data_19623
save_entry_information
_Entry.Sf_category entry_information
_Entry.NMR_STAR_version 3.0.9.13
_Entry.Entry_ID 19623
_Entry.PDB_ID 2MH8
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 19623
_Entity_delta_chem_shifts.ID 1
loop_
_Delta_CS.Atom_chem_shift_ID
_Delta_CS.Entity_delta_chem_shifts_ID
_Delta_CS.Conformer_ID
_Delta_CS.Assembly_atom_ID
_Delta_CS.Entity_assembly_ID
_Delta_CS.Entity_ID
_Delta_CS.Comp_index_ID
_Delta_CS.Seq_ID
_Delta_CS.Comp_ID
_Delta_CS.Atom_ID
_Delta_CS.Atom_type
_Delta_CS.Auth_seq_ID
_Delta_CS.Original_CS_value
_Delta_CS.Corrected_CS_value
_Delta_CS.Sparta_CS_value
_Delta_CS.Delta_CS_value
_Delta_CS.Entry_ID
1 1 1 . 1 1 2 2 GLY N N 2 113.169 113.169 107.990 5.179 19623
2 1 1 . 1 1 2 2 GLY C C 2 173.996 173.996 173.541 0.455 19623
3 1 1 . 1 1 2 2 GLY CA C 2 45.211 45.211 44.883 0.328 19623
4 1 1 . 1 1 2 2 GLY H H 2 8.533 8.533 8.388 0.145 19623
5 1 1 . 1 1 3 3 ASP N N 3 120.717 120.717 121.038 -0.321 19623
6 1 1 . 1 1 3 3 ASP HA H 3 4.559 4.559 4.488 0.071 19623
7 1 1 . 1 1 3 3 ASP C C 3 176.675 176.675 176.858 -0.183 19623
8 1 1 . 1 1 3 3 ASP CA C 3 54.489 54.489 54.133 0.356 19623
9 1 1 . 1 1 3 3 ASP CB C 3 41.197 41.197 41.153 0.044 19623
10 1 1 . 1 1 3 3 ASP H H 3 8.412 8.412 8.222 0.190 19623
11 1 1 . 1 1 4 4 LYS N N 4 121.955 121.955 125.806 -3.851 19623
12 1 1 . 1 1 4 4 LYS HA H 4 4.246 4.246 4.204 0.042 19623
13 1 1 . 1 1 4 4 LYS C C 4 177.301 177.301 177.802 -0.501 19623
14 1 1 . 1 1 4 4 LYS CA C 4 56.606 56.606 57.578 -0.972 19623
15 1 1 . 1 1 4 4 LYS CB C 4 32.436 32.436 32.595 -0.159 19623
16 1 1 . 1 1 4 4 LYS H H 4 8.490 8.490 8.422 0.068 19623
17 1 1 . 1 1 5 5 GLY N N 5 109.376 109.376 107.408 1.968 19623
18 1 1 . 1 1 5 5 GLY C C 5 174.045 174.045 175.093 -1.048 19623
19 1 1 . 1 1 5 5 GLY CA C 5 45.305 45.305 45.396 -0.091 19623
20 1 1 . 1 1 5 5 GLY H H 5 8.491 8.491 7.990 0.501 19623
21 1 1 . 1 1 6 6 TYR N N 6 120.416 120.416 119.483 0.933 19623
22 1 1 . 1 1 6 6 TYR HA H 6 4.510 4.510 4.502 0.008 19623
23 1 1 . 1 1 6 6 TYR C C 6 175.952 175.952 176.226 -0.274 19623
24 1 1 . 1 1 6 6 TYR CA C 6 58.383 58.383 56.803 1.580 19623
25 1 1 . 1 1 6 6 TYR CB C 6 38.562 38.562 38.984 -0.422 19623
26 1 1 . 1 1 6 6 TYR H H 6 8.134 8.134 8.212 -0.078 19623
27 1 1 . 1 1 7 7 ASN N N 7 122.415 122.415 118.963 3.452 19623
28 1 1 . 1 1 7 7 ASN HA H 7 4.588 4.588 4.825 -0.237 19623
29 1 1 . 1 1 7 7 ASN C C 7 175.521 175.521 176.668 -1.147 19623
30 1 1 . 1 1 7 7 ASN CA C 7 53.408 53.408 53.658 -0.251 19623
31 1 1 . 1 1 7 7 ASN CB C 7 38.780 38.780 38.777 0.003 19623
32 1 1 . 1 1 7 7 ASN H H 7 8.557 8.557 8.740 -0.183 19623
33 1 1 . 1 1 8 8 GLY N N 8 109.431 109.431 109.855 -0.424 19623
34 1 1 . 1 1 8 8 GLY C C 8 175.609 175.609 176.375 -0.766 19623
35 1 1 . 1 1 8 8 GLY CA C 8 45.990 45.990 47.153 -1.163 19623
36 1 1 . 1 1 8 8 GLY H H 8 8.285 8.285 8.649 -0.364 19623
37 1 1 . 1 1 9 9 LEU N N 9 123.596 123.596 122.344 1.252 19623
38 1 1 . 1 1 9 9 LEU HA H 9 3.933 3.933 4.118 -0.185 19623
39 1 1 . 1 1 9 9 LEU C C 9 177.458 177.458 178.130 -0.672 19623
40 1 1 . 1 1 9 9 LEU CA C 9 58.248 58.248 57.513 0.735 19623
41 1 1 . 1 1 9 9 LEU CB C 9 41.690 41.690 41.594 0.096 19623
42 1 1 . 1 1 9 9 LEU H H 9 8.136 8.136 7.810 0.326 19623
43 1 1 . 1 1 10 10 ALA N N 10 121.310 121.310 120.547 0.763 19623
44 1 1 . 1 1 10 10 ALA HA H 10 3.933 3.933 3.969 -0.036 19623
45 1 1 . 1 1 10 10 ALA C C 10 181.140 181.140 180.013 1.127 19623
46 1 1 . 1 1 10 10 ALA CA C 10 55.505 55.505 55.159 0.346 19623
47 1 1 . 1 1 10 10 ALA CB C 10 17.791 17.791 18.156 -0.365 19623
48 1 1 . 1 1 10 10 ALA H H 10 8.361 8.361 8.301 0.060 19623
49 1 1 . 1 1 11 11 GLU N N 11 118.893 118.893 119.392 -0.499 19623
50 1 1 . 1 1 11 11 GLU HA H 11 3.992 3.992 4.095 -0.103 19623
51 1 1 . 1 1 11 11 GLU C C 11 178.797 178.797 179.043 -0.246 19623
52 1 1 . 1 1 11 11 GLU CA C 11 59.892 59.892 59.072 0.820 19623
53 1 1 . 1 1 11 11 GLU CB C 11 28.991 28.991 29.745 -0.754 19623
54 1 1 . 1 1 11 11 GLU H H 11 8.490 8.490 8.421 0.069 19623
55 1 1 . 1 1 12 12 ALA N N 12 122.362 122.362 122.873 -0.511 19623
56 1 1 . 1 1 12 12 ALA HA H 12 4.080 4.080 4.073 0.007 19623
57 1 1 . 1 1 12 12 ALA C C 12 181.228 181.228 179.640 1.588 19623
58 1 1 . 1 1 12 12 ALA CA C 12 55.218 55.218 55.263 -0.045 19623
59 1 1 . 1 1 12 12 ALA CB C 12 18.462 18.462 18.330 0.132 19623
60 1 1 . 1 1 12 12 ALA H H 12 8.099 8.099 8.157 -0.058 19623
61 1 1 . 1 1 13 13 LYS N N 13 118.689 118.689 118.381 0.308 19623
62 1 1 . 1 1 13 13 LYS HA H 13 3.620 3.620 3.990 -0.370 19623
63 1 1 . 1 1 13 13 LYS C C 13 177.203 177.203 178.609 -1.406 19623
64 1 1 . 1 1 13 13 LYS CA C 13 60.390 60.390 59.811 0.579 19623
65 1 1 . 1 1 13 13 LYS CB C 13 33.624 33.624 32.386 1.238 19623
66 1 1 . 1 1 13 13 LYS H H 13 8.382 8.382 8.209 0.173 19623
67 1 1 . 1 1 14 14 GLU N N 14 117.865 117.865 120.313 -2.448 19623
68 1 1 . 1 1 14 14 GLU HA H 14 4.285 4.285 4.038 0.247 19623
69 1 1 . 1 1 14 14 GLU C C 14 179.404 179.404 178.941 0.463 19623
70 1 1 . 1 1 14 14 GLU CA C 14 60.007 60.007 59.633 0.374 19623
71 1 1 . 1 1 14 14 GLU CB C 14 29.418 29.418 29.573 -0.155 19623
72 1 1 . 1 1 14 14 GLU H H 14 7.952 7.952 8.145 -0.193 19623
73 1 1 . 1 1 15 15 LYS N N 15 119.020 119.020 118.523 0.497 19623
74 1 1 . 1 1 15 15 LYS HA H 15 3.933 3.933 4.120 -0.187 19623
75 1 1 . 1 1 15 15 LYS C C 15 177.976 177.976 178.883 -0.907 19623
76 1 1 . 1 1 15 15 LYS CA C 15 59.591 59.591 58.979 0.612 19623
77 1 1 . 1 1 15 15 LYS CB C 15 32.275 32.275 32.359 -0.084 19623
78 1 1 . 1 1 15 15 LYS H H 15 8.029 8.029 8.052 -0.023 19623
79 1 1 . 1 1 16 16 ALA N N 16 120.410 120.410 123.230 -2.820 19623
80 1 1 . 1 1 16 16 ALA HA H 16 3.962 3.962 4.167 -0.205 19623
81 1 1 . 1 1 16 16 ALA C C 16 179.140 179.140 179.464 -0.324 19623
82 1 1 . 1 1 16 16 ALA CA C 16 55.426 55.426 55.144 0.282 19623
83 1 1 . 1 1 16 16 ALA CB C 16 18.410 18.410 18.660 -0.251 19623
84 1 1 . 1 1 16 16 ALA H H 16 7.904 7.904 7.857 0.047 19623
85 1 1 . 1 1 17 17 ILE N N 17 117.363 117.363 114.943 2.420 19623
86 1 1 . 1 1 17 17 ILE HA H 17 5.850 5.850 3.881 1.969 19623
87 1 1 . 1 1 17 17 ILE C C 17 177.604 177.604 177.677 -0.073 19623
88 1 1 . 1 1 17 17 ILE CA C 17 66.545 66.545 63.912 2.633 19623
89 1 1 . 1 1 17 17 ILE CB C 17 37.843 37.843 37.514 0.329 19623
90 1 1 . 1 1 17 17 ILE H H 17 8.500 8.500 7.962 0.538 19623
91 1 1 . 1 1 18 18 LYS N N 18 119.838 119.838 122.028 -2.190 19623
92 1 1 . 1 1 18 18 LYS HA H 18 3.865 3.865 3.893 -0.028 19623
93 1 1 . 1 1 18 18 LYS C C 18 176.653 176.653 178.579 -1.926 19623
94 1 1 . 1 1 18 18 LYS CA C 18 60.189 60.189 60.313 -0.124 19623
95 1 1 . 1 1 18 18 LYS CB C 18 32.260 32.260 32.182 0.078 19623
96 1 1 . 1 1 18 18 LYS H H 18 7.833 7.833 7.998 -0.165 19623
97 1 1 . 1 1 19 19 ASP N N 19 120.497 120.497 120.146 0.351 19623
98 1 1 . 1 1 19 19 ASP HA H 19 4.569 4.569 4.299 0.270 19623
99 1 1 . 1 1 19 19 ASP C C 19 179.120 179.120 178.940 0.180 19623
100 1 1 . 1 1 19 19 ASP CA C 19 57.108 57.108 57.161 -0.053 19623
101 1 1 . 1 1 19 19 ASP CB C 19 40.853 40.853 40.520 0.333 19623
102 1 1 . 1 1 19 19 ASP H H 19 8.479 8.479 7.923 0.556 19623
103 1 1 . 1 1 20 20 LEU N N 20 121.660 121.660 119.943 1.717 19623
104 1 1 . 1 1 20 20 LEU HA H 20 4.148 4.148 3.978 0.170 19623
105 1 1 . 1 1 20 20 LEU C C 20 178.377 178.377 179.024 -0.647 19623
106 1 1 . 1 1 20 20 LEU CA C 20 58.225 58.225 58.224 0.001 19623
107 1 1 . 1 1 20 20 LEU CB C 20 41.585 41.585 41.714 -0.129 19623
108 1 1 . 1 1 20 20 LEU H H 20 8.136 8.136 8.005 0.131 19623
109 1 1 . 1 1 21 21 LYS N N 21 120.182 120.182 119.197 0.985 19623
110 1 1 . 1 1 21 21 LYS HA H 21 3.904 3.904 4.088 -0.184 19623
111 1 1 . 1 1 21 21 LYS C C 21 179.785 179.785 179.829 -0.044 19623
112 1 1 . 1 1 21 21 LYS CA C 21 59.557 59.557 59.185 0.372 19623
113 1 1 . 1 1 21 21 LYS CB C 21 29.655 29.655 32.295 -2.640 19623
114 1 1 . 1 1 21 21 LYS H H 21 8.043 8.043 8.028 0.015 19623
115 1 1 . 1 1 22 22 ILE N N 22 121.523 121.523 119.899 1.624 19623
116 1 1 . 1 1 22 22 ILE HA H 22 3.522 3.522 3.707 -0.185 19623
117 1 1 . 1 1 22 22 ILE C C 22 177.399 177.399 176.828 0.571 19623
118 1 1 . 1 1 22 22 ILE CA C 22 64.863 64.863 64.032 0.831 19623
119 1 1 . 1 1 22 22 ILE CB C 22 38.046 38.046 37.889 0.157 19623
120 1 1 . 1 1 22 22 ILE H H 22 8.735 8.735 7.649 1.086 19623
121 1 1 . 1 1 23 23 TYR N N 23 117.506 117.506 117.318 0.188 19623
122 1 1 . 1 1 23 23 TYR HA H 23 4.481 4.481 4.508 -0.027 19623
123 1 1 . 1 1 23 23 TYR C C 23 176.020 176.020 175.551 0.469 19623
124 1 1 . 1 1 23 23 TYR CA C 23 58.369 58.369 57.489 0.880 19623
125 1 1 . 1 1 23 23 TYR CB C 23 38.499 38.499 37.872 0.627 19623
126 1 1 . 1 1 23 23 TYR H H 23 7.291 7.291 7.258 0.033 19623
127 1 1 . 1 1 24 24 GLY N N 24 108.209 108.209 108.057 0.152 19623
128 1 1 . 1 1 24 24 GLY C C 24 174.651 174.651 174.992 -0.341 19623
129 1 1 . 1 1 24 24 GLY CA C 24 46.409 46.409 45.495 0.914 19623
130 1 1 . 1 1 24 24 GLY H H 24 7.910 7.910 7.429 0.481 19623
131 1 1 . 1 1 25 25 ILE N N 25 119.897 119.897 121.619 -1.722 19623
132 1 1 . 1 1 25 25 ILE HA H 25 3.747 3.747 4.132 -0.385 19623
133 1 1 . 1 1 25 25 ILE C C 25 175.864 175.864 176.539 -0.675 19623
134 1 1 . 1 1 25 25 ILE CA C 25 60.984 60.984 60.476 0.508 19623
135 1 1 . 1 1 25 25 ILE CB C 25 37.120 37.120 37.391 -0.271 19623
136 1 1 . 1 1 25 25 ILE H H 25 7.383 7.383 7.981 -0.598 19623
137 1 1 . 1 1 26 26 GLY N N 26 111.580 111.580 115.069 -3.489 19623
138 1 1 . 1 1 26 26 GLY C C 26 174.847 174.847 175.163 -0.316 19623
139 1 1 . 1 1 26 26 GLY CA C 26 45.322 45.322 44.294 1.028 19623
140 1 1 . 1 1 26 26 GLY H H 26 8.811 8.811 8.405 0.406 19623
141 1 1 . 1 1 27 27 GLU N N 27 120.229 120.229 120.087 0.142 19623
142 1 1 . 1 1 27 27 GLU C C 27 177.311 177.311 178.597 -1.286 19623
143 1 1 . 1 1 27 27 GLU CA C 27 59.730 59.730 59.542 0.188 19623
144 1 1 . 1 1 27 27 GLU CB C 27 29.933 29.933 29.684 0.249 19623
145 1 1 . 1 1 27 27 GLU H H 27 8.711 8.711 8.959 -0.247 19623
146 1 1 . 1 1 28 28 HIS N N 28 117.558 117.558 118.505 -0.947 19623
147 1 1 . 1 1 28 28 HIS C C 28 176.949 176.949 176.428 0.521 19623
148 1 1 . 1 1 28 28 HIS CA C 28 59.674 59.674 59.293 0.381 19623
149 1 1 . 1 1 28 28 HIS CB C 28 29.838 29.838 29.373 0.465 19623
150 1 1 . 1 1 28 28 HIS H H 28 8.870 8.870 8.564 0.306 19623
151 1 1 . 1 1 29 29 TYR N N 29 115.589 115.589 115.488 0.101 19623
152 1 1 . 1 1 29 29 TYR HA H 29 4.090 4.090 4.412 -0.322 19623
153 1 1 . 1 1 29 29 TYR C C 29 177.552 177.552 177.389 0.163 19623
154 1 1 . 1 1 29 29 TYR CA C 29 60.998 60.998 60.315 0.683 19623
155 1 1 . 1 1 29 29 TYR CB C 29 38.683 38.683 39.141 -0.458 19623
156 1 1 . 1 1 29 29 TYR H H 29 7.227 7.227 7.558 -0.331 19623
157 1 1 . 1 1 30 30 ILE N N 30 120.353 120.353 121.148 -0.795 19623
158 1 1 . 1 1 30 30 ILE HA H 30 3.444 3.444 3.543 -0.099 19623
159 1 1 . 1 1 30 30 ILE C C 30 178.211 178.211 177.639 0.572 19623
160 1 1 . 1 1 30 30 ILE CA C 30 65.640 65.640 65.756 -0.116 19623
161 1 1 . 1 1 30 30 ILE CB C 30 37.553 37.553 37.678 -0.125 19623
162 1 1 . 1 1 30 30 ILE H H 30 7.485 7.485 7.941 -0.456 19623
163 1 1 . 1 1 31 31 LYS N N 31 117.249 117.249 119.261 -2.012 19623
164 1 1 . 1 1 31 31 LYS HA H 31 4.011 4.011 4.064 -0.053 19623
165 1 1 . 1 1 31 31 LYS C C 31 178.954 178.954 178.869 0.085 19623
166 1 1 . 1 1 31 31 LYS CA C 31 58.893 58.893 59.201 -0.308 19623
167 1 1 . 1 1 31 31 LYS CB C 31 31.673 31.673 32.179 -0.506 19623
168 1 1 . 1 1 31 31 LYS H H 31 8.064 8.064 8.163 -0.099 19623
169 1 1 . 1 1 32 32 LEU N N 32 117.176 117.176 119.621 -2.445 19623
170 1 1 . 1 1 32 32 LEU HA H 32 3.894 3.894 3.929 -0.035 19623
171 1 1 . 1 1 32 32 LEU C C 32 179.883 179.883 177.839 2.044 19623
172 1 1 . 1 1 32 32 LEU CA C 32 57.987 57.987 57.508 0.479 19623
173 1 1 . 1 1 32 32 LEU CB C 32 41.255 41.255 41.614 -0.359 19623
174 1 1 . 1 1 32 32 LEU H H 32 7.154 7.154 7.213 -0.059 19623
175 1 1 . 1 1 33 33 ILE N N 33 118.598 118.598 115.527 3.071 19623
176 1 1 . 1 1 33 33 ILE HA H 33 3.571 3.571 3.732 -0.161 19623
177 1 1 . 1 1 33 33 ILE C C 33 177.917 177.917 178.946 -1.029 19623
178 1 1 . 1 1 33 33 ILE CA C 33 63.579 63.579 62.688 0.891 19623
179 1 1 . 1 1 33 33 ILE CB C 33 35.702 35.702 37.508 -1.806 19623
180 1 1 . 1 1 33 33 ILE H H 33 7.412 7.412 7.454 -0.042 19623
181 1 1 . 1 1 34 34 GLU N N 34 116.574 116.574 120.053 -3.479 19623
182 1 1 . 1 1 34 34 GLU HA H 34 3.826 3.826 4.003 -0.177 19623
183 1 1 . 1 1 34 34 GLU C C 34 178.661 178.661 178.649 0.012 19623
184 1 1 . 1 1 34 34 GLU CA C 34 59.689 59.689 59.760 -0.071 19623
185 1 1 . 1 1 34 34 GLU CB C 34 29.855 29.855 29.356 0.499 19623
186 1 1 . 1 1 34 34 GLU H H 34 7.987 7.987 7.779 0.208 19623
187 1 1 . 1 1 35 35 LYS N N 35 114.863 114.863 117.817 -2.954 19623
188 1 1 . 1 1 35 35 LYS HA H 35 4.207 4.207 4.310 -0.103 19623
189 1 1 . 1 1 35 35 LYS C C 35 176.861 176.861 175.836 1.025 19623
190 1 1 . 1 1 35 35 LYS CA C 35 56.328 56.328 55.409 0.919 19623
191 1 1 . 1 1 35 35 LYS CB C 35 33.007 33.007 32.719 0.287 19623
192 1 1 . 1 1 35 35 LYS H H 35 7.361 7.361 7.736 -0.375 19623
193 1 1 . 1 1 36 36 ALA N N 36 124.407 124.407 124.857 -0.450 19623
194 1 1 . 1 1 36 36 ALA HA H 36 4.129 4.129 4.209 -0.080 19623
195 1 1 . 1 1 36 36 ALA C C 36 178.279 178.279 177.671 0.608 19623
196 1 1 . 1 1 36 36 ALA CA C 36 53.257 53.257 52.904 0.353 19623
197 1 1 . 1 1 36 36 ALA CB C 36 19.581 19.581 19.707 -0.126 19623
198 1 1 . 1 1 36 36 ALA H H 36 7.365 7.365 7.462 -0.097 19623
199 1 1 . 1 1 37 37 LYS N N 37 116.217 116.217 119.862 -3.645 19623
200 1 1 . 1 1 37 37 LYS HA H 37 4.383 4.383 4.148 0.235 19623
201 1 1 . 1 1 37 37 LYS C C 37 176.167 176.167 176.117 0.050 19623
202 1 1 . 1 1 37 37 LYS CA C 37 56.602 56.602 57.931 -1.329 19623
203 1 1 . 1 1 37 37 LYS CB C 37 34.883 34.883 32.781 2.103 19623
204 1 1 . 1 1 37 37 LYS H H 37 8.908 8.908 8.667 0.241 19623
205 1 1 . 1 1 38 38 GLN N N 38 113.293 113.293 114.220 -0.927 19623
206 1 1 . 1 1 38 38 GLN HA H 38 4.813 4.813 4.499 0.314 19623
207 1 1 . 1 1 38 38 GLN C C 38 176.138 176.138 175.502 0.636 19623
208 1 1 . 1 1 38 38 GLN CA C 38 54.117 54.117 54.919 -0.802 19623
209 1 1 . 1 1 38 38 GLN CB C 38 32.222 32.222 31.274 0.948 19623
210 1 1 . 1 1 38 38 GLN H H 38 7.033 7.033 7.552 -0.519 19623
211 1 1 . 1 1 39 39 VAL N N 39 125.474 125.474 120.845 4.629 19623
212 1 1 . 1 1 39 39 VAL C C 39 177.751 177.751 177.701 0.050 19623
213 1 1 . 1 1 39 39 VAL CA C 39 67.737 67.737 66.212 1.525 19623
214 1 1 . 1 1 39 39 VAL CB C 39 31.438 31.438 31.390 0.048 19623
215 1 1 . 1 1 39 39 VAL H H 39 9.250 9.250 8.734 0.516 19623
216 1 1 . 1 1 40 40 ALA N N 40 120.717 120.717 122.523 -1.806 19623
217 1 1 . 1 1 40 40 ALA HA H 40 4.041 4.041 4.086 -0.045 19623
218 1 1 . 1 1 40 40 ALA C C 40 179.081 179.081 179.339 -0.258 19623
219 1 1 . 1 1 40 40 ALA CA C 40 55.059 55.059 55.256 -0.197 19623
220 1 1 . 1 1 40 40 ALA CB C 40 17.735 17.735 17.981 -0.246 19623
221 1 1 . 1 1 40 40 ALA H H 40 8.903 8.903 8.334 0.569 19623
222 1 1 . 1 1 41 41 ALA N N 41 116.698 116.698 121.042 -4.344 19623
223 1 1 . 1 1 41 41 ALA HA H 41 4.236 4.236 4.030 0.206 19623
224 1 1 . 1 1 41 41 ALA C C 41 180.294 180.294 179.776 0.518 19623
225 1 1 . 1 1 41 41 ALA CA C 41 54.688 54.688 54.654 0.034 19623
226 1 1 . 1 1 41 41 ALA CB C 41 18.724 18.724 18.141 0.583 19623
227 1 1 . 1 1 41 41 ALA H H 41 6.701 6.701 7.485 -0.784 19623
228 1 1 . 1 1 42 42 VAL N N 42 119.051 119.051 119.013 0.038 19623
229 1 1 . 1 1 42 42 VAL HA H 42 3.278 3.278 3.461 -0.183 19623
230 1 1 . 1 1 42 42 VAL C C 42 176.812 176.812 178.318 -1.506 19623
231 1 1 . 1 1 42 42 VAL CA C 42 67.641 67.641 67.140 0.501 19623
232 1 1 . 1 1 42 42 VAL CB C 42 31.399 31.399 31.611 -0.212 19623
233 1 1 . 1 1 42 42 VAL H H 42 7.552 7.552 8.121 -0.569 19623
234 1 1 . 1 1 43 43 GLU N N 43 117.715 117.715 119.692 -1.977 19623
235 1 1 . 1 1 43 43 GLU HA H 43 3.855 3.855 3.985 -0.130 19623
236 1 1 . 1 1 43 43 GLU C C 43 178.973 178.973 178.934 0.039 19623
237 1 1 . 1 1 43 43 GLU CA C 43 59.393 59.393 59.938 -0.544 19623
238 1 1 . 1 1 43 43 GLU CB C 43 28.811 28.811 29.476 -0.665 19623
239 1 1 . 1 1 43 43 GLU H H 43 7.804 7.804 8.217 -0.413 19623
240 1 1 . 1 1 44 44 ASP N N 44 119.175 119.175 120.413 -1.238 19623
241 1 1 . 1 1 44 44 ASP HA H 44 4.363 4.363 4.462 -0.099 19623
242 1 1 . 1 1 44 44 ASP C C 44 178.211 178.211 178.899 -0.688 19623
243 1 1 . 1 1 44 44 ASP CA C 44 57.308 57.308 57.095 0.213 19623
244 1 1 . 1 1 44 44 ASP CB C 44 40.504 40.504 40.613 -0.109 19623
245 1 1 . 1 1 44 44 ASP H H 44 8.169 8.169 8.116 0.053 19623
246 1 1 . 1 1 45 45 LEU N N 45 117.848 117.848 120.554 -2.706 19623
247 1 1 . 1 1 45 45 LEU HA H 45 4.119 4.119 3.935 0.184 19623
248 1 1 . 1 1 45 45 LEU C C 45 178.416 178.416 178.594 -0.178 19623
249 1 1 . 1 1 45 45 LEU CA C 45 57.294 57.294 57.944 -0.650 19623
250 1 1 . 1 1 45 45 LEU CB C 45 40.474 40.474 41.851 -1.377 19623
251 1 1 . 1 1 45 45 LEU H H 45 8.119 8.119 8.479 -0.359 19623
252 1 1 . 1 1 46 46 LYS N N 46 119.462 119.462 119.789 -0.327 19623
253 1 1 . 1 1 46 46 LYS HA H 46 3.972 3.972 3.809 0.163 19623
254 1 1 . 1 1 46 46 LYS C C 46 177.653 177.653 178.626 -0.973 19623
255 1 1 . 1 1 46 46 LYS CA C 46 60.276 60.276 60.156 0.120 19623
256 1 1 . 1 1 46 46 LYS CB C 46 31.450 31.450 32.154 -0.704 19623
257 1 1 . 1 1 46 46 LYS H H 46 8.483 8.483 7.939 0.544 19623
258 1 1 . 1 1 47 47 ASP N N 47 117.470 117.470 119.318 -1.848 19623
259 1 1 . 1 1 47 47 ASP HA H 47 4.344 4.344 4.341 0.003 19623
260 1 1 . 1 1 47 47 ASP C C 47 179.384 179.384 178.996 0.388 19623
261 1 1 . 1 1 47 47 ASP CA C 47 57.687 57.687 57.357 0.330 19623
262 1 1 . 1 1 47 47 ASP CB C 47 40.809 40.809 40.216 0.593 19623
263 1 1 . 1 1 47 47 ASP H H 47 7.846 7.846 7.887 -0.041 19623
264 1 1 . 1 1 48 48 GLU N N 48 119.662 119.662 119.679 -0.017 19623
265 1 1 . 1 1 48 48 GLU HA H 48 4.011 4.011 4.085 -0.074 19623
266 1 1 . 1 1 48 48 GLU C C 48 180.724 180.724 179.357 1.367 19623
267 1 1 . 1 1 48 48 GLU CA C 48 60.091 60.091 58.738 1.353 19623
268 1 1 . 1 1 48 48 GLU CB C 48 31.991 31.991 29.395 2.596 19623
269 1 1 . 1 1 48 48 GLU H H 48 8.327 8.327 7.891 0.436 19623
270 1 1 . 1 1 49 49 ILE N N 49 120.308 120.308 120.911 -0.603 19623
271 1 1 . 1 1 49 49 ILE HA H 49 3.738 3.738 3.567 0.171 19623
272 1 1 . 1 1 49 49 ILE C C 49 179.238 179.238 177.981 1.257 19623
273 1 1 . 1 1 49 49 ILE CA C 49 64.592 64.592 65.375 -0.783 19623
274 1 1 . 1 1 49 49 ILE CB C 49 37.959 37.959 37.896 0.063 19623
275 1 1 . 1 1 49 49 ILE H H 49 7.667 7.667 8.393 -0.726 19623
276 1 1 . 1 1 50 50 LEU N N 50 121.274 121.274 119.619 1.655 19623
277 1 1 . 1 1 50 50 LEU HA H 50 4.559 4.559 3.904 0.655 19623
278 1 1 . 1 1 50 50 LEU C C 50 179.971 179.971 179.041 0.930 19623
279 1 1 . 1 1 50 50 LEU CA C 50 57.794 57.794 57.318 0.476 19623
280 1 1 . 1 1 50 50 LEU CB C 50 40.856 40.856 41.075 -0.219 19623
281 1 1 . 1 1 50 50 LEU H H 50 8.474 8.474 7.912 0.562 19623
282 1 1 . 1 1 51 51 LYS N N 51 119.972 119.972 120.009 -0.037 19623
283 1 1 . 1 1 51 51 LYS HA H 51 3.982 3.982 3.896 0.086 19623
284 1 1 . 1 1 51 51 LYS C C 51 179.189 179.189 178.946 0.243 19623
285 1 1 . 1 1 51 51 LYS CA C 51 59.526 59.526 59.712 -0.186 19623
286 1 1 . 1 1 51 51 LYS CB C 51 32.175 32.175 32.118 0.057 19623
287 1 1 . 1 1 51 51 LYS H H 51 8.197 8.197 8.137 0.060 19623
288 1 1 . 1 1 52 52 ALA N N 52 121.059 121.059 120.695 0.364 19623
289 1 1 . 1 1 52 52 ALA HA H 52 4.158 4.158 3.981 0.177 19623
290 1 1 . 1 1 52 52 ALA C C 52 178.015 178.015 178.469 -0.454 19623
291 1 1 . 1 1 52 52 ALA CA C 52 53.662 53.662 54.541 -0.879 19623
292 1 1 . 1 1 52 52 ALA CB C 52 17.903 17.903 18.192 -0.288 19623
293 1 1 . 1 1 52 52 ALA H H 52 7.809 7.809 7.603 0.206 19623
294 1 1 . 1 1 53 53 HIS N N 53 115.943 115.943 116.653 -0.710 19623
295 1 1 . 1 1 53 53 HIS HA H 53 4.373 4.373 4.096 0.277 19623
296 1 1 . 1 1 53 53 HIS C C 53 174.015 174.015 176.751 -2.736 19623
297 1 1 . 1 1 53 53 HIS CA C 53 57.409 57.409 58.616 -1.207 19623
298 1 1 . 1 1 53 53 HIS CB C 53 29.010 29.010 29.947 -0.937 19623
299 1 1 . 1 1 53 53 HIS H H 53 7.598 7.598 7.618 -0.020 19623
300 1 1 . 1 1 54 54 ASP N N 54 119.133 119.133 117.237 1.896 19623
301 1 1 . 1 1 54 54 ASP HA H 54 4.442 4.442 4.420 0.022 19623
302 1 1 . 1 1 54 54 ASP C C 54 175.609 175.609 175.528 0.081 19623
303 1 1 . 1 1 54 54 ASP CA C 54 54.971 54.971 55.317 -0.346 19623
304 1 1 . 1 1 54 54 ASP CB C 54 40.209 40.209 40.920 -0.711 19623
305 1 1 . 1 1 54 54 ASP H H 54 7.974 7.974 7.944 0.030 19623
306 1 1 . 1 1 55 55 ARG N N 55 118.206 118.206 120.622 -2.416 19623
307 1 1 . 1 1 55 55 ARG HA H 55 4.324 4.324 4.129 0.195 19623
308 1 1 . 1 1 55 55 ARG C C 55 174.671 174.671 174.441 0.230 19623
309 1 1 . 1 1 55 55 ARG CA C 55 54.785 54.785 56.364 -1.579 19623
310 1 1 . 1 1 55 55 ARG CB C 55 30.507 30.507 29.993 0.514 19623
311 1 1 . 1 1 55 55 ARG H H 55 7.943 7.943 7.287 0.656 19623
312 1 2 . 1 1 2 2 GLY N N 2 113.169 113.169 108.295 4.874 19623
313 1 2 . 1 1 2 2 GLY C C 2 173.996 173.996 173.401 0.595 19623
314 1 2 . 1 1 2 2 GLY CA C 2 45.211 45.211 45.050 0.161 19623
315 1 2 . 1 1 2 2 GLY H H 2 8.533 8.533 8.321 0.212 19623
316 1 2 . 1 1 3 3 ASP N N 3 120.717 120.717 119.749 0.968 19623
317 1 2 . 1 1 3 3 ASP HA H 3 4.559 4.559 4.481 0.078 19623
318 1 2 . 1 1 3 3 ASP C C 3 176.675 176.675 177.160 -0.485 19623
319 1 2 . 1 1 3 3 ASP CA C 3 54.489 54.489 54.106 0.383 19623
320 1 2 . 1 1 3 3 ASP CB C 3 41.197 41.197 40.988 0.209 19623
321 1 2 . 1 1 3 3 ASP H H 3 8.412 8.412 7.940 0.472 19623
322 1 2 . 1 1 4 4 LYS N N 4 121.955 121.955 123.420 -1.465 19623
323 1 2 . 1 1 4 4 LYS HA H 4 4.246 4.246 4.257 -0.011 19623
324 1 2 . 1 1 4 4 LYS C C 4 177.301 177.301 177.261 0.040 19623
325 1 2 . 1 1 4 4 LYS CA C 4 56.606 56.606 54.529 2.077 19623
326 1 2 . 1 1 4 4 LYS CB C 4 32.436 32.436 32.349 0.087 19623
327 1 2 . 1 1 4 4 LYS H H 4 8.490 8.490 8.146 0.344 19623
328 1 2 . 1 1 5 5 GLY N N 5 109.376 109.376 108.128 1.248 19623
329 1 2 . 1 1 5 5 GLY C C 5 174.045 174.045 174.617 -0.572 19623
330 1 2 . 1 1 5 5 GLY CA C 5 45.305 45.305 45.596 -0.291 19623
331 1 2 . 1 1 5 5 GLY H H 5 8.491 8.491 8.159 0.332 19623
332 1 2 . 1 1 6 6 TYR N N 6 120.416 120.416 118.184 2.232 19623
333 1 2 . 1 1 6 6 TYR HA H 6 4.510 4.510 4.390 0.120 19623
334 1 2 . 1 1 6 6 TYR C C 6 175.952 175.952 175.747 0.205 19623
335 1 2 . 1 1 6 6 TYR CA C 6 58.383 58.383 55.553 2.830 19623
336 1 2 . 1 1 6 6 TYR CB C 6 38.562 38.562 38.854 -0.292 19623
337 1 2 . 1 1 6 6 TYR H H 6 8.134 8.134 8.047 0.087 19623
338 1 2 . 1 1 7 7 ASN N N 7 122.415 122.415 121.369 1.046 19623
339 1 2 . 1 1 7 7 ASN HA H 7 4.588 4.588 4.523 0.065 19623
340 1 2 . 1 1 7 7 ASN C C 7 175.521 175.521 176.085 -0.564 19623
341 1 2 . 1 1 7 7 ASN CA C 7 53.408 53.408 53.974 -0.566 19623
342 1 2 . 1 1 7 7 ASN CB C 7 38.780 38.780 37.573 1.207 19623
343 1 2 . 1 1 7 7 ASN H H 7 8.557 8.557 8.729 -0.172 19623
344 1 2 . 1 1 8 8 GLY N N 8 109.431 109.431 113.611 -4.180 19623
345 1 2 . 1 1 8 8 GLY C C 8 175.609 175.609 174.935 0.674 19623
346 1 2 . 1 1 8 8 GLY CA C 8 45.990 45.990 44.924 1.066 19623
347 1 2 . 1 1 8 8 GLY H H 8 8.285 8.285 8.694 -0.409 19623
348 1 2 . 1 1 9 9 LEU N N 9 123.596 123.596 122.452 1.144 19623
349 1 2 . 1 1 9 9 LEU HA H 9 3.933 3.933 4.146 -0.213 19623
350 1 2 . 1 1 9 9 LEU C C 9 177.458 177.458 177.404 0.054 19623
351 1 2 . 1 1 9 9 LEU CA C 9 58.248 58.248 58.385 -0.137 19623
352 1 2 . 1 1 9 9 LEU CB C 9 41.690 41.690 41.693 -0.003 19623
353 1 2 . 1 1 9 9 LEU H H 9 8.136 8.136 7.928 0.208 19623
354 1 2 . 1 1 10 10 ALA N N 10 121.310 121.310 120.952 0.358 19623
355 1 2 . 1 1 10 10 ALA HA H 10 3.933 3.933 3.873 0.060 19623
356 1 2 . 1 1 10 10 ALA C C 10 181.140 181.140 178.928 2.212 19623
357 1 2 . 1 1 10 10 ALA CA C 10 55.505 55.505 55.550 -0.045 19623
358 1 2 . 1 1 10 10 ALA CB C 10 17.791 17.791 17.737 0.054 19623
359 1 2 . 1 1 10 10 ALA H H 10 8.361 8.361 8.668 -0.307 19623
360 1 2 . 1 1 11 11 GLU N N 11 118.893 118.893 119.874 -0.981 19623
361 1 2 . 1 1 11 11 GLU HA H 11 3.992 3.992 3.970 0.022 19623
362 1 2 . 1 1 11 11 GLU C C 11 178.797 178.797 178.263 0.534 19623
363 1 2 . 1 1 11 11 GLU CA C 11 59.892 59.892 59.391 0.501 19623
364 1 2 . 1 1 11 11 GLU CB C 11 28.991 28.991 29.306 -0.316 19623
365 1 2 . 1 1 11 11 GLU H H 11 8.490 8.490 8.237 0.253 19623
366 1 2 . 1 1 12 12 ALA N N 12 122.362 122.362 121.824 0.538 19623
367 1 2 . 1 1 12 12 ALA HA H 12 4.080 4.080 4.083 -0.003 19623
368 1 2 . 1 1 12 12 ALA C C 12 181.228 181.228 179.872 1.356 19623
369 1 2 . 1 1 12 12 ALA CA C 12 55.218 55.218 55.174 0.044 19623
370 1 2 . 1 1 12 12 ALA CB C 12 18.462 18.462 18.354 0.108 19623
371 1 2 . 1 1 12 12 ALA H H 12 8.099 8.099 8.163 -0.064 19623
372 1 2 . 1 1 13 13 LYS N N 13 118.689 118.689 118.519 0.170 19623
373 1 2 . 1 1 13 13 LYS HA H 13 3.620 3.620 3.910 -0.290 19623
374 1 2 . 1 1 13 13 LYS C C 13 177.203 177.203 178.901 -1.698 19623
375 1 2 . 1 1 13 13 LYS CA C 13 60.390 60.390 60.290 0.100 19623
376 1 2 . 1 1 13 13 LYS CB C 13 33.624 33.624 32.321 1.303 19623
377 1 2 . 1 1 13 13 LYS H H 13 8.382 8.382 8.282 0.100 19623
378 1 2 . 1 1 14 14 GLU N N 14 117.865 117.865 119.612 -1.747 19623
379 1 2 . 1 1 14 14 GLU HA H 14 4.285 4.285 4.087 0.198 19623
380 1 2 . 1 1 14 14 GLU C C 14 179.404 179.404 178.952 0.452 19623
381 1 2 . 1 1 14 14 GLU CA C 14 60.007 60.007 59.377 0.630 19623
382 1 2 . 1 1 14 14 GLU CB C 14 29.418 29.418 29.657 -0.239 19623
383 1 2 . 1 1 14 14 GLU H H 14 7.952 7.952 8.098 -0.146 19623
384 1 2 . 1 1 15 15 LYS N N 15 119.020 119.020 118.935 0.085 19623
385 1 2 . 1 1 15 15 LYS HA H 15 3.933 3.933 4.090 -0.157 19623
386 1 2 . 1 1 15 15 LYS C C 15 177.976 177.976 178.956 -0.980 19623
387 1 2 . 1 1 15 15 LYS CA C 15 59.591 59.591 59.192 0.399 19623
388 1 2 . 1 1 15 15 LYS CB C 15 32.275 32.275 32.387 -0.112 19623
389 1 2 . 1 1 15 15 LYS H H 15 8.029 8.029 8.079 -0.050 19623
390 1 2 . 1 1 16 16 ALA N N 16 120.410 120.410 122.226 -1.816 19623
391 1 2 . 1 1 16 16 ALA HA H 16 3.962 3.962 4.155 -0.193 19623
392 1 2 . 1 1 16 16 ALA C C 16 179.140 179.140 179.489 -0.349 19623
393 1 2 . 1 1 16 16 ALA CA C 16 55.426 55.426 55.218 0.208 19623
394 1 2 . 1 1 16 16 ALA CB C 16 18.410 18.410 18.667 -0.257 19623
395 1 2 . 1 1 16 16 ALA H H 16 7.904 7.904 8.106 -0.202 19623
396 1 2 . 1 1 17 17 ILE N N 17 117.363 117.363 114.463 2.900 19623
397 1 2 . 1 1 17 17 ILE HA H 17 5.850 5.850 3.946 1.904 19623
398 1 2 . 1 1 17 17 ILE C C 17 177.604 177.604 177.609 -0.005 19623
399 1 2 . 1 1 17 17 ILE CA C 17 66.545 66.545 63.658 2.887 19623
400 1 2 . 1 1 17 17 ILE CB C 17 37.843 37.843 37.575 0.268 19623
401 1 2 . 1 1 17 17 ILE H H 17 8.500 8.500 7.567 0.933 19623
402 1 2 . 1 1 18 18 LYS N N 18 119.838 119.838 122.056 -2.218 19623
403 1 2 . 1 1 18 18 LYS HA H 18 3.865 3.865 3.927 -0.062 19623
404 1 2 . 1 1 18 18 LYS C C 18 176.653 176.653 178.685 -2.032 19623
405 1 2 . 1 1 18 18 LYS CA C 18 60.189 60.189 60.287 -0.098 19623
406 1 2 . 1 1 18 18 LYS CB C 18 32.260 32.260 32.176 0.084 19623
407 1 2 . 1 1 18 18 LYS H H 18 7.833 7.833 8.179 -0.346 19623
408 1 2 . 1 1 19 19 ASP N N 19 120.497 120.497 119.952 0.545 19623
409 1 2 . 1 1 19 19 ASP HA H 19 4.569 4.569 4.397 0.172 19623
410 1 2 . 1 1 19 19 ASP C C 19 179.120 179.120 178.873 0.247 19623
411 1 2 . 1 1 19 19 ASP CA C 19 57.108 57.108 57.010 0.098 19623
412 1 2 . 1 1 19 19 ASP CB C 19 40.853 40.853 40.583 0.270 19623
413 1 2 . 1 1 19 19 ASP H H 19 8.479 8.479 7.771 0.708 19623
414 1 2 . 1 1 20 20 LEU N N 20 121.660 121.660 120.526 1.134 19623
415 1 2 . 1 1 20 20 LEU HA H 20 4.148 4.148 4.015 0.133 19623
416 1 2 . 1 1 20 20 LEU C C 20 178.377 178.377 178.932 -0.555 19623
417 1 2 . 1 1 20 20 LEU CA C 20 58.225 58.225 58.333 -0.108 19623
418 1 2 . 1 1 20 20 LEU CB C 20 41.585 41.585 41.703 -0.118 19623
419 1 2 . 1 1 20 20 LEU H H 20 8.136 8.136 7.646 0.490 19623
420 1 2 . 1 1 21 21 LYS N N 21 120.182 120.182 118.857 1.325 19623
421 1 2 . 1 1 21 21 LYS HA H 21 3.904 3.904 4.032 -0.128 19623
422 1 2 . 1 1 21 21 LYS C C 21 179.785 179.785 179.185 0.600 19623
423 1 2 . 1 1 21 21 LYS CA C 21 59.557 59.557 59.213 0.344 19623
424 1 2 . 1 1 21 21 LYS CB C 21 29.655 29.655 32.315 -2.660 19623
425 1 2 . 1 1 21 21 LYS H H 21 8.043 8.043 8.009 0.034 19623
426 1 2 . 1 1 22 22 ILE N N 22 121.523 121.523 118.638 2.885 19623
427 1 2 . 1 1 22 22 ILE HA H 22 3.522 3.522 3.711 -0.189 19623
428 1 2 . 1 1 22 22 ILE C C 22 177.399 177.399 177.686 -0.287 19623
429 1 2 . 1 1 22 22 ILE CA C 22 64.863 64.863 63.985 0.878 19623
430 1 2 . 1 1 22 22 ILE CB C 22 38.046 38.046 37.980 0.067 19623
431 1 2 . 1 1 22 22 ILE H H 22 8.735 8.735 7.295 1.440 19623
432 1 2 . 1 1 23 23 TYR N N 23 117.506 117.506 117.358 0.148 19623
433 1 2 . 1 1 23 23 TYR HA H 23 4.481 4.481 4.555 -0.074 19623
434 1 2 . 1 1 23 23 TYR C C 23 176.020 176.020 176.017 0.003 19623
435 1 2 . 1 1 23 23 TYR CA C 23 58.369 58.369 58.116 0.253 19623
436 1 2 . 1 1 23 23 TYR CB C 23 38.499 38.499 37.637 0.862 19623
437 1 2 . 1 1 23 23 TYR H H 23 7.291 7.291 7.740 -0.449 19623
438 1 2 . 1 1 24 24 GLY N N 24 108.209 108.209 107.301 0.908 19623
439 1 2 . 1 1 24 24 GLY C C 24 174.651 174.651 174.606 0.045 19623
440 1 2 . 1 1 24 24 GLY CA C 24 46.409 46.409 45.104 1.305 19623
441 1 2 . 1 1 24 24 GLY H H 24 7.910 7.910 7.460 0.450 19623
442 1 2 . 1 1 25 25 ILE N N 25 119.897 119.897 122.354 -2.457 19623
443 1 2 . 1 1 25 25 ILE HA H 25 3.747 3.747 4.027 -0.280 19623
444 1 2 . 1 1 25 25 ILE C C 25 175.864 175.864 176.203 -0.339 19623
445 1 2 . 1 1 25 25 ILE CA C 25 60.984 60.984 61.378 -0.394 19623
446 1 2 . 1 1 25 25 ILE CB C 25 37.120 37.120 38.773 -1.653 19623
447 1 2 . 1 1 25 25 ILE H H 25 7.383 7.383 8.002 -0.619 19623
448 1 2 . 1 1 26 26 GLY N N 26 111.580 111.580 114.860 -3.280 19623
449 1 2 . 1 1 26 26 GLY C C 26 174.847 174.847 175.096 -0.249 19623
450 1 2 . 1 1 26 26 GLY CA C 26 45.322 45.322 44.481 0.841 19623
451 1 2 . 1 1 26 26 GLY H H 26 8.811 8.811 8.310 0.501 19623
452 1 2 . 1 1 27 27 GLU N N 27 120.229 120.229 119.220 1.009 19623
453 1 2 . 1 1 27 27 GLU C C 27 177.311 177.311 178.642 -1.331 19623
454 1 2 . 1 1 27 27 GLU CA C 27 59.730 59.730 59.454 0.276 19623
455 1 2 . 1 1 27 27 GLU CB C 27 29.933 29.933 29.661 0.272 19623
456 1 2 . 1 1 27 27 GLU H H 27 8.711 8.711 8.905 -0.194 19623
457 1 2 . 1 1 28 28 HIS N N 28 117.558 117.558 118.493 -0.935 19623
458 1 2 . 1 1 28 28 HIS C C 28 176.949 176.949 176.243 0.706 19623
459 1 2 . 1 1 28 28 HIS CA C 28 59.674 59.674 59.266 0.408 19623
460 1 2 . 1 1 28 28 HIS CB C 28 29.838 29.838 29.416 0.422 19623
461 1 2 . 1 1 28 28 HIS H H 28 8.870 8.870 8.597 0.273 19623
462 1 2 . 1 1 29 29 TYR N N 29 115.589 115.589 115.103 0.486 19623
463 1 2 . 1 1 29 29 TYR HA H 29 4.090 4.090 4.467 -0.377 19623
464 1 2 . 1 1 29 29 TYR C C 29 177.552 177.552 177.220 0.332 19623
465 1 2 . 1 1 29 29 TYR CA C 29 60.998 60.998 60.154 0.844 19623
466 1 2 . 1 1 29 29 TYR CB C 29 38.683 38.683 39.379 -0.696 19623
467 1 2 . 1 1 29 29 TYR H H 29 7.227 7.227 7.545 -0.318 19623
468 1 2 . 1 1 30 30 ILE N N 30 120.353 120.353 121.301 -0.948 19623
469 1 2 . 1 1 30 30 ILE HA H 30 3.444 3.444 3.558 -0.114 19623
470 1 2 . 1 1 30 30 ILE C C 30 178.211 178.211 177.655 0.556 19623
471 1 2 . 1 1 30 30 ILE CA C 30 65.640 65.640 65.804 -0.164 19623
472 1 2 . 1 1 30 30 ILE CB C 30 37.553 37.553 37.766 -0.213 19623
473 1 2 . 1 1 30 30 ILE H H 30 7.485 7.485 7.825 -0.340 19623
474 1 2 . 1 1 31 31 LYS N N 31 117.249 117.249 119.124 -1.875 19623
475 1 2 . 1 1 31 31 LYS HA H 31 4.011 4.011 4.248 -0.237 19623
476 1 2 . 1 1 31 31 LYS C C 31 178.954 178.954 178.905 0.049 19623
477 1 2 . 1 1 31 31 LYS CA C 31 58.893 58.893 59.055 -0.162 19623
478 1 2 . 1 1 31 31 LYS CB C 31 31.673 31.673 32.170 -0.497 19623
479 1 2 . 1 1 31 31 LYS H H 31 8.064 8.064 8.247 -0.183 19623
480 1 2 . 1 1 32 32 LEU N N 32 117.176 117.176 119.328 -2.152 19623
481 1 2 . 1 1 32 32 LEU HA H 32 3.894 3.894 3.929 -0.035 19623
482 1 2 . 1 1 32 32 LEU C C 32 179.883 179.883 178.037 1.846 19623
483 1 2 . 1 1 32 32 LEU CA C 32 57.987 57.987 57.598 0.389 19623
484 1 2 . 1 1 32 32 LEU CB C 32 41.255 41.255 41.840 -0.585 19623
485 1 2 . 1 1 32 32 LEU H H 32 7.154 7.154 7.343 -0.189 19623
486 1 2 . 1 1 33 33 ILE N N 33 118.598 118.598 115.762 2.836 19623
487 1 2 . 1 1 33 33 ILE HA H 33 3.571 3.571 3.724 -0.153 19623
488 1 2 . 1 1 33 33 ILE C C 33 177.917 177.917 178.797 -0.880 19623
489 1 2 . 1 1 33 33 ILE CA C 33 63.579 63.579 63.623 -0.044 19623
490 1 2 . 1 1 33 33 ILE CB C 33 35.702 35.702 38.184 -2.482 19623
491 1 2 . 1 1 33 33 ILE H H 33 7.412 7.412 7.423 -0.011 19623
492 1 2 . 1 1 34 34 GLU N N 34 116.574 116.574 120.311 -3.737 19623
493 1 2 . 1 1 34 34 GLU HA H 34 3.826 3.826 3.996 -0.170 19623
494 1 2 . 1 1 34 34 GLU C C 34 178.661 178.661 177.751 0.910 19623
495 1 2 . 1 1 34 34 GLU CA C 34 59.689 59.689 59.494 0.195 19623
496 1 2 . 1 1 34 34 GLU CB C 34 29.855 29.855 29.439 0.416 19623
497 1 2 . 1 1 34 34 GLU H H 34 7.987 7.987 7.919 0.068 19623
498 1 2 . 1 1 35 35 LYS N N 35 114.863 114.863 116.170 -1.307 19623
499 1 2 . 1 1 35 35 LYS HA H 35 4.207 4.207 4.314 -0.107 19623
500 1 2 . 1 1 35 35 LYS C C 35 176.861 176.861 175.592 1.269 19623
501 1 2 . 1 1 35 35 LYS CA C 35 56.328 56.328 55.067 1.261 19623
502 1 2 . 1 1 35 35 LYS CB C 35 33.007 33.007 32.652 0.355 19623
503 1 2 . 1 1 35 35 LYS H H 35 7.361 7.361 7.602 -0.241 19623
504 1 2 . 1 1 36 36 ALA N N 36 124.407 124.407 124.216 0.191 19623
505 1 2 . 1 1 36 36 ALA HA H 36 4.129 4.129 4.233 -0.104 19623
506 1 2 . 1 1 36 36 ALA C C 36 178.279 178.279 176.762 1.517 19623
507 1 2 . 1 1 36 36 ALA CA C 36 53.257 53.257 52.571 0.686 19623
508 1 2 . 1 1 36 36 ALA CB C 36 19.581 19.581 20.042 -0.461 19623
509 1 2 . 1 1 36 36 ALA H H 36 7.365 7.365 7.369 -0.004 19623
510 1 2 . 1 1 37 37 LYS N N 37 116.217 116.217 119.081 -2.864 19623
511 1 2 . 1 1 37 37 LYS HA H 37 4.383 4.383 4.273 0.110 19623
512 1 2 . 1 1 37 37 LYS C C 37 176.167 176.167 176.463 -0.296 19623
513 1 2 . 1 1 37 37 LYS CA C 37 56.602 56.602 57.448 -0.846 19623
514 1 2 . 1 1 37 37 LYS CB C 37 34.883 34.883 33.526 1.357 19623
515 1 2 . 1 1 37 37 LYS H H 37 8.908 8.908 8.423 0.485 19623
516 1 2 . 1 1 38 38 GLN N N 38 113.293 113.293 116.839 -3.546 19623
517 1 2 . 1 1 38 38 GLN HA H 38 4.813 4.813 4.357 0.456 19623
518 1 2 . 1 1 38 38 GLN C C 38 176.138 176.138 176.485 -0.347 19623
519 1 2 . 1 1 38 38 GLN CA C 38 54.117 54.117 54.062 0.055 19623
520 1 2 . 1 1 38 38 GLN CB C 38 32.222 32.222 31.904 0.318 19623
521 1 2 . 1 1 38 38 GLN H H 38 7.033 7.033 7.944 -0.911 19623
522 1 2 . 1 1 39 39 VAL N N 39 125.474 125.474 122.952 2.522 19623
523 1 2 . 1 1 39 39 VAL C C 39 177.751 177.751 177.535 0.216 19623
524 1 2 . 1 1 39 39 VAL CA C 39 67.737 67.737 66.900 0.837 19623
525 1 2 . 1 1 39 39 VAL CB C 39 31.438 31.438 31.864 -0.426 19623
526 1 2 . 1 1 39 39 VAL H H 39 9.250 9.250 9.165 0.085 19623
527 1 2 . 1 1 40 40 ALA N N 40 120.717 120.717 122.160 -1.443 19623
528 1 2 . 1 1 40 40 ALA HA H 40 4.041 4.041 4.085 -0.044 19623
529 1 2 . 1 1 40 40 ALA C C 40 179.081 179.081 179.119 -0.038 19623
530 1 2 . 1 1 40 40 ALA CA C 40 55.059 55.059 55.212 -0.153 19623
531 1 2 . 1 1 40 40 ALA CB C 40 17.735 17.735 17.913 -0.178 19623
532 1 2 . 1 1 40 40 ALA H H 40 8.903 8.903 8.342 0.561 19623
533 1 2 . 1 1 41 41 ALA N N 41 116.698 116.698 121.565 -4.867 19623
534 1 2 . 1 1 41 41 ALA HA H 41 4.236 4.236 4.065 0.171 19623
535 1 2 . 1 1 41 41 ALA C C 41 180.294 180.294 179.988 0.306 19623
536 1 2 . 1 1 41 41 ALA CA C 41 54.688 54.688 54.745 -0.057 19623
537 1 2 . 1 1 41 41 ALA CB C 41 18.724 18.724 18.291 0.433 19623
538 1 2 . 1 1 41 41 ALA H H 41 6.701 6.701 8.239 -1.538 19623
539 1 2 . 1 1 42 42 VAL N N 42 119.051 119.051 118.889 0.162 19623
540 1 2 . 1 1 42 42 VAL HA H 42 3.278 3.278 3.472 -0.194 19623
541 1 2 . 1 1 42 42 VAL C C 42 176.812 176.812 178.326 -1.514 19623
542 1 2 . 1 1 42 42 VAL CA C 42 67.641 67.641 67.118 0.523 19623
543 1 2 . 1 1 42 42 VAL CB C 42 31.399 31.399 31.649 -0.250 19623
544 1 2 . 1 1 42 42 VAL H H 42 7.552 7.552 8.075 -0.523 19623
545 1 2 . 1 1 43 43 GLU N N 43 117.715 117.715 119.635 -1.920 19623
546 1 2 . 1 1 43 43 GLU HA H 43 3.855 3.855 4.001 -0.146 19623
547 1 2 . 1 1 43 43 GLU C C 43 178.973 178.973 178.955 0.018 19623
548 1 2 . 1 1 43 43 GLU CA C 43 59.393 59.393 59.900 -0.507 19623
549 1 2 . 1 1 43 43 GLU CB C 43 28.811 28.811 29.483 -0.672 19623
550 1 2 . 1 1 43 43 GLU H H 43 7.804 7.804 8.079 -0.275 19623
551 1 2 . 1 1 44 44 ASP N N 44 119.175 119.175 120.536 -1.361 19623
552 1 2 . 1 1 44 44 ASP HA H 44 4.363 4.363 4.456 -0.093 19623
553 1 2 . 1 1 44 44 ASP C C 44 178.211 178.211 178.894 -0.683 19623
554 1 2 . 1 1 44 44 ASP CA C 44 57.308 57.308 57.201 0.107 19623
555 1 2 . 1 1 44 44 ASP CB C 44 40.504 40.504 40.582 -0.078 19623
556 1 2 . 1 1 44 44 ASP H H 44 8.169 8.169 8.247 -0.078 19623
557 1 2 . 1 1 45 45 LEU N N 45 117.848 117.848 120.472 -2.624 19623
558 1 2 . 1 1 45 45 LEU HA H 45 4.119 4.119 3.945 0.174 19623
559 1 2 . 1 1 45 45 LEU C C 45 178.416 178.416 178.599 -0.183 19623
560 1 2 . 1 1 45 45 LEU CA C 45 57.294 57.294 57.886 -0.592 19623
561 1 2 . 1 1 45 45 LEU CB C 45 40.474 40.474 41.833 -1.359 19623
562 1 2 . 1 1 45 45 LEU H H 45 8.119 8.119 8.346 -0.227 19623
563 1 2 . 1 1 46 46 LYS N N 46 119.462 119.462 119.825 -0.363 19623
564 1 2 . 1 1 46 46 LYS HA H 46 3.972 3.972 3.820 0.152 19623
565 1 2 . 1 1 46 46 LYS C C 46 177.653 177.653 178.632 -0.979 19623
566 1 2 . 1 1 46 46 LYS CA C 46 60.276 60.276 60.105 0.171 19623
567 1 2 . 1 1 46 46 LYS CB C 46 31.450 31.450 32.139 -0.689 19623
568 1 2 . 1 1 46 46 LYS H H 46 8.483 8.483 8.038 0.445 19623
569 1 2 . 1 1 47 47 ASP N N 47 117.470 117.470 118.931 -1.461 19623
570 1 2 . 1 1 47 47 ASP HA H 47 4.344 4.344 4.347 -0.003 19623
571 1 2 . 1 1 47 47 ASP C C 47 179.384 179.384 178.684 0.700 19623
572 1 2 . 1 1 47 47 ASP CA C 47 57.687 57.687 57.316 0.371 19623
573 1 2 . 1 1 47 47 ASP CB C 47 40.809 40.809 40.269 0.540 19623
574 1 2 . 1 1 47 47 ASP H H 47 7.846 7.846 7.987 -0.141 19623
575 1 2 . 1 1 48 48 GLU N N 48 119.662 119.662 119.755 -0.093 19623
576 1 2 . 1 1 48 48 GLU HA H 48 4.011 4.011 4.077 -0.066 19623
577 1 2 . 1 1 48 48 GLU C C 48 180.724 180.724 179.361 1.363 19623
578 1 2 . 1 1 48 48 GLU CA C 48 60.091 60.091 58.716 1.375 19623
579 1 2 . 1 1 48 48 GLU CB C 48 31.991 31.991 29.414 2.577 19623
580 1 2 . 1 1 48 48 GLU H H 48 8.327 8.327 7.892 0.435 19623
581 1 2 . 1 1 49 49 ILE N N 49 120.308 120.308 120.695 -0.387 19623
582 1 2 . 1 1 49 49 ILE HA H 49 3.738 3.738 3.604 0.134 19623
583 1 2 . 1 1 49 49 ILE C C 49 179.238 179.238 178.064 1.174 19623
584 1 2 . 1 1 49 49 ILE CA C 49 64.592 64.592 65.158 -0.566 19623
585 1 2 . 1 1 49 49 ILE CB C 49 37.959 37.959 37.943 0.016 19623
586 1 2 . 1 1 49 49 ILE H H 49 7.667 7.667 8.426 -0.759 19623
587 1 2 . 1 1 50 50 LEU N N 50 121.274 121.274 119.598 1.676 19623
588 1 2 . 1 1 50 50 LEU HA H 50 4.559 4.559 3.769 0.790 19623
589 1 2 . 1 1 50 50 LEU C C 50 179.971 179.971 178.787 1.184 19623
590 1 2 . 1 1 50 50 LEU CA C 50 57.794 57.794 57.663 0.130 19623
591 1 2 . 1 1 50 50 LEU CB C 50 40.856 40.856 41.107 -0.251 19623
592 1 2 . 1 1 50 50 LEU H H 50 8.474 8.474 7.784 0.690 19623
593 1 2 . 1 1 51 51 LYS N N 51 119.972 119.972 119.229 0.743 19623
594 1 2 . 1 1 51 51 LYS HA H 51 3.982 3.982 3.785 0.197 19623
595 1 2 . 1 1 51 51 LYS C C 51 179.189 179.189 179.414 -0.225 19623
596 1 2 . 1 1 51 51 LYS CA C 51 59.526 59.526 59.495 0.031 19623
597 1 2 . 1 1 51 51 LYS CB C 51 32.175 32.175 31.919 0.256 19623
598 1 2 . 1 1 51 51 LYS H H 51 8.197 8.197 8.106 0.091 19623
599 1 2 . 1 1 52 52 ALA N N 52 121.059 121.059 121.279 -0.220 19623
600 1 2 . 1 1 52 52 ALA HA H 52 4.158 4.158 4.013 0.145 19623
601 1 2 . 1 1 52 52 ALA C C 52 178.015 178.015 178.072 -0.057 19623
602 1 2 . 1 1 52 52 ALA CA C 52 53.662 53.662 54.178 -0.516 19623
603 1 2 . 1 1 52 52 ALA CB C 52 17.903 17.903 18.338 -0.435 19623
604 1 2 . 1 1 52 52 ALA H H 52 7.809 7.809 7.508 0.301 19623
605 1 2 . 1 1 53 53 HIS N N 53 115.943 115.943 112.575 3.368 19623
606 1 2 . 1 1 53 53 HIS HA H 53 4.373 4.373 4.588 -0.215 19623
607 1 2 . 1 1 53 53 HIS C C 53 174.015 174.015 174.154 -0.139 19623
608 1 2 . 1 1 53 53 HIS CA C 53 57.409 57.409 55.982 1.427 19623
609 1 2 . 1 1 53 53 HIS CB C 53 29.010 29.010 30.247 -1.237 19623
610 1 2 . 1 1 53 53 HIS H H 53 7.598 7.598 7.255 0.343 19623
611 1 2 . 1 1 54 54 ASP N N 54 119.133 119.133 117.379 1.754 19623
612 1 2 . 1 1 54 54 ASP HA H 54 4.442 4.442 3.939 0.503 19623
613 1 2 . 1 1 54 54 ASP C C 54 175.609 175.609 174.921 0.688 19623
614 1 2 . 1 1 54 54 ASP CA C 54 54.971 54.971 55.601 -0.630 19623
615 1 2 . 1 1 54 54 ASP CB C 54 40.209 40.209 39.397 0.812 19623
616 1 2 . 1 1 54 54 ASP H H 54 7.974 7.974 7.667 0.307 19623
617 1 2 . 1 1 55 55 ARG N N 55 118.206 118.206 118.537 -0.331 19623
618 1 2 . 1 1 55 55 ARG HA H 55 4.324 4.324 4.189 0.135 19623
619 1 2 . 1 1 55 55 ARG C C 55 174.671 174.671 174.441 0.230 19623
620 1 2 . 1 1 55 55 ARG CA C 55 54.785 54.785 55.042 -0.258 19623
621 1 2 . 1 1 55 55 ARG CB C 55 30.507 30.507 29.349 1.158 19623
622 1 2 . 1 1 55 55 ARG H H 55 7.943 7.943 7.944 -0.001 19623
623 1 3 . 1 1 2 2 GLY N N 2 113.169 113.169 110.647 2.522 19623
624 1 3 . 1 1 2 2 GLY C C 2 173.996 173.996 173.683 0.313 19623
625 1 3 . 1 1 2 2 GLY CA C 2 45.211 45.211 45.252 -0.041 19623
626 1 3 . 1 1 2 2 GLY H H 2 8.533 8.533 8.965 -0.432 19623
627 1 3 . 1 1 3 3 ASP N N 3 120.717 120.717 121.109 -0.392 19623
628 1 3 . 1 1 3 3 ASP HA H 3 4.559 4.559 4.581 -0.022 19623
629 1 3 . 1 1 3 3 ASP C C 3 176.675 176.675 175.441 1.234 19623
630 1 3 . 1 1 3 3 ASP CA C 3 54.489 54.489 53.540 0.949 19623
631 1 3 . 1 1 3 3 ASP CB C 3 41.197 41.197 41.905 -0.708 19623
632 1 3 . 1 1 3 3 ASP H H 3 8.412 8.412 8.081 0.331 19623
633 1 3 . 1 1 4 4 LYS N N 4 121.955 121.955 119.941 2.014 19623
634 1 3 . 1 1 4 4 LYS HA H 4 4.246 4.246 4.097 0.149 19623
635 1 3 . 1 1 4 4 LYS C C 4 177.301 177.301 177.291 0.010 19623
636 1 3 . 1 1 4 4 LYS CA C 4 56.606 56.606 57.057 -0.451 19623
637 1 3 . 1 1 4 4 LYS CB C 4 32.436 32.436 32.991 -0.555 19623
638 1 3 . 1 1 4 4 LYS H H 4 8.490 8.490 8.417 0.073 19623
639 1 3 . 1 1 5 5 GLY N N 5 109.376 109.376 109.477 -0.101 19623
640 1 3 . 1 1 5 5 GLY C C 5 174.045 174.045 174.224 -0.179 19623
641 1 3 . 1 1 5 5 GLY CA C 5 45.305 45.305 44.745 0.560 19623
642 1 3 . 1 1 5 5 GLY H H 5 8.491 8.491 8.582 -0.092 19623
643 1 3 . 1 1 6 6 TYR N N 6 120.416 120.416 120.233 0.183 19623
644 1 3 . 1 1 6 6 TYR HA H 6 4.510 4.510 4.442 0.068 19623
645 1 3 . 1 1 6 6 TYR C C 6 175.952 175.952 176.218 -0.266 19623
646 1 3 . 1 1 6 6 TYR CA C 6 58.383 58.383 57.298 1.085 19623
647 1 3 . 1 1 6 6 TYR CB C 6 38.562 38.562 37.529 1.033 19623
648 1 3 . 1 1 6 6 TYR H H 6 8.134 8.134 8.027 0.107 19623
649 1 3 . 1 1 7 7 ASN N N 7 122.415 122.415 124.652 -2.237 19623
650 1 3 . 1 1 7 7 ASN HA H 7 4.588 4.588 4.810 -0.222 19623
651 1 3 . 1 1 7 7 ASN C C 7 175.521 175.521 176.142 -0.621 19623
652 1 3 . 1 1 7 7 ASN CA C 7 53.408 53.408 53.802 -0.394 19623
653 1 3 . 1 1 7 7 ASN CB C 7 38.780 38.780 39.868 -1.089 19623
654 1 3 . 1 1 7 7 ASN H H 7 8.557 8.557 8.447 0.110 19623
655 1 3 . 1 1 8 8 GLY N N 8 109.431 109.431 108.478 0.953 19623
656 1 3 . 1 1 8 8 GLY C C 8 175.609 175.609 175.083 0.526 19623
657 1 3 . 1 1 8 8 GLY CA C 8 45.990 45.990 44.377 1.613 19623
658 1 3 . 1 1 8 8 GLY H H 8 8.285 8.285 8.430 -0.145 19623
659 1 3 . 1 1 9 9 LEU N N 9 123.596 123.596 123.460 0.136 19623
660 1 3 . 1 1 9 9 LEU HA H 9 3.933 3.933 4.125 -0.192 19623
661 1 3 . 1 1 9 9 LEU C C 9 177.458 177.458 178.493 -1.035 19623
662 1 3 . 1 1 9 9 LEU CA C 9 58.248 58.248 57.755 0.493 19623
663 1 3 . 1 1 9 9 LEU CB C 9 41.690 41.690 41.678 0.012 19623
664 1 3 . 1 1 9 9 LEU H H 9 8.136 8.136 8.554 -0.418 19623
665 1 3 . 1 1 10 10 ALA N N 10 121.310 121.310 121.129 0.181 19623
666 1 3 . 1 1 10 10 ALA HA H 10 3.933 3.933 3.940 -0.007 19623
667 1 3 . 1 1 10 10 ALA C C 10 181.140 181.140 179.287 1.853 19623
668 1 3 . 1 1 10 10 ALA CA C 10 55.505 55.505 55.065 0.440 19623
669 1 3 . 1 1 10 10 ALA CB C 10 17.791 17.791 17.710 0.081 19623
670 1 3 . 1 1 10 10 ALA H H 10 8.361 8.361 8.570 -0.209 19623
671 1 3 . 1 1 11 11 GLU N N 11 118.893 118.893 118.758 0.135 19623
672 1 3 . 1 1 11 11 GLU HA H 11 3.992 3.992 3.741 0.251 19623
673 1 3 . 1 1 11 11 GLU C C 11 178.797 178.797 178.789 0.008 19623
674 1 3 . 1 1 11 11 GLU CA C 11 59.892 59.892 59.233 0.659 19623
675 1 3 . 1 1 11 11 GLU CB C 11 28.991 28.991 29.036 -0.045 19623
676 1 3 . 1 1 11 11 GLU H H 11 8.490 8.490 8.547 -0.057 19623
677 1 3 . 1 1 12 12 ALA N N 12 122.362 122.362 122.310 0.052 19623
678 1 3 . 1 1 12 12 ALA HA H 12 4.080 4.080 4.101 -0.021 19623
679 1 3 . 1 1 12 12 ALA C C 12 181.228 181.228 179.540 1.688 19623
680 1 3 . 1 1 12 12 ALA CA C 12 55.218 55.218 55.318 -0.100 19623
681 1 3 . 1 1 12 12 ALA CB C 12 18.462 18.462 18.436 0.026 19623
682 1 3 . 1 1 12 12 ALA H H 12 8.099 8.099 7.988 0.111 19623
683 1 3 . 1 1 13 13 LYS N N 13 118.689 118.689 118.632 0.057 19623
684 1 3 . 1 1 13 13 LYS HA H 13 3.620 3.620 3.976 -0.356 19623
685 1 3 . 1 1 13 13 LYS C C 13 177.203 177.203 178.902 -1.699 19623
686 1 3 . 1 1 13 13 LYS CA C 13 60.390 60.390 59.758 0.632 19623
687 1 3 . 1 1 13 13 LYS CB C 13 33.624 33.624 32.309 1.315 19623
688 1 3 . 1 1 13 13 LYS H H 13 8.382 8.382 8.263 0.119 19623
689 1 3 . 1 1 14 14 GLU N N 14 117.865 117.865 120.134 -2.269 19623
690 1 3 . 1 1 14 14 GLU HA H 14 4.285 4.285 4.081 0.204 19623
691 1 3 . 1 1 14 14 GLU C C 14 179.404 179.404 178.850 0.554 19623
692 1 3 . 1 1 14 14 GLU CA C 14 60.007 60.007 59.455 0.552 19623
693 1 3 . 1 1 14 14 GLU CB C 14 29.418 29.418 29.272 0.146 19623
694 1 3 . 1 1 14 14 GLU H H 14 7.952 7.952 7.969 -0.017 19623
695 1 3 . 1 1 15 15 LYS N N 15 119.020 119.020 119.600 -0.580 19623
696 1 3 . 1 1 15 15 LYS HA H 15 3.933 3.933 4.147 -0.214 19623
697 1 3 . 1 1 15 15 LYS C C 15 177.976 177.976 178.790 -0.814 19623
698 1 3 . 1 1 15 15 LYS CA C 15 59.591 59.591 59.145 0.446 19623
699 1 3 . 1 1 15 15 LYS CB C 15 32.275 32.275 32.442 -0.167 19623
700 1 3 . 1 1 15 15 LYS H H 15 8.029 8.029 7.891 0.138 19623
701 1 3 . 1 1 16 16 ALA N N 16 120.410 120.410 121.873 -1.463 19623
702 1 3 . 1 1 16 16 ALA HA H 16 3.962 3.962 4.141 -0.179 19623
703 1 3 . 1 1 16 16 ALA C C 16 179.140 179.140 180.105 -0.965 19623
704 1 3 . 1 1 16 16 ALA CA C 16 55.426 55.426 55.145 0.281 19623
705 1 3 . 1 1 16 16 ALA CB C 16 18.410 18.410 18.421 -0.011 19623
706 1 3 . 1 1 16 16 ALA H H 16 7.904 7.904 8.105 -0.201 19623
707 1 3 . 1 1 17 17 ILE N N 17 117.363 117.363 118.557 -1.194 19623
708 1 3 . 1 1 17 17 ILE HA H 17 5.850 5.850 3.645 2.205 19623
709 1 3 . 1 1 17 17 ILE C C 17 177.604 177.604 177.823 -0.219 19623
710 1 3 . 1 1 17 17 ILE CA C 17 66.545 66.545 65.008 1.536 19623
711 1 3 . 1 1 17 17 ILE CB C 17 37.843 37.843 37.894 -0.051 19623
712 1 3 . 1 1 17 17 ILE H H 17 8.500 8.500 8.074 0.426 19623
713 1 3 . 1 1 18 18 LYS N N 18 119.838 119.838 120.971 -1.133 19623
714 1 3 . 1 1 18 18 LYS HA H 18 3.865 3.865 3.862 0.003 19623
715 1 3 . 1 1 18 18 LYS C C 18 176.653 176.653 178.814 -2.161 19623
716 1 3 . 1 1 18 18 LYS CA C 18 60.189 60.189 60.333 -0.144 19623
717 1 3 . 1 1 18 18 LYS CB C 18 32.260 32.260 32.190 0.070 19623
718 1 3 . 1 1 18 18 LYS H H 18 7.833 7.833 8.304 -0.471 19623
719 1 3 . 1 1 19 19 ASP N N 19 120.497 120.497 120.000 0.497 19623
720 1 3 . 1 1 19 19 ASP HA H 19 4.569 4.569 4.306 0.263 19623
721 1 3 . 1 1 19 19 ASP C C 19 179.120 179.120 178.938 0.182 19623
722 1 3 . 1 1 19 19 ASP CA C 19 57.108 57.108 57.256 -0.148 19623
723 1 3 . 1 1 19 19 ASP CB C 19 40.853 40.853 40.441 0.412 19623
724 1 3 . 1 1 19 19 ASP H H 19 8.479 8.479 8.133 0.346 19623
725 1 3 . 1 1 20 20 LEU N N 20 121.660 121.660 120.277 1.383 19623
726 1 3 . 1 1 20 20 LEU HA H 20 4.148 4.148 4.093 0.055 19623
727 1 3 . 1 1 20 20 LEU C C 20 178.377 178.377 178.947 -0.570 19623
728 1 3 . 1 1 20 20 LEU CA C 20 58.225 58.225 58.181 0.044 19623
729 1 3 . 1 1 20 20 LEU CB C 20 41.585 41.585 41.681 -0.096 19623
730 1 3 . 1 1 20 20 LEU H H 20 8.136 8.136 7.676 0.460 19623
731 1 3 . 1 1 21 21 LYS N N 21 120.182 120.182 119.607 0.575 19623
732 1 3 . 1 1 21 21 LYS HA H 21 3.904 3.904 4.049 -0.145 19623
733 1 3 . 1 1 21 21 LYS C C 21 179.785 179.785 179.332 0.453 19623
734 1 3 . 1 1 21 21 LYS CA C 21 59.557 59.557 59.299 0.258 19623
735 1 3 . 1 1 21 21 LYS CB C 21 29.655 29.655 32.373 -2.718 19623
736 1 3 . 1 1 21 21 LYS H H 21 8.043 8.043 8.151 -0.108 19623
737 1 3 . 1 1 22 22 ILE N N 22 121.523 121.523 119.342 2.181 19623
738 1 3 . 1 1 22 22 ILE HA H 22 3.522 3.522 3.687 -0.165 19623
739 1 3 . 1 1 22 22 ILE C C 22 177.399 177.399 177.924 -0.525 19623
740 1 3 . 1 1 22 22 ILE CA C 22 64.863 64.863 64.340 0.523 19623
741 1 3 . 1 1 22 22 ILE CB C 22 38.046 38.046 37.853 0.193 19623
742 1 3 . 1 1 22 22 ILE H H 22 8.735 8.735 7.628 1.107 19623
743 1 3 . 1 1 23 23 TYR N N 23 117.506 117.506 117.297 0.209 19623
744 1 3 . 1 1 23 23 TYR HA H 23 4.481 4.481 4.300 0.181 19623
745 1 3 . 1 1 23 23 TYR C C 23 176.020 176.020 176.680 -0.660 19623
746 1 3 . 1 1 23 23 TYR CA C 23 58.369 58.369 59.560 -1.191 19623
747 1 3 . 1 1 23 23 TYR CB C 23 38.499 38.499 38.829 -0.330 19623
748 1 3 . 1 1 23 23 TYR H H 23 7.291 7.291 7.739 -0.448 19623
749 1 3 . 1 1 24 24 GLY N N 24 108.209 108.209 106.522 1.687 19623
750 1 3 . 1 1 24 24 GLY C C 24 174.651 174.651 174.115 0.536 19623
751 1 3 . 1 1 24 24 GLY CA C 24 46.409 46.409 44.707 1.702 19623
752 1 3 . 1 1 24 24 GLY H H 24 7.910 7.910 7.671 0.239 19623
753 1 3 . 1 1 25 25 ILE N N 25 119.897 119.897 121.729 -1.832 19623
754 1 3 . 1 1 25 25 ILE HA H 25 3.747 3.747 4.041 -0.294 19623
755 1 3 . 1 1 25 25 ILE C C 25 175.864 175.864 176.315 -0.451 19623
756 1 3 . 1 1 25 25 ILE CA C 25 60.984 60.984 61.396 -0.412 19623
757 1 3 . 1 1 25 25 ILE CB C 25 37.120 37.120 38.772 -1.652 19623
758 1 3 . 1 1 25 25 ILE H H 25 7.383 7.383 7.887 -0.504 19623
759 1 3 . 1 1 26 26 GLY N N 26 111.580 111.580 114.975 -3.395 19623
760 1 3 . 1 1 26 26 GLY C C 26 174.847 174.847 175.082 -0.235 19623
761 1 3 . 1 1 26 26 GLY CA C 26 45.322 45.322 44.419 0.903 19623
762 1 3 . 1 1 26 26 GLY H H 26 8.811 8.811 8.349 0.462 19623
763 1 3 . 1 1 27 27 GLU N N 27 120.229 120.229 119.644 0.585 19623
764 1 3 . 1 1 27 27 GLU C C 27 177.311 177.311 178.550 -1.239 19623
765 1 3 . 1 1 27 27 GLU CA C 27 59.730 59.730 59.356 0.374 19623
766 1 3 . 1 1 27 27 GLU CB C 27 29.933 29.933 29.671 0.262 19623
767 1 3 . 1 1 27 27 GLU H H 27 8.711 8.711 8.932 -0.221 19623
768 1 3 . 1 1 28 28 HIS N N 28 117.558 117.558 118.433 -0.875 19623
769 1 3 . 1 1 28 28 HIS C C 28 176.949 176.949 176.132 0.817 19623
770 1 3 . 1 1 28 28 HIS CA C 28 59.674 59.674 59.125 0.549 19623
771 1 3 . 1 1 28 28 HIS CB C 28 29.838 29.838 29.361 0.477 19623
772 1 3 . 1 1 28 28 HIS H H 28 8.870 8.870 8.537 0.333 19623
773 1 3 . 1 1 29 29 TYR N N 29 115.589 115.589 115.202 0.387 19623
774 1 3 . 1 1 29 29 TYR HA H 29 4.090 4.090 4.426 -0.336 19623
775 1 3 . 1 1 29 29 TYR C C 29 177.552 177.552 177.811 -0.259 19623
776 1 3 . 1 1 29 29 TYR CA C 29 60.998 60.998 60.216 0.782 19623
777 1 3 . 1 1 29 29 TYR CB C 29 38.683 38.683 39.177 -0.494 19623
778 1 3 . 1 1 29 29 TYR H H 29 7.227 7.227 7.573 -0.346 19623
779 1 3 . 1 1 30 30 ILE N N 30 120.353 120.353 121.866 -1.513 19623
780 1 3 . 1 1 30 30 ILE HA H 30 3.444 3.444 3.562 -0.118 19623
781 1 3 . 1 1 30 30 ILE C C 30 178.211 178.211 177.490 0.721 19623
782 1 3 . 1 1 30 30 ILE CA C 30 65.640 65.640 65.551 0.089 19623
783 1 3 . 1 1 30 30 ILE CB C 30 37.553 37.553 37.602 -0.049 19623
784 1 3 . 1 1 30 30 ILE H H 30 7.485 7.485 7.784 -0.299 19623
785 1 3 . 1 1 31 31 LYS N N 31 117.249 117.249 119.421 -2.172 19623
786 1 3 . 1 1 31 31 LYS HA H 31 4.011 4.011 4.238 -0.227 19623
787 1 3 . 1 1 31 31 LYS C C 31 178.954 178.954 178.999 -0.045 19623
788 1 3 . 1 1 31 31 LYS CA C 31 58.893 58.893 59.142 -0.249 19623
789 1 3 . 1 1 31 31 LYS CB C 31 31.673 31.673 32.115 -0.442 19623
790 1 3 . 1 1 31 31 LYS H H 31 8.064 8.064 7.953 0.111 19623
791 1 3 . 1 1 32 32 LEU N N 32 117.176 117.176 119.706 -2.530 19623
792 1 3 . 1 1 32 32 LEU HA H 32 3.894 3.894 4.000 -0.106 19623
793 1 3 . 1 1 32 32 LEU C C 32 179.883 179.883 179.019 0.864 19623
794 1 3 . 1 1 32 32 LEU CA C 32 57.987 57.987 57.670 0.317 19623
795 1 3 . 1 1 32 32 LEU CB C 32 41.255 41.255 41.640 -0.385 19623
796 1 3 . 1 1 32 32 LEU H H 32 7.154 7.154 7.600 -0.446 19623
797 1 3 . 1 1 33 33 ILE N N 33 118.598 118.598 117.670 0.928 19623
798 1 3 . 1 1 33 33 ILE HA H 33 3.571 3.571 3.739 -0.168 19623
799 1 3 . 1 1 33 33 ILE C C 33 177.917 177.917 178.440 -0.523 19623
800 1 3 . 1 1 33 33 ILE CA C 33 63.579 63.579 64.249 -0.670 19623
801 1 3 . 1 1 33 33 ILE CB C 33 35.702 35.702 37.883 -2.181 19623
802 1 3 . 1 1 33 33 ILE H H 33 7.412 7.412 7.565 -0.153 19623
803 1 3 . 1 1 34 34 GLU N N 34 116.574 116.574 120.489 -3.915 19623
804 1 3 . 1 1 34 34 GLU HA H 34 3.826 3.826 4.024 -0.198 19623
805 1 3 . 1 1 34 34 GLU C C 34 178.661 178.661 178.788 -0.127 19623
806 1 3 . 1 1 34 34 GLU CA C 34 59.689 59.689 59.807 -0.118 19623
807 1 3 . 1 1 34 34 GLU CB C 34 29.855 29.855 29.331 0.524 19623
808 1 3 . 1 1 34 34 GLU H H 34 7.987 7.987 7.940 0.047 19623
809 1 3 . 1 1 35 35 LYS N N 35 114.863 114.863 117.529 -2.666 19623
810 1 3 . 1 1 35 35 LYS HA H 35 4.207 4.207 4.311 -0.104 19623
811 1 3 . 1 1 35 35 LYS C C 35 176.861 176.861 175.831 1.030 19623
812 1 3 . 1 1 35 35 LYS CA C 35 56.328 56.328 55.381 0.947 19623
813 1 3 . 1 1 35 35 LYS CB C 35 33.007 33.007 32.673 0.334 19623
814 1 3 . 1 1 35 35 LYS H H 35 7.361 7.361 7.623 -0.262 19623
815 1 3 . 1 1 36 36 ALA N N 36 124.407 124.407 124.237 0.170 19623
816 1 3 . 1 1 36 36 ALA HA H 36 4.129 4.129 4.282 -0.153 19623
817 1 3 . 1 1 36 36 ALA C C 36 178.279 178.279 177.381 0.898 19623
818 1 3 . 1 1 36 36 ALA CA C 36 53.257 53.257 52.849 0.408 19623
819 1 3 . 1 1 36 36 ALA CB C 36 19.581 19.581 19.651 -0.070 19623
820 1 3 . 1 1 36 36 ALA H H 36 7.365 7.365 7.442 -0.077 19623
821 1 3 . 1 1 37 37 LYS N N 37 116.217 116.217 119.374 -3.157 19623
822 1 3 . 1 1 37 37 LYS HA H 37 4.383 4.383 4.310 0.073 19623
823 1 3 . 1 1 37 37 LYS C C 37 176.167 176.167 175.946 0.221 19623
824 1 3 . 1 1 37 37 LYS CA C 37 56.602 56.602 56.654 -0.052 19623
825 1 3 . 1 1 37 37 LYS CB C 37 34.883 34.883 32.828 2.055 19623
826 1 3 . 1 1 37 37 LYS H H 37 8.908 8.908 8.675 0.233 19623
827 1 3 . 1 1 38 38 GLN N N 38 113.293 113.293 116.002 -2.709 19623
828 1 3 . 1 1 38 38 GLN HA H 38 4.813 4.813 4.469 0.344 19623
829 1 3 . 1 1 38 38 GLN C C 38 176.138 176.138 175.201 0.937 19623
830 1 3 . 1 1 38 38 GLN CA C 38 54.117 54.117 54.576 -0.459 19623
831 1 3 . 1 1 38 38 GLN CB C 38 32.222 32.222 31.110 1.112 19623
832 1 3 . 1 1 38 38 GLN H H 38 7.033 7.033 7.508 -0.475 19623
833 1 3 . 1 1 39 39 VAL N N 39 125.474 125.474 122.012 3.462 19623
834 1 3 . 1 1 39 39 VAL C C 39 177.751 177.751 177.565 0.186 19623
835 1 3 . 1 1 39 39 VAL CA C 39 67.737 67.737 66.022 1.714 19623
836 1 3 . 1 1 39 39 VAL CB C 39 31.438 31.438 31.841 -0.403 19623
837 1 3 . 1 1 39 39 VAL H H 39 9.250 9.250 8.816 0.434 19623
838 1 3 . 1 1 40 40 ALA N N 40 120.717 120.717 122.791 -2.074 19623
839 1 3 . 1 1 40 40 ALA HA H 40 4.041 4.041 4.086 -0.045 19623
840 1 3 . 1 1 40 40 ALA C C 40 179.081 179.081 179.369 -0.288 19623
841 1 3 . 1 1 40 40 ALA CA C 40 55.059 55.059 55.216 -0.157 19623
842 1 3 . 1 1 40 40 ALA CB C 40 17.735 17.735 17.968 -0.233 19623
843 1 3 . 1 1 40 40 ALA H H 40 8.903 8.903 8.421 0.482 19623
844 1 3 . 1 1 41 41 ALA N N 41 116.698 116.698 121.084 -4.386 19623
845 1 3 . 1 1 41 41 ALA HA H 41 4.236 4.236 4.047 0.189 19623
846 1 3 . 1 1 41 41 ALA C C 41 180.294 180.294 179.733 0.561 19623
847 1 3 . 1 1 41 41 ALA CA C 41 54.688 54.688 54.608 0.079 19623
848 1 3 . 1 1 41 41 ALA CB C 41 18.724 18.724 18.189 0.535 19623
849 1 3 . 1 1 41 41 ALA H H 41 6.701 6.701 7.466 -0.765 19623
850 1 3 . 1 1 42 42 VAL N N 42 119.051 119.051 119.002 0.049 19623
851 1 3 . 1 1 42 42 VAL HA H 42 3.278 3.278 3.475 -0.197 19623
852 1 3 . 1 1 42 42 VAL C C 42 176.812 176.812 178.397 -1.585 19623
853 1 3 . 1 1 42 42 VAL CA C 42 67.641 67.641 67.079 0.562 19623
854 1 3 . 1 1 42 42 VAL CB C 42 31.399 31.399 31.647 -0.248 19623
855 1 3 . 1 1 42 42 VAL H H 42 7.552 7.552 7.992 -0.440 19623
856 1 3 . 1 1 43 43 GLU N N 43 117.715 117.715 119.794 -2.079 19623
857 1 3 . 1 1 43 43 GLU HA H 43 3.855 3.855 4.006 -0.151 19623
858 1 3 . 1 1 43 43 GLU C C 43 178.973 178.973 178.903 0.070 19623
859 1 3 . 1 1 43 43 GLU CA C 43 59.393 59.393 59.934 -0.541 19623
860 1 3 . 1 1 43 43 GLU CB C 43 28.811 28.811 29.506 -0.695 19623
861 1 3 . 1 1 43 43 GLU H H 43 7.804 7.804 8.421 -0.617 19623
862 1 3 . 1 1 44 44 ASP N N 44 119.175 119.175 120.642 -1.467 19623
863 1 3 . 1 1 44 44 ASP HA H 44 4.363 4.363 4.453 -0.090 19623
864 1 3 . 1 1 44 44 ASP C C 44 178.211 178.211 178.915 -0.704 19623
865 1 3 . 1 1 44 44 ASP CA C 44 57.308 57.308 57.235 0.073 19623
866 1 3 . 1 1 44 44 ASP CB C 44 40.504 40.504 40.575 -0.071 19623
867 1 3 . 1 1 44 44 ASP H H 44 8.169 8.169 8.083 0.086 19623
868 1 3 . 1 1 45 45 LEU N N 45 117.848 117.848 120.301 -2.453 19623
869 1 3 . 1 1 45 45 LEU HA H 45 4.119 4.119 3.967 0.152 19623
870 1 3 . 1 1 45 45 LEU C C 45 178.416 178.416 178.620 -0.204 19623
871 1 3 . 1 1 45 45 LEU CA C 45 57.294 57.294 57.791 -0.497 19623
872 1 3 . 1 1 45 45 LEU CB C 45 40.474 40.474 41.812 -1.338 19623
873 1 3 . 1 1 45 45 LEU H H 45 8.119 8.119 8.403 -0.284 19623
874 1 3 . 1 1 46 46 LYS N N 46 119.462 119.462 120.150 -0.688 19623
875 1 3 . 1 1 46 46 LYS HA H 46 3.972 3.972 3.824 0.148 19623
876 1 3 . 1 1 46 46 LYS C C 46 177.653 177.653 178.639 -0.986 19623
877 1 3 . 1 1 46 46 LYS CA C 46 60.276 60.276 60.132 0.144 19623
878 1 3 . 1 1 46 46 LYS CB C 46 31.450 31.450 32.142 -0.692 19623
879 1 3 . 1 1 46 46 LYS H H 46 8.483 8.483 8.096 0.387 19623
880 1 3 . 1 1 47 47 ASP N N 47 117.470 117.470 119.258 -1.788 19623
881 1 3 . 1 1 47 47 ASP HA H 47 4.344 4.344 4.403 -0.059 19623
882 1 3 . 1 1 47 47 ASP C C 47 179.384 179.384 178.976 0.408 19623
883 1 3 . 1 1 47 47 ASP CA C 47 57.687 57.687 57.348 0.339 19623
884 1 3 . 1 1 47 47 ASP CB C 47 40.809 40.809 40.288 0.521 19623
885 1 3 . 1 1 47 47 ASP H H 47 7.846 7.846 8.025 -0.179 19623
886 1 3 . 1 1 48 48 GLU N N 48 119.662 119.662 119.955 -0.293 19623
887 1 3 . 1 1 48 48 GLU HA H 48 4.011 4.011 4.105 -0.094 19623
888 1 3 . 1 1 48 48 GLU C C 48 180.724 180.724 179.380 1.344 19623
889 1 3 . 1 1 48 48 GLU CA C 48 60.091 60.091 58.802 1.289 19623
890 1 3 . 1 1 48 48 GLU CB C 48 31.991 31.991 29.451 2.539 19623
891 1 3 . 1 1 48 48 GLU H H 48 8.327 8.327 7.897 0.430 19623
892 1 3 . 1 1 49 49 ILE N N 49 120.308 120.308 120.584 -0.276 19623
893 1 3 . 1 1 49 49 ILE HA H 49 3.738 3.738 3.620 0.118 19623
894 1 3 . 1 1 49 49 ILE C C 49 179.238 179.238 178.028 1.210 19623
895 1 3 . 1 1 49 49 ILE CA C 49 64.592 64.592 65.118 -0.526 19623
896 1 3 . 1 1 49 49 ILE CB C 49 37.959 37.959 37.896 0.063 19623
897 1 3 . 1 1 49 49 ILE H H 49 7.667 7.667 8.536 -0.869 19623
898 1 3 . 1 1 50 50 LEU N N 50 121.274 121.274 121.017 0.257 19623
899 1 3 . 1 1 50 50 LEU HA H 50 4.559 4.559 3.917 0.642 19623
900 1 3 . 1 1 50 50 LEU C C 50 179.971 179.971 177.997 1.974 19623
901 1 3 . 1 1 50 50 LEU CA C 50 57.794 57.794 57.907 -0.113 19623
902 1 3 . 1 1 50 50 LEU CB C 50 40.856 40.856 41.272 -0.416 19623
903 1 3 . 1 1 50 50 LEU H H 50 8.474 8.474 7.900 0.574 19623
904 1 3 . 1 1 51 51 LYS N N 51 119.972 119.972 119.417 0.555 19623
905 1 3 . 1 1 51 51 LYS HA H 51 3.982 3.982 3.854 0.128 19623
906 1 3 . 1 1 51 51 LYS C C 51 179.189 179.189 178.935 0.254 19623
907 1 3 . 1 1 51 51 LYS CA C 51 59.526 59.526 59.947 -0.421 19623
908 1 3 . 1 1 51 51 LYS CB C 51 32.175 32.175 32.063 0.112 19623
909 1 3 . 1 1 51 51 LYS H H 51 8.197 8.197 8.198 -0.001 19623
910 1 3 . 1 1 52 52 ALA N N 52 121.059 121.059 120.691 0.368 19623
911 1 3 . 1 1 52 52 ALA HA H 52 4.158 4.158 4.092 0.066 19623
912 1 3 . 1 1 52 52 ALA C C 52 178.015 178.015 178.908 -0.893 19623
913 1 3 . 1 1 52 52 ALA CA C 52 53.662 53.662 54.424 -0.762 19623
914 1 3 . 1 1 52 52 ALA CB C 52 17.903 17.903 18.277 -0.374 19623
915 1 3 . 1 1 52 52 ALA H H 52 7.809 7.809 7.718 0.091 19623
916 1 3 . 1 1 53 53 HIS N N 53 115.943 115.943 117.572 -1.629 19623
917 1 3 . 1 1 53 53 HIS HA H 53 4.373 4.373 4.192 0.181 19623
918 1 3 . 1 1 53 53 HIS C C 53 174.015 174.015 176.584 -2.569 19623
919 1 3 . 1 1 53 53 HIS CA C 53 57.409 57.409 59.020 -1.611 19623
920 1 3 . 1 1 53 53 HIS CB C 53 29.010 29.010 30.044 -1.034 19623
921 1 3 . 1 1 53 53 HIS H H 53 7.598 7.598 7.908 -0.310 19623
922 1 3 . 1 1 54 54 ASP N N 54 119.133 119.133 118.017 1.116 19623
923 1 3 . 1 1 54 54 ASP HA H 54 4.442 4.442 4.412 0.030 19623
924 1 3 . 1 1 54 54 ASP C C 54 175.609 175.609 176.695 -1.086 19623
925 1 3 . 1 1 54 54 ASP CA C 54 54.971 54.971 55.791 -0.820 19623
926 1 3 . 1 1 54 54 ASP CB C 54 40.209 40.209 41.080 -0.871 19623
927 1 3 . 1 1 54 54 ASP H H 54 7.974 7.974 8.083 -0.109 19623
928 1 3 . 1 1 55 55 ARG N N 55 118.206 118.206 120.832 -2.626 19623
929 1 3 . 1 1 55 55 ARG HA H 55 4.324 4.324 4.186 0.138 19623
930 1 3 . 1 1 55 55 ARG C C 55 174.671 174.671 175.752 -1.081 19623
931 1 3 . 1 1 55 55 ARG CA C 55 54.785 54.785 56.351 -1.566 19623
932 1 3 . 1 1 55 55 ARG CB C 55 30.507 30.507 30.845 -0.338 19623
933 1 3 . 1 1 55 55 ARG H H 55 7.943 7.943 7.622 0.321 19623
934 1 4 . 1 1 2 2 GLY N N 2 113.169 113.169 107.166 6.003 19623
935 1 4 . 1 1 2 2 GLY C C 2 173.996 173.996 173.561 0.435 19623
936 1 4 . 1 1 2 2 GLY CA C 2 45.211 45.211 45.322 -0.111 19623
937 1 4 . 1 1 2 2 GLY H H 2 8.533 8.533 8.438 0.095 19623
938 1 4 . 1 1 3 3 ASP N N 3 120.717 120.717 120.240 0.477 19623
939 1 4 . 1 1 3 3 ASP HA H 3 4.559 4.559 4.533 0.026 19623
940 1 4 . 1 1 3 3 ASP C C 3 176.675 176.675 175.865 0.810 19623
941 1 4 . 1 1 3 3 ASP CA C 3 54.489 54.489 53.627 0.862 19623
942 1 4 . 1 1 3 3 ASP CB C 3 41.197 41.197 41.113 0.084 19623
943 1 4 . 1 1 3 3 ASP H H 3 8.412 8.412 8.276 0.136 19623
944 1 4 . 1 1 4 4 LYS N N 4 121.955 121.955 127.435 -5.480 19623
945 1 4 . 1 1 4 4 LYS HA H 4 4.246 4.246 4.117 0.129 19623
946 1 4 . 1 1 4 4 LYS C C 4 177.301 177.301 177.378 -0.077 19623
947 1 4 . 1 1 4 4 LYS CA C 4 56.606 56.606 58.225 -1.619 19623
948 1 4 . 1 1 4 4 LYS CB C 4 32.436 32.436 32.746 -0.310 19623
949 1 4 . 1 1 4 4 LYS H H 4 8.490 8.490 8.495 -0.005 19623
950 1 4 . 1 1 5 5 GLY N N 5 109.376 109.376 113.119 -3.743 19623
951 1 4 . 1 1 5 5 GLY C C 5 174.045 174.045 173.889 0.156 19623
952 1 4 . 1 1 5 5 GLY CA C 5 45.305 45.305 44.564 0.741 19623
953 1 4 . 1 1 5 5 GLY H H 5 8.491 8.491 8.760 -0.269 19623
954 1 4 . 1 1 6 6 TYR N N 6 120.416 120.416 120.747 -0.331 19623
955 1 4 . 1 1 6 6 TYR HA H 6 4.510 4.510 4.640 -0.130 19623
956 1 4 . 1 1 6 6 TYR C C 6 175.952 175.952 175.729 0.223 19623
957 1 4 . 1 1 6 6 TYR CA C 6 58.383 58.383 57.282 1.101 19623
958 1 4 . 1 1 6 6 TYR CB C 6 38.562 38.562 39.549 -0.987 19623
959 1 4 . 1 1 6 6 TYR H H 6 8.134 8.134 7.856 0.278 19623
960 1 4 . 1 1 7 7 ASN N N 7 122.415 122.415 121.963 0.452 19623
961 1 4 . 1 1 7 7 ASN HA H 7 4.588 4.588 4.814 -0.226 19623
962 1 4 . 1 1 7 7 ASN C C 7 175.521 175.521 176.729 -1.208 19623
963 1 4 . 1 1 7 7 ASN CA C 7 53.408 53.408 53.507 -0.099 19623
964 1 4 . 1 1 7 7 ASN CB C 7 38.780 38.780 38.641 0.139 19623
965 1 4 . 1 1 7 7 ASN H H 7 8.557 8.557 8.903 -0.346 19623
966 1 4 . 1 1 8 8 GLY N N 8 109.431 109.431 110.368 -0.937 19623
967 1 4 . 1 1 8 8 GLY C C 8 175.609 175.609 175.939 -0.330 19623
968 1 4 . 1 1 8 8 GLY CA C 8 45.990 45.990 46.684 -0.694 19623
969 1 4 . 1 1 8 8 GLY H H 8 8.285 8.285 8.639 -0.354 19623
970 1 4 . 1 1 9 9 LEU N N 9 123.596 123.596 122.485 1.111 19623
971 1 4 . 1 1 9 9 LEU HA H 9 3.933 3.933 4.107 -0.174 19623
972 1 4 . 1 1 9 9 LEU C C 9 177.458 177.458 178.149 -0.691 19623
973 1 4 . 1 1 9 9 LEU CA C 9 58.248 58.248 57.505 0.743 19623
974 1 4 . 1 1 9 9 LEU CB C 9 41.690 41.690 41.550 0.140 19623
975 1 4 . 1 1 9 9 LEU H H 9 8.136 8.136 7.777 0.359 19623
976 1 4 . 1 1 10 10 ALA N N 10 121.310 121.310 120.766 0.544 19623
977 1 4 . 1 1 10 10 ALA HA H 10 3.933 3.933 3.919 0.014 19623
978 1 4 . 1 1 10 10 ALA C C 10 181.140 181.140 179.989 1.151 19623
979 1 4 . 1 1 10 10 ALA CA C 10 55.505 55.505 55.234 0.271 19623
980 1 4 . 1 1 10 10 ALA CB C 10 17.791 17.791 18.070 -0.279 19623
981 1 4 . 1 1 10 10 ALA H H 10 8.361 8.361 8.335 0.026 19623
982 1 4 . 1 1 11 11 GLU N N 11 118.893 118.893 119.198 -0.305 19623
983 1 4 . 1 1 11 11 GLU HA H 11 3.992 3.992 4.055 -0.063 19623
984 1 4 . 1 1 11 11 GLU C C 11 178.797 178.797 179.061 -0.264 19623
985 1 4 . 1 1 11 11 GLU CA C 11 59.892 59.892 59.133 0.759 19623
986 1 4 . 1 1 11 11 GLU CB C 11 28.991 28.991 29.736 -0.745 19623
987 1 4 . 1 1 11 11 GLU H H 11 8.490 8.490 8.222 0.268 19623
988 1 4 . 1 1 12 12 ALA N N 12 122.362 122.362 122.475 -0.113 19623
989 1 4 . 1 1 12 12 ALA HA H 12 4.080 4.080 4.048 0.032 19623
990 1 4 . 1 1 12 12 ALA C C 12 181.228 181.228 179.651 1.577 19623
991 1 4 . 1 1 12 12 ALA CA C 12 55.218 55.218 55.248 -0.030 19623
992 1 4 . 1 1 12 12 ALA CB C 12 18.462 18.462 18.234 0.228 19623
993 1 4 . 1 1 12 12 ALA H H 12 8.099 8.099 8.196 -0.097 19623
994 1 4 . 1 1 13 13 LYS N N 13 118.689 118.689 118.788 -0.099 19623
995 1 4 . 1 1 13 13 LYS HA H 13 3.620 3.620 3.981 -0.361 19623
996 1 4 . 1 1 13 13 LYS C C 13 177.203 177.203 179.040 -1.837 19623
997 1 4 . 1 1 13 13 LYS CA C 13 60.390 60.390 59.995 0.395 19623
998 1 4 . 1 1 13 13 LYS CB C 13 33.624 33.624 32.411 1.213 19623
999 1 4 . 1 1 13 13 LYS H H 13 8.382 8.382 8.244 0.138 19623
1000 1 4 . 1 1 14 14 GLU N N 14 117.865 117.865 119.638 -1.773 19623
1001 1 4 . 1 1 14 14 GLU HA H 14 4.285 4.285 4.043 0.242 19623
1002 1 4 . 1 1 14 14 GLU C C 14 179.404 179.404 179.138 0.266 19623
1003 1 4 . 1 1 14 14 GLU CA C 14 60.007 60.007 59.570 0.437 19623
1004 1 4 . 1 1 14 14 GLU CB C 14 29.418 29.418 29.418 0.000 19623
1005 1 4 . 1 1 14 14 GLU H H 14 7.952 7.952 8.023 -0.071 19623
1006 1 4 . 1 1 15 15 LYS N N 15 119.020 119.020 119.612 -0.592 19623
1007 1 4 . 1 1 15 15 LYS HA H 15 3.933 3.933 4.078 -0.145 19623
1008 1 4 . 1 1 15 15 LYS C C 15 177.976 177.976 178.808 -0.832 19623
1009 1 4 . 1 1 15 15 LYS CA C 15 59.591 59.591 59.650 -0.059 19623
1010 1 4 . 1 1 15 15 LYS CB C 15 32.275 32.275 32.398 -0.123 19623
1011 1 4 . 1 1 15 15 LYS H H 15 8.029 8.029 8.122 -0.093 19623
1012 1 4 . 1 1 16 16 ALA N N 16 120.410 120.410 123.020 -2.610 19623
1013 1 4 . 1 1 16 16 ALA HA H 16 3.962 3.962 4.196 -0.234 19623
1014 1 4 . 1 1 16 16 ALA C C 16 179.140 179.140 179.715 -0.575 19623
1015 1 4 . 1 1 16 16 ALA CA C 16 55.426 55.426 54.900 0.526 19623
1016 1 4 . 1 1 16 16 ALA CB C 16 18.410 18.410 18.469 -0.059 19623
1017 1 4 . 1 1 16 16 ALA H H 16 7.904 7.904 7.864 0.040 19623
1018 1 4 . 1 1 17 17 ILE N N 17 117.363 117.363 119.238 -1.875 19623
1019 1 4 . 1 1 17 17 ILE HA H 17 5.850 5.850 3.557 2.293 19623
1020 1 4 . 1 1 17 17 ILE C C 17 177.604 177.604 177.847 -0.243 19623
1021 1 4 . 1 1 17 17 ILE CA C 17 66.545 66.545 65.582 0.964 19623
1022 1 4 . 1 1 17 17 ILE CB C 17 37.843 37.843 37.781 0.062 19623
1023 1 4 . 1 1 17 17 ILE H H 17 8.500 8.500 8.442 0.058 19623
1024 1 4 . 1 1 18 18 LYS N N 18 119.838 119.838 120.303 -0.465 19623
1025 1 4 . 1 1 18 18 LYS HA H 18 3.865 3.865 3.843 0.022 19623
1026 1 4 . 1 1 18 18 LYS C C 18 176.653 176.653 178.750 -2.097 19623
1027 1 4 . 1 1 18 18 LYS CA C 18 60.189 60.189 60.202 -0.013 19623
1028 1 4 . 1 1 18 18 LYS CB C 18 32.260 32.260 32.189 0.071 19623
1029 1 4 . 1 1 18 18 LYS H H 18 7.833 7.833 8.092 -0.259 19623
1030 1 4 . 1 1 19 19 ASP N N 19 120.497 120.497 120.289 0.208 19623
1031 1 4 . 1 1 19 19 ASP HA H 19 4.569 4.569 4.235 0.334 19623
1032 1 4 . 1 1 19 19 ASP C C 19 179.120 179.120 178.923 0.197 19623
1033 1 4 . 1 1 19 19 ASP CA C 19 57.108 57.108 57.254 -0.146 19623
1034 1 4 . 1 1 19 19 ASP CB C 19 40.853 40.853 40.453 0.400 19623
1035 1 4 . 1 1 19 19 ASP H H 19 8.479 8.479 8.085 0.394 19623
1036 1 4 . 1 1 20 20 LEU N N 20 121.660 121.660 120.089 1.571 19623
1037 1 4 . 1 1 20 20 LEU HA H 20 4.148 4.148 4.139 0.009 19623
1038 1 4 . 1 1 20 20 LEU C C 20 178.377 178.377 178.966 -0.589 19623
1039 1 4 . 1 1 20 20 LEU CA C 20 58.225 58.225 58.362 -0.138 19623
1040 1 4 . 1 1 20 20 LEU CB C 20 41.585 41.585 41.706 -0.121 19623
1041 1 4 . 1 1 20 20 LEU H H 20 8.136 8.136 8.473 -0.337 19623
1042 1 4 . 1 1 21 21 LYS N N 21 120.182 120.182 119.455 0.727 19623
1043 1 4 . 1 1 21 21 LYS HA H 21 3.904 3.904 4.094 -0.190 19623
1044 1 4 . 1 1 21 21 LYS C C 21 179.785 179.785 179.401 0.384 19623
1045 1 4 . 1 1 21 21 LYS CA C 21 59.557 59.557 59.276 0.281 19623
1046 1 4 . 1 1 21 21 LYS CB C 21 29.655 29.655 32.441 -2.786 19623
1047 1 4 . 1 1 21 21 LYS H H 21 8.043 8.043 7.790 0.253 19623
1048 1 4 . 1 1 22 22 ILE N N 22 121.523 121.523 119.805 1.718 19623
1049 1 4 . 1 1 22 22 ILE HA H 22 3.522 3.522 3.708 -0.186 19623
1050 1 4 . 1 1 22 22 ILE C C 22 177.399 177.399 177.614 -0.215 19623
1051 1 4 . 1 1 22 22 ILE CA C 22 64.863 64.863 64.502 0.361 19623
1052 1 4 . 1 1 22 22 ILE CB C 22 38.046 38.046 37.950 0.096 19623
1053 1 4 . 1 1 22 22 ILE H H 22 8.735 8.735 7.919 0.816 19623
1054 1 4 . 1 1 23 23 TYR N N 23 117.506 117.506 116.831 0.675 19623
1055 1 4 . 1 1 23 23 TYR HA H 23 4.481 4.481 4.346 0.135 19623
1056 1 4 . 1 1 23 23 TYR C C 23 176.020 176.020 176.675 -0.655 19623
1057 1 4 . 1 1 23 23 TYR CA C 23 58.369 58.369 59.638 -1.269 19623
1058 1 4 . 1 1 23 23 TYR CB C 23 38.499 38.499 39.018 -0.519 19623
1059 1 4 . 1 1 23 23 TYR H H 23 7.291 7.291 7.847 -0.556 19623
1060 1 4 . 1 1 24 24 GLY N N 24 108.209 108.209 105.749 2.460 19623
1061 1 4 . 1 1 24 24 GLY C C 24 174.651 174.651 174.401 0.250 19623
1062 1 4 . 1 1 24 24 GLY CA C 24 46.409 46.409 44.704 1.705 19623
1063 1 4 . 1 1 24 24 GLY H H 24 7.910 7.910 7.695 0.215 19623
1064 1 4 . 1 1 25 25 ILE N N 25 119.897 119.897 121.605 -1.708 19623
1065 1 4 . 1 1 25 25 ILE HA H 25 3.747 3.747 4.038 -0.291 19623
1066 1 4 . 1 1 25 25 ILE C C 25 175.864 175.864 175.972 -0.108 19623
1067 1 4 . 1 1 25 25 ILE CA C 25 60.984 60.984 60.802 0.182 19623
1068 1 4 . 1 1 25 25 ILE CB C 25 37.120 37.120 39.238 -2.118 19623
1069 1 4 . 1 1 25 25 ILE H H 25 7.383 7.383 8.142 -0.759 19623
1070 1 4 . 1 1 26 26 GLY N N 26 111.580 111.580 113.603 -2.023 19623
1071 1 4 . 1 1 26 26 GLY C C 26 174.847 174.847 175.189 -0.342 19623
1072 1 4 . 1 1 26 26 GLY CA C 26 45.322 45.322 44.671 0.651 19623
1073 1 4 . 1 1 26 26 GLY H H 26 8.811 8.811 8.327 0.484 19623
1074 1 4 . 1 1 27 27 GLU N N 27 120.229 120.229 121.005 -0.776 19623
1075 1 4 . 1 1 27 27 GLU C C 27 177.311 177.311 178.693 -1.382 19623
1076 1 4 . 1 1 27 27 GLU CA C 27 59.730 59.730 59.496 0.234 19623
1077 1 4 . 1 1 27 27 GLU CB C 27 29.933 29.933 29.735 0.198 19623
1078 1 4 . 1 1 27 27 GLU H H 27 8.711 8.711 8.975 -0.264 19623
1079 1 4 . 1 1 28 28 HIS N N 28 117.558 117.558 118.595 -1.037 19623
1080 1 4 . 1 1 28 28 HIS C C 28 176.949 176.949 176.241 0.708 19623
1081 1 4 . 1 1 28 28 HIS CA C 28 59.674 59.674 59.251 0.423 19623
1082 1 4 . 1 1 28 28 HIS CB C 28 29.838 29.838 29.451 0.387 19623
1083 1 4 . 1 1 28 28 HIS H H 28 8.870 8.870 8.609 0.261 19623
1084 1 4 . 1 1 29 29 TYR N N 29 115.589 115.589 114.952 0.637 19623
1085 1 4 . 1 1 29 29 TYR HA H 29 4.090 4.090 4.450 -0.360 19623
1086 1 4 . 1 1 29 29 TYR C C 29 177.552 177.552 177.291 0.261 19623
1087 1 4 . 1 1 29 29 TYR CA C 29 60.998 60.998 60.161 0.837 19623
1088 1 4 . 1 1 29 29 TYR CB C 29 38.683 38.683 39.242 -0.559 19623
1089 1 4 . 1 1 29 29 TYR H H 29 7.227 7.227 7.701 -0.474 19623
1090 1 4 . 1 1 30 30 ILE N N 30 120.353 120.353 120.979 -0.626 19623
1091 1 4 . 1 1 30 30 ILE HA H 30 3.444 3.444 3.648 -0.204 19623
1092 1 4 . 1 1 30 30 ILE C C 30 178.211 178.211 178.160 0.051 19623
1093 1 4 . 1 1 30 30 ILE CA C 30 65.640 65.640 65.246 0.394 19623
1094 1 4 . 1 1 30 30 ILE CB C 30 37.553 37.553 37.846 -0.293 19623
1095 1 4 . 1 1 30 30 ILE H H 30 7.485 7.485 7.770 -0.285 19623
1096 1 4 . 1 1 31 31 LYS N N 31 117.249 117.249 119.354 -2.105 19623
1097 1 4 . 1 1 31 31 LYS HA H 31 4.011 4.011 4.048 -0.037 19623
1098 1 4 . 1 1 31 31 LYS C C 31 178.954 178.954 178.502 0.452 19623
1099 1 4 . 1 1 31 31 LYS CA C 31 58.893 58.893 59.005 -0.112 19623
1100 1 4 . 1 1 31 31 LYS CB C 31 31.673 31.673 32.011 -0.338 19623
1101 1 4 . 1 1 31 31 LYS H H 31 8.064 8.064 8.251 -0.187 19623
1102 1 4 . 1 1 32 32 LEU N N 32 117.176 117.176 119.462 -2.286 19623
1103 1 4 . 1 1 32 32 LEU HA H 32 3.894 3.894 3.968 -0.074 19623
1104 1 4 . 1 1 32 32 LEU C C 32 179.883 179.883 178.365 1.518 19623
1105 1 4 . 1 1 32 32 LEU CA C 32 57.987 57.987 57.220 0.767 19623
1106 1 4 . 1 1 32 32 LEU CB C 32 41.255 41.255 41.684 -0.429 19623
1107 1 4 . 1 1 32 32 LEU H H 32 7.154 7.154 7.244 -0.090 19623
1108 1 4 . 1 1 33 33 ILE N N 33 118.598 118.598 117.689 0.909 19623
1109 1 4 . 1 1 33 33 ILE HA H 33 3.571 3.571 3.757 -0.186 19623
1110 1 4 . 1 1 33 33 ILE C C 33 177.917 177.917 178.695 -0.778 19623
1111 1 4 . 1 1 33 33 ILE CA C 33 63.579 63.579 63.678 -0.099 19623
1112 1 4 . 1 1 33 33 ILE CB C 33 35.702 35.702 37.081 -1.379 19623
1113 1 4 . 1 1 33 33 ILE H H 33 7.412 7.412 7.561 -0.149 19623
1114 1 4 . 1 1 34 34 GLU N N 34 116.574 116.574 118.811 -2.237 19623
1115 1 4 . 1 1 34 34 GLU HA H 34 3.826 3.826 4.029 -0.203 19623
1116 1 4 . 1 1 34 34 GLU C C 34 178.661 178.661 178.374 0.287 19623
1117 1 4 . 1 1 34 34 GLU CA C 34 59.689 59.689 59.557 0.132 19623
1118 1 4 . 1 1 34 34 GLU CB C 34 29.855 29.855 28.937 0.918 19623
1119 1 4 . 1 1 34 34 GLU H H 34 7.987 7.987 8.194 -0.207 19623
1120 1 4 . 1 1 35 35 LYS N N 35 114.863 114.863 118.471 -3.608 19623
1121 1 4 . 1 1 35 35 LYS HA H 35 4.207 4.207 4.216 -0.009 19623
1122 1 4 . 1 1 35 35 LYS C C 35 176.861 176.861 176.175 0.686 19623
1123 1 4 . 1 1 35 35 LYS CA C 35 56.328 56.328 55.989 0.339 19623
1124 1 4 . 1 1 35 35 LYS CB C 35 33.007 33.007 32.520 0.487 19623
1125 1 4 . 1 1 35 35 LYS H H 35 7.361 7.361 7.311 0.050 19623
1126 1 4 . 1 1 36 36 ALA N N 36 124.407 124.407 124.080 0.327 19623
1127 1 4 . 1 1 36 36 ALA HA H 36 4.129 4.129 4.272 -0.143 19623
1128 1 4 . 1 1 36 36 ALA C C 36 178.279 178.279 177.293 0.986 19623
1129 1 4 . 1 1 36 36 ALA CA C 36 53.257 53.257 52.910 0.347 19623
1130 1 4 . 1 1 36 36 ALA CB C 36 19.581 19.581 19.668 -0.087 19623
1131 1 4 . 1 1 36 36 ALA H H 36 7.365 7.365 7.416 -0.051 19623
1132 1 4 . 1 1 37 37 LYS N N 37 116.217 116.217 118.832 -2.615 19623
1133 1 4 . 1 1 37 37 LYS HA H 37 4.383 4.383 4.350 0.033 19623
1134 1 4 . 1 1 37 37 LYS C C 37 176.167 176.167 176.207 -0.040 19623
1135 1 4 . 1 1 37 37 LYS CA C 37 56.602 56.602 57.025 -0.423 19623
1136 1 4 . 1 1 37 37 LYS CB C 37 34.883 34.883 33.533 1.350 19623
1137 1 4 . 1 1 37 37 LYS H H 37 8.908 8.908 8.689 0.219 19623
1138 1 4 . 1 1 38 38 GLN N N 38 113.293 113.293 117.460 -4.167 19623
1139 1 4 . 1 1 38 38 GLN HA H 38 4.813 4.813 4.582 0.231 19623
1140 1 4 . 1 1 38 38 GLN C C 38 176.138 176.138 176.132 0.006 19623
1141 1 4 . 1 1 38 38 GLN CA C 38 54.117 54.117 54.215 -0.097 19623
1142 1 4 . 1 1 38 38 GLN CB C 38 32.222 32.222 32.147 0.075 19623
1143 1 4 . 1 1 38 38 GLN H H 38 7.033 7.033 7.911 -0.878 19623
1144 1 4 . 1 1 39 39 VAL N N 39 125.474 125.474 123.336 2.138 19623
1145 1 4 . 1 1 39 39 VAL C C 39 177.751 177.751 177.546 0.205 19623
1146 1 4 . 1 1 39 39 VAL CA C 39 67.737 67.737 66.556 1.181 19623
1147 1 4 . 1 1 39 39 VAL CB C 39 31.438 31.438 31.725 -0.287 19623
1148 1 4 . 1 1 39 39 VAL H H 39 9.250 9.250 8.925 0.325 19623
1149 1 4 . 1 1 40 40 ALA N N 40 120.717 120.717 122.565 -1.848 19623
1150 1 4 . 1 1 40 40 ALA HA H 40 4.041 4.041 4.139 -0.098 19623
1151 1 4 . 1 1 40 40 ALA C C 40 179.081 179.081 179.491 -0.410 19623
1152 1 4 . 1 1 40 40 ALA CA C 40 55.059 55.059 55.223 -0.164 19623
1153 1 4 . 1 1 40 40 ALA CB C 40 17.735 17.735 17.701 0.034 19623
1154 1 4 . 1 1 40 40 ALA H H 40 8.903 8.903 8.401 0.502 19623
1155 1 4 . 1 1 41 41 ALA N N 41 116.698 116.698 121.423 -4.725 19623
1156 1 4 . 1 1 41 41 ALA HA H 41 4.236 4.236 4.081 0.155 19623
1157 1 4 . 1 1 41 41 ALA C C 41 180.294 180.294 180.036 0.258 19623
1158 1 4 . 1 1 41 41 ALA CA C 41 54.688 54.688 54.711 -0.023 19623
1159 1 4 . 1 1 41 41 ALA CB C 41 18.724 18.724 18.307 0.417 19623
1160 1 4 . 1 1 41 41 ALA H H 41 6.701 6.701 8.222 -1.521 19623
1161 1 4 . 1 1 42 42 VAL N N 42 119.051 119.051 118.881 0.170 19623
1162 1 4 . 1 1 42 42 VAL HA H 42 3.278 3.278 3.484 -0.206 19623
1163 1 4 . 1 1 42 42 VAL C C 42 176.812 176.812 178.305 -1.493 19623
1164 1 4 . 1 1 42 42 VAL CA C 42 67.641 67.641 67.076 0.565 19623
1165 1 4 . 1 1 42 42 VAL CB C 42 31.399 31.399 31.632 -0.233 19623
1166 1 4 . 1 1 42 42 VAL H H 42 7.552 7.552 8.015 -0.463 19623
1167 1 4 . 1 1 43 43 GLU N N 43 117.715 117.715 119.724 -2.009 19623
1168 1 4 . 1 1 43 43 GLU HA H 43 3.855 3.855 4.006 -0.151 19623
1169 1 4 . 1 1 43 43 GLU C C 43 178.973 178.973 178.923 0.050 19623
1170 1 4 . 1 1 43 43 GLU CA C 43 59.393 59.393 59.914 -0.521 19623
1171 1 4 . 1 1 43 43 GLU CB C 43 28.811 28.811 29.427 -0.615 19623
1172 1 4 . 1 1 43 43 GLU H H 43 7.804 7.804 8.217 -0.413 19623
1173 1 4 . 1 1 44 44 ASP N N 44 119.175 119.175 120.579 -1.404 19623
1174 1 4 . 1 1 44 44 ASP HA H 44 4.363 4.363 4.474 -0.111 19623
1175 1 4 . 1 1 44 44 ASP C C 44 178.211 178.211 178.885 -0.674 19623
1176 1 4 . 1 1 44 44 ASP CA C 44 57.308 57.308 57.184 0.124 19623
1177 1 4 . 1 1 44 44 ASP CB C 44 40.504 40.504 40.543 -0.039 19623
1178 1 4 . 1 1 44 44 ASP H H 44 8.169 8.169 8.284 -0.115 19623
1179 1 4 . 1 1 45 45 LEU N N 45 117.848 117.848 120.501 -2.653 19623
1180 1 4 . 1 1 45 45 LEU HA H 45 4.119 4.119 3.968 0.151 19623
1181 1 4 . 1 1 45 45 LEU C C 45 178.416 178.416 178.650 -0.234 19623
1182 1 4 . 1 1 45 45 LEU CA C 45 57.294 57.294 57.907 -0.613 19623
1183 1 4 . 1 1 45 45 LEU CB C 45 40.474 40.474 41.834 -1.359 19623
1184 1 4 . 1 1 45 45 LEU H H 45 8.119 8.119 8.476 -0.357 19623
1185 1 4 . 1 1 46 46 LYS N N 46 119.462 119.462 120.145 -0.683 19623
1186 1 4 . 1 1 46 46 LYS HA H 46 3.972 3.972 3.892 0.080 19623
1187 1 4 . 1 1 46 46 LYS C C 46 177.653 177.653 178.622 -0.969 19623
1188 1 4 . 1 1 46 46 LYS CA C 46 60.276 60.276 60.170 0.106 19623
1189 1 4 . 1 1 46 46 LYS CB C 46 31.450 31.450 32.193 -0.743 19623
1190 1 4 . 1 1 46 46 LYS H H 46 8.483 8.483 8.095 0.388 19623
1191 1 4 . 1 1 47 47 ASP N N 47 117.470 117.470 119.348 -1.878 19623
1192 1 4 . 1 1 47 47 ASP HA H 47 4.344 4.344 4.476 -0.132 19623
1193 1 4 . 1 1 47 47 ASP C C 47 179.384 179.384 179.087 0.297 19623
1194 1 4 . 1 1 47 47 ASP CA C 47 57.687 57.687 57.345 0.342 19623
1195 1 4 . 1 1 47 47 ASP CB C 47 40.809 40.809 40.324 0.485 19623
1196 1 4 . 1 1 47 47 ASP H H 47 7.846 7.846 8.070 -0.224 19623
1197 1 4 . 1 1 48 48 GLU N N 48 119.662 119.662 120.118 -0.456 19623
1198 1 4 . 1 1 48 48 GLU HA H 48 4.011 4.011 4.149 -0.138 19623
1199 1 4 . 1 1 48 48 GLU C C 48 180.724 180.724 179.375 1.349 19623
1200 1 4 . 1 1 48 48 GLU CA C 48 60.091 60.091 58.875 1.216 19623
1201 1 4 . 1 1 48 48 GLU CB C 48 31.991 31.991 29.633 2.358 19623
1202 1 4 . 1 1 48 48 GLU H H 48 8.327 8.327 8.264 0.063 19623
1203 1 4 . 1 1 49 49 ILE N N 49 120.308 120.308 120.629 -0.321 19623
1204 1 4 . 1 1 49 49 ILE HA H 49 3.738 3.738 3.708 0.030 19623
1205 1 4 . 1 1 49 49 ILE C C 49 179.238 179.238 178.141 1.097 19623
1206 1 4 . 1 1 49 49 ILE CA C 49 64.592 64.592 65.067 -0.475 19623
1207 1 4 . 1 1 49 49 ILE CB C 49 37.959 37.959 38.097 -0.138 19623
1208 1 4 . 1 1 49 49 ILE H H 49 7.667 7.667 8.422 -0.755 19623
1209 1 4 . 1 1 50 50 LEU N N 50 121.274 121.274 120.997 0.277 19623
1210 1 4 . 1 1 50 50 LEU HA H 50 4.559 4.559 3.914 0.645 19623
1211 1 4 . 1 1 50 50 LEU C C 50 179.971 179.971 177.870 2.101 19623
1212 1 4 . 1 1 50 50 LEU CA C 50 57.794 57.794 58.292 -0.498 19623
1213 1 4 . 1 1 50 50 LEU CB C 50 40.856 40.856 41.474 -0.618 19623
1214 1 4 . 1 1 50 50 LEU H H 50 8.474 8.474 8.177 0.297 19623
1215 1 4 . 1 1 51 51 LYS N N 51 119.972 119.972 119.441 0.531 19623
1216 1 4 . 1 1 51 51 LYS HA H 51 3.982 3.982 3.926 0.056 19623
1217 1 4 . 1 1 51 51 LYS C C 51 179.189 179.189 179.225 -0.036 19623
1218 1 4 . 1 1 51 51 LYS CA C 51 59.526 59.526 59.357 0.169 19623
1219 1 4 . 1 1 51 51 LYS CB C 51 32.175 32.175 32.238 -0.063 19623
1220 1 4 . 1 1 51 51 LYS H H 51 8.197 8.197 8.127 0.070 19623
1221 1 4 . 1 1 52 52 ALA N N 52 121.059 121.059 121.697 -0.638 19623
1222 1 4 . 1 1 52 52 ALA HA H 52 4.158 4.158 4.001 0.157 19623
1223 1 4 . 1 1 52 52 ALA C C 52 178.015 178.015 178.855 -0.840 19623
1224 1 4 . 1 1 52 52 ALA CA C 52 53.662 53.662 54.382 -0.720 19623
1225 1 4 . 1 1 52 52 ALA CB C 52 17.903 17.903 18.337 -0.434 19623
1226 1 4 . 1 1 52 52 ALA H H 52 7.809 7.809 7.903 -0.094 19623
1227 1 4 . 1 1 53 53 HIS N N 53 115.943 115.943 112.568 3.375 19623
1228 1 4 . 1 1 53 53 HIS HA H 53 4.373 4.373 4.594 -0.221 19623
1229 1 4 . 1 1 53 53 HIS C C 53 174.015 174.015 174.191 -0.176 19623
1230 1 4 . 1 1 53 53 HIS CA C 53 57.409 57.409 56.895 0.514 19623
1231 1 4 . 1 1 53 53 HIS CB C 53 29.010 29.010 30.417 -1.407 19623
1232 1 4 . 1 1 53 53 HIS H H 53 7.598 7.598 7.460 0.138 19623
1233 1 4 . 1 1 54 54 ASP N N 54 119.133 119.133 118.169 0.964 19623
1234 1 4 . 1 1 54 54 ASP HA H 54 4.442 4.442 4.395 0.047 19623
1235 1 4 . 1 1 54 54 ASP C C 54 175.609 175.609 176.044 -0.435 19623
1236 1 4 . 1 1 54 54 ASP CA C 54 54.971 54.971 55.621 -0.650 19623
1237 1 4 . 1 1 54 54 ASP CB C 54 40.209 40.209 39.130 1.079 19623
1238 1 4 . 1 1 54 54 ASP H H 54 7.974 7.974 8.014 -0.040 19623
1239 1 4 . 1 1 55 55 ARG N N 55 118.206 118.206 117.329 0.877 19623
1240 1 4 . 1 1 55 55 ARG HA H 55 4.324 4.324 4.451 -0.127 19623
1241 1 4 . 1 1 55 55 ARG C C 55 174.671 174.671 175.238 -0.567 19623
1242 1 4 . 1 1 55 55 ARG CA C 55 54.785 54.785 54.915 -0.130 19623
1243 1 4 . 1 1 55 55 ARG CB C 55 30.507 30.507 30.262 0.245 19623
1244 1 4 . 1 1 55 55 ARG H H 55 7.943 7.943 7.730 0.213 19623
1245 1 5 . 1 1 2 2 GLY N N 2 113.169 113.169 108.230 4.939 19623
1246 1 5 . 1 1 2 2 GLY C C 2 173.996 173.996 173.769 0.227 19623
1247 1 5 . 1 1 2 2 GLY CA C 2 45.211 45.211 44.821 0.390 19623
1248 1 5 . 1 1 2 2 GLY H H 2 8.533 8.533 8.480 0.053 19623
1249 1 5 . 1 1 3 3 ASP N N 3 120.717 120.717 121.284 -0.567 19623
1250 1 5 . 1 1 3 3 ASP HA H 3 4.559 4.559 4.693 -0.134 19623
1251 1 5 . 1 1 3 3 ASP C C 3 176.675 176.675 176.368 0.307 19623
1252 1 5 . 1 1 3 3 ASP CA C 3 54.489 54.489 53.767 0.722 19623
1253 1 5 . 1 1 3 3 ASP CB C 3 41.197 41.197 41.536 -0.339 19623
1254 1 5 . 1 1 3 3 ASP H H 3 8.412 8.412 8.180 0.232 19623
1255 1 5 . 1 1 4 4 LYS N N 4 121.955 121.955 121.975 -0.020 19623
1256 1 5 . 1 1 4 4 LYS HA H 4 4.246 4.246 4.160 0.086 19623
1257 1 5 . 1 1 4 4 LYS C C 4 177.301 177.301 177.677 -0.376 19623
1258 1 5 . 1 1 4 4 LYS CA C 4 56.606 56.606 56.496 0.110 19623
1259 1 5 . 1 1 4 4 LYS CB C 4 32.436 32.436 33.018 -0.582 19623
1260 1 5 . 1 1 4 4 LYS H H 4 8.490 8.490 8.373 0.117 19623
1261 1 5 . 1 1 5 5 GLY N N 5 109.376 109.376 110.707 -1.331 19623
1262 1 5 . 1 1 5 5 GLY C C 5 174.045 174.045 173.648 0.397 19623
1263 1 5 . 1 1 5 5 GLY CA C 5 45.305 45.305 44.701 0.604 19623
1264 1 5 . 1 1 5 5 GLY H H 5 8.491 8.491 8.446 0.045 19623
1265 1 5 . 1 1 6 6 TYR N N 6 120.416 120.416 123.407 -2.991 19623
1266 1 5 . 1 1 6 6 TYR HA H 6 4.510 4.510 4.557 -0.047 19623
1267 1 5 . 1 1 6 6 TYR C C 6 175.952 175.952 176.291 -0.339 19623
1268 1 5 . 1 1 6 6 TYR CA C 6 58.383 58.383 57.557 0.826 19623
1269 1 5 . 1 1 6 6 TYR CB C 6 38.562 38.562 39.295 -0.733 19623
1270 1 5 . 1 1 6 6 TYR H H 6 8.134 8.134 8.603 -0.469 19623
1271 1 5 . 1 1 7 7 ASN N N 7 122.415 122.415 119.842 2.573 19623
1272 1 5 . 1 1 7 7 ASN HA H 7 4.588 4.588 4.812 -0.224 19623
1273 1 5 . 1 1 7 7 ASN C C 7 175.521 175.521 176.905 -1.384 19623
1274 1 5 . 1 1 7 7 ASN CA C 7 53.408 53.408 53.648 -0.240 19623
1275 1 5 . 1 1 7 7 ASN CB C 7 38.780 38.780 38.829 -0.049 19623
1276 1 5 . 1 1 7 7 ASN H H 7 8.557 8.557 8.849 -0.292 19623
1277 1 5 . 1 1 8 8 GLY N N 8 109.431 109.431 109.645 -0.214 19623
1278 1 5 . 1 1 8 8 GLY C C 8 175.609 175.609 176.294 -0.685 19623
1279 1 5 . 1 1 8 8 GLY CA C 8 45.990 45.990 46.927 -0.937 19623
1280 1 5 . 1 1 8 8 GLY H H 8 8.285 8.285 8.711 -0.426 19623
1281 1 5 . 1 1 9 9 LEU N N 9 123.596 123.596 122.586 1.010 19623
1282 1 5 . 1 1 9 9 LEU HA H 9 3.933 3.933 4.119 -0.186 19623
1283 1 5 . 1 1 9 9 LEU C C 9 177.458 177.458 178.102 -0.644 19623
1284 1 5 . 1 1 9 9 LEU CA C 9 58.248 58.248 57.500 0.748 19623
1285 1 5 . 1 1 9 9 LEU CB C 9 41.690 41.690 41.590 0.100 19623
1286 1 5 . 1 1 9 9 LEU H H 9 8.136 8.136 7.580 0.556 19623
1287 1 5 . 1 1 10 10 ALA N N 10 121.310 121.310 120.554 0.756 19623
1288 1 5 . 1 1 10 10 ALA HA H 10 3.933 3.933 3.986 -0.053 19623
1289 1 5 . 1 1 10 10 ALA C C 10 181.140 181.140 179.834 1.306 19623
1290 1 5 . 1 1 10 10 ALA CA C 10 55.505 55.505 55.018 0.487 19623
1291 1 5 . 1 1 10 10 ALA CB C 10 17.791 17.791 18.238 -0.447 19623
1292 1 5 . 1 1 10 10 ALA H H 10 8.361 8.361 8.310 0.051 19623
1293 1 5 . 1 1 11 11 GLU N N 11 118.893 118.893 119.424 -0.531 19623
1294 1 5 . 1 1 11 11 GLU HA H 11 3.992 3.992 4.071 -0.079 19623
1295 1 5 . 1 1 11 11 GLU C C 11 178.797 178.797 179.030 -0.233 19623
1296 1 5 . 1 1 11 11 GLU CA C 11 59.892 59.892 59.180 0.712 19623
1297 1 5 . 1 1 11 11 GLU CB C 11 28.991 28.991 29.717 -0.726 19623
1298 1 5 . 1 1 11 11 GLU H H 11 8.490 8.490 8.197 0.293 19623
1299 1 5 . 1 1 12 12 ALA N N 12 122.362 122.362 122.606 -0.244 19623
1300 1 5 . 1 1 12 12 ALA HA H 12 4.080 4.080 4.070 0.010 19623
1301 1 5 . 1 1 12 12 ALA C C 12 181.228 181.228 179.656 1.572 19623
1302 1 5 . 1 1 12 12 ALA CA C 12 55.218 55.218 55.199 0.019 19623
1303 1 5 . 1 1 12 12 ALA CB C 12 18.462 18.462 18.306 0.156 19623
1304 1 5 . 1 1 12 12 ALA H H 12 8.099 8.099 8.108 -0.009 19623
1305 1 5 . 1 1 13 13 LYS N N 13 118.689 118.689 118.622 0.067 19623
1306 1 5 . 1 1 13 13 LYS HA H 13 3.620 3.620 3.966 -0.346 19623
1307 1 5 . 1 1 13 13 LYS C C 13 177.203 177.203 178.526 -1.323 19623
1308 1 5 . 1 1 13 13 LYS CA C 13 60.390 60.390 59.931 0.459 19623
1309 1 5 . 1 1 13 13 LYS CB C 13 33.624 33.624 32.359 1.265 19623
1310 1 5 . 1 1 13 13 LYS H H 13 8.382 8.382 8.342 0.040 19623
1311 1 5 . 1 1 14 14 GLU N N 14 117.865 117.865 120.050 -2.185 19623
1312 1 5 . 1 1 14 14 GLU HA H 14 4.285 4.285 4.020 0.265 19623
1313 1 5 . 1 1 14 14 GLU C C 14 179.404 179.404 178.981 0.423 19623
1314 1 5 . 1 1 14 14 GLU CA C 14 60.007 60.007 59.620 0.387 19623
1315 1 5 . 1 1 14 14 GLU CB C 14 29.418 29.418 29.565 -0.147 19623
1316 1 5 . 1 1 14 14 GLU H H 14 7.952 7.952 8.165 -0.213 19623
1317 1 5 . 1 1 15 15 LYS N N 15 119.020 119.020 118.368 0.652 19623
1318 1 5 . 1 1 15 15 LYS HA H 15 3.933 3.933 4.090 -0.157 19623
1319 1 5 . 1 1 15 15 LYS C C 15 177.976 177.976 178.924 -0.948 19623
1320 1 5 . 1 1 15 15 LYS CA C 15 59.591 59.591 59.114 0.477 19623
1321 1 5 . 1 1 15 15 LYS CB C 15 32.275 32.275 32.355 -0.080 19623
1322 1 5 . 1 1 15 15 LYS H H 15 8.029 8.029 7.932 0.097 19623
1323 1 5 . 1 1 16 16 ALA N N 16 120.410 120.410 122.564 -2.154 19623
1324 1 5 . 1 1 16 16 ALA HA H 16 3.962 3.962 4.137 -0.175 19623
1325 1 5 . 1 1 16 16 ALA C C 16 179.140 179.140 179.560 -0.420 19623
1326 1 5 . 1 1 16 16 ALA CA C 16 55.426 55.426 55.192 0.234 19623
1327 1 5 . 1 1 16 16 ALA CB C 16 18.410 18.410 18.649 -0.239 19623
1328 1 5 . 1 1 16 16 ALA H H 16 7.904 7.904 7.781 0.123 19623
1329 1 5 . 1 1 17 17 ILE N N 17 117.363 117.363 114.814 2.549 19623
1330 1 5 . 1 1 17 17 ILE HA H 17 5.850 5.850 3.905 1.945 19623
1331 1 5 . 1 1 17 17 ILE C C 17 177.604 177.604 177.651 -0.047 19623
1332 1 5 . 1 1 17 17 ILE CA C 17 66.545 66.545 63.803 2.742 19623
1333 1 5 . 1 1 17 17 ILE CB C 17 37.843 37.843 37.546 0.297 19623
1334 1 5 . 1 1 17 17 ILE H H 17 8.500 8.500 8.101 0.399 19623
1335 1 5 . 1 1 18 18 LYS N N 18 119.838 119.838 122.152 -2.314 19623
1336 1 5 . 1 1 18 18 LYS HA H 18 3.865 3.865 3.881 -0.016 19623
1337 1 5 . 1 1 18 18 LYS C C 18 176.653 176.653 178.600 -1.947 19623
1338 1 5 . 1 1 18 18 LYS CA C 18 60.189 60.189 60.400 -0.211 19623
1339 1 5 . 1 1 18 18 LYS CB C 18 32.260 32.260 32.144 0.116 19623
1340 1 5 . 1 1 18 18 LYS H H 18 7.833 7.833 8.051 -0.218 19623
1341 1 5 . 1 1 19 19 ASP N N 19 120.497 120.497 119.787 0.710 19623
1342 1 5 . 1 1 19 19 ASP HA H 19 4.569 4.569 4.270 0.299 19623
1343 1 5 . 1 1 19 19 ASP C C 19 179.120 179.120 178.870 0.250 19623
1344 1 5 . 1 1 19 19 ASP CA C 19 57.108 57.108 57.080 0.028 19623
1345 1 5 . 1 1 19 19 ASP CB C 19 40.853 40.853 40.455 0.398 19623
1346 1 5 . 1 1 19 19 ASP H H 19 8.479 8.479 7.692 0.787 19623
1347 1 5 . 1 1 20 20 LEU N N 20 121.660 121.660 120.028 1.632 19623
1348 1 5 . 1 1 20 20 LEU HA H 20 4.148 4.148 4.118 0.030 19623
1349 1 5 . 1 1 20 20 LEU C C 20 178.377 178.377 178.829 -0.452 19623
1350 1 5 . 1 1 20 20 LEU CA C 20 58.225 58.225 58.204 0.021 19623
1351 1 5 . 1 1 20 20 LEU CB C 20 41.585 41.585 41.746 -0.161 19623
1352 1 5 . 1 1 20 20 LEU H H 20 8.136 8.136 7.654 0.482 19623
1353 1 5 . 1 1 21 21 LYS N N 21 120.182 120.182 119.368 0.814 19623
1354 1 5 . 1 1 21 21 LYS HA H 21 3.904 3.904 4.146 -0.242 19623
1355 1 5 . 1 1 21 21 LYS C C 21 179.785 179.785 179.405 0.380 19623
1356 1 5 . 1 1 21 21 LYS CA C 21 59.557 59.557 59.246 0.311 19623
1357 1 5 . 1 1 21 21 LYS CB C 21 29.655 29.655 32.455 -2.800 19623
1358 1 5 . 1 1 21 21 LYS H H 21 8.043 8.043 8.048 -0.005 19623
1359 1 5 . 1 1 22 22 ILE N N 22 121.523 121.523 120.091 1.432 19623
1360 1 5 . 1 1 22 22 ILE HA H 22 3.522 3.522 3.672 -0.150 19623
1361 1 5 . 1 1 22 22 ILE C C 22 177.399 177.399 177.864 -0.465 19623
1362 1 5 . 1 1 22 22 ILE CA C 22 64.863 64.863 64.445 0.418 19623
1363 1 5 . 1 1 22 22 ILE CB C 22 38.046 38.046 37.822 0.225 19623
1364 1 5 . 1 1 22 22 ILE H H 22 8.735 8.735 7.664 1.071 19623
1365 1 5 . 1 1 23 23 TYR N N 23 117.506 117.506 118.188 -0.682 19623
1366 1 5 . 1 1 23 23 TYR HA H 23 4.481 4.481 4.349 0.132 19623
1367 1 5 . 1 1 23 23 TYR C C 23 176.020 176.020 176.833 -0.813 19623
1368 1 5 . 1 1 23 23 TYR CA C 23 58.369 58.369 59.310 -0.941 19623
1369 1 5 . 1 1 23 23 TYR CB C 23 38.499 38.499 38.348 0.151 19623
1370 1 5 . 1 1 23 23 TYR H H 23 7.291 7.291 7.943 -0.652 19623
1371 1 5 . 1 1 24 24 GLY N N 24 108.209 108.209 106.292 1.917 19623
1372 1 5 . 1 1 24 24 GLY C C 24 174.651 174.651 174.604 0.047 19623
1373 1 5 . 1 1 24 24 GLY CA C 24 46.409 46.409 44.964 1.445 19623
1374 1 5 . 1 1 24 24 GLY H H 24 7.910 7.910 7.774 0.136 19623
1375 1 5 . 1 1 25 25 ILE N N 25 119.897 119.897 122.473 -2.576 19623
1376 1 5 . 1 1 25 25 ILE HA H 25 3.747 3.747 4.353 -0.606 19623
1377 1 5 . 1 1 25 25 ILE C C 25 175.864 175.864 176.267 -0.403 19623
1378 1 5 . 1 1 25 25 ILE CA C 25 60.984 60.984 61.540 -0.556 19623
1379 1 5 . 1 1 25 25 ILE CB C 25 37.120 37.120 39.819 -2.699 19623
1380 1 5 . 1 1 25 25 ILE H H 25 7.383 7.383 8.097 -0.714 19623
1381 1 5 . 1 1 26 26 GLY N N 26 111.580 111.580 115.422 -3.842 19623
1382 1 5 . 1 1 26 26 GLY C C 26 174.847 174.847 175.279 -0.432 19623
1383 1 5 . 1 1 26 26 GLY CA C 26 45.322 45.322 44.778 0.544 19623
1384 1 5 . 1 1 26 26 GLY H H 26 8.811 8.811 8.522 0.289 19623
1385 1 5 . 1 1 27 27 GLU N N 27 120.229 120.229 121.175 -0.946 19623
1386 1 5 . 1 1 27 27 GLU C C 27 177.311 177.311 178.606 -1.295 19623
1387 1 5 . 1 1 27 27 GLU CA C 27 59.730 59.730 59.291 0.439 19623
1388 1 5 . 1 1 27 27 GLU CB C 27 29.933 29.933 29.744 0.189 19623
1389 1 5 . 1 1 27 27 GLU H H 27 8.711 8.711 8.988 -0.277 19623
1390 1 5 . 1 1 28 28 HIS N N 28 117.558 117.558 119.172 -1.614 19623
1391 1 5 . 1 1 28 28 HIS C C 28 176.949 176.949 177.076 -0.127 19623
1392 1 5 . 1 1 28 28 HIS CA C 28 59.674 59.674 59.601 0.073 19623
1393 1 5 . 1 1 28 28 HIS CB C 28 29.838 29.838 29.352 0.485 19623
1394 1 5 . 1 1 28 28 HIS H H 28 8.870 8.870 8.541 0.329 19623
1395 1 5 . 1 1 29 29 TYR N N 29 115.589 115.589 116.560 -0.971 19623
1396 1 5 . 1 1 29 29 TYR HA H 29 4.090 4.090 4.287 -0.197 19623
1397 1 5 . 1 1 29 29 TYR C C 29 177.552 177.552 178.039 -0.487 19623
1398 1 5 . 1 1 29 29 TYR CA C 29 60.998 60.998 61.045 -0.047 19623
1399 1 5 . 1 1 29 29 TYR CB C 29 38.683 38.683 38.550 0.133 19623
1400 1 5 . 1 1 29 29 TYR H H 29 7.227 7.227 7.686 -0.459 19623
1401 1 5 . 1 1 30 30 ILE N N 30 120.353 120.353 120.118 0.235 19623
1402 1 5 . 1 1 30 30 ILE HA H 30 3.444 3.444 3.682 -0.238 19623
1403 1 5 . 1 1 30 30 ILE C C 30 178.211 178.211 177.713 0.498 19623
1404 1 5 . 1 1 30 30 ILE CA C 30 65.640 65.640 63.271 2.369 19623
1405 1 5 . 1 1 30 30 ILE CB C 30 37.553 37.553 36.746 0.807 19623
1406 1 5 . 1 1 30 30 ILE H H 30 7.485 7.485 7.599 -0.114 19623
1407 1 5 . 1 1 31 31 LYS N N 31 117.249 117.249 119.890 -2.641 19623
1408 1 5 . 1 1 31 31 LYS HA H 31 4.011 4.011 4.085 -0.074 19623
1409 1 5 . 1 1 31 31 LYS C C 31 178.954 178.954 179.180 -0.226 19623
1410 1 5 . 1 1 31 31 LYS CA C 31 58.893 58.893 59.230 -0.337 19623
1411 1 5 . 1 1 31 31 LYS CB C 31 31.673 31.673 32.184 -0.511 19623
1412 1 5 . 1 1 31 31 LYS H H 31 8.064 8.064 8.173 -0.109 19623
1413 1 5 . 1 1 32 32 LEU N N 32 117.176 117.176 119.833 -2.657 19623
1414 1 5 . 1 1 32 32 LEU HA H 32 3.894 3.894 3.879 0.015 19623
1415 1 5 . 1 1 32 32 LEU C C 32 179.883 179.883 178.437 1.446 19623
1416 1 5 . 1 1 32 32 LEU CA C 32 57.987 57.987 57.667 0.320 19623
1417 1 5 . 1 1 32 32 LEU CB C 32 41.255 41.255 41.612 -0.357 19623
1418 1 5 . 1 1 32 32 LEU H H 32 7.154 7.154 7.208 -0.054 19623
1419 1 5 . 1 1 33 33 ILE N N 33 118.598 118.598 116.308 2.290 19623
1420 1 5 . 1 1 33 33 ILE HA H 33 3.571 3.571 3.729 -0.158 19623
1421 1 5 . 1 1 33 33 ILE C C 33 177.917 177.917 178.871 -0.954 19623
1422 1 5 . 1 1 33 33 ILE CA C 33 63.579 63.579 62.961 0.618 19623
1423 1 5 . 1 1 33 33 ILE CB C 33 35.702 35.702 37.359 -1.657 19623
1424 1 5 . 1 1 33 33 ILE H H 33 7.412 7.412 7.459 -0.047 19623
1425 1 5 . 1 1 34 34 GLU N N 34 116.574 116.574 120.087 -3.513 19623
1426 1 5 . 1 1 34 34 GLU HA H 34 3.826 3.826 4.028 -0.202 19623
1427 1 5 . 1 1 34 34 GLU C C 34 178.661 178.661 178.648 0.013 19623
1428 1 5 . 1 1 34 34 GLU CA C 34 59.689 59.689 59.637 0.052 19623
1429 1 5 . 1 1 34 34 GLU CB C 34 29.855 29.855 29.343 0.511 19623
1430 1 5 . 1 1 34 34 GLU H H 34 7.987 7.987 7.819 0.168 19623
1431 1 5 . 1 1 35 35 LYS N N 35 114.863 114.863 117.804 -2.941 19623
1432 1 5 . 1 1 35 35 LYS HA H 35 4.207 4.207 4.304 -0.097 19623
1433 1 5 . 1 1 35 35 LYS C C 35 176.861 176.861 175.909 0.952 19623
1434 1 5 . 1 1 35 35 LYS CA C 35 56.328 56.328 55.492 0.835 19623
1435 1 5 . 1 1 35 35 LYS CB C 35 33.007 33.007 32.733 0.274 19623
1436 1 5 . 1 1 35 35 LYS H H 35 7.361 7.361 7.797 -0.436 19623
1437 1 5 . 1 1 36 36 ALA N N 36 124.407 124.407 124.215 0.192 19623
1438 1 5 . 1 1 36 36 ALA HA H 36 4.129 4.129 4.291 -0.162 19623
1439 1 5 . 1 1 36 36 ALA C C 36 178.279 178.279 177.251 1.028 19623
1440 1 5 . 1 1 36 36 ALA CA C 36 53.257 53.257 52.818 0.439 19623
1441 1 5 . 1 1 36 36 ALA CB C 36 19.581 19.581 19.665 -0.083 19623
1442 1 5 . 1 1 36 36 ALA H H 36 7.365 7.365 7.431 -0.066 19623
1443 1 5 . 1 1 37 37 LYS N N 37 116.217 116.217 120.052 -3.835 19623
1444 1 5 . 1 1 37 37 LYS HA H 37 4.383 4.383 4.371 0.012 19623
1445 1 5 . 1 1 37 37 LYS C C 37 176.167 176.167 175.840 0.327 19623
1446 1 5 . 1 1 37 37 LYS CA C 37 56.602 56.602 56.761 -0.159 19623
1447 1 5 . 1 1 37 37 LYS CB C 37 34.883 34.883 33.003 1.880 19623
1448 1 5 . 1 1 37 37 LYS H H 37 8.908 8.908 8.715 0.193 19623
1449 1 5 . 1 1 38 38 GLN N N 38 113.293 113.293 117.893 -4.600 19623
1450 1 5 . 1 1 38 38 GLN HA H 38 4.813 4.813 4.551 0.262 19623
1451 1 5 . 1 1 38 38 GLN C C 38 176.138 176.138 175.467 0.671 19623
1452 1 5 . 1 1 38 38 GLN CA C 38 54.117 54.117 54.816 -0.698 19623
1453 1 5 . 1 1 38 38 GLN CB C 38 32.222 32.222 31.640 0.582 19623
1454 1 5 . 1 1 38 38 GLN H H 38 7.033 7.033 7.414 -0.381 19623
1455 1 5 . 1 1 39 39 VAL N N 39 125.474 125.474 124.393 1.081 19623
1456 1 5 . 1 1 39 39 VAL C C 39 177.751 177.751 177.233 0.518 19623
1457 1 5 . 1 1 39 39 VAL CA C 39 67.737 67.737 65.857 1.880 19623
1458 1 5 . 1 1 39 39 VAL CB C 39 31.438 31.438 31.595 -0.157 19623
1459 1 5 . 1 1 39 39 VAL H H 39 9.250 9.250 8.711 0.539 19623
1460 1 5 . 1 1 40 40 ALA N N 40 120.717 120.717 122.471 -1.754 19623
1461 1 5 . 1 1 40 40 ALA HA H 40 4.041 4.041 4.118 -0.077 19623
1462 1 5 . 1 1 40 40 ALA C C 40 179.081 179.081 179.459 -0.378 19623
1463 1 5 . 1 1 40 40 ALA CA C 40 55.059 55.059 55.232 -0.173 19623
1464 1 5 . 1 1 40 40 ALA CB C 40 17.735 17.735 17.706 0.029 19623
1465 1 5 . 1 1 40 40 ALA H H 40 8.903 8.903 8.402 0.501 19623
1466 1 5 . 1 1 41 41 ALA N N 41 116.698 116.698 121.422 -4.724 19623
1467 1 5 . 1 1 41 41 ALA HA H 41 4.236 4.236 4.061 0.175 19623
1468 1 5 . 1 1 41 41 ALA C C 41 180.294 180.294 180.014 0.280 19623
1469 1 5 . 1 1 41 41 ALA CA C 41 54.688 54.688 54.710 -0.022 19623
1470 1 5 . 1 1 41 41 ALA CB C 41 18.724 18.724 18.287 0.437 19623
1471 1 5 . 1 1 41 41 ALA H H 41 6.701 6.701 8.223 -1.522 19623
1472 1 5 . 1 1 42 42 VAL N N 42 119.051 119.051 118.970 0.081 19623
1473 1 5 . 1 1 42 42 VAL HA H 42 3.278 3.278 3.474 -0.196 19623
1474 1 5 . 1 1 42 42 VAL C C 42 176.812 176.812 178.338 -1.526 19623
1475 1 5 . 1 1 42 42 VAL CA C 42 67.641 67.641 67.109 0.533 19623
1476 1 5 . 1 1 42 42 VAL CB C 42 31.399 31.399 31.622 -0.223 19623
1477 1 5 . 1 1 42 42 VAL H H 42 7.552 7.552 8.266 -0.714 19623
1478 1 5 . 1 1 43 43 GLU N N 43 117.715 117.715 119.905 -2.190 19623
1479 1 5 . 1 1 43 43 GLU HA H 43 3.855 3.855 4.000 -0.145 19623
1480 1 5 . 1 1 43 43 GLU C C 43 178.973 178.973 178.967 0.006 19623
1481 1 5 . 1 1 43 43 GLU CA C 43 59.393 59.393 59.961 -0.568 19623
1482 1 5 . 1 1 43 43 GLU CB C 43 28.811 28.811 29.474 -0.663 19623
1483 1 5 . 1 1 43 43 GLU H H 43 7.804 7.804 8.176 -0.372 19623
1484 1 5 . 1 1 44 44 ASP N N 44 119.175 119.175 120.416 -1.241 19623
1485 1 5 . 1 1 44 44 ASP HA H 44 4.363 4.363 4.463 -0.100 19623
1486 1 5 . 1 1 44 44 ASP C C 44 178.211 178.211 178.937 -0.726 19623
1487 1 5 . 1 1 44 44 ASP CA C 44 57.308 57.308 57.128 0.180 19623
1488 1 5 . 1 1 44 44 ASP CB C 44 40.504 40.504 40.599 -0.095 19623
1489 1 5 . 1 1 44 44 ASP H H 44 8.169 8.169 8.287 -0.118 19623
1490 1 5 . 1 1 45 45 LEU N N 45 117.848 117.848 120.502 -2.654 19623
1491 1 5 . 1 1 45 45 LEU HA H 45 4.119 4.119 3.947 0.172 19623
1492 1 5 . 1 1 45 45 LEU C C 45 178.416 178.416 178.636 -0.220 19623
1493 1 5 . 1 1 45 45 LEU CA C 45 57.294 57.294 57.880 -0.586 19623
1494 1 5 . 1 1 45 45 LEU CB C 45 40.474 40.474 41.854 -1.380 19623
1495 1 5 . 1 1 45 45 LEU H H 45 8.119 8.119 8.439 -0.320 19623
1496 1 5 . 1 1 46 46 LYS N N 46 119.462 119.462 119.921 -0.459 19623
1497 1 5 . 1 1 46 46 LYS HA H 46 3.972 3.972 3.853 0.119 19623
1498 1 5 . 1 1 46 46 LYS C C 46 177.653 177.653 178.711 -1.058 19623
1499 1 5 . 1 1 46 46 LYS CA C 46 60.276 60.276 60.208 0.068 19623
1500 1 5 . 1 1 46 46 LYS CB C 46 31.450 31.450 32.132 -0.682 19623
1501 1 5 . 1 1 46 46 LYS H H 46 8.483 8.483 8.178 0.305 19623
1502 1 5 . 1 1 47 47 ASP N N 47 117.470 117.470 119.455 -1.985 19623
1503 1 5 . 1 1 47 47 ASP HA H 47 4.344 4.344 4.524 -0.180 19623
1504 1 5 . 1 1 47 47 ASP C C 47 179.384 179.384 178.918 0.466 19623
1505 1 5 . 1 1 47 47 ASP CA C 47 57.687 57.687 57.376 0.311 19623
1506 1 5 . 1 1 47 47 ASP CB C 47 40.809 40.809 40.296 0.513 19623
1507 1 5 . 1 1 47 47 ASP H H 47 7.846 7.846 8.023 -0.177 19623
1508 1 5 . 1 1 48 48 GLU N N 48 119.662 119.662 119.777 -0.115 19623
1509 1 5 . 1 1 48 48 GLU HA H 48 4.011 4.011 3.992 0.019 19623
1510 1 5 . 1 1 48 48 GLU C C 48 180.724 180.724 179.342 1.382 19623
1511 1 5 . 1 1 48 48 GLU CA C 48 60.091 60.091 58.700 1.391 19623
1512 1 5 . 1 1 48 48 GLU CB C 48 31.991 31.991 29.371 2.620 19623
1513 1 5 . 1 1 48 48 GLU H H 48 8.327 8.327 7.827 0.500 19623
1514 1 5 . 1 1 49 49 ILE N N 49 120.308 120.308 120.806 -0.498 19623
1515 1 5 . 1 1 49 49 ILE HA H 49 3.738 3.738 3.672 0.066 19623
1516 1 5 . 1 1 49 49 ILE C C 49 179.238 179.238 177.981 1.257 19623
1517 1 5 . 1 1 49 49 ILE CA C 49 64.592 64.592 65.211 -0.619 19623
1518 1 5 . 1 1 49 49 ILE CB C 49 37.959 37.959 37.949 0.010 19623
1519 1 5 . 1 1 49 49 ILE H H 49 7.667 7.667 8.470 -0.803 19623
1520 1 5 . 1 1 50 50 LEU N N 50 121.274 121.274 120.553 0.721 19623
1521 1 5 . 1 1 50 50 LEU HA H 50 4.559 4.559 3.907 0.652 19623
1522 1 5 . 1 1 50 50 LEU C C 50 179.971 179.971 178.870 1.101 19623
1523 1 5 . 1 1 50 50 LEU CA C 50 57.794 57.794 57.705 0.089 19623
1524 1 5 . 1 1 50 50 LEU CB C 50 40.856 40.856 41.225 -0.369 19623
1525 1 5 . 1 1 50 50 LEU H H 50 8.474 8.474 8.055 0.419 19623
1526 1 5 . 1 1 51 51 LYS N N 51 119.972 119.972 119.637 0.335 19623
1527 1 5 . 1 1 51 51 LYS HA H 51 3.982 3.982 4.000 -0.019 19623
1528 1 5 . 1 1 51 51 LYS C C 51 179.189 179.189 179.066 0.123 19623
1529 1 5 . 1 1 51 51 LYS CA C 51 59.526 59.526 59.378 0.148 19623
1530 1 5 . 1 1 51 51 LYS CB C 51 32.175 32.175 32.074 0.101 19623
1531 1 5 . 1 1 51 51 LYS H H 51 8.197 8.197 7.884 0.313 19623
1532 1 5 . 1 1 52 52 ALA N N 52 121.059 121.059 120.048 1.011 19623
1533 1 5 . 1 1 52 52 ALA HA H 52 4.158 4.158 4.063 0.095 19623
1534 1 5 . 1 1 52 52 ALA C C 52 178.015 178.015 178.608 -0.593 19623
1535 1 5 . 1 1 52 52 ALA CA C 52 53.662 53.662 54.269 -0.607 19623
1536 1 5 . 1 1 52 52 ALA CB C 52 17.903 17.903 18.379 -0.476 19623
1537 1 5 . 1 1 52 52 ALA H H 52 7.809 7.809 7.511 0.298 19623
1538 1 5 . 1 1 53 53 HIS N N 53 115.943 115.943 116.710 -0.767 19623
1539 1 5 . 1 1 53 53 HIS HA H 53 4.373 4.373 4.315 0.058 19623
1540 1 5 . 1 1 53 53 HIS C C 53 174.015 174.015 174.976 -0.961 19623
1541 1 5 . 1 1 53 53 HIS CA C 53 57.409 57.409 57.855 -0.445 19623
1542 1 5 . 1 1 53 53 HIS CB C 53 29.010 29.010 30.314 -1.304 19623
1543 1 5 . 1 1 53 53 HIS H H 53 7.598 7.598 7.901 -0.303 19623
1544 1 5 . 1 1 54 54 ASP N N 54 119.133 119.133 114.718 4.415 19623
1545 1 5 . 1 1 54 54 ASP HA H 54 4.442 4.442 4.343 0.099 19623
1546 1 5 . 1 1 54 54 ASP C C 54 175.609 175.609 176.026 -0.417 19623
1547 1 5 . 1 1 54 54 ASP CA C 54 54.971 54.971 55.398 -0.426 19623
1548 1 5 . 1 1 54 54 ASP CB C 54 40.209 40.209 38.681 1.528 19623
1549 1 5 . 1 1 54 54 ASP H H 54 7.974 7.974 8.128 -0.154 19623
1550 1 5 . 1 1 55 55 ARG N N 55 118.206 118.206 117.984 0.222 19623
1551 1 5 . 1 1 55 55 ARG HA H 55 4.324 4.324 4.461 -0.137 19623
1552 1 5 . 1 1 55 55 ARG C C 55 174.671 174.671 176.306 -1.635 19623
1553 1 5 . 1 1 55 55 ARG CA C 55 54.785 54.785 55.412 -0.627 19623
1554 1 5 . 1 1 55 55 ARG CB C 55 30.507 30.507 31.123 -0.616 19623
1555 1 5 . 1 1 55 55 ARG H H 55 7.943 7.943 8.138 -0.195 19623
1556 1 6 . 1 1 2 2 GLY N N 2 113.169 113.169 107.832 5.337 19623
1557 1 6 . 1 1 2 2 GLY C C 2 173.996 173.996 173.774 0.222 19623
1558 1 6 . 1 1 2 2 GLY CA C 2 45.211 45.211 44.770 0.441 19623
1559 1 6 . 1 1 2 2 GLY H H 2 8.533 8.533 7.715 0.818 19623
1560 1 6 . 1 1 3 3 ASP N N 3 120.717 120.717 119.526 1.191 19623
1561 1 6 . 1 1 3 3 ASP HA H 3 4.559 4.559 4.666 -0.107 19623
1562 1 6 . 1 1 3 3 ASP C C 3 176.675 176.675 176.142 0.533 19623
1563 1 6 . 1 1 3 3 ASP CA C 3 54.489 54.489 53.455 1.034 19623
1564 1 6 . 1 1 3 3 ASP CB C 3 41.197 41.197 41.555 -0.358 19623
1565 1 6 . 1 1 3 3 ASP H H 3 8.412 8.412 7.936 0.476 19623
1566 1 6 . 1 1 4 4 LYS N N 4 121.955 121.955 121.270 0.685 19623
1567 1 6 . 1 1 4 4 LYS HA H 4 4.246 4.246 4.019 0.227 19623
1568 1 6 . 1 1 4 4 LYS C C 4 177.301 177.301 177.438 -0.137 19623
1569 1 6 . 1 1 4 4 LYS CA C 4 56.606 56.606 58.147 -1.541 19623
1570 1 6 . 1 1 4 4 LYS CB C 4 32.436 32.436 32.210 0.226 19623
1571 1 6 . 1 1 4 4 LYS H H 4 8.490 8.490 8.381 0.109 19623
1572 1 6 . 1 1 5 5 GLY N N 5 109.376 109.376 113.125 -3.749 19623
1573 1 6 . 1 1 5 5 GLY C C 5 174.045 174.045 174.845 -0.800 19623
1574 1 6 . 1 1 5 5 GLY CA C 5 45.305 45.305 44.755 0.550 19623
1575 1 6 . 1 1 5 5 GLY H H 5 8.491 8.491 8.677 -0.186 19623
1576 1 6 . 1 1 6 6 TYR N N 6 120.416 120.416 120.686 -0.270 19623
1577 1 6 . 1 1 6 6 TYR HA H 6 4.510 4.510 4.282 0.228 19623
1578 1 6 . 1 1 6 6 TYR C C 6 175.952 175.952 174.357 1.595 19623
1579 1 6 . 1 1 6 6 TYR CA C 6 58.383 58.383 58.420 -0.037 19623
1580 1 6 . 1 1 6 6 TYR CB C 6 38.562 38.562 39.294 -0.732 19623
1581 1 6 . 1 1 6 6 TYR H H 6 8.134 8.134 7.777 0.357 19623
1582 1 6 . 1 1 7 7 ASN N N 7 122.415 122.415 126.630 -4.215 19623
1583 1 6 . 1 1 7 7 ASN HA H 7 4.588 4.588 4.480 0.108 19623
1584 1 6 . 1 1 7 7 ASN C C 7 175.521 175.521 175.897 -0.376 19623
1585 1 6 . 1 1 7 7 ASN CA C 7 53.408 53.408 53.999 -0.591 19623
1586 1 6 . 1 1 7 7 ASN CB C 7 38.780 38.780 38.179 0.601 19623
1587 1 6 . 1 1 7 7 ASN H H 7 8.557 8.557 8.271 0.286 19623
1588 1 6 . 1 1 8 8 GLY N N 8 109.431 109.431 111.152 -1.721 19623
1589 1 6 . 1 1 8 8 GLY C C 8 175.609 175.609 175.332 0.277 19623
1590 1 6 . 1 1 8 8 GLY CA C 8 45.990 45.990 45.285 0.705 19623
1591 1 6 . 1 1 8 8 GLY H H 8 8.285 8.285 8.622 -0.337 19623
1592 1 6 . 1 1 9 9 LEU N N 9 123.596 123.596 123.158 0.438 19623
1593 1 6 . 1 1 9 9 LEU HA H 9 3.933 3.933 4.274 -0.341 19623
1594 1 6 . 1 1 9 9 LEU C C 9 177.458 177.458 177.578 -0.120 19623
1595 1 6 . 1 1 9 9 LEU CA C 9 58.248 58.248 58.491 -0.243 19623
1596 1 6 . 1 1 9 9 LEU CB C 9 41.690 41.690 41.647 0.043 19623
1597 1 6 . 1 1 9 9 LEU H H 9 8.136 8.136 7.554 0.582 19623
1598 1 6 . 1 1 10 10 ALA N N 10 121.310 121.310 121.273 0.037 19623
1599 1 6 . 1 1 10 10 ALA HA H 10 3.933 3.933 3.978 -0.045 19623
1600 1 6 . 1 1 10 10 ALA C C 10 181.140 181.140 179.795 1.345 19623
1601 1 6 . 1 1 10 10 ALA CA C 10 55.505 55.505 55.160 0.345 19623
1602 1 6 . 1 1 10 10 ALA CB C 10 17.791 17.791 17.742 0.049 19623
1603 1 6 . 1 1 10 10 ALA H H 10 8.361 8.361 8.726 -0.365 19623
1604 1 6 . 1 1 11 11 GLU N N 11 118.893 118.893 119.357 -0.464 19623
1605 1 6 . 1 1 11 11 GLU HA H 11 3.992 3.992 4.050 -0.058 19623
1606 1 6 . 1 1 11 11 GLU C C 11 178.797 178.797 178.775 0.022 19623
1607 1 6 . 1 1 11 11 GLU CA C 11 59.892 59.892 59.274 0.618 19623
1608 1 6 . 1 1 11 11 GLU CB C 11 28.991 28.991 29.331 -0.341 19623
1609 1 6 . 1 1 11 11 GLU H H 11 8.490 8.490 8.104 0.386 19623
1610 1 6 . 1 1 12 12 ALA N N 12 122.362 122.362 122.500 -0.138 19623
1611 1 6 . 1 1 12 12 ALA HA H 12 4.080 4.080 4.110 -0.030 19623
1612 1 6 . 1 1 12 12 ALA C C 12 181.228 181.228 179.638 1.590 19623
1613 1 6 . 1 1 12 12 ALA CA C 12 55.218 55.218 55.215 0.003 19623
1614 1 6 . 1 1 12 12 ALA CB C 12 18.462 18.462 18.346 0.116 19623
1615 1 6 . 1 1 12 12 ALA H H 12 8.099 8.099 8.186 -0.087 19623
1616 1 6 . 1 1 13 13 LYS N N 13 118.689 118.689 118.694 -0.005 19623
1617 1 6 . 1 1 13 13 LYS HA H 13 3.620 3.620 3.998 -0.378 19623
1618 1 6 . 1 1 13 13 LYS C C 13 177.203 177.203 178.627 -1.424 19623
1619 1 6 . 1 1 13 13 LYS CA C 13 60.390 60.390 59.957 0.433 19623
1620 1 6 . 1 1 13 13 LYS CB C 13 33.624 33.624 32.377 1.247 19623
1621 1 6 . 1 1 13 13 LYS H H 13 8.382 8.382 8.294 0.088 19623
1622 1 6 . 1 1 14 14 GLU N N 14 117.865 117.865 120.218 -2.353 19623
1623 1 6 . 1 1 14 14 GLU HA H 14 4.285 4.285 4.044 0.241 19623
1624 1 6 . 1 1 14 14 GLU C C 14 179.404 179.404 178.893 0.511 19623
1625 1 6 . 1 1 14 14 GLU CA C 14 60.007 60.007 59.652 0.355 19623
1626 1 6 . 1 1 14 14 GLU CB C 14 29.418 29.418 29.518 -0.100 19623
1627 1 6 . 1 1 14 14 GLU H H 14 7.952 7.952 8.234 -0.282 19623
1628 1 6 . 1 1 15 15 LYS N N 15 119.020 119.020 118.989 0.031 19623
1629 1 6 . 1 1 15 15 LYS HA H 15 3.933 3.933 4.075 -0.142 19623
1630 1 6 . 1 1 15 15 LYS C C 15 177.976 177.976 178.983 -1.007 19623
1631 1 6 . 1 1 15 15 LYS CA C 15 59.591 59.591 59.434 0.157 19623
1632 1 6 . 1 1 15 15 LYS CB C 15 32.275 32.275 32.407 -0.132 19623
1633 1 6 . 1 1 15 15 LYS H H 15 8.029 8.029 8.039 -0.010 19623
1634 1 6 . 1 1 16 16 ALA N N 16 120.410 120.410 122.576 -2.166 19623
1635 1 6 . 1 1 16 16 ALA HA H 16 3.962 3.962 4.153 -0.191 19623
1636 1 6 . 1 1 16 16 ALA C C 16 179.140 179.140 179.675 -0.535 19623
1637 1 6 . 1 1 16 16 ALA CA C 16 55.426 55.426 55.094 0.332 19623
1638 1 6 . 1 1 16 16 ALA CB C 16 18.410 18.410 18.552 -0.142 19623
1639 1 6 . 1 1 16 16 ALA H H 16 7.904 7.904 8.021 -0.117 19623
1640 1 6 . 1 1 17 17 ILE N N 17 117.363 117.363 118.589 -1.226 19623
1641 1 6 . 1 1 17 17 ILE HA H 17 5.850 5.850 3.657 2.193 19623
1642 1 6 . 1 1 17 17 ILE C C 17 177.604 177.604 177.764 -0.160 19623
1643 1 6 . 1 1 17 17 ILE CA C 17 66.545 66.545 64.888 1.657 19623
1644 1 6 . 1 1 17 17 ILE CB C 17 37.843 37.843 37.809 0.034 19623
1645 1 6 . 1 1 17 17 ILE H H 17 8.500 8.500 8.299 0.201 19623
1646 1 6 . 1 1 18 18 LYS N N 18 119.838 119.838 121.151 -1.313 19623
1647 1 6 . 1 1 18 18 LYS HA H 18 3.865 3.865 3.838 0.027 19623
1648 1 6 . 1 1 18 18 LYS C C 18 176.653 176.653 178.750 -2.097 19623
1649 1 6 . 1 1 18 18 LYS CA C 18 60.189 60.189 60.395 -0.206 19623
1650 1 6 . 1 1 18 18 LYS CB C 18 32.260 32.260 32.139 0.121 19623
1651 1 6 . 1 1 18 18 LYS H H 18 7.833 7.833 8.276 -0.443 19623
1652 1 6 . 1 1 19 19 ASP N N 19 120.497 120.497 119.789 0.708 19623
1653 1 6 . 1 1 19 19 ASP HA H 19 4.569 4.569 4.296 0.273 19623
1654 1 6 . 1 1 19 19 ASP C C 19 179.120 179.120 178.935 0.185 19623
1655 1 6 . 1 1 19 19 ASP CA C 19 57.108 57.108 57.093 0.016 19623
1656 1 6 . 1 1 19 19 ASP CB C 19 40.853 40.853 40.432 0.421 19623
1657 1 6 . 1 1 19 19 ASP H H 19 8.479 8.479 7.768 0.711 19623
1658 1 6 . 1 1 20 20 LEU N N 20 121.660 121.660 120.395 1.265 19623
1659 1 6 . 1 1 20 20 LEU HA H 20 4.148 4.148 4.191 -0.043 19623
1660 1 6 . 1 1 20 20 LEU C C 20 178.377 178.377 178.997 -0.620 19623
1661 1 6 . 1 1 20 20 LEU CA C 20 58.225 58.225 58.349 -0.124 19623
1662 1 6 . 1 1 20 20 LEU CB C 20 41.585 41.585 41.767 -0.182 19623
1663 1 6 . 1 1 20 20 LEU H H 20 8.136 8.136 7.847 0.289 19623
1664 1 6 . 1 1 21 21 LYS N N 21 120.182 120.182 119.038 1.144 19623
1665 1 6 . 1 1 21 21 LYS HA H 21 3.904 3.904 4.161 -0.257 19623
1666 1 6 . 1 1 21 21 LYS C C 21 179.785 179.785 179.516 0.269 19623
1667 1 6 . 1 1 21 21 LYS CA C 21 59.557 59.557 59.211 0.346 19623
1668 1 6 . 1 1 21 21 LYS CB C 21 29.655 29.655 32.486 -2.831 19623
1669 1 6 . 1 1 21 21 LYS H H 21 8.043 8.043 8.202 -0.159 19623
1670 1 6 . 1 1 22 22 ILE N N 22 121.523 121.523 120.264 1.259 19623
1671 1 6 . 1 1 22 22 ILE HA H 22 3.522 3.522 3.681 -0.159 19623
1672 1 6 . 1 1 22 22 ILE C C 22 177.399 177.399 177.829 -0.430 19623
1673 1 6 . 1 1 22 22 ILE CA C 22 64.863 64.863 64.467 0.396 19623
1674 1 6 . 1 1 22 22 ILE CB C 22 38.046 38.046 37.853 0.193 19623
1675 1 6 . 1 1 22 22 ILE H H 22 8.735 8.735 7.937 0.798 19623
1676 1 6 . 1 1 23 23 TYR N N 23 117.506 117.506 117.138 0.368 19623
1677 1 6 . 1 1 23 23 TYR HA H 23 4.481 4.481 4.409 0.072 19623
1678 1 6 . 1 1 23 23 TYR C C 23 176.020 176.020 176.727 -0.707 19623
1679 1 6 . 1 1 23 23 TYR CA C 23 58.369 58.369 59.105 -0.736 19623
1680 1 6 . 1 1 23 23 TYR CB C 23 38.499 38.499 38.764 -0.265 19623
1681 1 6 . 1 1 23 23 TYR H H 23 7.291 7.291 7.831 -0.540 19623
1682 1 6 . 1 1 24 24 GLY N N 24 108.209 108.209 106.640 1.569 19623
1683 1 6 . 1 1 24 24 GLY C C 24 174.651 174.651 174.656 -0.005 19623
1684 1 6 . 1 1 24 24 GLY CA C 24 46.409 46.409 44.973 1.436 19623
1685 1 6 . 1 1 24 24 GLY H H 24 7.910 7.910 7.798 0.112 19623
1686 1 6 . 1 1 25 25 ILE N N 25 119.897 119.897 120.410 -0.513 19623
1687 1 6 . 1 1 25 25 ILE HA H 25 3.747 3.747 3.896 -0.149 19623
1688 1 6 . 1 1 25 25 ILE C C 25 175.864 175.864 176.108 -0.244 19623
1689 1 6 . 1 1 25 25 ILE CA C 25 60.984 60.984 60.966 0.018 19623
1690 1 6 . 1 1 25 25 ILE CB C 25 37.120 37.120 39.545 -2.425 19623
1691 1 6 . 1 1 25 25 ILE H H 25 7.383 7.383 8.028 -0.645 19623
1692 1 6 . 1 1 26 26 GLY N N 26 111.580 111.580 113.195 -1.615 19623
1693 1 6 . 1 1 26 26 GLY C C 26 174.847 174.847 175.210 -0.363 19623
1694 1 6 . 1 1 26 26 GLY CA C 26 45.322 45.322 44.765 0.557 19623
1695 1 6 . 1 1 26 26 GLY H H 26 8.811 8.811 8.225 0.586 19623
1696 1 6 . 1 1 27 27 GLU N N 27 120.229 120.229 122.182 -1.953 19623
1697 1 6 . 1 1 27 27 GLU C C 27 177.311 177.311 178.404 -1.093 19623
1698 1 6 . 1 1 27 27 GLU CA C 27 59.730 59.730 59.062 0.668 19623
1699 1 6 . 1 1 27 27 GLU CB C 27 29.933 29.933 29.697 0.236 19623
1700 1 6 . 1 1 27 27 GLU H H 27 8.711 8.711 8.991 -0.280 19623
1701 1 6 . 1 1 28 28 HIS N N 28 117.558 117.558 119.310 -1.752 19623
1702 1 6 . 1 1 28 28 HIS C C 28 176.949 176.949 177.043 -0.094 19623
1703 1 6 . 1 1 28 28 HIS CA C 28 59.674 59.674 59.601 0.073 19623
1704 1 6 . 1 1 28 28 HIS CB C 28 29.838 29.838 29.347 0.491 19623
1705 1 6 . 1 1 28 28 HIS H H 28 8.870 8.870 8.495 0.375 19623
1706 1 6 . 1 1 29 29 TYR N N 29 115.589 115.589 116.393 -0.804 19623
1707 1 6 . 1 1 29 29 TYR HA H 29 4.090 4.090 4.288 -0.198 19623
1708 1 6 . 1 1 29 29 TYR C C 29 177.552 177.552 177.911 -0.359 19623
1709 1 6 . 1 1 29 29 TYR CA C 29 60.998 60.998 61.059 -0.061 19623
1710 1 6 . 1 1 29 29 TYR CB C 29 38.683 38.683 38.516 0.167 19623
1711 1 6 . 1 1 29 29 TYR H H 29 7.227 7.227 7.766 -0.539 19623
1712 1 6 . 1 1 30 30 ILE N N 30 120.353 120.353 120.995 -0.642 19623
1713 1 6 . 1 1 30 30 ILE HA H 30 3.444 3.444 3.573 -0.129 19623
1714 1 6 . 1 1 30 30 ILE C C 30 178.211 178.211 177.665 0.546 19623
1715 1 6 . 1 1 30 30 ILE CA C 30 65.640 65.640 65.606 0.035 19623
1716 1 6 . 1 1 30 30 ILE CB C 30 37.553 37.553 37.669 -0.115 19623
1717 1 6 . 1 1 30 30 ILE H H 30 7.485 7.485 7.508 -0.023 19623
1718 1 6 . 1 1 31 31 LYS N N 31 117.249 117.249 119.776 -2.527 19623
1719 1 6 . 1 1 31 31 LYS HA H 31 4.011 4.011 4.045 -0.034 19623
1720 1 6 . 1 1 31 31 LYS C C 31 178.954 178.954 179.032 -0.078 19623
1721 1 6 . 1 1 31 31 LYS CA C 31 58.893 58.893 59.297 -0.404 19623
1722 1 6 . 1 1 31 31 LYS CB C 31 31.673 31.673 32.188 -0.515 19623
1723 1 6 . 1 1 31 31 LYS H H 31 8.064 8.064 8.184 -0.120 19623
1724 1 6 . 1 1 32 32 LEU N N 32 117.176 117.176 119.886 -2.710 19623
1725 1 6 . 1 1 32 32 LEU HA H 32 3.894 3.894 3.883 0.011 19623
1726 1 6 . 1 1 32 32 LEU C C 32 179.883 179.883 178.522 1.361 19623
1727 1 6 . 1 1 32 32 LEU CA C 32 57.987 57.987 57.626 0.361 19623
1728 1 6 . 1 1 32 32 LEU CB C 32 41.255 41.255 41.628 -0.373 19623
1729 1 6 . 1 1 32 32 LEU H H 32 7.154 7.154 7.210 -0.056 19623
1730 1 6 . 1 1 33 33 ILE N N 33 118.598 118.598 116.514 2.084 19623
1731 1 6 . 1 1 33 33 ILE HA H 33 3.571 3.571 3.781 -0.210 19623
1732 1 6 . 1 1 33 33 ILE C C 33 177.917 177.917 178.891 -0.974 19623
1733 1 6 . 1 1 33 33 ILE CA C 33 63.579 63.579 62.928 0.651 19623
1734 1 6 . 1 1 33 33 ILE CB C 33 35.702 35.702 37.158 -1.456 19623
1735 1 6 . 1 1 33 33 ILE H H 33 7.412 7.412 7.449 -0.037 19623
1736 1 6 . 1 1 34 34 GLU N N 34 116.574 116.574 120.464 -3.890 19623
1737 1 6 . 1 1 34 34 GLU HA H 34 3.826 3.826 4.055 -0.229 19623
1738 1 6 . 1 1 34 34 GLU C C 34 178.661 178.661 178.909 -0.248 19623
1739 1 6 . 1 1 34 34 GLU CA C 34 59.689 59.689 59.724 -0.035 19623
1740 1 6 . 1 1 34 34 GLU CB C 34 29.855 29.855 29.364 0.491 19623
1741 1 6 . 1 1 34 34 GLU H H 34 7.987 7.987 7.882 0.105 19623
1742 1 6 . 1 1 35 35 LYS N N 35 114.863 114.863 117.772 -2.909 19623
1743 1 6 . 1 1 35 35 LYS HA H 35 4.207 4.207 4.292 -0.085 19623
1744 1 6 . 1 1 35 35 LYS C C 35 176.861 176.861 175.864 0.997 19623
1745 1 6 . 1 1 35 35 LYS CA C 35 56.328 56.328 55.504 0.824 19623
1746 1 6 . 1 1 35 35 LYS CB C 35 33.007 33.007 32.651 0.356 19623
1747 1 6 . 1 1 35 35 LYS H H 35 7.361 7.361 7.785 -0.424 19623
1748 1 6 . 1 1 36 36 ALA N N 36 124.407 124.407 124.036 0.371 19623
1749 1 6 . 1 1 36 36 ALA HA H 36 4.129 4.129 4.290 -0.161 19623
1750 1 6 . 1 1 36 36 ALA C C 36 178.279 178.279 177.313 0.966 19623
1751 1 6 . 1 1 36 36 ALA CA C 36 53.257 53.257 52.801 0.456 19623
1752 1 6 . 1 1 36 36 ALA CB C 36 19.581 19.581 19.715 -0.134 19623
1753 1 6 . 1 1 36 36 ALA H H 36 7.365 7.365 7.363 0.002 19623
1754 1 6 . 1 1 37 37 LYS N N 37 116.217 116.217 119.741 -3.524 19623
1755 1 6 . 1 1 37 37 LYS HA H 37 4.383 4.383 4.351 0.032 19623
1756 1 6 . 1 1 37 37 LYS C C 37 176.167 176.167 176.075 0.092 19623
1757 1 6 . 1 1 37 37 LYS CA C 37 56.602 56.602 56.694 -0.092 19623
1758 1 6 . 1 1 37 37 LYS CB C 37 34.883 34.883 33.498 1.385 19623
1759 1 6 . 1 1 37 37 LYS H H 37 8.908 8.908 8.646 0.262 19623
1760 1 6 . 1 1 38 38 GLN N N 38 113.293 113.293 117.295 -4.002 19623
1761 1 6 . 1 1 38 38 GLN HA H 38 4.813 4.813 4.523 0.290 19623
1762 1 6 . 1 1 38 38 GLN C C 38 176.138 176.138 176.055 0.083 19623
1763 1 6 . 1 1 38 38 GLN CA C 38 54.117 54.117 54.154 -0.036 19623
1764 1 6 . 1 1 38 38 GLN CB C 38 32.222 32.222 31.696 0.526 19623
1765 1 6 . 1 1 38 38 GLN H H 38 7.033 7.033 7.703 -0.670 19623
1766 1 6 . 1 1 39 39 VAL N N 39 125.474 125.474 123.594 1.880 19623
1767 1 6 . 1 1 39 39 VAL C C 39 177.751 177.751 177.033 0.718 19623
1768 1 6 . 1 1 39 39 VAL CA C 39 67.737 67.737 65.237 2.501 19623
1769 1 6 . 1 1 39 39 VAL CB C 39 31.438 31.438 31.616 -0.178 19623
1770 1 6 . 1 1 39 39 VAL H H 39 9.250 9.250 8.685 0.565 19623
1771 1 6 . 1 1 40 40 ALA N N 40 120.717 120.717 122.437 -1.720 19623
1772 1 6 . 1 1 40 40 ALA HA H 40 4.041 4.041 4.143 -0.102 19623
1773 1 6 . 1 1 40 40 ALA C C 40 179.081 179.081 179.148 -0.067 19623
1774 1 6 . 1 1 40 40 ALA CA C 40 55.059 55.059 54.822 0.237 19623
1775 1 6 . 1 1 40 40 ALA CB C 40 17.735 17.735 17.703 0.032 19623
1776 1 6 . 1 1 40 40 ALA H H 40 8.903 8.903 8.298 0.605 19623
1777 1 6 . 1 1 41 41 ALA N N 41 116.698 116.698 121.898 -5.200 19623
1778 1 6 . 1 1 41 41 ALA HA H 41 4.236 4.236 4.056 0.180 19623
1779 1 6 . 1 1 41 41 ALA C C 41 180.294 180.294 179.955 0.339 19623
1780 1 6 . 1 1 41 41 ALA CA C 41 54.688 54.688 54.710 -0.022 19623
1781 1 6 . 1 1 41 41 ALA CB C 41 18.724 18.724 18.243 0.481 19623
1782 1 6 . 1 1 41 41 ALA H H 41 6.701 6.701 8.209 -1.508 19623
1783 1 6 . 1 1 42 42 VAL N N 42 119.051 119.051 118.674 0.377 19623
1784 1 6 . 1 1 42 42 VAL HA H 42 3.278 3.278 3.491 -0.213 19623
1785 1 6 . 1 1 42 42 VAL C C 42 176.812 176.812 178.266 -1.454 19623
1786 1 6 . 1 1 42 42 VAL CA C 42 67.641 67.641 67.105 0.536 19623
1787 1 6 . 1 1 42 42 VAL CB C 42 31.399 31.399 31.651 -0.252 19623
1788 1 6 . 1 1 42 42 VAL H H 42 7.552 7.552 8.153 -0.601 19623
1789 1 6 . 1 1 43 43 GLU N N 43 117.715 117.715 119.715 -2.000 19623
1790 1 6 . 1 1 43 43 GLU HA H 43 3.855 3.855 4.032 -0.177 19623
1791 1 6 . 1 1 43 43 GLU C C 43 178.973 178.973 178.929 0.044 19623
1792 1 6 . 1 1 43 43 GLU CA C 43 59.393 59.393 59.833 -0.440 19623
1793 1 6 . 1 1 43 43 GLU CB C 43 28.811 28.811 29.440 -0.629 19623
1794 1 6 . 1 1 43 43 GLU H H 43 7.804 7.804 7.611 0.193 19623
1795 1 6 . 1 1 44 44 ASP N N 44 119.175 119.175 120.444 -1.269 19623
1796 1 6 . 1 1 44 44 ASP HA H 44 4.363 4.363 4.466 -0.103 19623
1797 1 6 . 1 1 44 44 ASP C C 44 178.211 178.211 178.919 -0.708 19623
1798 1 6 . 1 1 44 44 ASP CA C 44 57.308 57.308 57.133 0.175 19623
1799 1 6 . 1 1 44 44 ASP CB C 44 40.504 40.504 40.587 -0.083 19623
1800 1 6 . 1 1 44 44 ASP H H 44 8.169 8.169 8.376 -0.207 19623
1801 1 6 . 1 1 45 45 LEU N N 45 117.848 117.848 120.563 -2.715 19623
1802 1 6 . 1 1 45 45 LEU HA H 45 4.119 4.119 3.967 0.152 19623
1803 1 6 . 1 1 45 45 LEU C C 45 178.416 178.416 178.568 -0.152 19623
1804 1 6 . 1 1 45 45 LEU CA C 45 57.294 57.294 57.847 -0.553 19623
1805 1 6 . 1 1 45 45 LEU CB C 45 40.474 40.474 41.883 -1.409 19623
1806 1 6 . 1 1 45 45 LEU H H 45 8.119 8.119 8.350 -0.231 19623
1807 1 6 . 1 1 46 46 LYS N N 46 119.462 119.462 120.098 -0.636 19623
1808 1 6 . 1 1 46 46 LYS HA H 46 3.972 3.972 3.862 0.110 19623
1809 1 6 . 1 1 46 46 LYS C C 46 177.653 177.653 178.688 -1.035 19623
1810 1 6 . 1 1 46 46 LYS CA C 46 60.276 60.276 60.334 -0.058 19623
1811 1 6 . 1 1 46 46 LYS CB C 46 31.450 31.450 32.178 -0.728 19623
1812 1 6 . 1 1 46 46 LYS H H 46 8.483 8.483 8.260 0.223 19623
1813 1 6 . 1 1 47 47 ASP N N 47 117.470 117.470 119.206 -1.736 19623
1814 1 6 . 1 1 47 47 ASP HA H 47 4.344 4.344 4.634 -0.290 19623
1815 1 6 . 1 1 47 47 ASP C C 47 179.384 179.384 179.024 0.360 19623
1816 1 6 . 1 1 47 47 ASP CA C 47 57.687 57.687 57.544 0.143 19623
1817 1 6 . 1 1 47 47 ASP CB C 47 40.809 40.809 40.316 0.493 19623
1818 1 6 . 1 1 47 47 ASP H H 47 7.846 7.846 8.082 -0.236 19623
1819 1 6 . 1 1 48 48 GLU N N 48 119.662 119.662 119.643 0.019 19623
1820 1 6 . 1 1 48 48 GLU HA H 48 4.011 4.011 4.063 -0.052 19623
1821 1 6 . 1 1 48 48 GLU C C 48 180.724 180.724 179.351 1.373 19623
1822 1 6 . 1 1 48 48 GLU CA C 48 60.091 60.091 58.478 1.613 19623
1823 1 6 . 1 1 48 48 GLU CB C 48 31.991 31.991 29.471 2.520 19623
1824 1 6 . 1 1 48 48 GLU H H 48 8.327 8.327 7.581 0.746 19623
1825 1 6 . 1 1 49 49 ILE N N 49 120.308 120.308 121.353 -1.045 19623
1826 1 6 . 1 1 49 49 ILE HA H 49 3.738 3.738 3.709 0.029 19623
1827 1 6 . 1 1 49 49 ILE C C 49 179.238 179.238 178.078 1.160 19623
1828 1 6 . 1 1 49 49 ILE CA C 49 64.592 64.592 65.513 -0.921 19623
1829 1 6 . 1 1 49 49 ILE CB C 49 37.959 37.959 37.979 -0.020 19623
1830 1 6 . 1 1 49 49 ILE H H 49 7.667 7.667 8.627 -0.960 19623
1831 1 6 . 1 1 50 50 LEU N N 50 121.274 121.274 120.602 0.672 19623
1832 1 6 . 1 1 50 50 LEU HA H 50 4.559 4.559 3.971 0.588 19623
1833 1 6 . 1 1 50 50 LEU C C 50 179.971 179.971 179.214 0.757 19623
1834 1 6 . 1 1 50 50 LEU CA C 50 57.794 57.794 57.934 -0.140 19623
1835 1 6 . 1 1 50 50 LEU CB C 50 40.856 40.856 41.562 -0.706 19623
1836 1 6 . 1 1 50 50 LEU H H 50 8.474 8.474 8.400 0.074 19623
1837 1 6 . 1 1 51 51 LYS N N 51 119.972 119.972 119.546 0.426 19623
1838 1 6 . 1 1 51 51 LYS HA H 51 3.982 3.982 3.919 0.063 19623
1839 1 6 . 1 1 51 51 LYS C C 51 179.189 179.189 179.107 0.082 19623
1840 1 6 . 1 1 51 51 LYS CA C 51 59.526 59.526 59.420 0.106 19623
1841 1 6 . 1 1 51 51 LYS CB C 51 32.175 32.175 32.076 0.099 19623
1842 1 6 . 1 1 51 51 LYS H H 51 8.197 8.197 7.865 0.332 19623
1843 1 6 . 1 1 52 52 ALA N N 52 121.059 121.059 120.272 0.787 19623
1844 1 6 . 1 1 52 52 ALA HA H 52 4.158 4.158 4.111 0.047 19623
1845 1 6 . 1 1 52 52 ALA C C 52 178.015 178.015 178.795 -0.780 19623
1846 1 6 . 1 1 52 52 ALA CA C 52 53.662 53.662 54.392 -0.730 19623
1847 1 6 . 1 1 52 52 ALA CB C 52 17.903 17.903 18.551 -0.648 19623
1848 1 6 . 1 1 52 52 ALA H H 52 7.809 7.809 7.625 0.184 19623
1849 1 6 . 1 1 53 53 HIS N N 53 115.943 115.943 115.961 -0.018 19623
1850 1 6 . 1 1 53 53 HIS HA H 53 4.373 4.373 4.290 0.083 19623
1851 1 6 . 1 1 53 53 HIS C C 53 174.015 174.015 174.341 -0.326 19623
1852 1 6 . 1 1 53 53 HIS CA C 53 57.409 57.409 55.886 1.523 19623
1853 1 6 . 1 1 53 53 HIS CB C 53 29.010 29.010 30.280 -1.270 19623
1854 1 6 . 1 1 53 53 HIS H H 53 7.598 7.598 7.838 -0.240 19623
1855 1 6 . 1 1 54 54 ASP N N 54 119.133 119.133 116.480 2.653 19623
1856 1 6 . 1 1 54 54 ASP HA H 54 4.442 4.442 4.276 0.166 19623
1857 1 6 . 1 1 54 54 ASP C C 54 175.609 175.609 175.622 -0.013 19623
1858 1 6 . 1 1 54 54 ASP CA C 54 54.971 54.971 55.460 -0.489 19623
1859 1 6 . 1 1 54 54 ASP CB C 54 40.209 40.209 38.959 1.250 19623
1860 1 6 . 1 1 54 54 ASP H H 54 7.974 7.974 7.847 0.127 19623
1861 1 6 . 1 1 55 55 ARG N N 55 118.206 118.206 115.201 3.005 19623
1862 1 6 . 1 1 55 55 ARG HA H 55 4.324 4.324 4.255 0.069 19623
1863 1 6 . 1 1 55 55 ARG C C 55 174.671 174.671 175.846 -1.175 19623
1864 1 6 . 1 1 55 55 ARG CA C 55 54.785 54.785 54.380 0.404 19623
1865 1 6 . 1 1 55 55 ARG CB C 55 30.507 30.507 30.820 -0.312 19623
1866 1 6 . 1 1 55 55 ARG H H 55 7.943 7.943 8.307 -0.364 19623
1867 1 7 . 1 1 2 2 GLY N N 2 113.169 113.169 109.882 3.287 19623
1868 1 7 . 1 1 2 2 GLY C C 2 173.996 173.996 173.960 0.036 19623
1869 1 7 . 1 1 2 2 GLY CA C 2 45.211 45.211 45.062 0.149 19623
1870 1 7 . 1 1 2 2 GLY H H 2 8.533 8.533 8.992 -0.459 19623
1871 1 7 . 1 1 3 3 ASP N N 3 120.717 120.717 120.904 -0.187 19623
1872 1 7 . 1 1 3 3 ASP HA H 3 4.559 4.559 4.543 0.016 19623
1873 1 7 . 1 1 3 3 ASP C C 3 176.675 176.675 175.498 1.177 19623
1874 1 7 . 1 1 3 3 ASP CA C 3 54.489 54.489 53.532 0.957 19623
1875 1 7 . 1 1 3 3 ASP CB C 3 41.197 41.197 41.722 -0.525 19623
1876 1 7 . 1 1 3 3 ASP H H 3 8.412 8.412 7.936 0.476 19623
1877 1 7 . 1 1 4 4 LYS N N 4 121.955 121.955 119.904 2.051 19623
1878 1 7 . 1 1 4 4 LYS HA H 4 4.246 4.246 4.124 0.122 19623
1879 1 7 . 1 1 4 4 LYS C C 4 177.301 177.301 177.014 0.287 19623
1880 1 7 . 1 1 4 4 LYS CA C 4 56.606 56.606 56.823 -0.217 19623
1881 1 7 . 1 1 4 4 LYS CB C 4 32.436 32.436 32.801 -0.365 19623
1882 1 7 . 1 1 4 4 LYS H H 4 8.490 8.490 8.207 0.283 19623
1883 1 7 . 1 1 5 5 GLY N N 5 109.376 109.376 108.687 0.689 19623
1884 1 7 . 1 1 5 5 GLY C C 5 174.045 174.045 174.708 -0.663 19623
1885 1 7 . 1 1 5 5 GLY CA C 5 45.305 45.305 44.767 0.538 19623
1886 1 7 . 1 1 5 5 GLY H H 5 8.491 8.491 8.513 -0.022 19623
1887 1 7 . 1 1 6 6 TYR N N 6 120.416 120.416 120.000 0.416 19623
1888 1 7 . 1 1 6 6 TYR HA H 6 4.510 4.510 4.630 -0.120 19623
1889 1 7 . 1 1 6 6 TYR C C 6 175.952 175.952 176.127 -0.175 19623
1890 1 7 . 1 1 6 6 TYR CA C 6 58.383 58.383 56.470 1.913 19623
1891 1 7 . 1 1 6 6 TYR CB C 6 38.562 38.562 37.274 1.288 19623
1892 1 7 . 1 1 6 6 TYR H H 6 8.134 8.134 8.030 0.104 19623
1893 1 7 . 1 1 7 7 ASN N N 7 122.415 122.415 123.670 -1.255 19623
1894 1 7 . 1 1 7 7 ASN HA H 7 4.588 4.588 4.970 -0.382 19623
1895 1 7 . 1 1 7 7 ASN C C 7 175.521 175.521 176.158 -0.637 19623
1896 1 7 . 1 1 7 7 ASN CA C 7 53.408 53.408 53.522 -0.114 19623
1897 1 7 . 1 1 7 7 ASN CB C 7 38.780 38.780 40.815 -2.035 19623
1898 1 7 . 1 1 7 7 ASN H H 7 8.557 8.557 9.126 -0.569 19623
1899 1 7 . 1 1 8 8 GLY N N 8 109.431 109.431 109.078 0.353 19623
1900 1 7 . 1 1 8 8 GLY C C 8 175.609 175.609 174.973 0.636 19623
1901 1 7 . 1 1 8 8 GLY CA C 8 45.990 45.990 44.400 1.590 19623
1902 1 7 . 1 1 8 8 GLY H H 8 8.285 8.285 8.467 -0.182 19623
1903 1 7 . 1 1 9 9 LEU N N 9 123.596 123.596 122.760 0.836 19623
1904 1 7 . 1 1 9 9 LEU HA H 9 3.933 3.933 4.090 -0.157 19623
1905 1 7 . 1 1 9 9 LEU C C 9 177.458 177.458 178.512 -1.054 19623
1906 1 7 . 1 1 9 9 LEU CA C 9 58.248 58.248 57.742 0.506 19623
1907 1 7 . 1 1 9 9 LEU CB C 9 41.690 41.690 41.651 0.039 19623
1908 1 7 . 1 1 9 9 LEU H H 9 8.136 8.136 8.528 -0.392 19623
1909 1 7 . 1 1 10 10 ALA N N 10 121.310 121.310 121.041 0.269 19623
1910 1 7 . 1 1 10 10 ALA HA H 10 3.933 3.933 3.942 -0.009 19623
1911 1 7 . 1 1 10 10 ALA C C 10 181.140 181.140 179.257 1.883 19623
1912 1 7 . 1 1 10 10 ALA CA C 10 55.505 55.505 55.015 0.490 19623
1913 1 7 . 1 1 10 10 ALA CB C 10 17.791 17.791 17.616 0.175 19623
1914 1 7 . 1 1 10 10 ALA H H 10 8.361 8.361 8.437 -0.076 19623
1915 1 7 . 1 1 11 11 GLU N N 11 118.893 118.893 118.540 0.353 19623
1916 1 7 . 1 1 11 11 GLU HA H 11 3.992 3.992 3.573 0.419 19623
1917 1 7 . 1 1 11 11 GLU C C 11 178.797 178.797 178.671 0.126 19623
1918 1 7 . 1 1 11 11 GLU CA C 11 59.892 59.892 59.100 0.792 19623
1919 1 7 . 1 1 11 11 GLU CB C 11 28.991 28.991 28.972 0.019 19623
1920 1 7 . 1 1 11 11 GLU H H 11 8.490 8.490 8.515 -0.025 19623
1921 1 7 . 1 1 12 12 ALA N N 12 122.362 122.362 122.051 0.311 19623
1922 1 7 . 1 1 12 12 ALA HA H 12 4.080 4.080 4.009 0.071 19623
1923 1 7 . 1 1 12 12 ALA C C 12 181.228 181.228 179.391 1.837 19623
1924 1 7 . 1 1 12 12 ALA CA C 12 55.218 55.218 55.242 -0.024 19623
1925 1 7 . 1 1 12 12 ALA CB C 12 18.462 18.462 18.392 0.070 19623
1926 1 7 . 1 1 12 12 ALA H H 12 8.099 8.099 7.983 0.116 19623
1927 1 7 . 1 1 13 13 LYS N N 13 118.689 118.689 118.916 -0.227 19623
1928 1 7 . 1 1 13 13 LYS HA H 13 3.620 3.620 3.964 -0.344 19623
1929 1 7 . 1 1 13 13 LYS C C 13 177.203 177.203 179.237 -2.034 19623
1930 1 7 . 1 1 13 13 LYS CA C 13 60.390 60.390 59.919 0.471 19623
1931 1 7 . 1 1 13 13 LYS CB C 13 33.624 33.624 32.218 1.406 19623
1932 1 7 . 1 1 13 13 LYS H H 13 8.382 8.382 8.142 0.240 19623
1933 1 7 . 1 1 14 14 GLU N N 14 117.865 117.865 118.896 -1.031 19623
1934 1 7 . 1 1 14 14 GLU HA H 14 4.285 4.285 4.103 0.182 19623
1935 1 7 . 1 1 14 14 GLU C C 14 179.404 179.404 178.984 0.420 19623
1936 1 7 . 1 1 14 14 GLU CA C 14 60.007 60.007 59.246 0.761 19623
1937 1 7 . 1 1 14 14 GLU CB C 14 29.418 29.418 29.244 0.173 19623
1938 1 7 . 1 1 14 14 GLU H H 14 7.952 7.952 7.912 0.040 19623
1939 1 7 . 1 1 15 15 LYS N N 15 119.020 119.020 120.086 -1.066 19623
1940 1 7 . 1 1 15 15 LYS HA H 15 3.933 3.933 4.190 -0.257 19623
1941 1 7 . 1 1 15 15 LYS C C 15 177.976 177.976 178.643 -0.667 19623
1942 1 7 . 1 1 15 15 LYS CA C 15 59.591 59.591 59.457 0.134 19623
1943 1 7 . 1 1 15 15 LYS CB C 15 32.275 32.275 32.640 -0.365 19623
1944 1 7 . 1 1 15 15 LYS H H 15 8.029 8.029 7.742 0.287 19623
1945 1 7 . 1 1 16 16 ALA N N 16 120.410 120.410 122.479 -2.069 19623
1946 1 7 . 1 1 16 16 ALA HA H 16 3.962 3.962 4.143 -0.181 19623
1947 1 7 . 1 1 16 16 ALA C C 16 179.140 179.140 179.859 -0.719 19623
1948 1 7 . 1 1 16 16 ALA CA C 16 55.426 55.426 55.125 0.301 19623
1949 1 7 . 1 1 16 16 ALA CB C 16 18.410 18.410 18.486 -0.076 19623
1950 1 7 . 1 1 16 16 ALA H H 16 7.904 7.904 8.048 -0.144 19623
1951 1 7 . 1 1 17 17 ILE N N 17 117.363 117.363 118.431 -1.068 19623
1952 1 7 . 1 1 17 17 ILE HA H 17 5.850 5.850 3.642 2.208 19623
1953 1 7 . 1 1 17 17 ILE C C 17 177.604 177.604 177.699 -0.095 19623
1954 1 7 . 1 1 17 17 ILE CA C 17 66.545 66.545 64.953 1.592 19623
1955 1 7 . 1 1 17 17 ILE CB C 17 37.843 37.843 37.832 0.011 19623
1956 1 7 . 1 1 17 17 ILE H H 17 8.500 8.500 8.200 0.300 19623
1957 1 7 . 1 1 18 18 LYS N N 18 119.838 119.838 121.068 -1.230 19623
1958 1 7 . 1 1 18 18 LYS HA H 18 3.865 3.865 3.838 0.027 19623
1959 1 7 . 1 1 18 18 LYS C C 18 176.653 176.653 178.782 -2.129 19623
1960 1 7 . 1 1 18 18 LYS CA C 18 60.189 60.189 60.337 -0.148 19623
1961 1 7 . 1 1 18 18 LYS CB C 18 32.260 32.260 32.143 0.117 19623
1962 1 7 . 1 1 18 18 LYS H H 18 7.833 7.833 8.045 -0.212 19623
1963 1 7 . 1 1 19 19 ASP N N 19 120.497 120.497 119.661 0.836 19623
1964 1 7 . 1 1 19 19 ASP HA H 19 4.569 4.569 4.330 0.239 19623
1965 1 7 . 1 1 19 19 ASP C C 19 179.120 179.120 178.993 0.127 19623
1966 1 7 . 1 1 19 19 ASP CA C 19 57.108 57.108 57.177 -0.069 19623
1967 1 7 . 1 1 19 19 ASP CB C 19 40.853 40.853 40.462 0.390 19623
1968 1 7 . 1 1 19 19 ASP H H 19 8.479 8.479 7.969 0.510 19623
1969 1 7 . 1 1 20 20 LEU N N 20 121.660 121.660 120.409 1.251 19623
1970 1 7 . 1 1 20 20 LEU HA H 20 4.148 4.148 4.103 0.045 19623
1971 1 7 . 1 1 20 20 LEU C C 20 178.377 178.377 178.959 -0.582 19623
1972 1 7 . 1 1 20 20 LEU CA C 20 58.225 58.225 58.211 0.014 19623
1973 1 7 . 1 1 20 20 LEU CB C 20 41.585 41.585 41.692 -0.107 19623
1974 1 7 . 1 1 20 20 LEU H H 20 8.136 8.136 7.662 0.474 19623
1975 1 7 . 1 1 21 21 LYS N N 21 120.182 120.182 119.563 0.619 19623
1976 1 7 . 1 1 21 21 LYS HA H 21 3.904 3.904 4.057 -0.153 19623
1977 1 7 . 1 1 21 21 LYS C C 21 179.785 179.785 179.362 0.423 19623
1978 1 7 . 1 1 21 21 LYS CA C 21 59.557 59.557 59.310 0.247 19623
1979 1 7 . 1 1 21 21 LYS CB C 21 29.655 29.655 32.381 -2.726 19623
1980 1 7 . 1 1 21 21 LYS H H 21 8.043 8.043 8.213 -0.170 19623
1981 1 7 . 1 1 22 22 ILE N N 22 121.523 121.523 119.410 2.113 19623
1982 1 7 . 1 1 22 22 ILE HA H 22 3.522 3.522 3.702 -0.180 19623
1983 1 7 . 1 1 22 22 ILE C C 22 177.399 177.399 177.920 -0.521 19623
1984 1 7 . 1 1 22 22 ILE CA C 22 64.863 64.863 64.354 0.509 19623
1985 1 7 . 1 1 22 22 ILE CB C 22 38.046 38.046 37.869 0.177 19623
1986 1 7 . 1 1 22 22 ILE H H 22 8.735 8.735 7.649 1.086 19623
1987 1 7 . 1 1 23 23 TYR N N 23 117.506 117.506 118.468 -0.962 19623
1988 1 7 . 1 1 23 23 TYR HA H 23 4.481 4.481 4.398 0.083 19623
1989 1 7 . 1 1 23 23 TYR C C 23 176.020 176.020 176.830 -0.810 19623
1990 1 7 . 1 1 23 23 TYR CA C 23 58.369 58.369 59.914 -1.545 19623
1991 1 7 . 1 1 23 23 TYR CB C 23 38.499 38.499 38.790 -0.291 19623
1992 1 7 . 1 1 23 23 TYR H H 23 7.291 7.291 7.784 -0.493 19623
1993 1 7 . 1 1 24 24 GLY N N 24 108.209 108.209 105.364 2.845 19623
1994 1 7 . 1 1 24 24 GLY C C 24 174.651 174.651 174.143 0.508 19623
1995 1 7 . 1 1 24 24 GLY CA C 24 46.409 46.409 44.675 1.734 19623
1996 1 7 . 1 1 24 24 GLY H H 24 7.910 7.910 7.683 0.227 19623
1997 1 7 . 1 1 25 25 ILE N N 25 119.897 119.897 121.753 -1.856 19623
1998 1 7 . 1 1 25 25 ILE HA H 25 3.747 3.747 3.981 -0.234 19623
1999 1 7 . 1 1 25 25 ILE C C 25 175.864 175.864 176.352 -0.488 19623
2000 1 7 . 1 1 25 25 ILE CA C 25 60.984 60.984 61.363 -0.379 19623
2001 1 7 . 1 1 25 25 ILE CB C 25 37.120 37.120 38.758 -1.638 19623
2002 1 7 . 1 1 25 25 ILE H H 25 7.383 7.383 7.901 -0.518 19623
2003 1 7 . 1 1 26 26 GLY N N 26 111.580 111.580 115.075 -3.495 19623
2004 1 7 . 1 1 26 26 GLY C C 26 174.847 174.847 175.084 -0.237 19623
2005 1 7 . 1 1 26 26 GLY CA C 26 45.322 45.322 44.444 0.878 19623
2006 1 7 . 1 1 26 26 GLY H H 26 8.811 8.811 8.318 0.493 19623
2007 1 7 . 1 1 27 27 GLU N N 27 120.229 120.229 119.914 0.315 19623
2008 1 7 . 1 1 27 27 GLU C C 27 177.311 177.311 178.543 -1.232 19623
2009 1 7 . 1 1 27 27 GLU CA C 27 59.730 59.730 59.413 0.317 19623
2010 1 7 . 1 1 27 27 GLU CB C 27 29.933 29.933 29.680 0.253 19623
2011 1 7 . 1 1 27 27 GLU H H 27 8.711 8.711 8.945 -0.234 19623
2012 1 7 . 1 1 28 28 HIS N N 28 117.558 117.558 118.404 -0.846 19623
2013 1 7 . 1 1 28 28 HIS C C 28 176.949 176.949 176.143 0.806 19623
2014 1 7 . 1 1 28 28 HIS CA C 28 59.674 59.674 59.123 0.551 19623
2015 1 7 . 1 1 28 28 HIS CB C 28 29.838 29.838 29.359 0.479 19623
2016 1 7 . 1 1 28 28 HIS H H 28 8.870 8.870 8.536 0.334 19623
2017 1 7 . 1 1 29 29 TYR N N 29 115.589 115.589 115.251 0.338 19623
2018 1 7 . 1 1 29 29 TYR HA H 29 4.090 4.090 4.403 -0.313 19623
2019 1 7 . 1 1 29 29 TYR C C 29 177.552 177.552 177.834 -0.282 19623
2020 1 7 . 1 1 29 29 TYR CA C 29 60.998 60.998 60.252 0.746 19623
2021 1 7 . 1 1 29 29 TYR CB C 29 38.683 38.683 39.136 -0.453 19623
2022 1 7 . 1 1 29 29 TYR H H 29 7.227 7.227 7.576 -0.349 19623
2023 1 7 . 1 1 30 30 ILE N N 30 120.353 120.353 121.874 -1.521 19623
2024 1 7 . 1 1 30 30 ILE HA H 30 3.444 3.444 3.560 -0.116 19623
2025 1 7 . 1 1 30 30 ILE C C 30 178.211 178.211 177.467 0.744 19623
2026 1 7 . 1 1 30 30 ILE CA C 30 65.640 65.640 65.502 0.137 19623
2027 1 7 . 1 1 30 30 ILE CB C 30 37.553 37.553 37.595 -0.042 19623
2028 1 7 . 1 1 30 30 ILE H H 30 7.485 7.485 7.813 -0.328 19623
2029 1 7 . 1 1 31 31 LYS N N 31 117.249 117.249 119.337 -2.088 19623
2030 1 7 . 1 1 31 31 LYS HA H 31 4.011 4.011 4.230 -0.219 19623
2031 1 7 . 1 1 31 31 LYS C C 31 178.954 178.954 178.954 0.000 19623
2032 1 7 . 1 1 31 31 LYS CA C 31 58.893 58.893 59.092 -0.199 19623
2033 1 7 . 1 1 31 31 LYS CB C 31 31.673 31.673 32.116 -0.443 19623
2034 1 7 . 1 1 31 31 LYS H H 31 8.064 8.064 7.956 0.108 19623
2035 1 7 . 1 1 32 32 LEU N N 32 117.176 117.176 119.693 -2.517 19623
2036 1 7 . 1 1 32 32 LEU HA H 32 3.894 3.894 3.986 -0.092 19623
2037 1 7 . 1 1 32 32 LEU C C 32 179.883 179.883 179.327 0.556 19623
2038 1 7 . 1 1 32 32 LEU CA C 32 57.987 57.987 57.664 0.323 19623
2039 1 7 . 1 1 32 32 LEU CB C 32 41.255 41.255 41.638 -0.383 19623
2040 1 7 . 1 1 32 32 LEU H H 32 7.154 7.154 7.546 -0.392 19623
2041 1 7 . 1 1 33 33 ILE N N 33 118.598 118.598 118.192 0.406 19623
2042 1 7 . 1 1 33 33 ILE HA H 33 3.571 3.571 3.707 -0.136 19623
2043 1 7 . 1 1 33 33 ILE C C 33 177.917 177.917 178.402 -0.485 19623
2044 1 7 . 1 1 33 33 ILE CA C 33 63.579 63.579 64.420 -0.841 19623
2045 1 7 . 1 1 33 33 ILE CB C 33 35.702 35.702 37.676 -1.974 19623
2046 1 7 . 1 1 33 33 ILE H H 33 7.412 7.412 7.569 -0.157 19623
2047 1 7 . 1 1 34 34 GLU N N 34 116.574 116.574 120.084 -3.510 19623
2048 1 7 . 1 1 34 34 GLU HA H 34 3.826 3.826 3.962 -0.136 19623
2049 1 7 . 1 1 34 34 GLU C C 34 178.661 178.661 178.319 0.342 19623
2050 1 7 . 1 1 34 34 GLU CA C 34 59.689 59.689 59.712 -0.023 19623
2051 1 7 . 1 1 34 34 GLU CB C 34 29.855 29.855 29.370 0.485 19623
2052 1 7 . 1 1 34 34 GLU H H 34 7.987 7.987 7.936 0.051 19623
2053 1 7 . 1 1 35 35 LYS N N 35 114.863 114.863 117.480 -2.617 19623
2054 1 7 . 1 1 35 35 LYS HA H 35 4.207 4.207 4.333 -0.126 19623
2055 1 7 . 1 1 35 35 LYS C C 35 176.861 176.861 175.785 1.076 19623
2056 1 7 . 1 1 35 35 LYS CA C 35 56.328 56.328 55.281 1.047 19623
2057 1 7 . 1 1 35 35 LYS CB C 35 33.007 33.007 32.786 0.221 19623
2058 1 7 . 1 1 35 35 LYS H H 35 7.361 7.361 7.508 -0.147 19623
2059 1 7 . 1 1 36 36 ALA N N 36 124.407 124.407 124.738 -0.331 19623
2060 1 7 . 1 1 36 36 ALA HA H 36 4.129 4.129 4.198 -0.069 19623
2061 1 7 . 1 1 36 36 ALA C C 36 178.279 178.279 177.399 0.880 19623
2062 1 7 . 1 1 36 36 ALA CA C 36 53.257 53.257 53.012 0.245 19623
2063 1 7 . 1 1 36 36 ALA CB C 36 19.581 19.581 19.692 -0.111 19623
2064 1 7 . 1 1 36 36 ALA H H 36 7.365 7.365 7.513 -0.148 19623
2065 1 7 . 1 1 37 37 LYS N N 37 116.217 116.217 119.773 -3.556 19623
2066 1 7 . 1 1 37 37 LYS HA H 37 4.383 4.383 4.272 0.111 19623
2067 1 7 . 1 1 37 37 LYS C C 37 176.167 176.167 175.967 0.200 19623
2068 1 7 . 1 1 37 37 LYS CA C 37 56.602 56.602 56.766 -0.164 19623
2069 1 7 . 1 1 37 37 LYS CB C 37 34.883 34.883 32.663 2.220 19623
2070 1 7 . 1 1 37 37 LYS H H 37 8.908 8.908 8.683 0.225 19623
2071 1 7 . 1 1 38 38 GLN N N 38 113.293 113.293 115.528 -2.235 19623
2072 1 7 . 1 1 38 38 GLN HA H 38 4.813 4.813 4.446 0.367 19623
2073 1 7 . 1 1 38 38 GLN C C 38 176.138 176.138 175.138 1.000 19623
2074 1 7 . 1 1 38 38 GLN CA C 38 54.117 54.117 54.595 -0.478 19623
2075 1 7 . 1 1 38 38 GLN CB C 38 32.222 32.222 30.997 1.225 19623
2076 1 7 . 1 1 38 38 GLN H H 38 7.033 7.033 7.459 -0.426 19623
2077 1 7 . 1 1 39 39 VAL N N 39 125.474 125.474 121.959 3.515 19623
2078 1 7 . 1 1 39 39 VAL C C 39 177.751 177.751 177.556 0.195 19623
2079 1 7 . 1 1 39 39 VAL CA C 39 67.737 67.737 66.018 1.719 19623
2080 1 7 . 1 1 39 39 VAL CB C 39 31.438 31.438 31.832 -0.394 19623
2081 1 7 . 1 1 39 39 VAL H H 39 9.250 9.250 8.801 0.449 19623
2082 1 7 . 1 1 40 40 ALA N N 40 120.717 120.717 122.770 -2.053 19623
2083 1 7 . 1 1 40 40 ALA HA H 40 4.041 4.041 4.081 -0.040 19623
2084 1 7 . 1 1 40 40 ALA C C 40 179.081 179.081 179.343 -0.262 19623
2085 1 7 . 1 1 40 40 ALA CA C 40 55.059 55.059 55.196 -0.137 19623
2086 1 7 . 1 1 40 40 ALA CB C 40 17.735 17.735 17.953 -0.217 19623
2087 1 7 . 1 1 40 40 ALA H H 40 8.903 8.903 8.427 0.476 19623
2088 1 7 . 1 1 41 41 ALA N N 41 116.698 116.698 121.089 -4.391 19623
2089 1 7 . 1 1 41 41 ALA HA H 41 4.236 4.236 4.052 0.184 19623
2090 1 7 . 1 1 41 41 ALA C C 41 180.294 180.294 179.722 0.572 19623
2091 1 7 . 1 1 41 41 ALA CA C 41 54.688 54.688 54.569 0.119 19623
2092 1 7 . 1 1 41 41 ALA CB C 41 18.724 18.724 18.194 0.530 19623
2093 1 7 . 1 1 41 41 ALA H H 41 6.701 6.701 7.433 -0.732 19623
2094 1 7 . 1 1 42 42 VAL N N 42 119.051 119.051 119.061 -0.010 19623
2095 1 7 . 1 1 42 42 VAL HA H 42 3.278 3.278 3.468 -0.190 19623
2096 1 7 . 1 1 42 42 VAL C C 42 176.812 176.812 178.387 -1.575 19623
2097 1 7 . 1 1 42 42 VAL CA C 42 67.641 67.641 67.084 0.557 19623
2098 1 7 . 1 1 42 42 VAL CB C 42 31.399 31.399 31.642 -0.243 19623
2099 1 7 . 1 1 42 42 VAL H H 42 7.552 7.552 8.023 -0.471 19623
2100 1 7 . 1 1 43 43 GLU N N 43 117.715 117.715 119.710 -1.995 19623
2101 1 7 . 1 1 43 43 GLU HA H 43 3.855 3.855 4.013 -0.158 19623
2102 1 7 . 1 1 43 43 GLU C C 43 178.973 178.973 178.895 0.078 19623
2103 1 7 . 1 1 43 43 GLU CA C 43 59.393 59.393 59.889 -0.496 19623
2104 1 7 . 1 1 43 43 GLU CB C 43 28.811 28.811 29.506 -0.695 19623
2105 1 7 . 1 1 43 43 GLU H H 43 7.804 7.804 8.341 -0.537 19623
2106 1 7 . 1 1 44 44 ASP N N 44 119.175 119.175 120.706 -1.531 19623
2107 1 7 . 1 1 44 44 ASP HA H 44 4.363 4.363 4.447 -0.084 19623
2108 1 7 . 1 1 44 44 ASP C C 44 178.211 178.211 178.906 -0.695 19623
2109 1 7 . 1 1 44 44 ASP CA C 44 57.308 57.308 57.247 0.061 19623
2110 1 7 . 1 1 44 44 ASP CB C 44 40.504 40.504 40.570 -0.066 19623
2111 1 7 . 1 1 44 44 ASP H H 44 8.169 8.169 8.097 0.072 19623
2112 1 7 . 1 1 45 45 LEU N N 45 117.848 117.848 120.293 -2.445 19623
2113 1 7 . 1 1 45 45 LEU HA H 45 4.119 4.119 3.959 0.160 19623
2114 1 7 . 1 1 45 45 LEU C C 45 178.416 178.416 178.602 -0.186 19623
2115 1 7 . 1 1 45 45 LEU CA C 45 57.294 57.294 57.793 -0.499 19623
2116 1 7 . 1 1 45 45 LEU CB C 45 40.474 40.474 41.812 -1.337 19623
2117 1 7 . 1 1 45 45 LEU H H 45 8.119 8.119 8.395 -0.276 19623
2118 1 7 . 1 1 46 46 LYS N N 46 119.462 119.462 120.100 -0.638 19623
2119 1 7 . 1 1 46 46 LYS HA H 46 3.972 3.972 3.818 0.154 19623
2120 1 7 . 1 1 46 46 LYS C C 46 177.653 177.653 178.644 -0.991 19623
2121 1 7 . 1 1 46 46 LYS CA C 46 60.276 60.276 60.131 0.145 19623
2122 1 7 . 1 1 46 46 LYS CB C 46 31.450 31.450 32.132 -0.682 19623
2123 1 7 . 1 1 46 46 LYS H H 46 8.483 8.483 8.080 0.403 19623
2124 1 7 . 1 1 47 47 ASP N N 47 117.470 117.470 119.263 -1.793 19623
2125 1 7 . 1 1 47 47 ASP HA H 47 4.344 4.344 4.397 -0.053 19623
2126 1 7 . 1 1 47 47 ASP C C 47 179.384 179.384 178.956 0.428 19623
2127 1 7 . 1 1 47 47 ASP CA C 47 57.687 57.687 57.358 0.329 19623
2128 1 7 . 1 1 47 47 ASP CB C 47 40.809 40.809 40.279 0.530 19623
2129 1 7 . 1 1 47 47 ASP H H 47 7.846 7.846 8.056 -0.210 19623
2130 1 7 . 1 1 48 48 GLU N N 48 119.662 119.662 119.944 -0.282 19623
2131 1 7 . 1 1 48 48 GLU HA H 48 4.011 4.011 4.088 -0.077 19623
2132 1 7 . 1 1 48 48 GLU C C 48 180.724 180.724 179.372 1.352 19623
2133 1 7 . 1 1 48 48 GLU CA C 48 60.091 60.091 58.784 1.307 19623
2134 1 7 . 1 1 48 48 GLU CB C 48 31.991 31.991 29.436 2.555 19623
2135 1 7 . 1 1 48 48 GLU H H 48 8.327 8.327 7.856 0.471 19623
2136 1 7 . 1 1 49 49 ILE N N 49 120.308 120.308 120.536 -0.228 19623
2137 1 7 . 1 1 49 49 ILE HA H 49 3.738 3.738 3.585 0.153 19623
2138 1 7 . 1 1 49 49 ILE C C 49 179.238 179.238 178.021 1.217 19623
2139 1 7 . 1 1 49 49 ILE CA C 49 64.592 64.592 65.084 -0.492 19623
2140 1 7 . 1 1 49 49 ILE CB C 49 37.959 37.959 37.888 0.071 19623
2141 1 7 . 1 1 49 49 ILE H H 49 7.667 7.667 8.547 -0.880 19623
2142 1 7 . 1 1 50 50 LEU N N 50 121.274 121.274 121.054 0.220 19623
2143 1 7 . 1 1 50 50 LEU HA H 50 4.559 4.559 3.904 0.655 19623
2144 1 7 . 1 1 50 50 LEU C C 50 179.971 179.971 178.011 1.960 19623
2145 1 7 . 1 1 50 50 LEU CA C 50 57.794 57.794 57.889 -0.095 19623
2146 1 7 . 1 1 50 50 LEU CB C 50 40.856 40.856 41.332 -0.476 19623
2147 1 7 . 1 1 50 50 LEU H H 50 8.474 8.474 7.910 0.564 19623
2148 1 7 . 1 1 51 51 LYS N N 51 119.972 119.972 119.014 0.958 19623
2149 1 7 . 1 1 51 51 LYS HA H 51 3.982 3.982 3.849 0.133 19623
2150 1 7 . 1 1 51 51 LYS C C 51 179.189 179.189 178.979 0.210 19623
2151 1 7 . 1 1 51 51 LYS CA C 51 59.526 59.526 59.584 -0.058 19623
2152 1 7 . 1 1 51 51 LYS CB C 51 32.175 32.175 32.138 0.037 19623
2153 1 7 . 1 1 51 51 LYS H H 51 8.197 8.197 8.133 0.064 19623
2154 1 7 . 1 1 52 52 ALA N N 52 121.059 121.059 120.399 0.660 19623
2155 1 7 . 1 1 52 52 ALA HA H 52 4.158 4.158 4.034 0.124 19623
2156 1 7 . 1 1 52 52 ALA C C 52 178.015 178.015 179.823 -1.808 19623
2157 1 7 . 1 1 52 52 ALA CA C 52 53.662 53.662 54.583 -0.921 19623
2158 1 7 . 1 1 52 52 ALA CB C 52 17.903 17.903 18.073 -0.170 19623
2159 1 7 . 1 1 52 52 ALA H H 52 7.809 7.809 7.600 0.209 19623
2160 1 7 . 1 1 53 53 HIS N N 53 115.943 115.943 117.276 -1.333 19623
2161 1 7 . 1 1 53 53 HIS HA H 53 4.373 4.373 4.061 0.312 19623
2162 1 7 . 1 1 53 53 HIS C C 53 174.015 174.015 176.088 -2.073 19623
2163 1 7 . 1 1 53 53 HIS CA C 53 57.409 57.409 58.590 -1.181 19623
2164 1 7 . 1 1 53 53 HIS CB C 53 29.010 29.010 29.669 -0.659 19623
2165 1 7 . 1 1 53 53 HIS H H 53 7.598 7.598 7.885 -0.287 19623
2166 1 7 . 1 1 54 54 ASP N N 54 119.133 119.133 116.784 2.349 19623
2167 1 7 . 1 1 54 54 ASP HA H 54 4.442 4.442 4.417 0.025 19623
2168 1 7 . 1 1 54 54 ASP C C 54 175.609 175.609 175.572 0.037 19623
2169 1 7 . 1 1 54 54 ASP CA C 54 54.971 54.971 55.278 -0.307 19623
2170 1 7 . 1 1 54 54 ASP CB C 54 40.209 40.209 41.016 -0.807 19623
2171 1 7 . 1 1 54 54 ASP H H 54 7.974 7.974 7.913 0.061 19623
2172 1 7 . 1 1 55 55 ARG N N 55 118.206 118.206 120.888 -2.682 19623
2173 1 7 . 1 1 55 55 ARG HA H 55 4.324 4.324 4.154 0.170 19623
2174 1 7 . 1 1 55 55 ARG C C 55 174.671 174.671 174.623 0.048 19623
2175 1 7 . 1 1 55 55 ARG CA C 55 54.785 54.785 56.334 -1.549 19623
2176 1 7 . 1 1 55 55 ARG CB C 55 30.507 30.507 29.974 0.532 19623
2177 1 7 . 1 1 55 55 ARG H H 55 7.943 7.943 6.884 1.059 19623
2178 1 8 . 1 1 2 2 GLY N N 2 113.169 113.169 111.180 1.989 19623
2179 1 8 . 1 1 2 2 GLY C C 2 173.996 173.996 173.819 0.177 19623
2180 1 8 . 1 1 2 2 GLY CA C 2 45.211 45.211 44.755 0.455 19623
2181 1 8 . 1 1 2 2 GLY H H 2 8.533 8.533 7.417 1.116 19623
2182 1 8 . 1 1 3 3 ASP N N 3 120.717 120.717 119.987 0.730 19623
2183 1 8 . 1 1 3 3 ASP HA H 3 4.559 4.559 4.654 -0.095 19623
2184 1 8 . 1 1 3 3 ASP C C 3 176.675 176.675 176.373 0.302 19623
2185 1 8 . 1 1 3 3 ASP CA C 3 54.489 54.489 53.395 1.094 19623
2186 1 8 . 1 1 3 3 ASP CB C 3 41.197 41.197 41.417 -0.220 19623
2187 1 8 . 1 1 3 3 ASP H H 3 8.412 8.412 7.688 0.724 19623
2188 1 8 . 1 1 4 4 LYS N N 4 121.955 121.955 121.771 0.184 19623
2189 1 8 . 1 1 4 4 LYS HA H 4 4.246 4.246 4.006 0.240 19623
2190 1 8 . 1 1 4 4 LYS C C 4 177.301 177.301 177.288 0.013 19623
2191 1 8 . 1 1 4 4 LYS CA C 4 56.606 56.606 58.270 -1.664 19623
2192 1 8 . 1 1 4 4 LYS CB C 4 32.436 32.436 32.001 0.435 19623
2193 1 8 . 1 1 4 4 LYS H H 4 8.490 8.490 8.481 0.009 19623
2194 1 8 . 1 1 5 5 GLY N N 5 109.376 109.376 113.375 -3.999 19623
2195 1 8 . 1 1 5 5 GLY C C 5 174.045 174.045 174.310 -0.265 19623
2196 1 8 . 1 1 5 5 GLY CA C 5 45.305 45.305 44.865 0.440 19623
2197 1 8 . 1 1 5 5 GLY H H 5 8.491 8.491 8.652 -0.161 19623
2198 1 8 . 1 1 6 6 TYR N N 6 120.416 120.416 122.270 -1.854 19623
2199 1 8 . 1 1 6 6 TYR HA H 6 4.510 4.510 4.282 0.228 19623
2200 1 8 . 1 1 6 6 TYR C C 6 175.952 175.952 175.052 0.900 19623
2201 1 8 . 1 1 6 6 TYR CA C 6 58.383 58.383 58.929 -0.546 19623
2202 1 8 . 1 1 6 6 TYR CB C 6 38.562 38.562 38.685 -0.123 19623
2203 1 8 . 1 1 6 6 TYR H H 6 8.134 8.134 8.032 0.102 19623
2204 1 8 . 1 1 7 7 ASN N N 7 122.415 122.415 125.551 -3.136 19623
2205 1 8 . 1 1 7 7 ASN HA H 7 4.588 4.588 4.580 0.008 19623
2206 1 8 . 1 1 7 7 ASN C C 7 175.521 175.521 175.039 0.482 19623
2207 1 8 . 1 1 7 7 ASN CA C 7 53.408 53.408 52.710 0.698 19623
2208 1 8 . 1 1 7 7 ASN CB C 7 38.780 38.780 39.583 -0.803 19623
2209 1 8 . 1 1 7 7 ASN H H 7 8.557 8.557 7.896 0.661 19623
2210 1 8 . 1 1 8 8 GLY N N 8 109.431 109.431 106.949 2.482 19623
2211 1 8 . 1 1 8 8 GLY C C 8 175.609 175.609 175.330 0.279 19623
2212 1 8 . 1 1 8 8 GLY CA C 8 45.990 45.990 44.365 1.625 19623
2213 1 8 . 1 1 8 8 GLY H H 8 8.285 8.285 8.550 -0.265 19623
2214 1 8 . 1 1 9 9 LEU N N 9 123.596 123.596 124.180 -0.584 19623
2215 1 8 . 1 1 9 9 LEU HA H 9 3.933 3.933 4.045 -0.112 19623
2216 1 8 . 1 1 9 9 LEU C C 9 177.458 177.458 178.553 -1.095 19623
2217 1 8 . 1 1 9 9 LEU CA C 9 58.248 58.248 57.832 0.416 19623
2218 1 8 . 1 1 9 9 LEU CB C 9 41.690 41.690 41.774 -0.084 19623
2219 1 8 . 1 1 9 9 LEU H H 9 8.136 8.136 8.590 -0.454 19623
2220 1 8 . 1 1 10 10 ALA N N 10 121.310 121.310 120.677 0.633 19623
2221 1 8 . 1 1 10 10 ALA HA H 10 3.933 3.933 4.108 -0.175 19623
2222 1 8 . 1 1 10 10 ALA C C 10 181.140 181.140 179.552 1.588 19623
2223 1 8 . 1 1 10 10 ALA CA C 10 55.505 55.505 55.026 0.478 19623
2224 1 8 . 1 1 10 10 ALA CB C 10 17.791 17.791 17.581 0.210 19623
2225 1 8 . 1 1 10 10 ALA H H 10 8.361 8.361 8.376 -0.015 19623
2226 1 8 . 1 1 11 11 GLU N N 11 118.893 118.893 119.571 -0.678 19623
2227 1 8 . 1 1 11 11 GLU HA H 11 3.992 3.992 3.999 -0.007 19623
2228 1 8 . 1 1 11 11 GLU C C 11 178.797 178.797 179.162 -0.365 19623
2229 1 8 . 1 1 11 11 GLU CA C 11 59.892 59.892 59.502 0.390 19623
2230 1 8 . 1 1 11 11 GLU CB C 11 28.991 28.991 29.383 -0.392 19623
2231 1 8 . 1 1 11 11 GLU H H 11 8.490 8.490 8.491 -0.001 19623
2232 1 8 . 1 1 12 12 ALA N N 12 122.362 122.362 122.216 0.146 19623
2233 1 8 . 1 1 12 12 ALA HA H 12 4.080 4.080 3.910 0.170 19623
2234 1 8 . 1 1 12 12 ALA C C 12 181.228 181.228 179.451 1.777 19623
2235 1 8 . 1 1 12 12 ALA CA C 12 55.218 55.218 55.338 -0.120 19623
2236 1 8 . 1 1 12 12 ALA CB C 12 18.462 18.462 18.391 0.071 19623
2237 1 8 . 1 1 12 12 ALA H H 12 8.099 8.099 8.109 -0.010 19623
2238 1 8 . 1 1 13 13 LYS N N 13 118.689 118.689 118.504 0.185 19623
2239 1 8 . 1 1 13 13 LYS HA H 13 3.620 3.620 3.975 -0.355 19623
2240 1 8 . 1 1 13 13 LYS C C 13 177.203 177.203 178.660 -1.457 19623
2241 1 8 . 1 1 13 13 LYS CA C 13 60.390 60.390 59.798 0.592 19623
2242 1 8 . 1 1 13 13 LYS CB C 13 33.624 33.624 32.325 1.299 19623
2243 1 8 . 1 1 13 13 LYS H H 13 8.382 8.382 8.090 0.292 19623
2244 1 8 . 1 1 14 14 GLU N N 14 117.865 117.865 120.418 -2.553 19623
2245 1 8 . 1 1 14 14 GLU HA H 14 4.285 4.285 3.996 0.289 19623
2246 1 8 . 1 1 14 14 GLU C C 14 179.404 179.404 178.869 0.535 19623
2247 1 8 . 1 1 14 14 GLU CA C 14 60.007 60.007 59.722 0.284 19623
2248 1 8 . 1 1 14 14 GLU CB C 14 29.418 29.418 29.504 -0.086 19623
2249 1 8 . 1 1 14 14 GLU H H 14 7.952 7.952 8.185 -0.233 19623
2250 1 8 . 1 1 15 15 LYS N N 15 119.020 119.020 118.560 0.460 19623
2251 1 8 . 1 1 15 15 LYS HA H 15 3.933 3.933 4.112 -0.179 19623
2252 1 8 . 1 1 15 15 LYS C C 15 177.976 177.976 178.928 -0.952 19623
2253 1 8 . 1 1 15 15 LYS CA C 15 59.591 59.591 59.088 0.503 19623
2254 1 8 . 1 1 15 15 LYS CB C 15 32.275 32.275 32.448 -0.173 19623
2255 1 8 . 1 1 15 15 LYS H H 15 8.029 8.029 7.530 0.499 19623
2256 1 8 . 1 1 16 16 ALA N N 16 120.410 120.410 123.298 -2.888 19623
2257 1 8 . 1 1 16 16 ALA HA H 16 3.962 3.962 4.122 -0.160 19623
2258 1 8 . 1 1 16 16 ALA C C 16 179.140 179.140 179.446 -0.306 19623
2259 1 8 . 1 1 16 16 ALA CA C 16 55.426 55.426 55.062 0.364 19623
2260 1 8 . 1 1 16 16 ALA CB C 16 18.410 18.410 18.478 -0.068 19623
2261 1 8 . 1 1 16 16 ALA H H 16 7.904 7.904 8.132 -0.228 19623
2262 1 8 . 1 1 17 17 ILE N N 17 117.363 117.363 118.902 -1.539 19623
2263 1 8 . 1 1 17 17 ILE HA H 17 5.850 5.850 3.560 2.290 19623
2264 1 8 . 1 1 17 17 ILE C C 17 177.604 177.604 177.723 -0.119 19623
2265 1 8 . 1 1 17 17 ILE CA C 17 66.545 66.545 65.213 1.332 19623
2266 1 8 . 1 1 17 17 ILE CB C 17 37.843 37.843 37.733 0.110 19623
2267 1 8 . 1 1 17 17 ILE H H 17 8.500 8.500 8.279 0.221 19623
2268 1 8 . 1 1 18 18 LYS N N 18 119.838 119.838 120.722 -0.884 19623
2269 1 8 . 1 1 18 18 LYS HA H 18 3.865 3.865 3.785 0.080 19623
2270 1 8 . 1 1 18 18 LYS C C 18 176.653 176.653 178.653 -2.000 19623
2271 1 8 . 1 1 18 18 LYS CA C 18 60.189 60.189 60.263 -0.074 19623
2272 1 8 . 1 1 18 18 LYS CB C 18 32.260 32.260 32.070 0.190 19623
2273 1 8 . 1 1 18 18 LYS H H 18 7.833 7.833 7.749 0.084 19623
2274 1 8 . 1 1 19 19 ASP N N 19 120.497 120.497 119.983 0.514 19623
2275 1 8 . 1 1 19 19 ASP HA H 19 4.569 4.569 4.051 0.518 19623
2276 1 8 . 1 1 19 19 ASP C C 19 179.120 179.120 178.410 0.710 19623
2277 1 8 . 1 1 19 19 ASP CA C 19 57.108 57.108 56.769 0.340 19623
2278 1 8 . 1 1 19 19 ASP CB C 19 40.853 40.853 40.196 0.657 19623
2279 1 8 . 1 1 19 19 ASP H H 19 8.479 8.479 7.843 0.636 19623
2280 1 8 . 1 1 20 20 LEU N N 20 121.660 121.660 120.312 1.348 19623
2281 1 8 . 1 1 20 20 LEU HA H 20 4.148 4.148 3.826 0.322 19623
2282 1 8 . 1 1 20 20 LEU C C 20 178.377 178.377 178.851 -0.474 19623
2283 1 8 . 1 1 20 20 LEU CA C 20 58.225 58.225 58.252 -0.027 19623
2284 1 8 . 1 1 20 20 LEU CB C 20 41.585 41.585 41.644 -0.059 19623
2285 1 8 . 1 1 20 20 LEU H H 20 8.136 8.136 8.260 -0.124 19623
2286 1 8 . 1 1 21 21 LYS N N 21 120.182 120.182 119.111 1.071 19623
2287 1 8 . 1 1 21 21 LYS HA H 21 3.904 3.904 4.029 -0.125 19623
2288 1 8 . 1 1 21 21 LYS C C 21 179.785 179.785 179.280 0.505 19623
2289 1 8 . 1 1 21 21 LYS CA C 21 59.557 59.557 59.201 0.356 19623
2290 1 8 . 1 1 21 21 LYS CB C 21 29.655 29.655 32.404 -2.749 19623
2291 1 8 . 1 1 21 21 LYS H H 21 8.043 8.043 8.099 -0.056 19623
2292 1 8 . 1 1 22 22 ILE N N 22 121.523 121.523 119.083 2.440 19623
2293 1 8 . 1 1 22 22 ILE HA H 22 3.522 3.522 3.728 -0.206 19623
2294 1 8 . 1 1 22 22 ILE C C 22 177.399 177.399 177.966 -0.567 19623
2295 1 8 . 1 1 22 22 ILE CA C 22 64.863 64.863 64.258 0.605 19623
2296 1 8 . 1 1 22 22 ILE CB C 22 38.046 38.046 37.939 0.107 19623
2297 1 8 . 1 1 22 22 ILE H H 22 8.735 8.735 7.628 1.107 19623
2298 1 8 . 1 1 23 23 TYR N N 23 117.506 117.506 118.088 -0.582 19623
2299 1 8 . 1 1 23 23 TYR HA H 23 4.481 4.481 4.478 0.003 19623
2300 1 8 . 1 1 23 23 TYR C C 23 176.020 176.020 176.462 -0.442 19623
2301 1 8 . 1 1 23 23 TYR CA C 23 58.369 58.369 57.094 1.275 19623
2302 1 8 . 1 1 23 23 TYR CB C 23 38.499 38.499 37.793 0.706 19623
2303 1 8 . 1 1 23 23 TYR H H 23 7.291 7.291 7.800 -0.509 19623
2304 1 8 . 1 1 24 24 GLY N N 24 108.209 108.209 106.483 1.726 19623
2305 1 8 . 1 1 24 24 GLY C C 24 174.651 174.651 174.387 0.264 19623
2306 1 8 . 1 1 24 24 GLY CA C 24 46.409 46.409 44.866 1.543 19623
2307 1 8 . 1 1 24 24 GLY H H 24 7.910 7.910 7.390 0.520 19623
2308 1 8 . 1 1 25 25 ILE N N 25 119.897 119.897 122.286 -2.389 19623
2309 1 8 . 1 1 25 25 ILE HA H 25 3.747 3.747 4.030 -0.283 19623
2310 1 8 . 1 1 25 25 ILE C C 25 175.864 175.864 176.626 -0.762 19623
2311 1 8 . 1 1 25 25 ILE CA C 25 60.984 60.984 59.730 1.254 19623
2312 1 8 . 1 1 25 25 ILE CB C 25 37.120 37.120 37.735 -0.615 19623
2313 1 8 . 1 1 25 25 ILE H H 25 7.383 7.383 8.132 -0.749 19623
2314 1 8 . 1 1 26 26 GLY N N 26 111.580 111.580 114.770 -3.190 19623
2315 1 8 . 1 1 26 26 GLY C C 26 174.847 174.847 175.182 -0.335 19623
2316 1 8 . 1 1 26 26 GLY CA C 26 45.322 45.322 44.372 0.950 19623
2317 1 8 . 1 1 26 26 GLY H H 26 8.811 8.811 8.406 0.405 19623
2318 1 8 . 1 1 27 27 GLU N N 27 120.229 120.229 121.352 -1.123 19623
2319 1 8 . 1 1 27 27 GLU C C 27 177.311 177.311 178.221 -0.910 19623
2320 1 8 . 1 1 27 27 GLU CA C 27 59.730 59.730 59.660 0.070 19623
2321 1 8 . 1 1 27 27 GLU CB C 27 29.933 29.933 29.837 0.096 19623
2322 1 8 . 1 1 27 27 GLU H H 27 8.711 8.711 8.977 -0.266 19623
2323 1 8 . 1 1 28 28 HIS N N 28 117.558 117.558 117.376 0.182 19623
2324 1 8 . 1 1 28 28 HIS C C 28 176.949 176.949 176.987 -0.038 19623
2325 1 8 . 1 1 28 28 HIS CA C 28 59.674 59.674 59.427 0.247 19623
2326 1 8 . 1 1 28 28 HIS CB C 28 29.838 29.838 29.510 0.328 19623
2327 1 8 . 1 1 28 28 HIS H H 28 8.870 8.870 8.675 0.195 19623
2328 1 8 . 1 1 29 29 TYR N N 29 115.589 115.589 116.476 -0.887 19623
2329 1 8 . 1 1 29 29 TYR HA H 29 4.090 4.090 4.343 -0.253 19623
2330 1 8 . 1 1 29 29 TYR C C 29 177.552 177.552 177.700 -0.148 19623
2331 1 8 . 1 1 29 29 TYR CA C 29 60.998 60.998 60.996 0.002 19623
2332 1 8 . 1 1 29 29 TYR CB C 29 38.683 38.683 38.885 -0.202 19623
2333 1 8 . 1 1 29 29 TYR H H 29 7.227 7.227 7.736 -0.509 19623
2334 1 8 . 1 1 30 30 ILE N N 30 120.353 120.353 120.538 -0.185 19623
2335 1 8 . 1 1 30 30 ILE HA H 30 3.444 3.444 3.603 -0.159 19623
2336 1 8 . 1 1 30 30 ILE C C 30 178.211 178.211 177.792 0.419 19623
2337 1 8 . 1 1 30 30 ILE CA C 30 65.640 65.640 65.210 0.430 19623
2338 1 8 . 1 1 30 30 ILE CB C 30 37.553 37.553 37.690 -0.137 19623
2339 1 8 . 1 1 30 30 ILE H H 30 7.485 7.485 8.078 -0.593 19623
2340 1 8 . 1 1 31 31 LYS N N 31 117.249 117.249 117.870 -0.621 19623
2341 1 8 . 1 1 31 31 LYS HA H 31 4.011 4.011 4.221 -0.209 19623
2342 1 8 . 1 1 31 31 LYS C C 31 178.954 178.954 178.181 0.773 19623
2343 1 8 . 1 1 31 31 LYS CA C 31 58.893 58.893 58.829 0.064 19623
2344 1 8 . 1 1 31 31 LYS CB C 31 31.673 31.673 32.115 -0.443 19623
2345 1 8 . 1 1 31 31 LYS H H 31 8.064 8.064 8.060 0.004 19623
2346 1 8 . 1 1 32 32 LEU N N 32 117.176 117.176 120.220 -3.044 19623
2347 1 8 . 1 1 32 32 LEU HA H 32 3.894 3.894 4.043 -0.149 19623
2348 1 8 . 1 1 32 32 LEU C C 32 179.883 179.883 178.479 1.404 19623
2349 1 8 . 1 1 32 32 LEU CA C 32 57.987 57.987 57.583 0.404 19623
2350 1 8 . 1 1 32 32 LEU CB C 32 41.255 41.255 42.066 -0.811 19623
2351 1 8 . 1 1 32 32 LEU H H 32 7.154 7.154 7.358 -0.204 19623
2352 1 8 . 1 1 33 33 ILE N N 33 118.598 118.598 118.611 -0.013 19623
2353 1 8 . 1 1 33 33 ILE HA H 33 3.571 3.571 3.756 -0.185 19623
2354 1 8 . 1 1 33 33 ILE C C 33 177.917 177.917 177.679 0.238 19623
2355 1 8 . 1 1 33 33 ILE CA C 33 63.579 63.579 63.883 -0.304 19623
2356 1 8 . 1 1 33 33 ILE CB C 33 35.702 35.702 37.717 -2.015 19623
2357 1 8 . 1 1 33 33 ILE H H 33 7.412 7.412 7.569 -0.157 19623
2358 1 8 . 1 1 34 34 GLU N N 34 116.574 116.574 119.770 -3.196 19623
2359 1 8 . 1 1 34 34 GLU HA H 34 3.826 3.826 4.107 -0.281 19623
2360 1 8 . 1 1 34 34 GLU C C 34 178.661 178.661 178.077 0.584 19623
2361 1 8 . 1 1 34 34 GLU CA C 34 59.689 59.689 59.031 0.658 19623
2362 1 8 . 1 1 34 34 GLU CB C 34 29.855 29.855 29.340 0.515 19623
2363 1 8 . 1 1 34 34 GLU H H 34 7.987 7.987 7.851 0.136 19623
2364 1 8 . 1 1 35 35 LYS N N 35 114.863 114.863 118.715 -3.852 19623
2365 1 8 . 1 1 35 35 LYS HA H 35 4.207 4.207 4.288 -0.081 19623
2366 1 8 . 1 1 35 35 LYS C C 35 176.861 176.861 175.943 0.918 19623
2367 1 8 . 1 1 35 35 LYS CA C 35 56.328 56.328 55.444 0.884 19623
2368 1 8 . 1 1 35 35 LYS CB C 35 33.007 33.007 32.683 0.324 19623
2369 1 8 . 1 1 35 35 LYS H H 35 7.361 7.361 7.758 -0.397 19623
2370 1 8 . 1 1 36 36 ALA N N 36 124.407 124.407 124.452 -0.045 19623
2371 1 8 . 1 1 36 36 ALA HA H 36 4.129 4.129 4.270 -0.141 19623
2372 1 8 . 1 1 36 36 ALA C C 36 178.279 178.279 177.612 0.667 19623
2373 1 8 . 1 1 36 36 ALA CA C 36 53.257 53.257 52.946 0.311 19623
2374 1 8 . 1 1 36 36 ALA CB C 36 19.581 19.581 19.723 -0.142 19623
2375 1 8 . 1 1 36 36 ALA H H 36 7.365 7.365 7.401 -0.036 19623
2376 1 8 . 1 1 37 37 LYS N N 37 116.217 116.217 119.737 -3.520 19623
2377 1 8 . 1 1 37 37 LYS HA H 37 4.383 4.383 4.402 -0.019 19623
2378 1 8 . 1 1 37 37 LYS C C 37 176.167 176.167 176.463 -0.296 19623
2379 1 8 . 1 1 37 37 LYS CA C 37 56.602 56.602 56.950 -0.348 19623
2380 1 8 . 1 1 37 37 LYS CB C 37 34.883 34.883 33.453 1.430 19623
2381 1 8 . 1 1 37 37 LYS H H 37 8.908 8.908 8.676 0.232 19623
2382 1 8 . 1 1 38 38 GLN N N 38 113.293 113.293 116.614 -3.321 19623
2383 1 8 . 1 1 38 38 GLN HA H 38 4.813 4.813 4.811 0.002 19623
2384 1 8 . 1 1 38 38 GLN C C 38 176.138 176.138 177.094 -0.956 19623
2385 1 8 . 1 1 38 38 GLN CA C 38 54.117 54.117 54.070 0.047 19623
2386 1 8 . 1 1 38 38 GLN CB C 38 32.222 32.222 32.478 -0.256 19623
2387 1 8 . 1 1 38 38 GLN H H 38 7.033 7.033 7.651 -0.618 19623
2388 1 8 . 1 1 39 39 VAL N N 39 125.474 125.474 122.394 3.080 19623
2389 1 8 . 1 1 39 39 VAL C C 39 177.751 177.751 177.390 0.361 19623
2390 1 8 . 1 1 39 39 VAL CA C 39 67.737 67.737 66.898 0.839 19623
2391 1 8 . 1 1 39 39 VAL CB C 39 31.438 31.438 31.729 -0.291 19623
2392 1 8 . 1 1 39 39 VAL H H 39 9.250 9.250 8.847 0.403 19623
2393 1 8 . 1 1 40 40 ALA N N 40 120.717 120.717 122.262 -1.545 19623
2394 1 8 . 1 1 40 40 ALA HA H 40 4.041 4.041 4.029 0.012 19623
2395 1 8 . 1 1 40 40 ALA C C 40 179.081 179.081 179.039 0.042 19623
2396 1 8 . 1 1 40 40 ALA CA C 40 55.059 55.059 55.284 -0.225 19623
2397 1 8 . 1 1 40 40 ALA CB C 40 17.735 17.735 18.135 -0.400 19623
2398 1 8 . 1 1 40 40 ALA H H 40 8.903 8.903 8.652 0.251 19623
2399 1 8 . 1 1 41 41 ALA N N 41 116.698 116.698 120.470 -3.772 19623
2400 1 8 . 1 1 41 41 ALA HA H 41 4.236 4.236 4.066 0.170 19623
2401 1 8 . 1 1 41 41 ALA C C 41 180.294 180.294 179.658 0.636 19623
2402 1 8 . 1 1 41 41 ALA CA C 41 54.688 54.688 54.519 0.169 19623
2403 1 8 . 1 1 41 41 ALA CB C 41 18.724 18.724 18.121 0.603 19623
2404 1 8 . 1 1 41 41 ALA H H 41 6.701 6.701 7.981 -1.280 19623
2405 1 8 . 1 1 42 42 VAL N N 42 119.051 119.051 119.408 -0.357 19623
2406 1 8 . 1 1 42 42 VAL HA H 42 3.278 3.278 3.505 -0.227 19623
2407 1 8 . 1 1 42 42 VAL C C 42 176.812 176.812 178.378 -1.566 19623
2408 1 8 . 1 1 42 42 VAL CA C 42 67.641 67.641 66.967 0.674 19623
2409 1 8 . 1 1 42 42 VAL CB C 42 31.399 31.399 31.713 -0.314 19623
2410 1 8 . 1 1 42 42 VAL H H 42 7.552 7.552 8.276 -0.724 19623
2411 1 8 . 1 1 43 43 GLU N N 43 117.715 117.715 119.408 -1.693 19623
2412 1 8 . 1 1 43 43 GLU HA H 43 3.855 3.855 4.019 -0.164 19623
2413 1 8 . 1 1 43 43 GLU C C 43 178.973 178.973 178.997 -0.024 19623
2414 1 8 . 1 1 43 43 GLU CA C 43 59.393 59.393 59.784 -0.391 19623
2415 1 8 . 1 1 43 43 GLU CB C 43 28.811 28.811 29.381 -0.570 19623
2416 1 8 . 1 1 43 43 GLU H H 43 7.804 7.804 8.008 -0.204 19623
2417 1 8 . 1 1 44 44 ASP N N 44 119.175 119.175 120.759 -1.584 19623
2418 1 8 . 1 1 44 44 ASP HA H 44 4.363 4.363 4.449 -0.086 19623
2419 1 8 . 1 1 44 44 ASP C C 44 178.211 178.211 178.854 -0.643 19623
2420 1 8 . 1 1 44 44 ASP CA C 44 57.308 57.308 57.282 0.026 19623
2421 1 8 . 1 1 44 44 ASP CB C 44 40.504 40.504 40.600 -0.096 19623
2422 1 8 . 1 1 44 44 ASP H H 44 8.169 8.169 8.245 -0.076 19623
2423 1 8 . 1 1 45 45 LEU N N 45 117.848 117.848 120.088 -2.240 19623
2424 1 8 . 1 1 45 45 LEU HA H 45 4.119 4.119 4.038 0.081 19623
2425 1 8 . 1 1 45 45 LEU C C 45 178.416 178.416 178.707 -0.291 19623
2426 1 8 . 1 1 45 45 LEU CA C 45 57.294 57.294 57.406 -0.112 19623
2427 1 8 . 1 1 45 45 LEU CB C 45 40.474 40.474 41.800 -1.327 19623
2428 1 8 . 1 1 45 45 LEU H H 45 8.119 8.119 8.380 -0.261 19623
2429 1 8 . 1 1 46 46 LYS N N 46 119.462 119.462 120.494 -1.032 19623
2430 1 8 . 1 1 46 46 LYS HA H 46 3.972 3.972 3.938 0.034 19623
2431 1 8 . 1 1 46 46 LYS C C 46 177.653 177.653 178.936 -1.283 19623
2432 1 8 . 1 1 46 46 LYS CA C 46 60.276 60.276 60.141 0.135 19623
2433 1 8 . 1 1 46 46 LYS CB C 46 31.450 31.450 32.244 -0.794 19623
2434 1 8 . 1 1 46 46 LYS H H 46 8.483 8.483 8.292 0.191 19623
2435 1 8 . 1 1 47 47 ASP N N 47 117.470 117.470 119.162 -1.692 19623
2436 1 8 . 1 1 47 47 ASP HA H 47 4.344 4.344 4.598 -0.254 19623
2437 1 8 . 1 1 47 47 ASP C C 47 179.384 179.384 178.838 0.546 19623
2438 1 8 . 1 1 47 47 ASP CA C 47 57.687 57.687 57.224 0.463 19623
2439 1 8 . 1 1 47 47 ASP CB C 47 40.809 40.809 40.262 0.547 19623
2440 1 8 . 1 1 47 47 ASP H H 47 7.846 7.846 7.992 -0.146 19623
2441 1 8 . 1 1 48 48 GLU N N 48 119.662 119.662 120.109 -0.447 19623
2442 1 8 . 1 1 48 48 GLU HA H 48 4.011 4.011 4.035 -0.024 19623
2443 1 8 . 1 1 48 48 GLU C C 48 180.724 180.724 179.335 1.389 19623
2444 1 8 . 1 1 48 48 GLU CA C 48 60.091 60.091 58.827 1.264 19623
2445 1 8 . 1 1 48 48 GLU CB C 48 31.991 31.991 29.376 2.615 19623
2446 1 8 . 1 1 48 48 GLU H H 48 8.327 8.327 7.840 0.487 19623
2447 1 8 . 1 1 49 49 ILE N N 49 120.308 120.308 120.517 -0.209 19623
2448 1 8 . 1 1 49 49 ILE HA H 49 3.738 3.738 3.813 -0.075 19623
2449 1 8 . 1 1 49 49 ILE C C 49 179.238 179.238 178.242 0.996 19623
2450 1 8 . 1 1 49 49 ILE CA C 49 64.592 64.592 65.301 -0.709 19623
2451 1 8 . 1 1 49 49 ILE CB C 49 37.959 37.959 38.019 -0.060 19623
2452 1 8 . 1 1 49 49 ILE H H 49 7.667 7.667 8.381 -0.714 19623
2453 1 8 . 1 1 50 50 LEU N N 50 121.274 121.274 119.955 1.319 19623
2454 1 8 . 1 1 50 50 LEU HA H 50 4.559 4.559 4.088 0.471 19623
2455 1 8 . 1 1 50 50 LEU C C 50 179.971 179.971 179.238 0.733 19623
2456 1 8 . 1 1 50 50 LEU CA C 50 57.794 57.794 57.872 -0.078 19623
2457 1 8 . 1 1 50 50 LEU CB C 50 40.856 40.856 41.740 -0.884 19623
2458 1 8 . 1 1 50 50 LEU H H 50 8.474 8.474 7.555 0.919 19623
2459 1 8 . 1 1 51 51 LYS N N 51 119.972 119.972 119.212 0.760 19623
2460 1 8 . 1 1 51 51 LYS HA H 51 3.982 3.982 4.087 -0.105 19623
2461 1 8 . 1 1 51 51 LYS C C 51 179.189 179.189 179.476 -0.287 19623
2462 1 8 . 1 1 51 51 LYS CA C 51 59.526 59.526 59.434 0.092 19623
2463 1 8 . 1 1 51 51 LYS CB C 51 32.175 32.175 32.029 0.146 19623
2464 1 8 . 1 1 51 51 LYS H H 51 8.197 8.197 8.275 -0.078 19623
2465 1 8 . 1 1 52 52 ALA N N 52 121.059 121.059 121.194 -0.135 19623
2466 1 8 . 1 1 52 52 ALA HA H 52 4.158 4.158 4.123 0.035 19623
2467 1 8 . 1 1 52 52 ALA C C 52 178.015 178.015 178.089 -0.074 19623
2468 1 8 . 1 1 52 52 ALA CA C 52 53.662 53.662 54.222 -0.560 19623
2469 1 8 . 1 1 52 52 ALA CB C 52 17.903 17.903 18.660 -0.757 19623
2470 1 8 . 1 1 52 52 ALA H H 52 7.809 7.809 7.849 -0.040 19623
2471 1 8 . 1 1 53 53 HIS N N 53 115.943 115.943 115.135 0.808 19623
2472 1 8 . 1 1 53 53 HIS HA H 53 4.373 4.373 4.551 -0.178 19623
2473 1 8 . 1 1 53 53 HIS C C 53 174.015 174.015 175.052 -1.037 19623
2474 1 8 . 1 1 53 53 HIS CA C 53 57.409 57.409 56.240 1.169 19623
2475 1 8 . 1 1 53 53 HIS CB C 53 29.010 29.010 29.662 -0.652 19623
2476 1 8 . 1 1 53 53 HIS H H 53 7.598 7.598 7.523 0.075 19623
2477 1 8 . 1 1 54 54 ASP N N 54 119.133 119.133 117.303 1.830 19623
2478 1 8 . 1 1 54 54 ASP HA H 54 4.442 4.442 4.300 0.142 19623
2479 1 8 . 1 1 54 54 ASP C C 54 175.609 175.609 176.062 -0.453 19623
2480 1 8 . 1 1 54 54 ASP CA C 54 54.971 54.971 55.814 -0.843 19623
2481 1 8 . 1 1 54 54 ASP CB C 54 40.209 40.209 39.112 1.097 19623
2482 1 8 . 1 1 54 54 ASP H H 54 7.974 7.974 7.984 -0.010 19623
2483 1 8 . 1 1 55 55 ARG N N 55 118.206 118.206 116.225 1.981 19623
2484 1 8 . 1 1 55 55 ARG HA H 55 4.324 4.324 4.562 -0.238 19623
2485 1 8 . 1 1 55 55 ARG C C 55 174.671 174.671 175.292 -0.621 19623
2486 1 8 . 1 1 55 55 ARG CA C 55 54.785 54.785 54.561 0.224 19623
2487 1 8 . 1 1 55 55 ARG CB C 55 30.507 30.507 31.045 -0.538 19623
2488 1 8 . 1 1 55 55 ARG H H 55 7.943 7.943 8.267 -0.324 19623
2489 1 9 . 1 1 2 2 GLY N N 2 113.169 113.169 111.643 1.526 19623
2490 1 9 . 1 1 2 2 GLY C C 2 173.996 173.996 174.249 -0.253 19623
2491 1 9 . 1 1 2 2 GLY CA C 2 45.211 45.211 45.389 -0.178 19623
2492 1 9 . 1 1 2 2 GLY H H 2 8.533 8.533 8.579 -0.046 19623
2493 1 9 . 1 1 3 3 ASP N N 3 120.717 120.717 118.849 1.868 19623
2494 1 9 . 1 1 3 3 ASP HA H 3 4.559 4.559 4.667 -0.108 19623
2495 1 9 . 1 1 3 3 ASP C C 3 176.675 176.675 177.527 -0.852 19623
2496 1 9 . 1 1 3 3 ASP CA C 3 54.489 54.489 54.637 -0.148 19623
2497 1 9 . 1 1 3 3 ASP CB C 3 41.197 41.197 40.919 0.278 19623
2498 1 9 . 1 1 3 3 ASP H H 3 8.412 8.412 8.883 -0.471 19623
2499 1 9 . 1 1 4 4 LYS N N 4 121.955 121.955 119.585 2.370 19623
2500 1 9 . 1 1 4 4 LYS HA H 4 4.246 4.246 4.382 -0.136 19623
2501 1 9 . 1 1 4 4 LYS C C 4 177.301 177.301 176.440 0.861 19623
2502 1 9 . 1 1 4 4 LYS CA C 4 56.606 56.606 56.052 0.554 19623
2503 1 9 . 1 1 4 4 LYS CB C 4 32.436 32.436 32.740 -0.305 19623
2504 1 9 . 1 1 4 4 LYS H H 4 8.490 8.490 8.063 0.427 19623
2505 1 9 . 1 1 5 5 GLY N N 5 109.376 109.376 107.096 2.280 19623
2506 1 9 . 1 1 5 5 GLY C C 5 174.045 174.045 174.012 0.033 19623
2507 1 9 . 1 1 5 5 GLY CA C 5 45.305 45.305 44.849 0.456 19623
2508 1 9 . 1 1 5 5 GLY H H 5 8.491 8.491 8.094 0.397 19623
2509 1 9 . 1 1 6 6 TYR N N 6 120.416 120.416 119.205 1.211 19623
2510 1 9 . 1 1 6 6 TYR HA H 6 4.510 4.510 4.415 0.095 19623
2511 1 9 . 1 1 6 6 TYR C C 6 175.952 175.952 176.487 -0.535 19623
2512 1 9 . 1 1 6 6 TYR CA C 6 58.383 58.383 56.334 2.049 19623
2513 1 9 . 1 1 6 6 TYR CB C 6 38.562 38.562 39.164 -0.602 19623
2514 1 9 . 1 1 6 6 TYR H H 6 8.134 8.134 8.015 0.119 19623
2515 1 9 . 1 1 7 7 ASN N N 7 122.415 122.415 123.434 -1.019 19623
2516 1 9 . 1 1 7 7 ASN HA H 7 4.588 4.588 4.625 -0.037 19623
2517 1 9 . 1 1 7 7 ASN C C 7 175.521 175.521 177.868 -2.347 19623
2518 1 9 . 1 1 7 7 ASN CA C 7 53.408 53.408 55.244 -1.836 19623
2519 1 9 . 1 1 7 7 ASN CB C 7 38.780 38.780 38.248 0.532 19623
2520 1 9 . 1 1 7 7 ASN H H 7 8.557 8.557 9.014 -0.457 19623
2521 1 9 . 1 1 8 8 GLY N N 8 109.431 109.431 108.800 0.631 19623
2522 1 9 . 1 1 8 8 GLY C C 8 175.609 175.609 176.442 -0.833 19623
2523 1 9 . 1 1 8 8 GLY CA C 8 45.990 45.990 46.948 -0.958 19623
2524 1 9 . 1 1 8 8 GLY H H 8 8.285 8.285 8.799 -0.514 19623
2525 1 9 . 1 1 9 9 LEU N N 9 123.596 123.596 123.325 0.271 19623
2526 1 9 . 1 1 9 9 LEU HA H 9 3.933 3.933 4.087 -0.154 19623
2527 1 9 . 1 1 9 9 LEU C C 9 177.458 177.458 178.177 -0.719 19623
2528 1 9 . 1 1 9 9 LEU CA C 9 58.248 58.248 57.486 0.762 19623
2529 1 9 . 1 1 9 9 LEU CB C 9 41.690 41.690 41.725 -0.035 19623
2530 1 9 . 1 1 9 9 LEU H H 9 8.136 8.136 7.393 0.743 19623
2531 1 9 . 1 1 10 10 ALA N N 10 121.310 121.310 121.097 0.213 19623
2532 1 9 . 1 1 10 10 ALA HA H 10 3.933 3.933 3.931 0.002 19623
2533 1 9 . 1 1 10 10 ALA C C 10 181.140 181.140 179.906 1.234 19623
2534 1 9 . 1 1 10 10 ALA CA C 10 55.505 55.505 55.288 0.217 19623
2535 1 9 . 1 1 10 10 ALA CB C 10 17.791 17.791 18.056 -0.265 19623
2536 1 9 . 1 1 10 10 ALA H H 10 8.361 8.361 7.690 0.671 19623
2537 1 9 . 1 1 11 11 GLU N N 11 118.893 118.893 119.195 -0.302 19623
2538 1 9 . 1 1 11 11 GLU HA H 11 3.992 3.992 4.211 -0.219 19623
2539 1 9 . 1 1 11 11 GLU C C 11 178.797 178.797 179.054 -0.257 19623
2540 1 9 . 1 1 11 11 GLU CA C 11 59.892 59.892 59.171 0.721 19623
2541 1 9 . 1 1 11 11 GLU CB C 11 28.991 28.991 29.707 -0.716 19623
2542 1 9 . 1 1 11 11 GLU H H 11 8.490 8.490 8.266 0.224 19623
2543 1 9 . 1 1 12 12 ALA N N 12 122.362 122.362 122.426 -0.064 19623
2544 1 9 . 1 1 12 12 ALA HA H 12 4.080 4.080 4.067 0.013 19623
2545 1 9 . 1 1 12 12 ALA C C 12 181.228 181.228 179.621 1.607 19623
2546 1 9 . 1 1 12 12 ALA CA C 12 55.218 55.218 55.224 -0.006 19623
2547 1 9 . 1 1 12 12 ALA CB C 12 18.462 18.462 18.263 0.199 19623
2548 1 9 . 1 1 12 12 ALA H H 12 8.099 8.099 8.185 -0.086 19623
2549 1 9 . 1 1 13 13 LYS N N 13 118.689 118.689 118.838 -0.149 19623
2550 1 9 . 1 1 13 13 LYS HA H 13 3.620 3.620 3.983 -0.363 19623
2551 1 9 . 1 1 13 13 LYS C C 13 177.203 177.203 179.087 -1.884 19623
2552 1 9 . 1 1 13 13 LYS CA C 13 60.390 60.390 60.005 0.385 19623
2553 1 9 . 1 1 13 13 LYS CB C 13 33.624 33.624 32.391 1.233 19623
2554 1 9 . 1 1 13 13 LYS H H 13 8.382 8.382 8.251 0.131 19623
2555 1 9 . 1 1 14 14 GLU N N 14 117.865 117.865 119.736 -1.871 19623
2556 1 9 . 1 1 14 14 GLU HA H 14 4.285 4.285 4.047 0.238 19623
2557 1 9 . 1 1 14 14 GLU C C 14 179.404 179.404 179.185 0.219 19623
2558 1 9 . 1 1 14 14 GLU CA C 14 60.007 60.007 59.611 0.396 19623
2559 1 9 . 1 1 14 14 GLU CB C 14 29.418 29.418 29.458 -0.040 19623
2560 1 9 . 1 1 14 14 GLU H H 14 7.952 7.952 8.045 -0.093 19623
2561 1 9 . 1 1 15 15 LYS N N 15 119.020 119.020 119.482 -0.462 19623
2562 1 9 . 1 1 15 15 LYS HA H 15 3.933 3.933 4.088 -0.155 19623
2563 1 9 . 1 1 15 15 LYS C C 15 177.976 177.976 178.865 -0.889 19623
2564 1 9 . 1 1 15 15 LYS CA C 15 59.591 59.591 59.607 -0.016 19623
2565 1 9 . 1 1 15 15 LYS CB C 15 32.275 32.275 32.431 -0.156 19623
2566 1 9 . 1 1 15 15 LYS H H 15 8.029 8.029 8.060 -0.031 19623
2567 1 9 . 1 1 16 16 ALA N N 16 120.410 120.410 122.983 -2.573 19623
2568 1 9 . 1 1 16 16 ALA HA H 16 3.962 3.962 4.189 -0.227 19623
2569 1 9 . 1 1 16 16 ALA C C 16 179.140 179.140 179.684 -0.544 19623
2570 1 9 . 1 1 16 16 ALA CA C 16 55.426 55.426 55.010 0.416 19623
2571 1 9 . 1 1 16 16 ALA CB C 16 18.410 18.410 18.558 -0.148 19623
2572 1 9 . 1 1 16 16 ALA H H 16 7.904 7.904 8.063 -0.159 19623
2573 1 9 . 1 1 17 17 ILE N N 17 117.363 117.363 118.876 -1.513 19623
2574 1 9 . 1 1 17 17 ILE HA H 17 5.850 5.850 3.589 2.261 19623
2575 1 9 . 1 1 17 17 ILE C C 17 177.604 177.604 177.685 -0.081 19623
2576 1 9 . 1 1 17 17 ILE CA C 17 66.545 66.545 65.580 0.965 19623
2577 1 9 . 1 1 17 17 ILE CB C 17 37.843 37.843 37.814 0.029 19623
2578 1 9 . 1 1 17 17 ILE H H 17 8.500 8.500 8.425 0.075 19623
2579 1 9 . 1 1 18 18 LYS N N 18 119.838 119.838 120.865 -1.027 19623
2580 1 9 . 1 1 18 18 LYS HA H 18 3.865 3.865 3.838 0.027 19623
2581 1 9 . 1 1 18 18 LYS C C 18 176.653 176.653 178.737 -2.084 19623
2582 1 9 . 1 1 18 18 LYS CA C 18 60.189 60.189 60.340 -0.151 19623
2583 1 9 . 1 1 18 18 LYS CB C 18 32.260 32.260 32.151 0.109 19623
2584 1 9 . 1 1 18 18 LYS H H 18 7.833 7.833 8.135 -0.302 19623
2585 1 9 . 1 1 19 19 ASP N N 19 120.497 120.497 120.118 0.379 19623
2586 1 9 . 1 1 19 19 ASP HA H 19 4.569 4.569 4.311 0.258 19623
2587 1 9 . 1 1 19 19 ASP C C 19 179.120 179.120 178.999 0.121 19623
2588 1 9 . 1 1 19 19 ASP CA C 19 57.108 57.108 57.203 -0.095 19623
2589 1 9 . 1 1 19 19 ASP CB C 19 40.853 40.853 40.521 0.332 19623
2590 1 9 . 1 1 19 19 ASP H H 19 8.479 8.479 7.926 0.553 19623
2591 1 9 . 1 1 20 20 LEU N N 20 121.660 121.660 120.409 1.251 19623
2592 1 9 . 1 1 20 20 LEU HA H 20 4.148 4.148 4.024 0.124 19623
2593 1 9 . 1 1 20 20 LEU C C 20 178.377 178.377 179.155 -0.778 19623
2594 1 9 . 1 1 20 20 LEU CA C 20 58.225 58.225 58.453 -0.228 19623
2595 1 9 . 1 1 20 20 LEU CB C 20 41.585 41.585 41.751 -0.166 19623
2596 1 9 . 1 1 20 20 LEU H H 20 8.136 8.136 8.337 -0.201 19623
2597 1 9 . 1 1 21 21 LYS N N 21 120.182 120.182 118.986 1.196 19623
2598 1 9 . 1 1 21 21 LYS HA H 21 3.904 3.904 4.082 -0.178 19623
2599 1 9 . 1 1 21 21 LYS C C 21 179.785 179.785 179.405 0.380 19623
2600 1 9 . 1 1 21 21 LYS CA C 21 59.557 59.557 59.238 0.319 19623
2601 1 9 . 1 1 21 21 LYS CB C 21 29.655 29.655 32.413 -2.759 19623
2602 1 9 . 1 1 21 21 LYS H H 21 8.043 8.043 8.174 -0.131 19623
2603 1 9 . 1 1 22 22 ILE N N 22 121.523 121.523 119.196 2.327 19623
2604 1 9 . 1 1 22 22 ILE HA H 22 3.522 3.522 3.706 -0.184 19623
2605 1 9 . 1 1 22 22 ILE C C 22 177.399 177.399 177.318 0.081 19623
2606 1 9 . 1 1 22 22 ILE CA C 22 64.863 64.863 64.400 0.463 19623
2607 1 9 . 1 1 22 22 ILE CB C 22 38.046 38.046 37.980 0.066 19623
2608 1 9 . 1 1 22 22 ILE H H 22 8.735 8.735 7.668 1.067 19623
2609 1 9 . 1 1 23 23 TYR N N 23 117.506 117.506 115.785 1.721 19623
2610 1 9 . 1 1 23 23 TYR HA H 23 4.481 4.481 4.515 -0.034 19623
2611 1 9 . 1 1 23 23 TYR C C 23 176.020 176.020 175.936 0.084 19623
2612 1 9 . 1 1 23 23 TYR CA C 23 58.369 58.369 58.148 0.221 19623
2613 1 9 . 1 1 23 23 TYR CB C 23 38.499 38.499 38.623 -0.124 19623
2614 1 9 . 1 1 23 23 TYR H H 23 7.291 7.291 7.644 -0.353 19623
2615 1 9 . 1 1 24 24 GLY N N 24 108.209 108.209 107.122 1.087 19623
2616 1 9 . 1 1 24 24 GLY C C 24 174.651 174.651 174.730 -0.079 19623
2617 1 9 . 1 1 24 24 GLY CA C 24 46.409 46.409 44.999 1.410 19623
2618 1 9 . 1 1 24 24 GLY H H 24 7.910 7.910 7.519 0.391 19623
2619 1 9 . 1 1 25 25 ILE N N 25 119.897 119.897 121.957 -2.060 19623
2620 1 9 . 1 1 25 25 ILE HA H 25 3.747 3.747 4.305 -0.558 19623
2621 1 9 . 1 1 25 25 ILE C C 25 175.864 175.864 176.629 -0.765 19623
2622 1 9 . 1 1 25 25 ILE CA C 25 60.984 60.984 60.214 0.770 19623
2623 1 9 . 1 1 25 25 ILE CB C 25 37.120 37.120 37.848 -0.728 19623
2624 1 9 . 1 1 25 25 ILE H H 25 7.383 7.383 8.240 -0.857 19623
2625 1 9 . 1 1 26 26 GLY N N 26 111.580 111.580 114.814 -3.234 19623
2626 1 9 . 1 1 26 26 GLY C C 26 174.847 174.847 175.215 -0.368 19623
2627 1 9 . 1 1 26 26 GLY CA C 26 45.322 45.322 44.404 0.918 19623
2628 1 9 . 1 1 26 26 GLY H H 26 8.811 8.811 8.416 0.395 19623
2629 1 9 . 1 1 27 27 GLU N N 27 120.229 120.229 119.962 0.267 19623
2630 1 9 . 1 1 27 27 GLU C C 27 177.311 177.311 178.604 -1.293 19623
2631 1 9 . 1 1 27 27 GLU CA C 27 59.730 59.730 59.337 0.394 19623
2632 1 9 . 1 1 27 27 GLU CB C 27 29.933 29.933 29.720 0.213 19623
2633 1 9 . 1 1 27 27 GLU H H 27 8.711 8.711 8.941 -0.230 19623
2634 1 9 . 1 1 28 28 HIS N N 28 117.558 117.558 118.572 -1.014 19623
2635 1 9 . 1 1 28 28 HIS C C 28 176.949 176.949 176.458 0.491 19623
2636 1 9 . 1 1 28 28 HIS CA C 28 59.674 59.674 59.319 0.355 19623
2637 1 9 . 1 1 28 28 HIS CB C 28 29.838 29.838 29.379 0.459 19623
2638 1 9 . 1 1 28 28 HIS H H 28 8.870 8.870 8.559 0.311 19623
2639 1 9 . 1 1 29 29 TYR N N 29 115.589 115.589 115.492 0.097 19623
2640 1 9 . 1 1 29 29 TYR HA H 29 4.090 4.090 4.428 -0.338 19623
2641 1 9 . 1 1 29 29 TYR C C 29 177.552 177.552 177.431 0.121 19623
2642 1 9 . 1 1 29 29 TYR CA C 29 60.998 60.998 60.270 0.728 19623
2643 1 9 . 1 1 29 29 TYR CB C 29 38.683 38.683 39.074 -0.391 19623
2644 1 9 . 1 1 29 29 TYR H H 29 7.227 7.227 7.550 -0.323 19623
2645 1 9 . 1 1 30 30 ILE N N 30 120.353 120.353 121.185 -0.832 19623
2646 1 9 . 1 1 30 30 ILE HA H 30 3.444 3.444 3.562 -0.118 19623
2647 1 9 . 1 1 30 30 ILE C C 30 178.211 178.211 177.605 0.606 19623
2648 1 9 . 1 1 30 30 ILE CA C 30 65.640 65.640 65.690 -0.050 19623
2649 1 9 . 1 1 30 30 ILE CB C 30 37.553 37.553 37.651 -0.098 19623
2650 1 9 . 1 1 30 30 ILE H H 30 7.485 7.485 7.789 -0.304 19623
2651 1 9 . 1 1 31 31 LYS N N 31 117.249 117.249 119.230 -1.981 19623
2652 1 9 . 1 1 31 31 LYS HA H 31 4.011 4.011 4.059 -0.048 19623
2653 1 9 . 1 1 31 31 LYS C C 31 178.954 178.954 178.866 0.088 19623
2654 1 9 . 1 1 31 31 LYS CA C 31 58.893 58.893 59.206 -0.313 19623
2655 1 9 . 1 1 31 31 LYS CB C 31 31.673 31.673 32.120 -0.447 19623
2656 1 9 . 1 1 31 31 LYS H H 31 8.064 8.064 8.097 -0.033 19623
2657 1 9 . 1 1 32 32 LEU N N 32 117.176 117.176 119.740 -2.564 19623
2658 1 9 . 1 1 32 32 LEU HA H 32 3.894 3.894 3.981 -0.087 19623
2659 1 9 . 1 1 32 32 LEU C C 32 179.883 179.883 178.505 1.378 19623
2660 1 9 . 1 1 32 32 LEU CA C 32 57.987 57.987 57.496 0.491 19623
2661 1 9 . 1 1 32 32 LEU CB C 32 41.255 41.255 41.630 -0.374 19623
2662 1 9 . 1 1 32 32 LEU H H 32 7.154 7.154 7.463 -0.309 19623
2663 1 9 . 1 1 33 33 ILE N N 33 118.598 118.598 118.462 0.136 19623
2664 1 9 . 1 1 33 33 ILE HA H 33 3.571 3.571 3.829 -0.258 19623
2665 1 9 . 1 1 33 33 ILE C C 33 177.917 177.917 178.738 -0.821 19623
2666 1 9 . 1 1 33 33 ILE CA C 33 63.579 63.579 62.914 0.665 19623
2667 1 9 . 1 1 33 33 ILE CB C 33 35.702 35.702 37.231 -1.529 19623
2668 1 9 . 1 1 33 33 ILE H H 33 7.412 7.412 7.524 -0.112 19623
2669 1 9 . 1 1 34 34 GLU N N 34 116.574 116.574 120.701 -4.127 19623
2670 1 9 . 1 1 34 34 GLU HA H 34 3.826 3.826 4.058 -0.232 19623
2671 1 9 . 1 1 34 34 GLU C C 34 178.661 178.661 178.900 -0.239 19623
2672 1 9 . 1 1 34 34 GLU CA C 34 59.689 59.689 59.794 -0.104 19623
2673 1 9 . 1 1 34 34 GLU CB C 34 29.855 29.855 29.355 0.500 19623
2674 1 9 . 1 1 34 34 GLU H H 34 7.987 7.987 7.907 0.080 19623
2675 1 9 . 1 1 35 35 LYS N N 35 114.863 114.863 117.706 -2.843 19623
2676 1 9 . 1 1 35 35 LYS HA H 35 4.207 4.207 4.316 -0.109 19623
2677 1 9 . 1 1 35 35 LYS C C 35 176.861 176.861 175.858 1.003 19623
2678 1 9 . 1 1 35 35 LYS CA C 35 56.328 56.328 55.460 0.868 19623
2679 1 9 . 1 1 35 35 LYS CB C 35 33.007 33.007 32.743 0.264 19623
2680 1 9 . 1 1 35 35 LYS H H 35 7.361 7.361 7.746 -0.385 19623
2681 1 9 . 1 1 36 36 ALA N N 36 124.407 124.407 124.159 0.248 19623
2682 1 9 . 1 1 36 36 ALA HA H 36 4.129 4.129 4.303 -0.174 19623
2683 1 9 . 1 1 36 36 ALA C C 36 178.279 178.279 177.289 0.990 19623
2684 1 9 . 1 1 36 36 ALA CA C 36 53.257 53.257 52.790 0.467 19623
2685 1 9 . 1 1 36 36 ALA CB C 36 19.581 19.581 19.745 -0.164 19623
2686 1 9 . 1 1 36 36 ALA H H 36 7.365 7.365 7.399 -0.034 19623
2687 1 9 . 1 1 37 37 LYS N N 37 116.217 116.217 117.908 -1.691 19623
2688 1 9 . 1 1 37 37 LYS HA H 37 4.383 4.383 4.356 0.027 19623
2689 1 9 . 1 1 37 37 LYS C C 37 176.167 176.167 175.616 0.551 19623
2690 1 9 . 1 1 37 37 LYS CA C 37 56.602 56.602 57.091 -0.489 19623
2691 1 9 . 1 1 37 37 LYS CB C 37 34.883 34.883 33.644 1.240 19623
2692 1 9 . 1 1 37 37 LYS H H 37 8.908 8.908 8.646 0.262 19623
2693 1 9 . 1 1 38 38 GLN N N 38 113.293 113.293 114.712 -1.419 19623
2694 1 9 . 1 1 38 38 GLN HA H 38 4.813 4.813 4.783 0.030 19623
2695 1 9 . 1 1 38 38 GLN C C 38 176.138 176.138 175.705 0.433 19623
2696 1 9 . 1 1 38 38 GLN CA C 38 54.117 54.117 54.381 -0.264 19623
2697 1 9 . 1 1 38 38 GLN CB C 38 32.222 32.222 31.871 0.351 19623
2698 1 9 . 1 1 38 38 GLN H H 38 7.033 7.033 7.569 -0.536 19623
2699 1 9 . 1 1 39 39 VAL N N 39 125.474 125.474 121.289 4.185 19623
2700 1 9 . 1 1 39 39 VAL C C 39 177.751 177.751 177.777 -0.026 19623
2701 1 9 . 1 1 39 39 VAL CA C 39 67.737 67.737 66.719 1.018 19623
2702 1 9 . 1 1 39 39 VAL CB C 39 31.438 31.438 31.684 -0.246 19623
2703 1 9 . 1 1 39 39 VAL H H 39 9.250 9.250 9.078 0.172 19623
2704 1 9 . 1 1 40 40 ALA N N 40 120.717 120.717 122.466 -1.749 19623
2705 1 9 . 1 1 40 40 ALA HA H 40 4.041 4.041 4.067 -0.026 19623
2706 1 9 . 1 1 40 40 ALA C C 40 179.081 179.081 179.365 -0.284 19623
2707 1 9 . 1 1 40 40 ALA CA C 40 55.059 55.059 55.218 -0.159 19623
2708 1 9 . 1 1 40 40 ALA CB C 40 17.735 17.735 17.898 -0.163 19623
2709 1 9 . 1 1 40 40 ALA H H 40 8.903 8.903 8.443 0.460 19623
2710 1 9 . 1 1 41 41 ALA N N 41 116.698 116.698 121.277 -4.579 19623
2711 1 9 . 1 1 41 41 ALA HA H 41 4.236 4.236 4.031 0.205 19623
2712 1 9 . 1 1 41 41 ALA C C 41 180.294 180.294 179.737 0.557 19623
2713 1 9 . 1 1 41 41 ALA CA C 41 54.688 54.688 54.641 0.047 19623
2714 1 9 . 1 1 41 41 ALA CB C 41 18.724 18.724 18.156 0.568 19623
2715 1 9 . 1 1 41 41 ALA H H 41 6.701 6.701 7.436 -0.735 19623
2716 1 9 . 1 1 42 42 VAL N N 42 119.051 119.051 119.003 0.048 19623
2717 1 9 . 1 1 42 42 VAL HA H 42 3.278 3.278 3.478 -0.200 19623
2718 1 9 . 1 1 42 42 VAL C C 42 176.812 176.812 178.401 -1.589 19623
2719 1 9 . 1 1 42 42 VAL CA C 42 67.641 67.641 67.129 0.512 19623
2720 1 9 . 1 1 42 42 VAL CB C 42 31.399 31.399 31.643 -0.244 19623
2721 1 9 . 1 1 42 42 VAL H H 42 7.552 7.552 7.994 -0.442 19623
2722 1 9 . 1 1 43 43 GLU N N 43 117.715 117.715 119.602 -1.887 19623
2723 1 9 . 1 1 43 43 GLU HA H 43 3.855 3.855 4.027 -0.172 19623
2724 1 9 . 1 1 43 43 GLU C C 43 178.973 178.973 178.917 0.056 19623
2725 1 9 . 1 1 43 43 GLU CA C 43 59.393 59.393 59.913 -0.520 19623
2726 1 9 . 1 1 43 43 GLU CB C 43 28.811 28.811 29.518 -0.707 19623
2727 1 9 . 1 1 43 43 GLU H H 43 7.804 7.804 8.193 -0.389 19623
2728 1 9 . 1 1 44 44 ASP N N 44 119.175 119.175 120.629 -1.454 19623
2729 1 9 . 1 1 44 44 ASP HA H 44 4.363 4.363 4.470 -0.107 19623
2730 1 9 . 1 1 44 44 ASP C C 44 178.211 178.211 178.955 -0.744 19623
2731 1 9 . 1 1 44 44 ASP CA C 44 57.308 57.308 57.180 0.128 19623
2732 1 9 . 1 1 44 44 ASP CB C 44 40.504 40.504 40.581 -0.077 19623
2733 1 9 . 1 1 44 44 ASP H H 44 8.169 8.169 8.131 0.038 19623
2734 1 9 . 1 1 45 45 LEU N N 45 117.848 117.848 120.728 -2.880 19623
2735 1 9 . 1 1 45 45 LEU HA H 45 4.119 4.119 4.053 0.066 19623
2736 1 9 . 1 1 45 45 LEU C C 45 178.416 178.416 179.184 -0.768 19623
2737 1 9 . 1 1 45 45 LEU CA C 45 57.294 57.294 57.667 -0.374 19623
2738 1 9 . 1 1 45 45 LEU CB C 45 40.474 40.474 41.896 -1.422 19623
2739 1 9 . 1 1 45 45 LEU H H 45 8.119 8.119 8.549 -0.430 19623
2740 1 9 . 1 1 46 46 LYS N N 46 119.462 119.462 120.010 -0.548 19623
2741 1 9 . 1 1 46 46 LYS HA H 46 3.972 3.972 3.943 0.029 19623
2742 1 9 . 1 1 46 46 LYS C C 46 177.653 177.653 178.731 -1.078 19623
2743 1 9 . 1 1 46 46 LYS CA C 46 60.276 60.276 59.794 0.482 19623
2744 1 9 . 1 1 46 46 LYS CB C 46 31.450 31.450 31.976 -0.526 19623
2745 1 9 . 1 1 46 46 LYS H H 46 8.483 8.483 7.958 0.525 19623
2746 1 9 . 1 1 47 47 ASP N N 47 117.470 117.470 119.443 -1.973 19623
2747 1 9 . 1 1 47 47 ASP HA H 47 4.344 4.344 4.535 -0.191 19623
2748 1 9 . 1 1 47 47 ASP C C 47 179.384 179.384 178.488 0.896 19623
2749 1 9 . 1 1 47 47 ASP CA C 47 57.687 57.687 57.498 0.189 19623
2750 1 9 . 1 1 47 47 ASP CB C 47 40.809 40.809 40.464 0.345 19623
2751 1 9 . 1 1 47 47 ASP H H 47 7.846 7.846 8.044 -0.198 19623
2752 1 9 . 1 1 48 48 GLU N N 48 119.662 119.662 120.844 -1.182 19623
2753 1 9 . 1 1 48 48 GLU HA H 48 4.011 4.011 3.995 0.016 19623
2754 1 9 . 1 1 48 48 GLU C C 48 180.724 180.724 179.106 1.618 19623
2755 1 9 . 1 1 48 48 GLU CA C 48 60.091 60.091 59.316 0.775 19623
2756 1 9 . 1 1 48 48 GLU CB C 48 31.991 31.991 29.692 2.299 19623
2757 1 9 . 1 1 48 48 GLU H H 48 8.327 8.327 7.892 0.435 19623
2758 1 9 . 1 1 49 49 ILE N N 49 120.308 120.308 119.846 0.462 19623
2759 1 9 . 1 1 49 49 ILE HA H 49 3.738 3.738 3.501 0.237 19623
2760 1 9 . 1 1 49 49 ILE C C 49 179.238 179.238 178.026 1.212 19623
2761 1 9 . 1 1 49 49 ILE CA C 49 64.592 64.592 65.502 -0.910 19623
2762 1 9 . 1 1 49 49 ILE CB C 49 37.959 37.959 38.032 -0.073 19623
2763 1 9 . 1 1 49 49 ILE H H 49 7.667 7.667 8.304 -0.637 19623
2764 1 9 . 1 1 50 50 LEU N N 50 121.274 121.274 119.267 2.007 19623
2765 1 9 . 1 1 50 50 LEU HA H 50 4.559 4.559 3.873 0.686 19623
2766 1 9 . 1 1 50 50 LEU C C 50 179.971 179.971 178.946 1.025 19623
2767 1 9 . 1 1 50 50 LEU CA C 50 57.794 57.794 58.001 -0.207 19623
2768 1 9 . 1 1 50 50 LEU CB C 50 40.856 40.856 41.636 -0.780 19623
2769 1 9 . 1 1 50 50 LEU H H 50 8.474 8.474 7.802 0.672 19623
2770 1 9 . 1 1 51 51 LYS N N 51 119.972 119.972 118.650 1.322 19623
2771 1 9 . 1 1 51 51 LYS HA H 51 3.982 3.982 3.970 0.012 19623
2772 1 9 . 1 1 51 51 LYS C C 51 179.189 179.189 179.441 -0.252 19623
2773 1 9 . 1 1 51 51 LYS CA C 51 59.526 59.526 59.340 0.186 19623
2774 1 9 . 1 1 51 51 LYS CB C 51 32.175 32.175 31.857 0.318 19623
2775 1 9 . 1 1 51 51 LYS H H 51 8.197 8.197 8.358 -0.161 19623
2776 1 9 . 1 1 52 52 ALA N N 52 121.059 121.059 122.132 -1.073 19623
2777 1 9 . 1 1 52 52 ALA HA H 52 4.158 4.158 4.012 0.146 19623
2778 1 9 . 1 1 52 52 ALA C C 52 178.015 178.015 177.975 0.040 19623
2779 1 9 . 1 1 52 52 ALA CA C 52 53.662 53.662 54.402 -0.740 19623
2780 1 9 . 1 1 52 52 ALA CB C 52 17.903 17.903 18.341 -0.438 19623
2781 1 9 . 1 1 52 52 ALA H H 52 7.809 7.809 7.868 -0.059 19623
2782 1 9 . 1 1 53 53 HIS N N 53 115.943 115.943 113.604 2.339 19623
2783 1 9 . 1 1 53 53 HIS HA H 53 4.373 4.373 4.774 -0.401 19623
2784 1 9 . 1 1 53 53 HIS C C 53 174.015 174.015 173.665 0.350 19623
2785 1 9 . 1 1 53 53 HIS CA C 53 57.409 57.409 55.526 1.883 19623
2786 1 9 . 1 1 53 53 HIS CB C 53 29.010 29.010 30.453 -1.443 19623
2787 1 9 . 1 1 53 53 HIS H H 53 7.598 7.598 7.397 0.201 19623
2788 1 9 . 1 1 54 54 ASP N N 54 119.133 119.133 118.170 0.963 19623
2789 1 9 . 1 1 54 54 ASP HA H 54 4.442 4.442 4.372 0.070 19623
2790 1 9 . 1 1 54 54 ASP C C 54 175.609 175.609 176.562 -0.953 19623
2791 1 9 . 1 1 54 54 ASP CA C 54 54.971 54.971 55.815 -0.844 19623
2792 1 9 . 1 1 54 54 ASP CB C 54 40.209 40.209 39.704 0.505 19623
2793 1 9 . 1 1 54 54 ASP H H 54 7.974 7.974 7.715 0.259 19623
2794 1 9 . 1 1 55 55 ARG N N 55 118.206 118.206 116.916 1.290 19623
2795 1 9 . 1 1 55 55 ARG HA H 55 4.324 4.324 4.440 -0.116 19623
2796 1 9 . 1 1 55 55 ARG C C 55 174.671 174.671 175.765 -1.094 19623
2797 1 9 . 1 1 55 55 ARG CA C 55 54.785 54.785 54.334 0.451 19623
2798 1 9 . 1 1 55 55 ARG CB C 55 30.507 30.507 29.862 0.645 19623
2799 1 9 . 1 1 55 55 ARG H H 55 7.943 7.943 8.282 -0.339 19623
2800 1 10 . 1 1 2 2 GLY N N 2 113.169 113.169 111.465 1.704 19623
2801 1 10 . 1 1 2 2 GLY C C 2 173.996 173.996 174.748 -0.752 19623
2802 1 10 . 1 1 2 2 GLY CA C 2 45.211 45.211 44.791 0.420 19623
2803 1 10 . 1 1 2 2 GLY H H 2 8.533 8.533 8.295 0.238 19623
2804 1 10 . 1 1 3 3 ASP N N 3 120.717 120.717 122.876 -2.159 19623
2805 1 10 . 1 1 3 3 ASP HA H 3 4.559 4.559 4.588 -0.029 19623
2806 1 10 . 1 1 3 3 ASP C C 3 176.675 176.675 176.414 0.261 19623
2807 1 10 . 1 1 3 3 ASP CA C 3 54.489 54.489 53.913 0.576 19623
2808 1 10 . 1 1 3 3 ASP CB C 3 41.197 41.197 42.380 -1.183 19623
2809 1 10 . 1 1 3 3 ASP H H 3 8.412 8.412 8.814 -0.402 19623
2810 1 10 . 1 1 4 4 LYS N N 4 121.955 121.955 121.709 0.246 19623
2811 1 10 . 1 1 4 4 LYS HA H 4 4.246 4.246 4.000 0.246 19623
2812 1 10 . 1 1 4 4 LYS C C 4 177.301 177.301 177.283 0.018 19623
2813 1 10 . 1 1 4 4 LYS CA C 4 56.606 56.606 57.222 -0.617 19623
2814 1 10 . 1 1 4 4 LYS CB C 4 32.436 32.436 32.905 -0.469 19623
2815 1 10 . 1 1 4 4 LYS H H 4 8.490 8.490 8.298 0.192 19623
2816 1 10 . 1 1 5 5 GLY N N 5 109.376 109.376 112.663 -3.287 19623
2817 1 10 . 1 1 5 5 GLY C C 5 174.045 174.045 173.699 0.346 19623
2818 1 10 . 1 1 5 5 GLY CA C 5 45.305 45.305 44.693 0.612 19623
2819 1 10 . 1 1 5 5 GLY H H 5 8.491 8.491 8.569 -0.078 19623
2820 1 10 . 1 1 6 6 TYR N N 6 120.416 120.416 120.030 0.386 19623
2821 1 10 . 1 1 6 6 TYR HA H 6 4.510 4.510 4.488 0.022 19623
2822 1 10 . 1 1 6 6 TYR C C 6 175.952 175.952 176.173 -0.221 19623
2823 1 10 . 1 1 6 6 TYR CA C 6 58.383 58.383 58.590 -0.207 19623
2824 1 10 . 1 1 6 6 TYR CB C 6 38.562 38.562 39.402 -0.840 19623
2825 1 10 . 1 1 6 6 TYR H H 6 8.134 8.134 8.441 -0.307 19623
2826 1 10 . 1 1 7 7 ASN N N 7 122.415 122.415 118.271 4.144 19623
2827 1 10 . 1 1 7 7 ASN HA H 7 4.588 4.588 4.613 -0.025 19623
2828 1 10 . 1 1 7 7 ASN C C 7 175.521 175.521 176.063 -0.542 19623
2829 1 10 . 1 1 7 7 ASN CA C 7 53.408 53.408 54.551 -1.143 19623
2830 1 10 . 1 1 7 7 ASN CB C 7 38.780 38.780 38.794 -0.014 19623
2831 1 10 . 1 1 7 7 ASN H H 7 8.557 8.557 8.881 -0.324 19623
2832 1 10 . 1 1 8 8 GLY N N 8 109.431 109.431 107.613 1.818 19623
2833 1 10 . 1 1 8 8 GLY C C 8 175.609 175.609 174.993 0.616 19623
2834 1 10 . 1 1 8 8 GLY CA C 8 45.990 45.990 44.341 1.649 19623
2835 1 10 . 1 1 8 8 GLY H H 8 8.285 8.285 7.957 0.328 19623
2836 1 10 . 1 1 9 9 LEU N N 9 123.596 123.596 126.872 -3.276 19623
2837 1 10 . 1 1 9 9 LEU HA H 9 3.933 3.933 4.053 -0.120 19623
2838 1 10 . 1 1 9 9 LEU C C 9 177.458 177.458 178.481 -1.023 19623
2839 1 10 . 1 1 9 9 LEU CA C 9 58.248 58.248 57.721 0.527 19623
2840 1 10 . 1 1 9 9 LEU CB C 9 41.690 41.690 42.071 -0.381 19623
2841 1 10 . 1 1 9 9 LEU H H 9 8.136 8.136 8.639 -0.503 19623
2842 1 10 . 1 1 10 10 ALA N N 10 121.310 121.310 120.866 0.444 19623
2843 1 10 . 1 1 10 10 ALA HA H 10 3.933 3.933 4.099 -0.166 19623
2844 1 10 . 1 1 10 10 ALA C C 10 181.140 181.140 179.645 1.495 19623
2845 1 10 . 1 1 10 10 ALA CA C 10 55.505 55.505 55.236 0.269 19623
2846 1 10 . 1 1 10 10 ALA CB C 10 17.791 17.791 17.569 0.222 19623
2847 1 10 . 1 1 10 10 ALA H H 10 8.361 8.361 8.413 -0.052 19623
2848 1 10 . 1 1 11 11 GLU N N 11 118.893 118.893 119.270 -0.377 19623
2849 1 10 . 1 1 11 11 GLU HA H 11 3.992 3.992 4.004 -0.012 19623
2850 1 10 . 1 1 11 11 GLU C C 11 178.797 178.797 179.262 -0.465 19623
2851 1 10 . 1 1 11 11 GLU CA C 11 59.892 59.892 59.450 0.441 19623
2852 1 10 . 1 1 11 11 GLU CB C 11 28.991 28.991 29.338 -0.347 19623
2853 1 10 . 1 1 11 11 GLU H H 11 8.490 8.490 8.653 -0.164 19623
2854 1 10 . 1 1 12 12 ALA N N 12 122.362 122.362 122.889 -0.527 19623
2855 1 10 . 1 1 12 12 ALA HA H 12 4.080 4.080 4.192 -0.112 19623
2856 1 10 . 1 1 12 12 ALA C C 12 181.228 181.228 179.575 1.653 19623
2857 1 10 . 1 1 12 12 ALA CA C 12 55.218 55.218 55.408 -0.190 19623
2858 1 10 . 1 1 12 12 ALA CB C 12 18.462 18.462 18.415 0.047 19623
2859 1 10 . 1 1 12 12 ALA H H 12 8.099 8.099 8.284 -0.185 19623
2860 1 10 . 1 1 13 13 LYS N N 13 118.689 118.689 118.636 0.053 19623
2861 1 10 . 1 1 13 13 LYS HA H 13 3.620 3.620 3.997 -0.377 19623
2862 1 10 . 1 1 13 13 LYS C C 13 177.203 177.203 179.193 -1.990 19623
2863 1 10 . 1 1 13 13 LYS CA C 13 60.390 60.390 60.190 0.200 19623
2864 1 10 . 1 1 13 13 LYS CB C 13 33.624 33.624 32.495 1.129 19623
2865 1 10 . 1 1 13 13 LYS H H 13 8.382 8.382 8.345 0.037 19623
2866 1 10 . 1 1 14 14 GLU N N 14 117.865 117.865 119.617 -1.752 19623
2867 1 10 . 1 1 14 14 GLU HA H 14 4.285 4.285 4.035 0.250 19623
2868 1 10 . 1 1 14 14 GLU C C 14 179.404 179.404 178.968 0.436 19623
2869 1 10 . 1 1 14 14 GLU CA C 14 60.007 60.007 59.527 0.480 19623
2870 1 10 . 1 1 14 14 GLU CB C 14 29.418 29.418 29.581 -0.163 19623
2871 1 10 . 1 1 14 14 GLU H H 14 7.952 7.952 8.269 -0.317 19623
2872 1 10 . 1 1 15 15 LYS N N 15 119.020 119.020 120.114 -1.094 19623
2873 1 10 . 1 1 15 15 LYS HA H 15 3.933 3.933 4.131 -0.198 19623
2874 1 10 . 1 1 15 15 LYS C C 15 177.976 177.976 178.468 -0.492 19623
2875 1 10 . 1 1 15 15 LYS CA C 15 59.591 59.591 58.992 0.598 19623
2876 1 10 . 1 1 15 15 LYS CB C 15 32.275 32.275 32.158 0.117 19623
2877 1 10 . 1 1 15 15 LYS H H 15 8.029 8.029 8.147 -0.118 19623
2878 1 10 . 1 1 16 16 ALA N N 16 120.410 120.410 121.888 -1.478 19623
2879 1 10 . 1 1 16 16 ALA HA H 16 3.962 3.962 4.149 -0.187 19623
2880 1 10 . 1 1 16 16 ALA C C 16 179.140 179.140 179.974 -0.834 19623
2881 1 10 . 1 1 16 16 ALA CA C 16 55.426 55.426 55.018 0.408 19623
2882 1 10 . 1 1 16 16 ALA CB C 16 18.410 18.410 18.340 0.070 19623
2883 1 10 . 1 1 16 16 ALA H H 16 7.904 7.904 7.950 -0.046 19623
2884 1 10 . 1 1 17 17 ILE N N 17 117.363 117.363 118.510 -1.147 19623
2885 1 10 . 1 1 17 17 ILE HA H 17 5.850 5.850 3.589 2.261 19623
2886 1 10 . 1 1 17 17 ILE C C 17 177.604 177.604 178.180 -0.576 19623
2887 1 10 . 1 1 17 17 ILE CA C 17 66.545 66.545 65.301 1.244 19623
2888 1 10 . 1 1 17 17 ILE CB C 17 37.843 37.843 37.821 0.022 19623
2889 1 10 . 1 1 17 17 ILE H H 17 8.500 8.500 7.938 0.562 19623
2890 1 10 . 1 1 18 18 LYS N N 18 119.838 119.838 119.981 -0.143 19623
2891 1 10 . 1 1 18 18 LYS HA H 18 3.865 3.865 3.939 -0.074 19623
2892 1 10 . 1 1 18 18 LYS C C 18 176.653 176.653 179.261 -2.608 19623
2893 1 10 . 1 1 18 18 LYS CA C 18 60.189 60.189 59.955 0.234 19623
2894 1 10 . 1 1 18 18 LYS CB C 18 32.260 32.260 32.140 0.120 19623
2895 1 10 . 1 1 18 18 LYS H H 18 7.833 7.833 8.107 -0.274 19623
2896 1 10 . 1 1 19 19 ASP N N 19 120.497 120.497 120.281 0.216 19623
2897 1 10 . 1 1 19 19 ASP HA H 19 4.569 4.569 4.480 0.089 19623
2898 1 10 . 1 1 19 19 ASP C C 19 179.120 179.120 178.742 0.378 19623
2899 1 10 . 1 1 19 19 ASP CA C 19 57.108 57.108 56.845 0.263 19623
2900 1 10 . 1 1 19 19 ASP CB C 19 40.853 40.853 40.647 0.206 19623
2901 1 10 . 1 1 19 19 ASP H H 19 8.479 8.479 7.891 0.588 19623
2902 1 10 . 1 1 20 20 LEU N N 20 121.660 121.660 120.394 1.266 19623
2903 1 10 . 1 1 20 20 LEU HA H 20 4.148 4.148 4.080 0.068 19623
2904 1 10 . 1 1 20 20 LEU C C 20 178.377 178.377 178.843 -0.466 19623
2905 1 10 . 1 1 20 20 LEU CA C 20 58.225 58.225 58.045 0.180 19623
2906 1 10 . 1 1 20 20 LEU CB C 20 41.585 41.585 41.687 -0.102 19623
2907 1 10 . 1 1 20 20 LEU H H 20 8.136 8.136 8.291 -0.155 19623
2908 1 10 . 1 1 21 21 LYS N N 21 120.182 120.182 118.945 1.237 19623
2909 1 10 . 1 1 21 21 LYS HA H 21 3.904 3.904 4.080 -0.176 19623
2910 1 10 . 1 1 21 21 LYS C C 21 179.785 179.785 179.601 0.184 19623
2911 1 10 . 1 1 21 21 LYS CA C 21 59.557 59.557 59.304 0.253 19623
2912 1 10 . 1 1 21 21 LYS CB C 21 29.655 29.655 32.159 -2.504 19623
2913 1 10 . 1 1 21 21 LYS H H 21 8.043 8.043 8.097 -0.054 19623
2914 1 10 . 1 1 22 22 ILE N N 22 121.523 121.523 119.845 1.678 19623
2915 1 10 . 1 1 22 22 ILE HA H 22 3.522 3.522 3.691 -0.169 19623
2916 1 10 . 1 1 22 22 ILE C C 22 177.399 177.399 177.052 0.347 19623
2917 1 10 . 1 1 22 22 ILE CA C 22 64.863 64.863 63.859 1.004 19623
2918 1 10 . 1 1 22 22 ILE CB C 22 38.046 38.046 37.737 0.309 19623
2919 1 10 . 1 1 22 22 ILE H H 22 8.735 8.735 7.369 1.366 19623
2920 1 10 . 1 1 23 23 TYR N N 23 117.506 117.506 116.407 1.099 19623
2921 1 10 . 1 1 23 23 TYR HA H 23 4.481 4.481 4.485 -0.004 19623
2922 1 10 . 1 1 23 23 TYR C C 23 176.020 176.020 175.979 0.041 19623
2923 1 10 . 1 1 23 23 TYR CA C 23 58.369 58.369 58.118 0.251 19623
2924 1 10 . 1 1 23 23 TYR CB C 23 38.499 38.499 38.343 0.156 19623
2925 1 10 . 1 1 23 23 TYR H H 23 7.291 7.291 7.401 -0.110 19623
2926 1 10 . 1 1 24 24 GLY N N 24 108.209 108.209 108.255 -0.046 19623
2927 1 10 . 1 1 24 24 GLY C C 24 174.651 174.651 175.067 -0.416 19623
2928 1 10 . 1 1 24 24 GLY CA C 24 46.409 46.409 45.295 1.114 19623
2929 1 10 . 1 1 24 24 GLY H H 24 7.910 7.910 7.377 0.533 19623
2930 1 10 . 1 1 25 25 ILE N N 25 119.897 119.897 120.796 -0.899 19623
2931 1 10 . 1 1 25 25 ILE HA H 25 3.747 3.747 3.810 -0.063 19623
2932 1 10 . 1 1 25 25 ILE C C 25 175.864 175.864 176.812 -0.948 19623
2933 1 10 . 1 1 25 25 ILE CA C 25 60.984 60.984 60.416 0.568 19623
2934 1 10 . 1 1 25 25 ILE CB C 25 37.120 37.120 37.343 -0.223 19623
2935 1 10 . 1 1 25 25 ILE H H 25 7.383 7.383 7.798 -0.415 19623
2936 1 10 . 1 1 26 26 GLY N N 26 111.580 111.580 115.011 -3.431 19623
2937 1 10 . 1 1 26 26 GLY C C 26 174.847 174.847 175.224 -0.377 19623
2938 1 10 . 1 1 26 26 GLY CA C 26 45.322 45.322 44.420 0.902 19623
2939 1 10 . 1 1 26 26 GLY H H 26 8.811 8.811 8.259 0.552 19623
2940 1 10 . 1 1 27 27 GLU N N 27 120.229 120.229 121.443 -1.214 19623
2941 1 10 . 1 1 27 27 GLU C C 27 177.311 177.311 178.739 -1.428 19623
2942 1 10 . 1 1 27 27 GLU CA C 27 59.730 59.730 59.701 0.029 19623
2943 1 10 . 1 1 27 27 GLU CB C 27 29.933 29.933 29.750 0.183 19623
2944 1 10 . 1 1 27 27 GLU H H 27 8.711 8.711 9.020 -0.309 19623
2945 1 10 . 1 1 28 28 HIS N N 28 117.558 117.558 118.820 -1.262 19623
2946 1 10 . 1 1 28 28 HIS C C 28 176.949 176.949 177.081 -0.132 19623
2947 1 10 . 1 1 28 28 HIS CA C 28 59.674 59.674 59.677 -0.003 19623
2948 1 10 . 1 1 28 28 HIS CB C 28 29.838 29.838 29.484 0.354 19623
2949 1 10 . 1 1 28 28 HIS H H 28 8.870 8.870 8.644 0.226 19623
2950 1 10 . 1 1 29 29 TYR N N 29 115.589 115.589 116.563 -0.974 19623
2951 1 10 . 1 1 29 29 TYR HA H 29 4.090 4.090 4.369 -0.279 19623
2952 1 10 . 1 1 29 29 TYR C C 29 177.552 177.552 177.883 -0.331 19623
2953 1 10 . 1 1 29 29 TYR CA C 29 60.998 60.998 60.770 0.229 19623
2954 1 10 . 1 1 29 29 TYR CB C 29 38.683 38.683 38.731 -0.048 19623
2955 1 10 . 1 1 29 29 TYR H H 29 7.227 7.227 7.677 -0.450 19623
2956 1 10 . 1 1 30 30 ILE N N 30 120.353 120.353 121.204 -0.851 19623
2957 1 10 . 1 1 30 30 ILE HA H 30 3.444 3.444 3.583 -0.139 19623
2958 1 10 . 1 1 30 30 ILE C C 30 178.211 178.211 177.634 0.577 19623
2959 1 10 . 1 1 30 30 ILE CA C 30 65.640 65.640 65.631 0.009 19623
2960 1 10 . 1 1 30 30 ILE CB C 30 37.553 37.553 37.723 -0.170 19623
2961 1 10 . 1 1 30 30 ILE H H 30 7.485 7.485 8.133 -0.648 19623
2962 1 10 . 1 1 31 31 LYS N N 31 117.249 117.249 119.693 -2.444 19623
2963 1 10 . 1 1 31 31 LYS HA H 31 4.011 4.011 4.199 -0.188 19623
2964 1 10 . 1 1 31 31 LYS C C 31 178.954 178.954 178.973 -0.019 19623
2965 1 10 . 1 1 31 31 LYS CA C 31 58.893 58.893 59.291 -0.398 19623
2966 1 10 . 1 1 31 31 LYS CB C 31 31.673 31.673 32.142 -0.469 19623
2967 1 10 . 1 1 31 31 LYS H H 31 8.064 8.064 8.122 -0.058 19623
2968 1 10 . 1 1 32 32 LEU N N 32 117.176 117.176 119.838 -2.662 19623
2969 1 10 . 1 1 32 32 LEU HA H 32 3.894 3.894 3.959 -0.065 19623
2970 1 10 . 1 1 32 32 LEU C C 32 179.883 179.883 178.756 1.127 19623
2971 1 10 . 1 1 32 32 LEU CA C 32 57.987 57.987 57.662 0.325 19623
2972 1 10 . 1 1 32 32 LEU CB C 32 41.255 41.255 41.461 -0.206 19623
2973 1 10 . 1 1 32 32 LEU H H 32 7.154 7.154 7.251 -0.097 19623
2974 1 10 . 1 1 33 33 ILE N N 33 118.598 118.598 117.209 1.389 19623
2975 1 10 . 1 1 33 33 ILE HA H 33 3.571 3.571 3.827 -0.256 19623
2976 1 10 . 1 1 33 33 ILE C C 33 177.917 177.917 178.466 -0.549 19623
2977 1 10 . 1 1 33 33 ILE CA C 33 63.579 63.579 62.889 0.690 19623
2978 1 10 . 1 1 33 33 ILE CB C 33 35.702 35.702 37.157 -1.455 19623
2979 1 10 . 1 1 33 33 ILE H H 33 7.412 7.412 7.543 -0.131 19623
2980 1 10 . 1 1 34 34 GLU N N 34 116.574 116.574 120.087 -3.513 19623
2981 1 10 . 1 1 34 34 GLU HA H 34 3.826 3.826 4.002 -0.176 19623
2982 1 10 . 1 1 34 34 GLU C C 34 178.661 178.661 178.457 0.204 19623
2983 1 10 . 1 1 34 34 GLU CA C 34 59.689 59.689 59.668 0.021 19623
2984 1 10 . 1 1 34 34 GLU CB C 34 29.855 29.855 29.251 0.604 19623
2985 1 10 . 1 1 34 34 GLU H H 34 7.987 7.987 7.846 0.141 19623
2986 1 10 . 1 1 35 35 LYS N N 35 114.863 114.863 117.774 -2.911 19623
2987 1 10 . 1 1 35 35 LYS HA H 35 4.207 4.207 4.309 -0.102 19623
2988 1 10 . 1 1 35 35 LYS C C 35 176.861 176.861 175.917 0.944 19623
2989 1 10 . 1 1 35 35 LYS CA C 35 56.328 56.328 55.489 0.840 19623
2990 1 10 . 1 1 35 35 LYS CB C 35 33.007 33.007 32.694 0.313 19623
2991 1 10 . 1 1 35 35 LYS H H 35 7.361 7.361 7.564 -0.203 19623
2992 1 10 . 1 1 36 36 ALA N N 36 124.407 124.407 124.670 -0.263 19623
2993 1 10 . 1 1 36 36 ALA HA H 36 4.129 4.129 4.229 -0.100 19623
2994 1 10 . 1 1 36 36 ALA C C 36 178.279 178.279 177.158 1.121 19623
2995 1 10 . 1 1 36 36 ALA CA C 36 53.257 53.257 53.088 0.169 19623
2996 1 10 . 1 1 36 36 ALA CB C 36 19.581 19.581 19.738 -0.157 19623
2997 1 10 . 1 1 36 36 ALA H H 36 7.365 7.365 7.666 -0.301 19623
2998 1 10 . 1 1 37 37 LYS N N 37 116.217 116.217 120.758 -4.541 19623
2999 1 10 . 1 1 37 37 LYS HA H 37 4.383 4.383 4.366 0.017 19623
3000 1 10 . 1 1 37 37 LYS C C 37 176.167 176.167 176.008 0.159 19623
3001 1 10 . 1 1 37 37 LYS CA C 37 56.602 56.602 56.588 0.014 19623
3002 1 10 . 1 1 37 37 LYS CB C 37 34.883 34.883 33.439 1.444 19623
3003 1 10 . 1 1 37 37 LYS H H 37 8.908 8.908 8.698 0.210 19623
3004 1 10 . 1 1 38 38 GLN N N 38 113.293 113.293 117.794 -4.501 19623
3005 1 10 . 1 1 38 38 GLN HA H 38 4.813 4.813 4.509 0.304 19623
3006 1 10 . 1 1 38 38 GLN C C 38 176.138 176.138 176.468 -0.330 19623
3007 1 10 . 1 1 38 38 GLN CA C 38 54.117 54.117 54.326 -0.209 19623
3008 1 10 . 1 1 38 38 GLN CB C 38 32.222 32.222 32.158 0.064 19623
3009 1 10 . 1 1 38 38 GLN H H 38 7.033 7.033 7.843 -0.810 19623
3010 1 10 . 1 1 39 39 VAL N N 39 125.474 125.474 123.939 1.535 19623
3011 1 10 . 1 1 39 39 VAL C C 39 177.751 177.751 177.577 0.174 19623
3012 1 10 . 1 1 39 39 VAL CA C 39 67.737 67.737 66.364 1.373 19623
3013 1 10 . 1 1 39 39 VAL CB C 39 31.438 31.438 31.782 -0.344 19623
3014 1 10 . 1 1 39 39 VAL H H 39 9.250 9.250 8.879 0.371 19623
3015 1 10 . 1 1 40 40 ALA N N 40 120.717 120.717 122.235 -1.518 19623
3016 1 10 . 1 1 40 40 ALA HA H 40 4.041 4.041 4.063 -0.022 19623
3017 1 10 . 1 1 40 40 ALA C C 40 179.081 179.081 179.233 -0.152 19623
3018 1 10 . 1 1 40 40 ALA CA C 40 55.059 55.059 55.054 0.005 19623
3019 1 10 . 1 1 40 40 ALA CB C 40 17.735 17.735 18.155 -0.420 19623
3020 1 10 . 1 1 40 40 ALA H H 40 8.903 8.903 8.212 0.691 19623
3021 1 10 . 1 1 41 41 ALA N N 41 116.698 116.698 120.722 -4.024 19623
3022 1 10 . 1 1 41 41 ALA HA H 41 4.236 4.236 4.030 0.206 19623
3023 1 10 . 1 1 41 41 ALA C C 41 180.294 180.294 179.650 0.644 19623
3024 1 10 . 1 1 41 41 ALA CA C 41 54.688 54.688 54.549 0.139 19623
3025 1 10 . 1 1 41 41 ALA CB C 41 18.724 18.724 18.132 0.592 19623
3026 1 10 . 1 1 41 41 ALA H H 41 6.701 6.701 7.905 -1.204 19623
3027 1 10 . 1 1 42 42 VAL N N 42 119.051 119.051 118.825 0.226 19623
3028 1 10 . 1 1 42 42 VAL HA H 42 3.278 3.278 3.492 -0.214 19623
3029 1 10 . 1 1 42 42 VAL C C 42 176.812 176.812 178.251 -1.439 19623
3030 1 10 . 1 1 42 42 VAL CA C 42 67.641 67.641 67.097 0.544 19623
3031 1 10 . 1 1 42 42 VAL CB C 42 31.399 31.399 31.643 -0.244 19623
3032 1 10 . 1 1 42 42 VAL H H 42 7.552 7.552 8.040 -0.488 19623
3033 1 10 . 1 1 43 43 GLU N N 43 117.715 117.715 118.726 -1.011 19623
3034 1 10 . 1 1 43 43 GLU HA H 43 3.855 3.855 4.065 -0.210 19623
3035 1 10 . 1 1 43 43 GLU C C 43 178.973 178.973 178.940 0.033 19623
3036 1 10 . 1 1 43 43 GLU CA C 43 59.393 59.393 59.407 -0.014 19623
3037 1 10 . 1 1 43 43 GLU CB C 43 28.811 28.811 29.411 -0.600 19623
3038 1 10 . 1 1 43 43 GLU H H 43 7.804 7.804 7.835 -0.031 19623
3039 1 10 . 1 1 44 44 ASP N N 44 119.175 119.175 120.222 -1.047 19623
3040 1 10 . 1 1 44 44 ASP HA H 44 4.363 4.363 4.497 -0.134 19623
3041 1 10 . 1 1 44 44 ASP C C 44 178.211 178.211 178.594 -0.383 19623
3042 1 10 . 1 1 44 44 ASP CA C 44 57.308 57.308 56.808 0.500 19623
3043 1 10 . 1 1 44 44 ASP CB C 44 40.504 40.504 40.705 -0.201 19623
3044 1 10 . 1 1 44 44 ASP H H 44 8.169 8.169 8.100 0.069 19623
3045 1 10 . 1 1 45 45 LEU N N 45 117.848 117.848 120.160 -2.312 19623
3046 1 10 . 1 1 45 45 LEU HA H 45 4.119 4.119 4.085 0.034 19623
3047 1 10 . 1 1 45 45 LEU C C 45 178.416 178.416 178.699 -0.283 19623
3048 1 10 . 1 1 45 45 LEU CA C 45 57.294 57.294 57.822 -0.528 19623
3049 1 10 . 1 1 45 45 LEU CB C 45 40.474 40.474 41.980 -1.506 19623
3050 1 10 . 1 1 45 45 LEU H H 45 8.119 8.119 8.222 -0.103 19623
3051 1 10 . 1 1 46 46 LYS N N 46 119.462 119.462 118.327 1.135 19623
3052 1 10 . 1 1 46 46 LYS HA H 46 3.972 3.972 3.959 0.013 19623
3053 1 10 . 1 1 46 46 LYS C C 46 177.653 177.653 178.549 -0.896 19623
3054 1 10 . 1 1 46 46 LYS CA C 46 60.276 60.276 59.837 0.439 19623
3055 1 10 . 1 1 46 46 LYS CB C 46 31.450 31.450 31.695 -0.245 19623
3056 1 10 . 1 1 46 46 LYS H H 46 8.483 8.483 8.168 0.315 19623
3057 1 10 . 1 1 47 47 ASP N N 47 117.470 117.470 120.854 -3.384 19623
3058 1 10 . 1 1 47 47 ASP HA H 47 4.344 4.344 4.595 -0.251 19623
3059 1 10 . 1 1 47 47 ASP C C 47 179.384 179.384 178.713 0.671 19623
3060 1 10 . 1 1 47 47 ASP CA C 47 57.687 57.687 57.168 0.519 19623
3061 1 10 . 1 1 47 47 ASP CB C 47 40.809 40.809 40.334 0.474 19623
3062 1 10 . 1 1 47 47 ASP H H 47 7.846 7.846 7.784 0.062 19623
3063 1 10 . 1 1 48 48 GLU N N 48 119.662 119.662 120.512 -0.850 19623
3064 1 10 . 1 1 48 48 GLU HA H 48 4.011 4.011 4.096 -0.085 19623
3065 1 10 . 1 1 48 48 GLU C C 48 180.724 180.724 179.408 1.316 19623
3066 1 10 . 1 1 48 48 GLU CA C 48 60.091 60.091 59.091 1.000 19623
3067 1 10 . 1 1 48 48 GLU CB C 48 31.991 31.991 29.805 2.186 19623
3068 1 10 . 1 1 48 48 GLU H H 48 8.327 8.327 7.561 0.766 19623
3069 1 10 . 1 1 49 49 ILE N N 49 120.308 120.308 121.166 -0.858 19623
3070 1 10 . 1 1 49 49 ILE HA H 49 3.738 3.738 3.689 0.049 19623
3071 1 10 . 1 1 49 49 ILE C C 49 179.238 179.238 177.783 1.455 19623
3072 1 10 . 1 1 49 49 ILE CA C 49 64.592 64.592 65.921 -1.329 19623
3073 1 10 . 1 1 49 49 ILE CB C 49 37.959 37.959 38.201 -0.242 19623
3074 1 10 . 1 1 49 49 ILE H H 49 7.667 7.667 8.632 -0.965 19623
3075 1 10 . 1 1 50 50 LEU N N 50 121.274 121.274 119.288 1.986 19623
3076 1 10 . 1 1 50 50 LEU HA H 50 4.559 4.559 3.898 0.661 19623
3077 1 10 . 1 1 50 50 LEU C C 50 179.971 179.971 178.761 1.210 19623
3078 1 10 . 1 1 50 50 LEU CA C 50 57.794 57.794 57.738 0.056 19623
3079 1 10 . 1 1 50 50 LEU CB C 50 40.856 40.856 41.393 -0.537 19623
3080 1 10 . 1 1 50 50 LEU H H 50 8.474 8.474 8.068 0.406 19623
3081 1 10 . 1 1 51 51 LYS N N 51 119.972 119.972 120.235 -0.263 19623
3082 1 10 . 1 1 51 51 LYS HA H 51 3.982 3.982 3.945 0.037 19623
3083 1 10 . 1 1 51 51 LYS C C 51 179.189 179.189 179.355 -0.166 19623
3084 1 10 . 1 1 51 51 LYS CA C 51 59.526 59.526 59.537 -0.011 19623
3085 1 10 . 1 1 51 51 LYS CB C 51 32.175 32.175 32.224 -0.049 19623
3086 1 10 . 1 1 51 51 LYS H H 51 8.197 8.197 8.248 -0.051 19623
3087 1 10 . 1 1 52 52 ALA N N 52 121.059 121.059 121.456 -0.397 19623
3088 1 10 . 1 1 52 52 ALA HA H 52 4.158 4.158 4.041 0.117 19623
3089 1 10 . 1 1 52 52 ALA C C 52 178.015 178.015 178.854 -0.839 19623
3090 1 10 . 1 1 52 52 ALA CA C 52 53.662 53.662 54.367 -0.705 19623
3091 1 10 . 1 1 52 52 ALA CB C 52 17.903 17.903 18.421 -0.518 19623
3092 1 10 . 1 1 52 52 ALA H H 52 7.809 7.809 7.897 -0.088 19623
3093 1 10 . 1 1 53 53 HIS N N 53 115.943 115.943 114.003 1.940 19623
3094 1 10 . 1 1 53 53 HIS HA H 53 4.373 4.373 4.607 -0.234 19623
3095 1 10 . 1 1 53 53 HIS C C 53 174.015 174.015 174.817 -0.802 19623
3096 1 10 . 1 1 53 53 HIS CA C 53 57.409 57.409 56.454 0.955 19623
3097 1 10 . 1 1 53 53 HIS CB C 53 29.010 29.010 30.330 -1.320 19623
3098 1 10 . 1 1 53 53 HIS H H 53 7.598 7.598 7.476 0.122 19623
3099 1 10 . 1 1 54 54 ASP N N 54 119.133 119.133 117.459 1.674 19623
3100 1 10 . 1 1 54 54 ASP HA H 54 4.442 4.442 4.321 0.121 19623
3101 1 10 . 1 1 54 54 ASP C C 54 175.609 175.609 176.058 -0.449 19623
3102 1 10 . 1 1 54 54 ASP CA C 54 54.971 54.971 55.730 -0.759 19623
3103 1 10 . 1 1 54 54 ASP CB C 54 40.209 40.209 39.346 0.863 19623
3104 1 10 . 1 1 54 54 ASP H H 54 7.974 7.974 7.912 0.062 19623
3105 1 10 . 1 1 55 55 ARG N N 55 118.206 118.206 116.581 1.625 19623
3106 1 10 . 1 1 55 55 ARG HA H 55 4.324 4.324 4.569 -0.245 19623
3107 1 10 . 1 1 55 55 ARG C C 55 174.671 174.671 175.251 -0.580 19623
3108 1 10 . 1 1 55 55 ARG CA C 55 54.785 54.785 54.477 0.308 19623
3109 1 10 . 1 1 55 55 ARG CB C 55 30.507 30.507 30.756 -0.249 19623
3110 1 10 . 1 1 55 55 ARG H H 55 7.943 7.943 8.194 -0.251 19623
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 54 2.096 0.375 2.082 19623
2 1 1 "Average Difference" HA 56 0.328 -0.058 0.325 19623
3 1 1 "Average Difference" C 54 0.883 0.091 0.886 19623
4 1 1 "Average Difference" CA 54 0.797 -0.184 0.783 19623
5 1 1 "Average Difference" CB 49 0.811 0.042 0.819 19623
6 1 1 "Average Difference" HN 54 0.382 -0.045 0.383 19623
7 1 2 "Average Difference" N 54 2.038 0.247 2.042 19623
8 1 2 "Average Difference" HA 56 0.343 -0.084 0.336 19623
9 1 2 "Average Difference" C 54 0.855 -0.098 0.857 19623
10 1 2 "Average Difference" CA 54 0.834 -0.333 0.772 19623
11 1 2 "Average Difference" CB 49 0.884 0.055 0.891 19623
12 1 2 "Average Difference" HN 54 0.476 -0.036 0.479 19623
13 1 3 "Average Difference" N 54 1.776 0.616 1.682 19623
14 1 3 "Average Difference" HA 56 0.352 -0.052 0.351 19623
15 1 3 "Average Difference" C 54 0.955 0.058 0.963 19623
16 1 3 "Average Difference" CA 54 0.753 -0.165 0.742 19623
17 1 3 "Average Difference" CB 49 0.893 0.121 0.894 19623
18 1 3 "Average Difference" HN 54 0.377 0.026 0.379 19623
19 1 4 "Average Difference" N 54 2.080 0.592 2.012 19623
20 1 4 "Average Difference" HA 56 0.367 -0.049 0.367 19623
21 1 4 "Average Difference" C 54 0.826 0.043 0.832 19623
22 1 4 "Average Difference" CA 54 0.631 -0.166 0.614 19623
23 1 4 "Average Difference" CB 49 0.838 0.135 0.835 19623
24 1 4 "Average Difference" HN 54 0.395 0.067 0.393 19623
25 1 5 "Average Difference" N 54 2.126 0.558 2.070 19623
26 1 5 "Average Difference" HA 56 0.329 -0.032 0.330 19623
27 1 5 "Average Difference" C 54 0.832 0.121 0.831 19623
28 1 5 "Average Difference" CA 54 0.770 -0.245 0.736 19623
29 1 5 "Average Difference" CB 49 0.928 0.097 0.933 19623
30 1 5 "Average Difference" HN 54 0.436 0.024 0.439 19623
31 1 6 "Average Difference" N 54 2.092 0.639 2.010 19623
32 1 6 "Average Difference" HA 56 0.363 -0.071 0.359 19623
33 1 6 "Average Difference" C 54 0.797 0.040 0.804 19623
34 1 6 "Average Difference" CA 54 0.717 -0.227 0.686 19623
35 1 6 "Average Difference" CB 49 0.863 0.097 0.867 19623
36 1 6 "Average Difference" HN 54 0.455 0.001 0.459 19623
37 1 7 "Average Difference" N 54 1.816 0.520 1.757 19623
38 1 7 "Average Difference" HA 56 0.358 -0.056 0.357 19623
39 1 7 "Average Difference" C 54 0.947 0.023 0.956 19623
40 1 7 "Average Difference" CA 54 0.777 -0.208 0.755 19623
41 1 7 "Average Difference" CB 49 0.926 0.087 0.931 19623
42 1 7 "Average Difference" HN 54 0.409 -0.006 0.413 19623
43 1 8 "Average Difference" N 54 1.920 0.647 1.825 19623
44 1 8 "Average Difference" HA 56 0.373 -0.047 0.373 19623
45 1 8 "Average Difference" C 54 0.804 0.010 0.812 19623
46 1 8 "Average Difference" CA 54 0.696 -0.318 0.625 19623
47 1 8 "Average Difference" CB 49 0.823 0.093 0.827 19623
48 1 8 "Average Difference" HN 54 0.463 0.003 0.468 19623
49 1 9 "Average Difference" N 54 1.823 0.303 1.815 19623
50 1 9 "Average Difference" HA 56 0.368 -0.025 0.371 19623
51 1 9 "Average Difference" C 54 0.904 0.118 0.905 19623
52 1 9 "Average Difference" CA 54 0.706 -0.223 0.676 19623
53 1 9 "Average Difference" CB 49 0.766 0.095 0.768 19623
54 1 9 "Average Difference" HN 54 0.404 0.014 0.408 19623
55 1 10 "Average Difference" N 54 1.997 0.641 1.909 19623
56 1 10 "Average Difference" HA 56 0.353 -0.010 0.356 19623
57 1 10 "Average Difference" C 54 0.853 0.094 0.856 19623
58 1 10 "Average Difference" CA 54 0.631 -0.264 0.579 19623
59 1 10 "Average Difference" CB 49 0.745 0.117 0.744 19623
60 1 10 "Average Difference" HN 54 0.436 0.034 0.438 19623
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 19623
_Entity_delta_chem_shifts.ID 2
_Entity_delta_chem_shifts.Details
;
This saveframe contains the averaged SPARTA chemical shift over all the models used.
;
loop_
_Delta_CS.Atom_chem_shift_ID
_Delta_CS.Entity_delta_chem_shifts_ID
_Delta_CS.Assembly_atom_ID
_Delta_CS.Entity_assembly_ID
_Delta_CS.Entity_ID
_Delta_CS.Comp_index_ID
_Delta_CS.Seq_ID
_Delta_CS.Comp_ID
_Delta_CS.Atom_ID
_Delta_CS.Atom_type
_Delta_CS.Auth_seq_ID
_Delta_CS.Original_CS_value
_Delta_CS.Corrected_CS_value
_Delta_CS.Sparta_CS_value
_Delta_CS.Delta_CS_value
_Delta_CS.Entry_ID
1 1 . 1 1 2 2 GLY N N 2 113.169 113.169 109.433 3.736 19623
2 1 . 1 1 2 2 GLY C C 2 173.996 173.996 173.851 0.145 19623
3 1 . 1 1 2 2 GLY CA C 2 45.211 45.211 45.010 0.201 19623
4 1 . 1 1 2 2 GLY H H 2 8.533 8.533 8.359 0.174 19623
5 1 . 1 1 3 3 ASP N N 3 120.717 120.717 120.556 0.161 19623
6 1 . 1 1 3 3 ASP HA H 3 4.559 4.559 4.589 -0.030 19623
7 1 . 1 1 3 3 ASP C C 3 176.675 176.675 176.365 0.310 19623
8 1 . 1 1 3 3 ASP CA C 3 54.489 54.489 53.810 0.678 19623
9 1 . 1 1 3 3 ASP CB C 3 41.197 41.197 41.469 -0.272 19623
10 1 . 1 1 3 3 ASP H H 3 8.412 8.412 8.196 0.216 19623
11 1 . 1 1 4 4 LYS N N 4 121.955 121.955 122.282 -0.327 19623
12 1 . 1 1 4 4 LYS HA H 4 4.246 4.246 4.137 0.109 19623
13 1 . 1 1 4 4 LYS C C 4 177.301 177.301 177.287 0.014 19623
14 1 . 1 1 4 4 LYS CA C 4 56.606 56.606 57.040 -0.434 19623
15 1 . 1 1 4 4 LYS CB C 4 32.436 32.436 32.636 -0.200 19623
16 1 . 1 1 4 4 LYS H H 4 8.490 8.490 8.328 0.162 19623
17 1 . 1 1 5 5 GLY N N 5 109.376 109.376 110.379 -1.002 19623
18 1 . 1 1 5 5 GLY C C 5 174.045 174.045 174.305 -0.260 19623
19 1 . 1 1 5 5 GLY CA C 5 45.305 45.305 44.893 0.412 19623
20 1 . 1 1 5 5 GLY H H 5 8.491 8.491 8.444 0.047 19623
21 1 . 1 1 6 6 TYR N N 6 120.416 120.416 120.424 -0.009 19623
22 1 . 1 1 6 6 TYR HA H 6 4.510 4.510 4.463 0.047 19623
23 1 . 1 1 6 6 TYR C C 6 175.952 175.952 175.841 0.111 19623
24 1 . 1 1 6 6 TYR CA C 6 58.383 58.383 57.324 1.059 19623
25 1 . 1 1 6 6 TYR CB C 6 38.562 38.562 38.803 -0.241 19623
26 1 . 1 1 6 6 TYR H H 6 8.134 8.134 8.104 0.030 19623
27 1 . 1 1 7 7 ASN N N 7 122.415 122.415 122.434 -0.020 19623
28 1 . 1 1 7 7 ASN HA H 7 4.588 4.588 4.705 -0.117 19623
29 1 . 1 1 7 7 ASN C C 7 175.521 175.521 176.355 -0.834 19623
30 1 . 1 1 7 7 ASN CA C 7 53.408 53.408 53.861 -0.454 19623
31 1 . 1 1 7 7 ASN CB C 7 38.780 38.780 38.931 -0.151 19623
32 1 . 1 1 7 7 ASN H H 7 8.557 8.557 8.686 -0.129 19623
33 1 . 1 1 8 8 GLY N N 8 109.431 109.431 109.555 -0.124 19623
34 1 . 1 1 8 8 GLY C C 8 175.609 175.609 175.570 0.039 19623
35 1 . 1 1 8 8 GLY CA C 8 45.990 45.990 45.540 0.450 19623
36 1 . 1 1 8 8 GLY H H 8 8.285 8.285 8.552 -0.267 19623
37 1 . 1 1 9 9 LEU N N 9 123.596 123.596 123.362 0.234 19623
38 1 . 1 1 9 9 LEU HA H 9 3.933 3.933 4.116 -0.183 19623
39 1 . 1 1 9 9 LEU C C 9 177.458 177.458 178.158 -0.700 19623
40 1 . 1 1 9 9 LEU CA C 9 58.248 58.248 57.793 0.455 19623
41 1 . 1 1 9 9 LEU CB C 9 41.690 41.690 41.697 -0.007 19623
42 1 . 1 1 9 9 LEU H H 9 8.136 8.136 8.035 0.101 19623
43 1 . 1 1 10 10 ALA N N 10 121.310 121.310 120.890 0.420 19623
44 1 . 1 1 10 10 ALA HA H 10 3.933 3.933 3.975 -0.042 19623
45 1 . 1 1 10 10 ALA C C 10 181.140 181.140 179.621 1.519 19623
46 1 . 1 1 10 10 ALA CA C 10 55.505 55.505 55.175 0.330 19623
47 1 . 1 1 10 10 ALA CB C 10 17.791 17.791 17.848 -0.057 19623
48 1 . 1 1 10 10 ALA H H 10 8.361 8.361 8.383 -0.022 19623
49 1 . 1 1 11 11 GLU N N 11 118.893 118.893 119.258 -0.365 19623
50 1 . 1 1 11 11 GLU HA H 11 3.992 3.992 3.977 0.015 19623
51 1 . 1 1 11 11 GLU C C 11 178.797 178.797 178.911 -0.114 19623
52 1 . 1 1 11 11 GLU CA C 11 59.892 59.892 59.251 0.641 19623
53 1 . 1 1 11 11 GLU CB C 11 28.991 28.991 29.427 -0.436 19623
54 1 . 1 1 11 11 GLU H H 11 8.490 8.490 8.365 0.125 19623
55 1 . 1 1 12 12 ALA N N 12 122.362 122.362 122.417 -0.055 19623
56 1 . 1 1 12 12 ALA HA H 12 4.080 4.080 4.066 0.014 19623
57 1 . 1 1 12 12 ALA C C 12 181.228 181.228 179.603 1.624 19623
58 1 . 1 1 12 12 ALA CA C 12 55.218 55.218 55.263 -0.045 19623
59 1 . 1 1 12 12 ALA CB C 12 18.462 18.462 18.347 0.115 19623
60 1 . 1 1 12 12 ALA H H 12 8.099 8.099 8.136 -0.037 19623
61 1 . 1 1 13 13 LYS N N 13 118.689 118.689 118.653 0.036 19623
62 1 . 1 1 13 13 LYS HA H 13 3.620 3.620 3.974 -0.354 19623
63 1 . 1 1 13 13 LYS C C 13 177.203 177.203 178.878 -1.675 19623
64 1 . 1 1 13 13 LYS CA C 13 60.390 60.390 59.965 0.425 19623
65 1 . 1 1 13 13 LYS CB C 13 33.624 33.624 32.359 1.265 19623
66 1 . 1 1 13 13 LYS H H 13 8.382 8.382 8.246 0.136 19623
67 1 . 1 1 14 14 GLU N N 14 117.865 117.865 119.863 -1.998 19623
68 1 . 1 1 14 14 GLU HA H 14 4.285 4.285 4.049 0.236 19623
69 1 . 1 1 14 14 GLU C C 14 179.404 179.404 178.976 0.428 19623
70 1 . 1 1 14 14 GLU CA C 14 60.007 60.007 59.541 0.466 19623
71 1 . 1 1 14 14 GLU CB C 14 29.418 29.418 29.479 -0.061 19623
72 1 . 1 1 14 14 GLU H H 14 7.952 7.952 8.104 -0.152 19623
73 1 . 1 1 15 15 LYS N N 15 119.020 119.020 119.227 -0.207 19623
74 1 . 1 1 15 15 LYS HA H 15 3.933 3.933 4.112 -0.179 19623
75 1 . 1 1 15 15 LYS C C 15 177.976 177.976 178.825 -0.849 19623
76 1 . 1 1 15 15 LYS CA C 15 59.591 59.591 59.266 0.325 19623
77 1 . 1 1 15 15 LYS CB C 15 32.275 32.275 32.402 -0.128 19623
78 1 . 1 1 15 15 LYS H H 15 8.029 8.029 7.959 0.070 19623
79 1 . 1 1 16 16 ALA N N 16 120.410 120.410 122.614 -2.204 19623
80 1 . 1 1 16 16 ALA HA H 16 3.962 3.962 4.155 -0.193 19623
81 1 . 1 1 16 16 ALA C C 16 179.140 179.140 179.697 -0.557 19623
82 1 . 1 1 16 16 ALA CA C 16 55.426 55.426 55.091 0.335 19623
83 1 . 1 1 16 16 ALA CB C 16 18.410 18.410 18.528 -0.118 19623
84 1 . 1 1 16 16 ALA H H 16 7.904 7.904 7.993 -0.089 19623
85 1 . 1 1 17 17 ILE N N 17 117.363 117.363 117.532 -0.169 19623
86 1 . 1 1 17 17 ILE HA H 17 5.850 5.850 3.697 2.153 19623
87 1 . 1 1 17 17 ILE C C 17 177.604 177.604 177.766 -0.162 19623
88 1 . 1 1 17 17 ILE CA C 17 66.545 66.545 64.790 1.755 19623
89 1 . 1 1 17 17 ILE CB C 17 37.843 37.843 37.732 0.111 19623
90 1 . 1 1 17 17 ILE H H 17 8.500 8.500 8.129 0.371 19623
91 1 . 1 1 18 18 LYS N N 18 119.838 119.838 121.130 -1.292 19623
92 1 . 1 1 18 18 LYS HA H 18 3.865 3.865 3.864 0.001 19623
93 1 . 1 1 18 18 LYS C C 18 176.653 176.653 178.761 -2.108 19623
94 1 . 1 1 18 18 LYS CA C 18 60.189 60.189 60.282 -0.093 19623
95 1 . 1 1 18 18 LYS CB C 18 32.260 32.260 32.152 0.108 19623
96 1 . 1 1 18 18 LYS H H 18 7.833 7.833 8.094 -0.261 19623
97 1 . 1 1 19 19 ASP N N 19 120.497 120.497 120.001 0.496 19623
98 1 . 1 1 19 19 ASP HA H 19 4.569 4.569 4.298 0.272 19623
99 1 . 1 1 19 19 ASP C C 19 179.120 179.120 178.862 0.258 19623
100 1 . 1 1 19 19 ASP CA C 19 57.108 57.108 57.085 0.023 19623
101 1 . 1 1 19 19 ASP CB C 19 40.853 40.853 40.471 0.382 19623
102 1 . 1 1 19 19 ASP H H 19 8.479 8.479 7.900 0.579 19623
103 1 . 1 1 20 20 LEU N N 20 121.660 121.660 120.278 1.382 19623
104 1 . 1 1 20 20 LEU HA H 20 4.148 4.148 4.057 0.091 19623
105 1 . 1 1 20 20 LEU C C 20 178.377 178.377 178.950 -0.573 19623
106 1 . 1 1 20 20 LEU CA C 20 58.225 58.225 58.261 -0.037 19623
107 1 . 1 1 20 20 LEU CB C 20 41.585 41.585 41.709 -0.124 19623
108 1 . 1 1 20 20 LEU H H 20 8.136 8.136 7.985 0.151 19623
109 1 . 1 1 21 21 LYS N N 21 120.182 120.182 119.213 0.969 19623
110 1 . 1 1 21 21 LYS HA H 21 3.904 3.904 4.082 -0.178 19623
111 1 . 1 1 21 21 LYS C C 21 179.785 179.785 179.432 0.353 19623
112 1 . 1 1 21 21 LYS CA C 21 59.557 59.557 59.248 0.309 19623
113 1 . 1 1 21 21 LYS CB C 21 29.655 29.655 32.372 -2.717 19623
114 1 . 1 1 21 21 LYS H H 21 8.043 8.043 8.081 -0.038 19623
115 1 . 1 1 22 22 ILE N N 22 121.523 121.523 119.557 1.966 19623
116 1 . 1 1 22 22 ILE HA H 22 3.522 3.522 3.699 -0.177 19623
117 1 . 1 1 22 22 ILE C C 22 177.399 177.399 177.600 -0.201 19623
118 1 . 1 1 22 22 ILE CA C 22 64.863 64.863 64.264 0.599 19623
119 1 . 1 1 22 22 ILE CB C 22 38.046 38.046 37.887 0.159 19623
120 1 . 1 1 22 22 ILE H H 22 8.735 8.735 7.641 1.094 19623
121 1 . 1 1 23 23 TYR N N 23 117.506 117.506 117.288 0.218 19623
122 1 . 1 1 23 23 TYR HA H 23 4.481 4.481 4.434 0.047 19623
123 1 . 1 1 23 23 TYR C C 23 176.020 176.020 176.369 -0.349 19623
124 1 . 1 1 23 23 TYR CA C 23 58.369 58.369 58.649 -0.280 19623
125 1 . 1 1 23 23 TYR CB C 23 38.499 38.499 38.402 0.097 19623
126 1 . 1 1 23 23 TYR H H 23 7.291 7.291 7.699 -0.408 19623
127 1 . 1 1 24 24 GLY N N 24 108.209 108.209 106.779 1.430 19623
128 1 . 1 1 24 24 GLY C C 24 174.651 174.651 174.570 0.081 19623
129 1 . 1 1 24 24 GLY CA C 24 46.409 46.409 44.978 1.431 19623
130 1 . 1 1 24 24 GLY H H 24 7.910 7.910 7.580 0.330 19623
131 1 . 1 1 25 25 ILE N N 25 119.897 119.897 121.698 -1.801 19623
132 1 . 1 1 25 25 ILE HA H 25 3.747 3.747 4.061 -0.314 19623
133 1 . 1 1 25 25 ILE C C 25 175.864 175.864 176.382 -0.518 19623
134 1 . 1 1 25 25 ILE CA C 25 60.984 60.984 60.828 0.156 19623
135 1 . 1 1 25 25 ILE CB C 25 37.120 37.120 38.522 -1.402 19623
136 1 . 1 1 25 25 ILE H H 25 7.383 7.383 8.021 -0.638 19623
137 1 . 1 1 26 26 GLY N N 26 111.580 111.580 114.679 -3.099 19623
138 1 . 1 1 26 26 GLY C C 26 174.847 174.847 175.172 -0.325 19623
139 1 . 1 1 26 26 GLY CA C 26 45.322 45.322 44.505 0.817 19623
140 1 . 1 1 26 26 GLY H H 26 8.811 8.811 8.354 0.457 19623
141 1 . 1 1 27 27 GLU N N 27 120.229 120.229 120.598 -0.369 19623
142 1 . 1 1 27 27 GLU C C 27 177.311 177.311 178.560 -1.249 19623
143 1 . 1 1 27 27 GLU CA C 27 59.730 59.730 59.431 0.299 19623
144 1 . 1 1 27 27 GLU CB C 27 29.933 29.933 29.718 0.215 19623
145 1 . 1 1 27 27 GLU H H 27 8.711 8.711 8.963 -0.252 19623
146 1 . 1 1 28 28 HIS N N 28 117.558 117.558 118.568 -1.010 19623
147 1 . 1 1 28 28 HIS C C 28 176.949 176.949 176.583 0.366 19623
148 1 . 1 1 28 28 HIS CA C 28 59.674 59.674 59.368 0.306 19623
149 1 . 1 1 28 28 HIS CB C 28 29.838 29.838 29.403 0.435 19623
150 1 . 1 1 28 28 HIS H H 28 8.870 8.870 8.576 0.294 19623
151 1 . 1 1 29 29 TYR N N 29 115.589 115.589 115.748 -0.159 19623
152 1 . 1 1 29 29 TYR HA H 29 4.090 4.090 4.387 -0.297 19623
153 1 . 1 1 29 29 TYR C C 29 177.552 177.552 177.651 -0.099 19623
154 1 . 1 1 29 29 TYR CA C 29 60.998 60.998 60.524 0.474 19623
155 1 . 1 1 29 29 TYR CB C 29 38.683 38.683 38.983 -0.300 19623
156 1 . 1 1 29 29 TYR H H 29 7.227 7.227 7.637 -0.410 19623
157 1 . 1 1 30 30 ILE N N 30 120.353 120.353 121.121 -0.768 19623
158 1 . 1 1 30 30 ILE HA H 30 3.444 3.444 3.587 -0.143 19623
159 1 . 1 1 30 30 ILE C C 30 178.211 178.211 177.682 0.529 19623
160 1 . 1 1 30 30 ILE CA C 30 65.640 65.640 65.327 0.313 19623
161 1 . 1 1 30 30 ILE CB C 30 37.553 37.553 37.597 -0.043 19623
162 1 . 1 1 30 30 ILE H H 30 7.485 7.485 7.824 -0.339 19623
163 1 . 1 1 31 31 LYS N N 31 117.249 117.249 119.296 -2.047 19623
164 1 . 1 1 31 31 LYS HA H 31 4.011 4.011 4.144 -0.133 19623
165 1 . 1 1 31 31 LYS C C 31 178.954 178.954 178.846 0.108 19623
166 1 . 1 1 31 31 LYS CA C 31 58.893 58.893 59.135 -0.242 19623
167 1 . 1 1 31 31 LYS CB C 31 31.673 31.673 32.134 -0.461 19623
168 1 . 1 1 31 31 LYS H H 31 8.064 8.064 8.121 -0.057 19623
169 1 . 1 1 32 32 LEU N N 32 117.176 117.176 119.733 -2.557 19623
170 1 . 1 1 32 32 LEU HA H 32 3.894 3.894 3.956 -0.062 19623
171 1 . 1 1 32 32 LEU C C 32 179.883 179.883 178.529 1.354 19623
172 1 . 1 1 32 32 LEU CA C 32 57.987 57.987 57.569 0.418 19623
173 1 . 1 1 32 32 LEU CB C 32 41.255 41.255 41.681 -0.426 19623
174 1 . 1 1 32 32 LEU H H 32 7.154 7.154 7.344 -0.190 19623
175 1 . 1 1 33 33 ILE N N 33 118.598 118.598 117.194 1.404 19623
176 1 . 1 1 33 33 ILE HA H 33 3.571 3.571 3.758 -0.187 19623
177 1 . 1 1 33 33 ILE C C 33 177.917 177.917 178.593 -0.675 19623
178 1 . 1 1 33 33 ILE CA C 33 63.579 63.579 63.423 0.156 19623
179 1 . 1 1 33 33 ILE CB C 33 35.702 35.702 37.495 -1.793 19623
180 1 . 1 1 33 33 ILE H H 33 7.412 7.412 7.512 -0.100 19623
181 1 . 1 1 34 34 GLU N N 34 116.574 116.574 120.086 -3.512 19623
182 1 . 1 1 34 34 GLU HA H 34 3.826 3.826 4.026 -0.200 19623
183 1 . 1 1 34 34 GLU C C 34 178.661 178.661 178.487 0.174 19623
184 1 . 1 1 34 34 GLU CA C 34 59.689 59.689 59.618 0.071 19623
185 1 . 1 1 34 34 GLU CB C 34 29.855 29.855 29.309 0.546 19623
186 1 . 1 1 34 34 GLU H H 34 7.987 7.987 7.907 0.080 19623
187 1 . 1 1 35 35 LYS N N 35 114.863 114.863 117.724 -2.861 19623
188 1 . 1 1 35 35 LYS HA H 35 4.207 4.207 4.299 -0.092 19623
189 1 . 1 1 35 35 LYS C C 35 176.861 176.861 175.871 0.990 19623
190 1 . 1 1 35 35 LYS CA C 35 56.328 56.328 55.452 0.876 19623
191 1 . 1 1 35 35 LYS CB C 35 33.007 33.007 32.685 0.322 19623
192 1 . 1 1 35 35 LYS H H 35 7.361 7.361 7.643 -0.282 19623
193 1 . 1 1 36 36 ALA N N 36 124.407 124.407 124.366 0.041 19623
194 1 . 1 1 36 36 ALA HA H 36 4.129 4.129 4.258 -0.129 19623
195 1 . 1 1 36 36 ALA C C 36 178.279 178.279 177.313 0.966 19623
196 1 . 1 1 36 36 ALA CA C 36 53.257 53.257 52.869 0.388 19623
197 1 . 1 1 36 36 ALA CB C 36 19.581 19.581 19.735 -0.153 19623
198 1 . 1 1 36 36 ALA H H 36 7.365 7.365 7.446 -0.081 19623
199 1 . 1 1 37 37 LYS N N 37 116.217 116.217 119.512 -3.295 19623
200 1 . 1 1 37 37 LYS HA H 37 4.383 4.383 4.320 0.063 19623
201 1 . 1 1 37 37 LYS C C 37 176.167 176.167 176.070 0.097 19623
202 1 . 1 1 37 37 LYS CA C 37 56.602 56.602 56.991 -0.389 19623
203 1 . 1 1 37 37 LYS CB C 37 34.883 34.883 33.237 1.646 19623
204 1 . 1 1 37 37 LYS H H 37 8.908 8.908 8.652 0.256 19623
205 1 . 1 1 38 38 GLN N N 38 113.293 113.293 116.436 -3.143 19623
206 1 . 1 1 38 38 GLN HA H 38 4.813 4.813 4.553 0.260 19623
207 1 . 1 1 38 38 GLN C C 38 176.138 176.138 175.925 0.213 19623
208 1 . 1 1 38 38 GLN CA C 38 54.117 54.117 54.411 -0.294 19623
209 1 . 1 1 38 38 GLN CB C 38 32.222 32.222 31.727 0.494 19623
210 1 . 1 1 38 38 GLN H H 38 7.033 7.033 7.655 -0.622 19623
211 1 . 1 1 39 39 VAL N N 39 125.474 125.474 122.671 2.803 19623
212 1 . 1 1 39 39 VAL C C 39 177.751 177.751 177.491 0.260 19623
213 1 . 1 1 39 39 VAL CA C 39 67.737 67.737 66.278 1.459 19623
214 1 . 1 1 39 39 VAL CB C 39 31.438 31.438 31.706 -0.268 19623
215 1 . 1 1 39 39 VAL H H 39 9.250 9.250 8.864 0.386 19623
216 1 . 1 1 40 40 ALA N N 40 120.717 120.717 122.468 -1.751 19623
217 1 . 1 1 40 40 ALA HA H 40 4.041 4.041 4.090 -0.049 19623
218 1 . 1 1 40 40 ALA C C 40 179.081 179.081 179.291 -0.209 19623
219 1 . 1 1 40 40 ALA CA C 40 55.059 55.059 55.171 -0.112 19623
220 1 . 1 1 40 40 ALA CB C 40 17.735 17.735 17.911 -0.176 19623
221 1 . 1 1 40 40 ALA H H 40 8.903 8.903 8.393 0.510 19623
222 1 . 1 1 41 41 ALA N N 41 116.698 116.698 121.199 -4.501 19623
223 1 . 1 1 41 41 ALA HA H 41 4.236 4.236 4.052 0.184 19623
224 1 . 1 1 41 41 ALA C C 41 180.294 180.294 179.827 0.467 19623
225 1 . 1 1 41 41 ALA CA C 41 54.688 54.688 54.642 0.046 19623
226 1 . 1 1 41 41 ALA CB C 41 18.724 18.724 18.206 0.518 19623
227 1 . 1 1 41 41 ALA H H 41 6.701 6.701 7.860 -1.159 19623
228 1 . 1 1 42 42 VAL N N 42 119.051 119.051 118.973 0.078 19623
229 1 . 1 1 42 42 VAL HA H 42 3.278 3.278 3.480 -0.202 19623
230 1 . 1 1 42 42 VAL C C 42 176.812 176.812 178.337 -1.525 19623
231 1 . 1 1 42 42 VAL CA C 42 67.641 67.641 67.090 0.551 19623
232 1 . 1 1 42 42 VAL CB C 42 31.399 31.399 31.645 -0.246 19623
233 1 . 1 1 42 42 VAL H H 42 7.552 7.552 8.095 -0.544 19623
234 1 . 1 1 43 43 GLU N N 43 117.715 117.715 119.591 -1.876 19623
235 1 . 1 1 43 43 GLU HA H 43 3.855 3.855 4.015 -0.160 19623
236 1 . 1 1 43 43 GLU C C 43 178.973 178.973 178.936 0.037 19623
237 1 . 1 1 43 43 GLU CA C 43 59.393 59.393 59.847 -0.454 19623
238 1 . 1 1 43 43 GLU CB C 43 28.811 28.811 29.462 -0.651 19623
239 1 . 1 1 43 43 GLU H H 43 7.804 7.804 8.110 -0.306 19623
240 1 . 1 1 44 44 ASP N N 44 119.175 119.175 120.535 -1.360 19623
241 1 . 1 1 44 44 ASP HA H 44 4.363 4.363 4.464 -0.101 19623
242 1 . 1 1 44 44 ASP C C 44 178.211 178.211 178.876 -0.665 19623
243 1 . 1 1 44 44 ASP CA C 44 57.308 57.308 57.149 0.159 19623
244 1 . 1 1 44 44 ASP CB C 44 40.504 40.504 40.596 -0.091 19623
245 1 . 1 1 44 44 ASP H H 44 8.169 8.169 8.197 -0.028 19623
246 1 . 1 1 45 45 LEU N N 45 117.848 117.848 120.416 -2.568 19623
247 1 . 1 1 45 45 LEU HA H 45 4.119 4.119 3.986 0.133 19623
248 1 . 1 1 45 45 LEU C C 45 178.416 178.416 178.686 -0.270 19623
249 1 . 1 1 45 45 LEU CA C 45 57.294 57.294 57.794 -0.500 19623
250 1 . 1 1 45 45 LEU CB C 45 40.474 40.474 41.855 -1.381 19623
251 1 . 1 1 45 45 LEU H H 45 8.119 8.119 8.404 -0.285 19623
252 1 . 1 1 46 46 LYS N N 46 119.462 119.462 119.886 -0.424 19623
253 1 . 1 1 46 46 LYS HA H 46 3.972 3.972 3.872 0.100 19623
254 1 . 1 1 46 46 LYS C C 46 177.653 177.653 178.678 -1.025 19623
255 1 . 1 1 46 46 LYS CA C 46 60.276 60.276 60.101 0.175 19623
256 1 . 1 1 46 46 LYS CB C 46 31.450 31.450 32.098 -0.649 19623
257 1 . 1 1 46 46 LYS H H 46 8.483 8.483 8.110 0.373 19623
258 1 . 1 1 47 47 ASP N N 47 117.470 117.470 119.424 -1.954 19623
259 1 . 1 1 47 47 ASP HA H 47 4.344 4.344 4.485 -0.141 19623
260 1 . 1 1 47 47 ASP C C 47 179.384 179.384 178.868 0.516 19623
261 1 . 1 1 47 47 ASP CA C 47 57.687 57.687 57.353 0.334 19623
262 1 . 1 1 47 47 ASP CB C 47 40.809 40.809 40.305 0.504 19623
263 1 . 1 1 47 47 ASP H H 47 7.846 7.846 7.995 -0.149 19623
264 1 . 1 1 48 48 GLU N N 48 119.662 119.662 120.034 -0.372 19623
265 1 . 1 1 48 48 GLU HA H 48 4.011 4.011 4.069 -0.057 19623
266 1 . 1 1 48 48 GLU C C 48 180.724 180.724 179.339 1.385 19623
267 1 . 1 1 48 48 GLU CA C 48 60.091 60.091 58.833 1.258 19623
268 1 . 1 1 48 48 GLU CB C 48 31.991 31.991 29.504 2.487 19623
269 1 . 1 1 48 48 GLU H H 48 8.327 8.327 7.850 0.477 19623
270 1 . 1 1 49 49 ILE N N 49 120.308 120.308 120.704 -0.396 19623
271 1 . 1 1 49 49 ILE HA H 49 3.738 3.738 3.647 0.091 19623
272 1 . 1 1 49 49 ILE C C 49 179.238 179.238 178.034 1.204 19623
273 1 . 1 1 49 49 ILE CA C 49 64.592 64.592 65.325 -0.733 19623
274 1 . 1 1 49 49 ILE CB C 49 37.959 37.959 37.990 -0.031 19623
275 1 . 1 1 49 49 ILE H H 49 7.667 7.667 8.474 -0.807 19623
276 1 . 1 1 50 50 LEU N N 50 121.274 121.274 120.195 1.079 19623
277 1 . 1 1 50 50 LEU HA H 50 4.559 4.559 3.915 0.645 19623
278 1 . 1 1 50 50 LEU C C 50 179.971 179.971 178.673 1.298 19623
279 1 . 1 1 50 50 LEU CA C 50 57.794 57.794 57.832 -0.038 19623
280 1 . 1 1 50 50 LEU CB C 50 40.856 40.856 41.382 -0.526 19623
281 1 . 1 1 50 50 LEU H H 50 8.474 8.474 7.956 0.518 19623
282 1 . 1 1 51 51 LYS N N 51 119.972 119.972 119.439 0.533 19623
283 1 . 1 1 51 51 LYS HA H 51 3.982 3.982 3.923 0.059 19623
284 1 . 1 1 51 51 LYS C C 51 179.189 179.189 179.194 -0.005 19623
285 1 . 1 1 51 51 LYS CA C 51 59.526 59.526 59.520 0.006 19623
286 1 . 1 1 51 51 LYS CB C 51 32.175 32.175 32.074 0.101 19623
287 1 . 1 1 51 51 LYS H H 51 8.197 8.197 8.133 0.064 19623
288 1 . 1 1 52 52 ALA N N 52 121.059 121.059 120.986 0.073 19623
289 1 . 1 1 52 52 ALA HA H 52 4.158 4.158 4.047 0.111 19623
290 1 . 1 1 52 52 ALA C C 52 178.015 178.015 178.645 -0.630 19623
291 1 . 1 1 52 52 ALA CA C 52 53.662 53.662 54.376 -0.714 19623
292 1 . 1 1 52 52 ALA CB C 52 17.903 17.903 18.357 -0.454 19623
293 1 . 1 1 52 52 ALA H H 52 7.809 7.809 7.708 0.101 19623
294 1 . 1 1 53 53 HIS N N 53 115.943 115.943 115.206 0.737 19623
295 1 . 1 1 53 53 HIS HA H 53 4.373 4.373 4.407 -0.034 19623
296 1 . 1 1 53 53 HIS C C 53 174.015 174.015 175.062 -1.047 19623
297 1 . 1 1 53 53 HIS CA C 53 57.409 57.409 57.106 0.303 19623
298 1 . 1 1 53 53 HIS CB C 53 29.010 29.010 30.136 -1.126 19623
299 1 . 1 1 53 53 HIS H H 53 7.598 7.598 7.626 -0.028 19623
300 1 . 1 1 54 54 ASP N N 54 119.133 119.133 117.172 1.961 19623
301 1 . 1 1 54 54 ASP HA H 54 4.442 4.442 4.319 0.123 19623
302 1 . 1 1 54 54 ASP C C 54 175.609 175.609 175.909 -0.300 19623
303 1 . 1 1 54 54 ASP CA C 54 54.971 54.971 55.583 -0.611 19623
304 1 . 1 1 54 54 ASP CB C 54 40.209 40.209 39.735 0.475 19623
305 1 . 1 1 54 54 ASP H H 54 7.974 7.974 7.921 0.053 19623
306 1 . 1 1 55 55 ARG N N 55 118.206 118.206 118.112 0.095 19623
307 1 . 1 1 55 55 ARG HA H 55 4.324 4.324 4.340 -0.016 19623
308 1 . 1 1 55 55 ARG C C 55 174.671 174.671 175.296 -0.625 19623
309 1 . 1 1 55 55 ARG CA C 55 54.785 54.785 55.217 -0.432 19623
310 1 . 1 1 55 55 ARG CB C 55 30.507 30.507 30.403 0.104 19623
311 1 . 1 1 55 55 ARG H H 55 7.943 7.943 7.865 0.077 19623
stop_
save_