 1 1 48 48 LEU H H 60 8.636 8.636 8.480 0.156 18522
234 1 . 1 1 49 49 ASP N N 61 117.382 117.382 117.943 -0.561 18522
235 1 . 1 1 49 49 ASP HA H 61 4.421 4.421 4.629 -0.208 18522
236 1 . 1 1 49 49 ASP C C 61 177.668 177.668 177.887 -0.219 18522
237 1 . 1 1 49 49 ASP CA C 61 57.087 57.087 54.810 2.277 18522
238 1 . 1 1 49 49 ASP CB C 61 44.478 44.478 41.788 2.690 18522
239 1 . 1 1 49 49 ASP H H 61 7.665 7.665 7.847 -0.182 18522
240 1 . 1 1 50 50 GLY N N 62 103.228 103.228 107.960 -4.732 18522
241 1 . 1 1 50 50 GLY C C 62 174.776 174.776 174.966 -0.190 18522
242 1 . 1 1 50 50 GLY CA C 62 46.533 46.533 45.971 0.562 18522
243 1 . 1 1 50 50 GLY H H 62 7.216 7.216 8.153 -0.937 18522
244 1 . 1 1 51 51 THR N N 63 117.230 117.230 111.788 5.442 18522
245 1 . 1 1 51 51 THR HA H 63 3.907 3.907 3.866 0.041 18522
246 1 . 1 1 51 51 THR C C 63 175.961 175.961 174.420 1.541 18522
247 1 . 1 1 51 51 THR CA C 63 66.478 66.478 62.961 3.517 18522
248 1 . 1 1 51 51 THR CB C 63 68.268 68.268 67.246 1.022 18522
249 1 . 1 1 51 51 THR H H 63 8.319 8.319 7.775 0.544 18522
250 1 . 1 1 52 52 VAL N N 64 113.826 113.826 115.814 -1.988 18522
251 1 . 1 1 52 52 VAL HA H 64 3.950 3.950 4.241 -0.291 18522
252 1 . 1 1 52 52 VAL C C 64 173.883 173.883 174.731 -0.848 18522
253 1 . 1 1 52 52 VAL CA C 64 60.708 60.708 60.233 0.475 18522
254 1 . 1 1 52 52 VAL CB C 64 33.079 33.079 30.421 2.658 18522
255 1 . 1 1 52 52 VAL H H 64 8.147 8.147 7.412 0.735 18522
256 1 . 1 1 53 53 ALA N N 65 123.521 123.521 124.133 -0.612 18522
257 1 . 1 1 53 53 ALA HA H 65 4.414 4.414 4.405 0.009 18522
258 1 . 1 1 53 53 ALA C C 65 175.247 175.247 176.719 -1.472 18522
259 1 . 1 1 53 53 ALA CA C 65 50.440 50.440 50.746 -0.307 18522
260 1 . 1 1 53 53 ALA CB C 65 23.266 23.266 20.392 2.874 18522
261 1 . 1 1 53 53 ALA H H 65 8.633 8.633 7.425 1.208 18522
262 1 . 1 1 54 54 ALA N N 66 120.818 120.818 122.335 -1.517 18522
263 1 . 1 1 54 54 ALA HA H 66 3.720 3.720 3.967 -0.247 18522
264 1 . 1 1 54 54 ALA C C 66 178.411 178.411 178.261 0.150 18522
265 1 . 1 1 54 54 ALA CA C 66 53.016 53.016 53.332 -0.316 18522
266 1 . 1 1 54 54 ALA CB C 66 17.840 17.840 17.885 -0.045 18522
267 1 . 1 1 54 54 ALA H H 66 8.451 8.451 8.321 0.130 18522
268 1 . 1 1 55 55 GLY N N 67 112.260 112.260 113.082 -0.822 18522
269 1 . 1 1 55 55 GLY C C 67 173.296 173.296 173.894 -0.598 18522
270 1 . 1 1 55 55 GLY CA C 67 45.025 45.025 44.706 0.319 18522
271 1 . 1 1 55 55 GLY H H 67 9.600 9.600 8.583 1.017 18522
272 1 . 1 1 56 56 ASP N N 68 121.293 121.293 121.796 -0.503 18522
273 1 . 1 1 56 56 ASP HA H 68 4.861 4.861 4.823 0.038 18522
274 1 . 1 1 56 56 ASP C C 68 174.937 174.937 174.613 0.324 18522
275 1 . 1 1 56 56 ASP CA C 68 55.641 55.641 54.075 1.567 18522
276 1 . 1 1 56 56 ASP CB C 68 40.696 40.696 42.789 -2.093 18522
277 1 . 1 1 56 56 ASP H H 68 8.043 8.043 7.707 0.336 18522
278 1 . 1 1 57 57 GLU N N 69 122.814 122.814 121.134 1.680 18522
279 1 . 1 1 57 57 GLU C C 69 177.202 177.202 175.858 1.344 18522
280 1 . 1 1 57 57 GLU CA C 69 54.472 54.472 54.904 -0.433 18522
281 1 . 1 1 57 57 GLU CB C 69 32.800 32.800 31.325 1.475 18522
282 1 . 1 1 57 57 GLU H H 69 8.455 8.455 8.279 0.176 18522
283 1 . 1 1 58 58 ILE N N 70 125.862 125.862 126.116 -0.254 18522
284 1 . 1 1 58 58 ILE HA H 70 4.526 4.526 4.445 0.081 18522
285 1 . 1 1 58 58 ILE C C 70 175.035 175.035 175.792 -0.757 18522
286 1 . 1 1 58 58 ILE CA C 70 60.918 60.918 60.546 0.372 18522
287 1 . 1 1 58 58 ILE CB C 70 39.236 39.236 37.464 1.772 18522
288 1 . 1 1 58 58 ILE H H 70 8.619 8.619 8.391 0.228 18522
289 1 . 1 1 59 59 THR N N 71 115.507 115.507 120.823 -5.316 18522
290 1 . 1 1 59 59 THR HA H 71 4.513 4.513 4.351 0.162 18522
291 1 . 1 1 59 59 THR C C 71 176.425 176.425 173.962 2.462 18522
292 1 . 1 1 59 59 THR CA C 71 61.158 61.158 61.882 -0.724 18522
293 1 . 1 1 59 59 THR CB C 71 69.604 69.604 70.098 -0.494 18522
294 1 . 1 1 59 59 THR H H 71 9.242 9.242 8.827 0.415 18522
295 1 . 1 1 60 60 GLY N N 72 111.789 111.789 108.705 3.084 18522
296 1 . 1 1 60 60 GLY C C 72 170.981 170.981 171.467 -0.486 18522
297 1 . 1 1 60 60 GLY CA C 72 46.554 46.554 45.146 1.408 18522
298 1 . 1 1 60 60 GLY H H 72 7.883 7.883 7.714 0.169 18522
299 1 . 1 1 61 61 VAL N N 73 119.277 119.277 120.407 -1.130 18522
300 1 . 1 1 61 61 VAL C C 73 175.951 175.951 175.726 0.225 18522
301 1 . 1 1 61 61 VAL CA C 73 60.982 60.982 59.468 1.514 18522
302 1 . 1 1 61 61 VAL CB C 73 36.197 36.197 34.284 1.913 18522
303 1 . 1 1 61 61 VAL H H 73 8.424 8.424 8.749 -0.325 18522
304 1 . 1 1 62 62 ASN N N 74 127.731 127.731 126.275 1.456 18522
305 1 . 1 1 62 62 ASN HA H 74 4.520 4.520 4.384 0.136 18522
306 1 . 1 1 62 62 ASN C C 74 174.878 174.878 175.099 -0.221 18522
307 1 . 1 1 62 62 ASN CA C 74 54.418 54.418 54.494 -0.076 18522
308 1 . 1 1 62 62 ASN CB C 74 36.655 36.655 37.762 -1.107 18522
309 1 . 1 1 62 62 ASN H H 74 10.384 10.384 9.233 1.151 18522
310 1 . 1 1 63 63 GLY N N 75 104.633 104.633 103.178 1.455 18522
311 1 . 1 1 63 63 GLY C C 75 173.610 173.610 173.422 0.188 18522
312 1 . 1 1 63 63 GLY CA C 75 45.261 45.261 44.907 0.354 18522
313 1 . 1 1 63 63 GLY H H 75 8.926 8.926 8.318 0.608 18522
314 1 . 1 1 64 64 ARG N N 76 120.451 120.451 121.198 -0.747 18522
315 1 . 1 1 64 64 ARG HA H 76 4.501 4.501 4.644 -0.144 18522
316 1 . 1 1 64 64 ARG C C 76 175.085 175.085 175.542 -0.457 18522
317 1 . 1 1 64 64 ARG CA C 76 54.252 54.252 54.150 0.102 18522
318 1 . 1 1 64 64 ARG CB C 76 31.482 31.482 31.692 -0.210 18522
319 1 . 1 1 64 64 ARG H H 76 7.753 7.753 7.979 -0.226 18522
320 1 . 1 1 65 65 SER N N 77 116.586 116.586 118.692 -2.106 18522
321 1 . 1 1 65 65 SER HA H 77 4.483 4.483 4.565 -0.082 18522
322 1 . 1 1 65 65 SER C C 77 176.953 176.953 175.952 1.000 18522
323 1 . 1 1 65 65 SER CA C 77 58.292 58.292 58.875 -0.583 18522
324 1 . 1 1 65 65 SER CB C 77 63.643 63.643 63.661 -0.018 18522
325 1 . 1 1 65 65 SER H H 77 8.555 8.555 8.817 -0.262 18522
326 1 . 1 1 66 66 ILE N N 78 116.618 116.618 120.207 -3.589 18522
327 1 . 1 1 66 66 ILE HA H 78 4.420 4.420 4.216 0.204 18522
328 1 . 1 1 66 66 ILE C C 78 175.072 175.072 176.871 -1.799 18522
329 1 . 1 1 66 66 ILE CA C 78 59.122 59.122 61.415 -2.293 18522
330 1 . 1 1 66 66 ILE CB C 78 36.758 36.758 37.308 -0.550 18522
331 1 . 1 1 66 66 ILE H H 78 7.599 7.599 8.266 -0.667 18522
332 1 . 1 1 67 67 LYS N N 79 123.287 123.287 122.355 0.932 18522
333 1 . 1 1 67 67 LYS HA H 79 4.049 4.049 4.099 -0.050 18522
334 1 . 1 1 67 67 LYS C C 79 178.333 178.333 177.594 0.739 18522
335 1 . 1 1 67 67 LYS CA C 79 58.321 58.321 58.018 0.303 18522
336 1 . 1 1 67 67 LYS CB C 79 31.635 31.635 31.636 -0.001 18522
337 1 . 1 1 67 67 LYS H H 79 7.898 7.898 8.103 -0.205 18522
338 1 . 1 1 68 68 GLY N N 80 114.933 114.933 108.539 6.394 18522
339 1 . 1 1 68 68 GLY C C 80 174.385 174.385 174.544 -0.159 18522
340 1 . 1 1 68 68 GLY CA C 80 45.518 45.518 45.619 -0.101 18522
341 1 . 1 1 68 68 GLY H H 80 8.999 8.999 8.112 0.887 18522
342 1 . 1 1 69 69 LYS N N 81 119.403 119.403 119.671 -0.268 18522
343 1 . 1 1 69 69 LYS HA H 81 4.043 4.043 4.612 -0.569 18522
344 1 . 1 1 69 69 LYS C C 81 177.064 177.064 175.204 1.860 18522
345 1 . 1 1 69 69 LYS CA C 81 54.722 54.722 55.192 -0.470 18522
346 1 . 1 1 69 69 LYS CB C 81 33.560 33.560 33.525 0.035 18522
347 1 . 1 1 69 69 LYS H H 81 7.845 7.845 7.897 -0.052 18522
348 1 . 1 1 70 70 THR N N 82 112.066 112.066 113.070 -1.004 18522
349 1 . 1 1 70 70 THR HA H 82 4.666 4.666 4.636 0.030 18522
350 1 . 1 1 70 70 THR C C 82 175.955 175.955 175.067 0.888 18522
351 1 . 1 1 70 70 THR CA C 82 60.438 60.438 60.571 -0.133 18522
352 1 . 1 1 70 70 THR CB C 82 71.629 71.629 72.162 -0.533 18522
353 1 . 1 1 70 70 THR H H 82 9.153 9.153 7.919 1.234 18522
354 1 . 1 1 71 71 LYS N N 83 118.730 118.730 123.870 -5.140 18522
355 1 . 1 1 71 71 LYS HA H 83 3.870 3.870 3.945 -0.075 18522
356 1 . 1 1 71 71 LYS C C 83 177.464 177.464 178.396 -0.932 18522
357 1 . 1 1 71 71 LYS CA C 83 60.357 60.357 59.906 0.451 18522
358 1 . 1 1 71 71 LYS CB C 83 31.350 31.350 31.707 -0.357 18522
359 1 . 1 1 71 71 LYS H H 83 8.969 8.969 8.790 0.179 18522
360 1 . 1 1 72 72 VAL N N 84 117.444 117.444 118.810 -1.366 18522
361 1 . 1 1 72 72 VAL HA H 84 3.633 3.633 3.701 -0.068 18522
362 1 . 1 1 72 72 VAL C C 84 178.315 178.315 177.478 0.838 18522
363 1 . 1 1 72 72 VAL CA C 84 66.079 66.079 65.727 0.352 18522
364 1 . 1 1 72 72 VAL CB C 84 32.091 32.091 31.491 0.600 18522
365 1 . 1 1 72 72 VAL H H 84 7.631 7.631 8.237 -0.606 18522
366 1 . 1 1 73 73 GLU N N 85 120.890 120.890 119.211 1.679 18522
367 1 . 1 1 73 73 GLU HA H 85 3.964 3.964 4.090 -0.126 18522
368 1 . 1 1 73 73 GLU C C 85 179.971 179.971 178.898 1.073 18522
369 1 . 1 1 73 73 GLU CA C 85 59.316 59.316 59.367 -0.051 18522
370 1 . 1 1 73 73 GLU CB C 85 30.355 30.355 29.648 0.707 18522
371 1 . 1 1 73 73 GLU H H 85 7.617 7.617 7.682 -0.065 18522
372 1 . 1 1 74 74 VAL N N 86 121.246 121.246 118.400 2.846 18522
373 1 . 1 1 74 74 VAL HA H 86 3.630 3.630 3.776 -0.146 18522
374 1 . 1 1 74 74 VAL C C 86 177.217 177.217 177.696 -0.479 18522
375 1 . 1 1 74 74 VAL CA C 86 66.678 66.678 65.926 0.752 18522
376 1 . 1 1 74 74 VAL CB C 86 31.307 31.307 30.968 0.339 18522
377 1 . 1 1 74 74 VAL H H 86 8.368 8.368 8.302 0.066 18522
378 1 . 1 1 75 75 ALA N N 87 122.148 122.148 122.479 -0.331 18522
379 1 . 1 1 75 75 ALA HA H 87 3.947 3.947 3.942 0.005 18522
380 1 . 1 1 75 75 ALA C C 87 179.545 179.545 179.189 0.356 18522
381 1 . 1 1 75 75 ALA CA C 87 55.851 55.851 55.429 0.422 18522
382 1 . 1 1 75 75 ALA CB C 87 18.491 18.491 18.012 0.479 18522
383 1 . 1 1 75 75 ALA H H 87 8.577 8.577 8.210 0.367 18522
384 1 . 1 1 76 76 LYS N N 88 117.733 117.733 119.463 -1.730 18522
385 1 . 1 1 76 76 LYS HA H 88 4.051 4.051 4.035 0.016 18522
386 1 . 1 1 76 76 LYS CA C 88 59.393 59.393 59.313 0.080 18522
387 1 . 1 1 76 76 LYS CB C 88 32.058 32.058 32.344 -0.286 18522
388 1 . 1 1 76 76 LYS H H 88 7.854 7.854 7.440 0.414 18522
389 1 . 1 1 77 77 MET N N 89 117.676 117.676 118.102 -0.426 18522
390 1 . 1 1 77 77 MET HA H 89 4.048 4.048 4.081 -0.033 18522
391 1 . 1 1 77 77 MET C C 89 178.791 178.791 178.859 -0.068 18522
392 1 . 1 1 77 77 MET CA C 89 59.128 59.128 58.854 0.274 18522
393 1 . 1 1 77 77 MET CB C 89 33.801 33.801 32.205 1.596 18522
394 1 . 1 1 77 77 MET H H 89 7.759 7.759 8.265 -0.506 18522
395 1 . 1 1 78 78 ILE N N 90 117.305 117.305 119.104 -1.799 18522
396 1 . 1 1 78 78 ILE HA H 90 3.590 3.590 3.682 -0.092 18522
397 1 . 1 1 78 78 ILE C C 90 178.658 178.658 178.158 0.500 18522
398 1 . 1 1 78 78 ILE CA C 90 65.482 65.482 64.856 0.626 18522
399 1 . 1 1 78 78 ILE CB C 90 38.845 38.845 37.431 1.414 18522
400 1 . 1 1 78 78 ILE H H 90 7.972 7.972 8.107 -0.135 18522
401 1 . 1 1 79 79 GLN N N 91 120.935 120.935 118.665 2.270 18522
402 1 . 1 1 79 79 GLN HA H 91 3.998 3.998 4.179 -0.181 18522
403 1 . 1 1 79 79 GLN C C 91 178.274 178.274 178.419 -0.145 18522
404 1 . 1 1 79 79 GLN CA C 91 59.151 59.151 58.063 1.088 18522
405 1 . 1 1 79 79 GLN CB C 91 28.934 28.934 28.745 0.189 18522
406 1 . 1 1 79 79 GLN H H 91 8.826 8.826 8.166 0.660 18522
407 1 . 1 1 80 80 GLU N N 92 115.213 115.213 120.912 -5.699 18522
408 1 . 1 1 80 80 GLU HA H 92 4.061 4.061 4.109 -0.048 18522
409 1 . 1 1 80 80 GLU C C 92 176.824 176.824 178.355 -1.531 18522
410 1 . 1 1 80 80 GLU CA C 92 58.006 58.006 58.950 -0.944 18522
411 1 . 1 1 80 80 GLU CB C 92 29.890 29.890 29.777 0.113 18522
412 1 . 1 1 80 80 GLU H H 92 8.020 8.020 8.334 -0.314 18522
413 1 . 1 1 81 81 VAL N N 93 119.047 119.047 115.981 3.066 18522
414 1 . 1 1 81 81 VAL HA H 93 3.930 3.930 3.896 0.034 18522
415 1 . 1 1 81 81 VAL C C 93 176.016 176.016 175.701 0.315 18522
416 1 . 1 1 81 81 VAL CA C 93 63.153 63.153 63.232 -0.079 18522
417 1 . 1 1 81 81 VAL CB C 93 32.154 32.154 31.296 0.858 18522
418 1 . 1 1 81 81 VAL H H 93 7.073 7.073 7.555 -0.482 18522
419 1 . 1 1 82 82 LYS N N 94 128.366 128.366 120.608 7.758 18522
420 1 . 1 1 82 82 LYS C C 94 177.460 177.460 177.173 0.287 18522
421 1 . 1 1 82 82 LYS CA C 94 55.753 55.753 57.178 -1.425 18522
422 1 . 1 1 82 82 LYS CB C 94 32.332 32.332 32.049 0.283 18522
423 1 . 1 1 82 82 LYS H H 94 8.762 8.762 7.724 1.038 18522
424 1 . 1 1 83 83 GLY N N 95 112.528 112.528 111.552 0.976 18522
425 1 . 1 1 83 83 GLY C C 95 173.468 173.468 173.374 0.094 18522
426 1 . 1 1 83 83 GLY CA C 95 46.243 46.243 45.270 0.973 18522
427 1 . 1 1 83 83 GLY H H 95 8.673 8.673 8.829 -0.156 18522
428 1 . 1 1 84 84 GLU N N 96 121.485 121.485 120.116 1.369 18522
429 1 . 1 1 84 84 GLU HA H 96 4.749 4.749 4.969 -0.220 18522
430 1 . 1 1 84 84 GLU C C 96 174.583 174.583 174.339 0.244 18522
431 1 . 1 1 84 84 GLU CA C 96 55.821 55.821 54.644 1.177 18522
432 1 . 1 1 84 84 GLU CB C 96 31.410 31.410 33.649 -2.239 18522
433 1 . 1 1 84 84 GLU H H 96 8.297 8.297 7.680 0.617 18522
434 1 . 1 1 85 85 VAL N N 97 120.501 120.501 113.901 6.600 18522
435 1 . 1 1 85 85 VAL HA H 97 4.665 4.665 4.593 0.072 18522
436 1 . 1 1 85 85 VAL C C 97 173.047 173.047 174.020 -0.973 18522
437 1 . 1 1 85 85 VAL CA C 97 60.114 60.114 60.593 -0.479 18522
438 1 . 1 1 85 85 VAL CB C 97 35.184 35.184 35.620 -0.436 18522
439 1 . 1 1 85 85 VAL H H 97 9.096 9.096 8.452 0.644 18522
440 1 . 1 1 86 86 THR N N 98 125.019 125.019 119.864 5.155 18522
441 1 . 1 1 86 86 THR HA H 98 4.076 4.076 5.010 -0.934 18522
442 1 . 1 1 86 86 THR C C 98 173.807 173.807 173.673 0.134 18522
443 1 . 1 1 86 86 THR CA C 98 61.735 61.735 61.488 0.247 18522
444 1 . 1 1 86 86 THR CB C 98 69.531 69.531 70.154 -0.623 18522
445 1 . 1 1 86 86 THR H H 98 9.352 9.352 8.380 0.972 18522
446 1 . 1 1 87 87 ILE N N 99 128.383 128.383 123.238 5.145 18522
447 1 . 1 1 87 87 ILE HA H 99 4.661 4.661 4.749 -0.088 18522
448 1 . 1 1 87 87 ILE C C 99 174.614 174.614 174.429 0.185 18522
449 1 . 1 1 87 87 ILE CA C 99 58.258 58.258 59.148 -0.890 18522
450 1 . 1 1 87 87 ILE CB C 99 38.528 38.528 38.880 -0.352 18522
451 1 . 1 1 87 87 ILE H H 99 9.329 9.329 8.632 0.697 18522
452 1 . 1 1 88 88 HIS N N 100 128.279 128.279 125.800 2.479 18522
453 1 . 1 1 88 88 HIS HA H 100 4.948 4.948 5.298 -0.350 18522
454 1 . 1 1 88 88 HIS C C 100 174.787 174.787 174.429 0.358 18522
455 1 . 1 1 88 88 HIS CA C 100 54.620 54.620 54.474 0.146 18522
456 1 . 1 1 88 88 HIS H H 100 8.647 8.647 8.532 0.115 18522
457 1 . 1 1 89 89 TYR N N 101 121.320 121.320 123.350 -2.030 18522
458 1 . 1 1 89 89 TYR HA H 101 5.947 5.947 5.211 0.736 18522
459 1 . 1 1 89 89 TYR C C 101 173.769 173.769 173.363 0.407 18522
460 1 . 1 1 89 89 TYR CA C 101 55.669 55.669 56.267 -0.598 18522
461 1 . 1 1 89 89 TYR CB C 101 42.195 42.195 40.967 1.228 18522
462 1 . 1 1 89 89 TYR H H 101 8.414 8.414 8.981 -0.567 18522
463 1 . 1 1 90 90 ASN N N 102 116.679 116.679 116.916 -0.237 18522
464 1 . 1 1 90 90 ASN HA H 102 5.335 5.335 5.295 0.040 18522
465 1 . 1 1 90 90 ASN C C 102 175.406 175.406 173.993 1.413 18522
466 1 . 1 1 90 90 ASN CA C 102 51.961 51.961 52.201 -0.240 18522
467 1 . 1 1 90 90 ASN CB C 102 41.800 41.800 42.152 -0.352 18522
468 1 . 1 1 90 90 ASN H H 102 9.282 9.282 8.540 0.743 18522
469 1 . 1 1 91 91 LYS N N 103 124.129 124.129 119.983 4.146 18522
470 1 . 1 1 91 91 LYS C C 103 176.678 176.678 175.687 0.991 18522
471 1 . 1 1 91 91 LYS CA C 103 55.006 55.006 55.412 -0.406 18522
472 1 . 1 1 91 91 LYS H H 103 8.949 8.949 8.431 0.518 18522
473 1 . 1 1 92 92 LEU N N 104 127.043 127.043 118.065 8.978 18522
474 1 . 1 1 92 92 LEU HA H 104 4.425 4.425 4.418 0.007 18522
475 1 . 1 1 92 92 LEU CA C 104 55.060 55.060 54.965 0.095 18522
476 1 . 1 1 92 92 LEU CB C 104 42.559 42.559 42.681 -0.122 18522
477 1 . 1 1 92 92 LEU H H 104 9.150 9.150 8.193 0.957 18522
478 1 . 1 1 93 93 GLN HA H 105 4.315 4.315 4.365 -0.050 18522
479 1 . 1 1 93 93 GLN C C 105 175.070 175.070 175.123 -0.053 18522
480 1 . 1 1 93 93 GLN CA C 105 55.490 55.490 55.624 -0.134 18522
481 1 . 1 1 93 93 GLN CB C 105 28.909 28.909 28.853 0.056 18522
482 1 . 1 1 94 94 ALA N N 106 125.133 125.133 123.214 1.919 18522
483 1 . 1 1 94 94 ALA HA H 106 4.366 4.366 4.331 0.035 18522
484 1 . 1 1 94 94 ALA C C 106 176.392 176.392 175.678 0.714 18522
485 1 . 1 1 94 94 ALA CA C 106 51.723 51.723 52.158 -0.435 18522
486 1 . 1 1 94 94 ALA CB C 106 20.185 20.185 19.869 0.316 18522
487 1 . 1 1 94 94 ALA H H 106 8.226 8.226 7.996 0.230 18522
488 1 . 1 1 95 95 ASP N N 107 122.013 122.013 119.262 2.751 18522
489 1 . 1 1 95 95 ASP HA H 107 4.413 4.413 4.957 -0.544 18522
490 1 . 1 1 95 95 ASP C C 107 175.019 175.019 175.047 -0.028 18522
491 1 . 1 1 95 95 ASP CA C 107 55.642 55.642 52.108 3.534 18522
492 1 . 1 1 95 95 ASP CB C 107 41.266 41.266 42.666 -1.400 18522
493 1 . 1 1 95 95 ASP H H 107 8.429 8.429 8.239 0.190 18522
494 1 . 1 1 96 96 PRO HA H 108 4.207 4.207 3.998 0.209 18522
495 1 . 1 1 96 96 PRO C C 108 178.840 178.840 178.207 0.633 18522
496 1 . 1 1 96 96 PRO CA C 108 65.396 65.396 66.209 -0.813 18522
497 1 . 1 1 96 96 PRO CB C 108 32.181 32.181 31.761 0.420 18522
498 1 . 1 1 97 97 LYS N N 109 117.942 117.942 115.337 2.605 18522
499 1 . 1 1 97 97 LYS HA H 109 4.143 4.143 4.022 0.121 18522
500 1 . 1 1 97 97 LYS C C 109 178.099 178.099 179.031 -0.932 18522
501 1 . 1 1 97 97 LYS CA C 109 58.167 58.167 59.160 -0.993 18522
502 1 . 1 1 97 97 LYS CB C 109 31.649 31.649 31.467 0.183 18522
503 1 . 1 1 97 97 LYS H H 109 8.335 8.335 8.276 0.059 18522
504 1 . 1 1 98 98 GLN N N 110 119.159 119.159 118.121 1.038 18522
505 1 . 1 1 98 98 GLN HA H 110 4.130 4.130 4.306 -0.176 18522
506 1 . 1 1 98 98 GLN C C 110 178.298 178.298 178.199 0.099 18522
507 1 . 1 1 98 98 GLN CA C 110 57.660 57.660 57.187 0.473 18522
508 1 . 1 1 98 98 GLN CB C 110 28.720 28.720 28.811 -0.091 18522
509 1 . 1 1 98 98 GLN H H 110 7.985 7.985 8.065 -0.080 18522
510 1 . 1 1 99 99 LEU N N 111 120.490 120.490 122.464 -1.974 18522
511 1 . 1 1 99 99 LEU HA H 111 3.877 3.877 4.247 -0.370 18522
512 1 . 1 1 99 99 LEU C C 111 177.729 177.729 178.275 -0.546 18522
513 1 . 1 1 99 99 LEU CA C 111 57.049 57.049 57.803 -0.754 18522
514 1 . 1 1 99 99 LEU CB C 111 41.466 41.466 41.889 -0.423 18522
515 1 . 1 1 99 99 LEU H H 111 7.994 7.994 8.440 -0.446 18522
516 1 . 1 1 100 100 GLU N N 112 118.251 118.251 118.421 -0.170 18522
517 1 . 1 1 100 100 GLU HA H 112 3.972 3.972 4.122 -0.150 18522
518 1 . 1 1 100 100 GLU C C 112 178.402 178.402 178.630 -0.228 18522
519 1 . 1 1 100 100 GLU CA C 112 59.056 59.056 59.087 -0.031 18522
520 1 . 1 1 100 100 GLU CB C 112 29.732 29.732 29.046 0.686 18522
521 1 . 1 1 100 100 GLU H H 112 7.760 7.760 8.102 -0.342 18522
522 1 . 1 1 101 101 VAL N N 113 117.229 117.229 119.487 -2.258 18522
523 1 . 1 1 101 101 VAL HA H 113 3.762 3.762 3.837 -0.075 18522
524 1 . 1 1 101 101 VAL C C 113 178.107 178.107 177.816 0.291 18522
525 1 . 1 1 101 101 VAL CA C 113 64.791 64.791 65.578 -0.787 18522
526 1 . 1 1 101 101 VAL CB C 113 32.149 32.149 31.771 0.378 18522
527 1 . 1 1 101 101 VAL H H 113 7.437 7.437 7.465 -0.028 18522
528 1 . 1 1 102 102 LEU N N 114 122.124 122.124 119.019 3.105 18522
529 1 . 1 1 102 102 LEU HA H 114 4.033 4.033 4.183 -0.150 18522
530 1 . 1 1 102 102 LEU C C 114 178.506 178.506 178.208 0.298 18522
531 1 . 1 1 102 102 LEU CA C 114 57.243 57.243 56.766 0.477 18522
532 1 . 1 1 102 102 LEU CB C 114 42.028 42.028 41.936 0.092 18522
533 1 . 1 1 102 102 LEU H H 114 7.765 7.765 7.656 0.109 18522
534 1 . 1 1 103 103 PHE N N 115 115.346 115.346 118.681 -3.335 18522
535 1 . 1 1 103 103 PHE HA H 115 4.224 4.224 4.377 -0.153 18522
536 1 . 1 1 103 103 PHE C C 115 175.621 175.621 176.021 -0.400 18522
537 1 . 1 1 103 103 PHE CA C 115 57.537 57.537 58.609 -1.072 18522
538 1 . 1 1 103 103 PHE CB C 115 38.057 38.057 39.339 -1.282 18522
539 1 . 1 1 103 103 PHE H H 115 7.805 7.805 7.796 0.009 18522
540 1 . 1 1 104 104 GLN N N 116 119.021 119.021 118.469 0.552 18522
541 1 . 1 1 104 104 GLN HA H 116 4.407 4.407 4.148 0.259 18522
542 1 . 1 1 104 104 GLN C C 116 176.402 176.402 175.682 0.720 18522
543 1 . 1 1 104 104 GLN CA C 116 55.521 55.521 56.815 -1.294 18522
544 1 . 1 1 104 104 GLN CB C 116 29.170 29.170 28.335 0.835 18522
545 1 . 1 1 104 104 GLN H H 116 7.974 7.974 7.902 0.072 18522
546 1 . 1 1 105 105 GLY N N 117 108.868 108.868 108.044 0.824 18522
547 1 . 1 1 105 105 GLY CA C 117 45.124 45.124 45.236 -0.112 18522
548 1 . 1 1 105 105 GLY H H 117 8.195 8.195 7.956 0.239 18522
549 1 . 1 1 106 106 PRO HA H 118 4.490 4.490 4.197 0.293 18522
550 1 . 1 1 106 106 PRO C C 118 176.001 176.001 176.262 -0.261 18522
551 1 . 1 1 106 106 PRO CA C 118 63.523 63.523 63.637 -0.114 18522
552 1 . 1 1 106 106 PRO CB C 118 32.078 32.078 31.843 0.235 18522
553 1 . 1 1 107 107 GLN N N 119 126.950 126.950 119.182 7.768 18522
554 1 . 1 1 107 107 GLN C C 119 181.211 181.211 175.375 5.836 18522
555 1 . 1 1 107 107 GLN CA C 119 57.416 57.416 55.779 1.637 18522
556 1 . 1 1 107 107 GLN H H 119 8.079 8.079 8.227 -0.148 18522
557 1 . 1 1 111 111 ARG C C 123 174.608 174.608 175.100 -0.492 18522
558 1 . 1 1 111 111 ARG CA C 123 55.099 55.099 55.748 -0.649 18522
559 1 . 1 1 112 112 HIS N N 124 122.212 122.212 119.628 2.584 18522
560 1 . 1 1 112 112 HIS HA H 124 4.718 4.718 4.432 0.286 18522
561 1 . 1 1 112 112 HIS C C 124 176.040 176.040 174.365 1.675 18522
562 1 . 1 1 112 112 HIS CA C 124 54.213 54.213 55.487 -1.274 18522
563 1 . 1 1 112 112 HIS CB C 124 31.164 31.164 29.845 1.319 18522
564 1 . 1 1 112 112 HIS H H 124 7.640 7.640 8.314 -0.674 18522
565 1 . 1 1 113 113 TRP C C 125 176.168 176.168 175.209 0.959 18522
566 1 . 1 1 114 114 LEU N N 126 121.893 121.893 121.554 0.339 18522
567 1 . 1 1 114 114 LEU HA H 126 4.869 4.869 4.767 0.102 18522
568 1 . 1 1 114 114 LEU CA C 126 54.151 54.151 53.546 0.605 18522
569 1 . 1 1 114 114 LEU CB C 126 45.144 45.144 44.675 0.469 18522
570 1 . 1 1 114 114 LEU H H 126 8.606 8.606 8.538 0.068 18522
571 1 . 1 1 115 115 LYS N N 127 125.850 125.850 120.063 5.787 18522
572 1 . 1 1 115 115 LYS HA H 127 4.203 4.203 4.929 -0.726 18522
573 1 . 1 1 115 115 LYS C C 127 175.564 175.564 174.549 1.015 18522
574 1 . 1 1 115 115 LYS CA C 127 57.252 57.252 55.416 1.836 18522
575 1 . 1 1 115 115 LYS CB C 127 33.406 33.406 34.642 -1.236 18522
576 1 . 1 1 115 115 LYS H H 127 8.647 8.647 8.175 0.472 18522
stop_
save_