data_17355
save_entry_information
_Entry.Sf_category entry_information
_Entry.NMR_STAR_version 3.0.9.13
_Entry.Entry_ID 17355
_Entry.PDB_ID 2L7G
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 17355
_Entity_delta_chem_shifts.ID 1
loop_
_Delta_CS.Atom_chem_shift_ID
_Delta_CS.Entity_delta_chem_shifts_ID
_Delta_CS.Conformer_ID
_Delta_CS.Assembly_atom_ID
_Delta_CS.Entity_assembly_ID
_Delta_CS.Entity_ID
_Delta_CS.Comp_index_ID
_Delta_CS.Seq_ID
_Delta_CS.Comp_ID
_Delta_CS.Atom_ID
_Delta_CS.Atom_type
_Delta_CS.Auth_seq_ID
_Delta_CS.Original_CS_value
_Delta_CS.Corrected_CS_value
_Delta_CS.Sparta_CS_value
_Delta_CS.Delta_CS_value
_Delta_CS.Entry_ID
1 1 1 . 1 1 3 3 ARG HA H 3 4.321 4.321 4.109 0.212 17355
2 1 1 . 1 1 3 3 ARG CA C 3 56.560 56.560 57.931 -1.371 17355
3 1 1 . 1 1 4 4 ALA N N 4 125.797 125.797 121.010 4.787 17355
4 1 1 . 1 1 4 4 ALA HA H 4 4.283 4.283 4.377 -0.094 17355
5 1 1 . 1 1 4 4 ALA CA C 4 52.900 52.900 51.959 0.941 17355
6 1 1 . 1 1 4 4 ALA CB C 4 19.411 19.411 20.042 -0.631 17355
7 1 1 . 1 1 4 4 ALA H H 4 8.563 8.563 7.674 0.889 17355
8 1 1 . 1 1 5 5 ASP N N 5 118.416 118.416 120.380 -1.964 17355
9 1 1 . 1 1 5 5 ASP HA H 5 4.584 4.584 4.477 0.107 17355
10 1 1 . 1 1 5 5 ASP CA C 5 54.337 54.337 54.373 -0.035 17355
11 1 1 . 1 1 5 5 ASP CB C 5 41.186 41.186 40.772 0.414 17355
12 1 1 . 1 1 5 5 ASP H H 5 8.208 8.208 8.313 -0.105 17355
13 1 1 . 1 1 6 6 ASP N N 6 120.632 120.632 120.808 -0.176 17355
14 1 1 . 1 1 6 6 ASP HA H 6 4.578 4.578 4.607 -0.029 17355
15 1 1 . 1 1 6 6 ASP CA C 6 54.589 54.589 53.347 1.242 17355
16 1 1 . 1 1 6 6 ASP CB C 6 41.239 41.239 41.973 -0.734 17355
17 1 1 . 1 1 6 6 ASP H H 6 8.140 8.140 8.508 -0.368 17355
18 1 1 . 1 1 7 7 THR N N 7 113.693 113.693 111.970 1.723 17355
19 1 1 . 1 1 7 7 THR HA H 7 4.245 4.245 4.336 -0.091 17355
20 1 1 . 1 1 7 7 THR CA C 7 62.392 62.392 63.854 -1.462 17355
21 1 1 . 1 1 7 7 THR CB C 7 69.721 69.721 68.825 0.896 17355
22 1 1 . 1 1 7 7 THR H H 7 8.045 8.045 8.174 -0.129 17355
23 1 1 . 1 1 8 8 ALA N N 8 126.414 126.414 124.166 2.248 17355
24 1 1 . 1 1 8 8 ALA HA H 8 4.314 4.314 4.224 0.090 17355
25 1 1 . 1 1 8 8 ALA CA C 8 52.253 52.253 52.119 0.134 17355
26 1 1 . 1 1 8 8 ALA CB C 8 19.464 19.464 19.420 0.044 17355
27 1 1 . 1 1 8 8 ALA H H 8 8.139 8.139 7.519 0.620 17355
28 1 1 . 1 1 9 9 LEU N N 9 122.921 122.921 121.124 1.797 17355
29 1 1 . 1 1 9 9 LEU HA H 9 4.559 4.559 4.754 -0.195 17355
30 1 1 . 1 1 9 9 LEU CA C 9 53.088 53.088 52.460 0.628 17355
31 1 1 . 1 1 9 9 LEU CB C 9 41.929 41.929 42.575 -0.646 17355
32 1 1 . 1 1 9 9 LEU H H 9 8.113 8.113 8.244 -0.131 17355
33 1 1 . 1 1 10 10 PRO HA H 10 4.367 4.367 4.417 -0.050 17355
34 1 1 . 1 1 10 10 PRO CA C 10 63.373 63.373 63.515 -0.142 17355
35 1 1 . 1 1 10 10 PRO CB C 10 31.975 31.975 32.087 -0.112 17355
36 1 1 . 1 1 11 11 ALA N N 11 124.349 124.349 121.022 3.327 17355
37 1 1 . 1 1 11 11 ALA HA H 11 4.262 4.262 4.443 -0.181 17355
38 1 1 . 1 1 11 11 ALA CA C 11 52.496 52.496 52.131 0.365 17355
39 1 1 . 1 1 11 11 ALA CB C 11 19.424 19.424 19.741 -0.317 17355
40 1 1 . 1 1 11 11 ALA H H 11 8.317 8.317 7.723 0.594 17355
41 1 1 . 1 1 12 12 ALA N N 12 123.291 123.291 124.774 -1.483 17355
42 1 1 . 1 1 12 12 ALA HA H 12 4.380 4.380 4.768 -0.388 17355
43 1 1 . 1 1 12 12 ALA CA C 12 52.461 52.461 51.485 0.976 17355
44 1 1 . 1 1 12 12 ALA CB C 12 19.557 19.557 20.218 -0.661 17355
45 1 1 . 1 1 12 12 ALA H H 12 8.287 8.287 8.229 0.058 17355
46 1 1 . 1 1 13 13 THR N N 13 112.758 112.758 112.316 0.442 17355
47 1 1 . 1 1 13 13 THR HA H 13 4.350 4.350 4.576 -0.226 17355
48 1 1 . 1 1 13 13 THR CA C 13 62.074 62.074 63.383 -1.309 17355
49 1 1 . 1 1 13 13 THR CB C 13 70.070 70.070 71.409 -1.339 17355
50 1 1 . 1 1 13 13 THR H H 13 8.074 8.074 8.845 -0.771 17355
51 1 1 . 1 1 14 14 GLY N N 14 110.774 110.774 108.671 2.103 17355
52 1 1 . 1 1 14 14 GLY CA C 14 45.692 45.692 45.818 -0.126 17355
53 1 1 . 1 1 14 14 GLY H H 14 8.405 8.405 7.670 0.735 17355
54 1 1 . 1 1 15 15 ALA N N 15 124.127 124.127 124.084 0.043 17355
55 1 1 . 1 1 15 15 ALA HA H 15 4.137 4.137 4.266 -0.129 17355
56 1 1 . 1 1 15 15 ALA CA C 15 55.368 55.368 54.415 0.953 17355
57 1 1 . 1 1 15 15 ALA CB C 15 20.100 20.100 19.250 0.850 17355
58 1 1 . 1 1 15 15 ALA H H 15 8.866 8.866 8.435 0.431 17355
59 1 1 . 1 1 16 16 LEU N N 16 118.013 118.013 119.723 -1.710 17355
60 1 1 . 1 1 16 16 LEU HA H 16 3.870 3.870 4.001 -0.131 17355
61 1 1 . 1 1 16 16 LEU CA C 16 58.820 58.820 57.744 1.076 17355
62 1 1 . 1 1 16 16 LEU CB C 16 41.332 41.332 41.437 -0.105 17355
63 1 1 . 1 1 16 16 LEU H H 16 8.414 8.414 8.579 -0.165 17355
64 1 1 . 1 1 17 17 GLU N N 17 117.730 117.730 115.561 2.169 17355
65 1 1 . 1 1 17 17 GLU HA H 17 3.978 3.978 4.146 -0.168 17355
66 1 1 . 1 1 17 17 GLU CA C 17 59.909 59.909 57.943 1.966 17355
67 1 1 . 1 1 17 17 GLU CB C 17 29.212 29.212 28.714 0.498 17355
68 1 1 . 1 1 17 17 GLU H H 17 8.088 8.088 8.096 -0.008 17355
69 1 1 . 1 1 18 18 LEU N N 18 121.355 121.355 121.579 -0.224 17355
70 1 1 . 1 1 18 18 LEU HA H 18 4.165 4.165 4.081 0.084 17355
71 1 1 . 1 1 18 18 LEU CA C 18 58.469 58.469 57.952 0.517 17355
72 1 1 . 1 1 18 18 LEU CB C 18 42.459 42.459 42.215 0.244 17355
73 1 1 . 1 1 18 18 LEU H H 18 7.767 7.767 7.285 0.482 17355
74 1 1 . 1 1 19 19 VAL N N 19 118.522 118.522 116.819 1.703 17355
75 1 1 . 1 1 19 19 VAL HA H 19 3.424 3.424 3.759 -0.335 17355
76 1 1 . 1 1 19 19 VAL CA C 19 67.958 67.958 66.004 1.954 17355
77 1 1 . 1 1 19 19 VAL CB C 19 31.922 31.922 31.935 -0.013 17355
78 1 1 . 1 1 19 19 VAL H H 19 8.661 8.661 7.519 1.142 17355
79 1 1 . 1 1 20 20 ARG N N 20 117.959 117.959 117.684 0.275 17355
80 1 1 . 1 1 20 20 ARG HA H 20 3.576 3.576 4.275 -0.699 17355
81 1 1 . 1 1 20 20 ARG CA C 20 60.994 60.994 56.823 4.171 17355
82 1 1 . 1 1 20 20 ARG CB C 20 30.703 30.703 28.011 2.692 17355
83 1 1 . 1 1 20 20 ARG H H 20 8.705 8.705 8.339 0.366 17355
84 1 1 . 1 1 21 21 HIS N N 21 115.245 115.245 116.467 -1.222 17355
85 1 1 . 1 1 21 21 HIS HA H 21 4.144 4.144 4.569 -0.425 17355
86 1 1 . 1 1 21 21 HIS CA C 21 60.536 60.536 57.077 3.459 17355
87 1 1 . 1 1 21 21 HIS CB C 21 29.099 29.099 32.673 -3.574 17355
88 1 1 . 1 1 21 21 HIS H H 21 7.811 7.811 8.240 -0.429 17355
89 1 1 . 1 1 22 22 LEU N N 22 119.884 119.884 120.298 -0.414 17355
90 1 1 . 1 1 22 22 LEU HA H 22 4.078 4.078 4.112 -0.034 17355
91 1 1 . 1 1 22 22 LEU CA C 22 58.164 58.164 58.087 0.077 17355
92 1 1 . 1 1 22 22 LEU CB C 22 42.889 42.889 41.961 0.929 17355
93 1 1 . 1 1 22 22 LEU H H 22 8.301 8.301 7.683 0.618 17355
94 1 1 . 1 1 23 23 VAL N N 23 119.391 119.391 118.764 0.627 17355
95 1 1 . 1 1 23 23 VAL HA H 23 3.429 3.429 3.656 -0.227 17355
96 1 1 . 1 1 23 23 VAL CA C 23 67.179 67.179 66.559 0.620 17355
97 1 1 . 1 1 23 23 VAL CB C 23 31.366 31.366 31.313 0.053 17355
98 1 1 . 1 1 23 23 VAL H H 23 8.897 8.897 7.398 1.499 17355
99 1 1 . 1 1 24 24 ALA N N 24 121.610 121.610 121.711 -0.101 17355
100 1 1 . 1 1 24 24 ALA HA H 24 3.851 3.851 3.956 -0.105 17355
101 1 1 . 1 1 24 24 ALA CA C 24 55.944 55.944 55.262 0.682 17355
102 1 1 . 1 1 24 24 ALA CB C 24 18.042 18.042 18.448 -0.406 17355
103 1 1 . 1 1 24 24 ALA H H 24 8.276 8.276 8.247 0.029 17355
104 1 1 . 1 1 25 25 GLU N N 25 114.822 114.822 116.582 -1.760 17355
105 1 1 . 1 1 25 25 GLU HA H 25 4.042 4.042 4.336 -0.294 17355
106 1 1 . 1 1 25 25 GLU CA C 25 59.255 59.255 58.504 0.751 17355
107 1 1 . 1 1 25 25 GLU CB C 25 29.951 29.951 29.231 0.720 17355
108 1 1 . 1 1 25 25 GLU H H 25 7.693 7.693 7.885 -0.192 17355
109 1 1 . 1 1 26 26 ARG N N 26 118.510 118.510 117.384 1.126 17355
110 1 1 . 1 1 26 26 ARG HA H 26 4.252 4.252 4.293 -0.041 17355
111 1 1 . 1 1 26 26 ARG CA C 26 57.090 57.090 56.525 0.565 17355
112 1 1 . 1 1 26 26 ARG CB C 26 30.080 30.080 30.099 -0.019 17355
113 1 1 . 1 1 26 26 ARG H H 26 7.783 7.783 7.620 0.163 17355
114 1 1 . 1 1 27 27 ALA N N 27 120.375 120.375 119.473 0.902 17355
115 1 1 . 1 1 27 27 ALA HA H 27 4.342 4.342 4.525 -0.183 17355
116 1 1 . 1 1 27 27 ALA CA C 27 52.134 52.134 52.256 -0.122 17355
117 1 1 . 1 1 27 27 ALA CB C 27 19.283 19.283 21.375 -2.092 17355
118 1 1 . 1 1 27 27 ALA H H 27 8.638 8.638 7.786 0.852 17355
119 1 1 . 1 1 28 28 GLU N N 28 115.494 115.494 116.259 -0.765 17355
120 1 1 . 1 1 28 28 GLU HA H 28 3.873 3.873 4.397 -0.524 17355
121 1 1 . 1 1 28 28 GLU CA C 28 56.940 56.940 57.132 -0.192 17355
122 1 1 . 1 1 28 28 GLU CB C 28 27.058 27.058 30.671 -3.613 17355
123 1 1 . 1 1 28 28 GLU H H 28 7.734 7.734 8.106 -0.372 17355
124 1 1 . 1 1 29 29 LEU N N 29 119.978 119.978 120.652 -0.674 17355
125 1 1 . 1 1 29 29 LEU HA H 29 4.898 4.898 4.989 -0.091 17355
126 1 1 . 1 1 29 29 LEU CA C 29 51.498 51.498 51.615 -0.117 17355
127 1 1 . 1 1 29 29 LEU CB C 29 45.348 45.348 45.441 -0.093 17355
128 1 1 . 1 1 29 29 LEU H H 29 8.075 8.075 8.256 -0.181 17355
129 1 1 . 1 1 30 30 PRO HA H 30 4.461 4.461 4.416 0.045 17355
130 1 1 . 1 1 30 30 PRO CA C 30 62.524 62.524 62.440 0.084 17355
131 1 1 . 1 1 30 30 PRO CB C 30 32.015 32.015 29.646 2.369 17355
132 1 1 . 1 1 31 31 VAL N N 31 123.773 123.773 118.604 5.169 17355
133 1 1 . 1 1 31 31 VAL HA H 31 3.540 3.540 3.849 -0.309 17355
134 1 1 . 1 1 31 31 VAL CA C 31 65.493 65.493 63.909 1.584 17355
135 1 1 . 1 1 31 31 VAL CB C 31 31.865 31.865 31.284 0.581 17355
136 1 1 . 1 1 31 31 VAL H H 31 8.432 8.432 8.238 0.194 17355
137 1 1 . 1 1 32 32 GLU N N 32 117.215 117.215 120.443 -3.228 17355
138 1 1 . 1 1 32 32 GLU HA H 32 4.053 4.053 4.785 -0.732 17355
139 1 1 . 1 1 32 32 GLU CA C 32 59.131 59.131 57.303 1.828 17355
140 1 1 . 1 1 32 32 GLU CB C 32 28.781 28.781 30.886 -2.105 17355
141 1 1 . 1 1 32 32 GLU H H 32 8.971 8.971 8.327 0.644 17355
142 1 1 . 1 1 33 33 VAL N N 33 113.611 113.611 119.220 -5.609 17355
143 1 1 . 1 1 33 33 VAL HA H 33 4.214 4.214 4.268 -0.054 17355
144 1 1 . 1 1 33 33 VAL CA C 33 61.795 61.795 61.767 0.028 17355
145 1 1 . 1 1 33 33 VAL CB C 33 32.094 32.094 30.292 1.802 17355
146 1 1 . 1 1 33 33 VAL H H 33 7.470 7.470 8.088 -0.618 17355
147 1 1 . 1 1 34 34 LEU N N 34 123.533 123.533 124.108 -0.575 17355
148 1 1 . 1 1 34 34 LEU HA H 34 4.114 4.114 4.511 -0.397 17355
149 1 1 . 1 1 34 34 LEU CA C 34 54.877 54.877 53.949 0.928 17355
150 1 1 . 1 1 34 34 LEU CB C 34 42.590 42.590 42.545 0.045 17355
151 1 1 . 1 1 34 34 LEU H H 34 7.300 7.300 7.532 -0.232 17355
152 1 1 . 1 1 35 35 ARG N N 35 125.820 125.820 126.301 -0.481 17355
153 1 1 . 1 1 35 35 ARG HA H 35 4.578 4.578 4.063 0.515 17355
154 1 1 . 1 1 35 35 ARG CA C 35 54.619 54.619 57.755 -3.136 17355
155 1 1 . 1 1 35 35 ARG CB C 35 31.909 31.909 31.033 0.876 17355
156 1 1 . 1 1 35 35 ARG H H 35 8.415 8.415 8.552 -0.137 17355
157 1 1 . 1 1 36 36 ASP N N 36 123.211 123.211 116.258 6.953 17355
158 1 1 . 1 1 36 36 ASP HA H 36 4.156 4.156 4.597 -0.441 17355
159 1 1 . 1 1 36 36 ASP CA C 36 57.258 57.258 55.692 1.566 17355
160 1 1 . 1 1 36 36 ASP CB C 36 40.400 40.400 41.664 -1.264 17355
161 1 1 . 1 1 36 36 ASP H H 36 8.880 8.880 8.482 0.398 17355
162 1 1 . 1 1 37 37 ASP N N 37 112.390 112.390 118.256 -5.866 17355
163 1 1 . 1 1 37 37 ASP HA H 37 4.614 4.614 4.729 -0.115 17355
164 1 1 . 1 1 37 37 ASP CA C 37 52.651 52.651 53.415 -0.764 17355
165 1 1 . 1 1 37 37 ASP CB C 37 40.100 40.100 40.624 -0.524 17355
166 1 1 . 1 1 37 37 ASP H H 37 7.800 7.800 8.246 -0.446 17355
167 1 1 . 1 1 38 38 SER N N 38 116.534 116.534 116.281 0.253 17355
168 1 1 . 1 1 38 38 SER HA H 38 4.147 4.147 4.273 -0.126 17355
169 1 1 . 1 1 38 38 SER CA C 38 61.186 61.186 58.650 2.536 17355
170 1 1 . 1 1 38 38 SER CB C 38 63.946 63.946 63.210 0.736 17355
171 1 1 . 1 1 38 38 SER H H 38 7.376 7.376 7.812 -0.436 17355
172 1 1 . 1 1 39 39 ARG N N 39 124.337 124.337 124.146 0.191 17355
173 1 1 . 1 1 39 39 ARG HA H 39 4.521 4.521 4.470 0.051 17355
174 1 1 . 1 1 39 39 ARG CA C 39 55.049 55.049 55.098 -0.049 17355
175 1 1 . 1 1 39 39 ARG CB C 39 30.723 30.723 31.521 -0.798 17355
176 1 1 . 1 1 39 39 ARG H H 39 10.095 10.095 8.272 1.823 17355
177 1 1 . 1 1 40 40 PHE N N 40 122.834 122.834 118.616 4.218 17355
178 1 1 . 1 1 40 40 PHE HA H 40 3.916 3.916 4.693 -0.777 17355
179 1 1 . 1 1 40 40 PHE CA C 40 62.869 62.869 58.710 4.159 17355
180 1 1 . 1 1 40 40 PHE CB C 40 39.662 39.662 38.156 1.506 17355
181 1 1 . 1 1 40 40 PHE H H 40 7.498 7.498 8.288 -0.790 17355
182 1 1 . 1 1 41 41 LEU N N 41 117.682 117.682 117.364 0.318 17355
183 1 1 . 1 1 41 41 LEU HA H 41 4.519 4.519 4.263 0.256 17355
184 1 1 . 1 1 41 41 LEU CA C 41 58.111 58.111 55.795 2.316 17355
185 1 1 . 1 1 41 41 LEU CB C 41 41.087 41.087 42.786 -1.699 17355
186 1 1 . 1 1 41 41 LEU H H 41 8.619 8.619 7.679 0.940 17355
187 1 1 . 1 1 42 42 ASP N N 42 114.800 114.800 119.943 -5.143 17355
188 1 1 . 1 1 42 42 ASP HA H 42 4.185 4.185 4.422 -0.237 17355
189 1 1 . 1 1 42 42 ASP CA C 42 57.713 57.713 56.428 1.285 17355
190 1 1 . 1 1 42 42 ASP CB C 42 41.206 41.206 40.840 0.366 17355
191 1 1 . 1 1 42 42 ASP H H 42 8.239 8.239 8.086 0.153 17355
192 1 1 . 1 1 43 43 ASP N N 43 111.125 111.125 119.343 -8.218 17355
193 1 1 . 1 1 43 43 ASP HA H 43 4.915 4.915 4.601 0.314 17355
194 1 1 . 1 1 43 43 ASP CA C 43 56.105 56.105 54.977 1.128 17355
195 1 1 . 1 1 43 43 ASP CB C 43 41.703 41.703 40.775 0.928 17355
196 1 1 . 1 1 43 43 ASP H H 43 7.355 7.355 8.022 -0.667 17355
197 1 1 . 1 1 44 44 LEU N N 44 114.924 114.924 118.707 -3.783 17355
198 1 1 . 1 1 44 44 LEU HA H 44 4.273 4.273 4.076 0.197 17355
199 1 1 . 1 1 44 44 LEU CA C 44 54.480 54.480 56.464 -1.984 17355
200 1 1 . 1 1 44 44 LEU CB C 44 41.671 41.671 42.684 -1.014 17355
201 1 1 . 1 1 44 44 LEU H H 44 7.172 7.172 7.777 -0.605 17355
202 1 1 . 1 1 45 45 HIS N N 45 114.429 114.429 115.889 -1.460 17355
203 1 1 . 1 1 45 45 HIS HA H 45 4.581 4.581 4.382 0.199 17355
204 1 1 . 1 1 45 45 HIS CA C 45 56.189 56.189 56.825 -0.636 17355
205 1 1 . 1 1 45 45 HIS CB C 45 26.073 26.073 28.105 -2.032 17355
206 1 1 . 1 1 45 45 HIS H H 45 7.308 7.308 8.050 -0.742 17355
207 1 1 . 1 1 46 46 MET N N 46 118.597 118.597 121.840 -3.243 17355
208 1 1 . 1 1 46 46 MET HA H 46 4.614 4.614 4.768 -0.154 17355
209 1 1 . 1 1 46 46 MET CA C 46 55.646 55.646 54.505 1.141 17355
210 1 1 . 1 1 46 46 MET CB C 46 35.501 35.501 35.735 -0.234 17355
211 1 1 . 1 1 46 46 MET H H 46 8.618 8.618 8.071 0.547 17355
212 1 1 . 1 1 47 47 SER N N 47 116.110 116.110 119.147 -3.037 17355
213 1 1 . 1 1 47 47 SER HA H 47 4.559 4.559 4.666 -0.107 17355
214 1 1 . 1 1 47 47 SER CA C 47 56.696 56.696 58.072 -1.376 17355
215 1 1 . 1 1 47 47 SER CB C 47 65.888 65.888 64.419 1.469 17355
216 1 1 . 1 1 47 47 SER H H 47 8.446 8.446 8.951 -0.505 17355
217 1 1 . 1 1 48 48 SER N N 48 116.756 116.756 117.720 -0.964 17355
218 1 1 . 1 1 48 48 SER HA H 48 3.701 3.701 4.160 -0.459 17355
219 1 1 . 1 1 48 48 SER CA C 48 62.260 62.260 62.347 -0.087 17355
220 1 1 . 1 1 48 48 SER CB C 48 62.289 62.289 62.831 -0.542 17355
221 1 1 . 1 1 48 48 SER H H 48 8.948 8.948 8.781 0.167 17355
222 1 1 . 1 1 49 49 ILE N N 49 122.227 122.227 122.296 -0.069 17355
223 1 1 . 1 1 49 49 ILE HA H 49 3.806 3.806 3.931 -0.125 17355
224 1 1 . 1 1 49 49 ILE CA C 49 64.215 64.215 64.304 -0.089 17355
225 1 1 . 1 1 49 49 ILE CB C 49 38.059 38.059 36.005 2.054 17355
226 1 1 . 1 1 49 49 ILE H H 49 7.595 7.595 8.061 -0.466 17355
227 1 1 . 1 1 50 50 THR N N 50 120.233 120.233 115.735 4.498 17355
228 1 1 . 1 1 50 50 THR HA H 50 3.878 3.878 3.965 -0.087 17355
229 1 1 . 1 1 50 50 THR CA C 50 66.427 66.427 66.298 0.129 17355
230 1 1 . 1 1 50 50 THR CB C 50 68.223 68.223 68.142 0.081 17355
231 1 1 . 1 1 50 50 THR H H 50 7.539 7.539 8.044 -0.505 17355
232 1 1 . 1 1 51 51 VAL N N 51 121.320 121.320 120.720 0.600 17355
233 1 1 . 1 1 51 51 VAL HA H 51 3.090 3.090 3.642 -0.552 17355
234 1 1 . 1 1 51 51 VAL CA C 51 67.440 67.440 66.602 0.838 17355
235 1 1 . 1 1 51 51 VAL CB C 51 31.087 31.087 31.354 -0.267 17355
236 1 1 . 1 1 51 51 VAL H H 51 8.178 8.178 8.394 -0.216 17355
237 1 1 . 1 1 52 52 GLY N N 52 105.968 105.968 107.375 -1.407 17355
238 1 1 . 1 1 52 52 GLY CA C 52 47.339 47.339 46.679 0.660 17355
239 1 1 . 1 1 52 52 GLY H H 52 8.004 8.004 7.861 0.143 17355
240 1 1 . 1 1 53 53 GLN N N 53 120.486 120.486 118.364 2.122 17355
241 1 1 . 1 1 53 53 GLN HA H 53 4.086 4.086 4.316 -0.230 17355
242 1 1 . 1 1 53 53 GLN CA C 53 58.919 58.919 56.404 2.515 17355
243 1 1 . 1 1 53 53 GLN CB C 53 27.867 27.867 28.788 -0.921 17355
244 1 1 . 1 1 53 53 GLN H H 53 7.675 7.675 7.693 -0.018 17355
245 1 1 . 1 1 54 54 LEU N N 54 121.901 121.901 116.518 5.383 17355
246 1 1 . 1 1 54 54 LEU HA H 54 4.049 4.049 4.465 -0.416 17355
247 1 1 . 1 1 54 54 LEU CA C 54 58.661 58.661 57.016 1.645 17355
248 1 1 . 1 1 54 54 LEU CB C 54 42.426 42.426 41.809 0.617 17355
249 1 1 . 1 1 54 54 LEU H H 54 8.038 8.038 7.145 0.893 17355
250 1 1 . 1 1 55 55 VAL N N 55 119.226 119.226 120.822 -1.596 17355
251 1 1 . 1 1 55 55 VAL HA H 55 3.543 3.543 3.680 -0.137 17355
252 1 1 . 1 1 55 55 VAL CA C 55 66.871 66.871 64.845 2.026 17355
253 1 1 . 1 1 55 55 VAL CB C 55 31.392 31.392 31.030 0.362 17355
254 1 1 . 1 1 55 55 VAL H H 55 8.375 8.375 8.465 -0.090 17355
255 1 1 . 1 1 56 56 ASN N N 56 117.987 117.987 117.322 0.665 17355
256 1 1 . 1 1 56 56 ASN HA H 56 4.473 4.473 4.486 -0.013 17355
257 1 1 . 1 1 56 56 ASN CA C 56 56.557 56.557 55.162 1.395 17355
258 1 1 . 1 1 56 56 ASN CB C 56 38.509 38.509 38.306 0.203 17355
259 1 1 . 1 1 56 56 ASN H H 56 7.521 7.521 8.388 -0.867 17355
260 1 1 . 1 1 57 57 GLU N N 57 121.765 121.765 119.888 1.877 17355
261 1 1 . 1 1 57 57 GLU HA H 57 4.070 4.070 4.227 -0.157 17355
262 1 1 . 1 1 57 57 GLU CA C 57 59.496 59.496 58.397 1.099 17355
263 1 1 . 1 1 57 57 GLU CB C 57 29.395 29.395 29.765 -0.370 17355
264 1 1 . 1 1 57 57 GLU H H 57 8.225 8.225 7.624 0.601 17355
265 1 1 . 1 1 58 58 ALA N N 58 123.779 123.779 121.922 1.857 17355
266 1 1 . 1 1 58 58 ALA HA H 58 3.874 3.874 4.275 -0.401 17355
267 1 1 . 1 1 58 58 ALA CA C 58 55.227 55.227 54.858 0.369 17355
268 1 1 . 1 1 58 58 ALA CB C 58 18.388 18.388 18.289 0.099 17355
269 1 1 . 1 1 58 58 ALA H H 58 8.659 8.659 7.460 1.199 17355
270 1 1 . 1 1 59 59 ALA N N 59 118.656 118.656 121.829 -3.173 17355
271 1 1 . 1 1 59 59 ALA HA H 59 3.819 3.819 3.940 -0.121 17355
272 1 1 . 1 1 59 59 ALA CA C 59 55.871 55.871 55.260 0.611 17355
273 1 1 . 1 1 59 59 ALA CB C 59 18.152 18.152 18.491 -0.339 17355
274 1 1 . 1 1 59 59 ALA H H 59 8.537 8.537 7.691 0.846 17355
275 1 1 . 1 1 60 60 ARG N N 60 117.701 117.701 118.412 -0.711 17355
276 1 1 . 1 1 60 60 ARG HA H 60 4.096 4.096 3.966 0.130 17355
277 1 1 . 1 1 60 60 ARG CA C 60 59.609 59.609 58.739 0.870 17355
278 1 1 . 1 1 60 60 ARG CB C 60 29.974 29.974 29.272 0.702 17355
279 1 1 . 1 1 60 60 ARG H H 60 7.923 7.923 7.599 0.324 17355
280 1 1 . 1 1 61 61 ALA N N 61 123.271 123.271 121.391 1.880 17355
281 1 1 . 1 1 61 61 ALA HA H 61 4.137 4.137 4.168 -0.031 17355
282 1 1 . 1 1 61 61 ALA CA C 61 54.912 54.912 54.094 0.818 17355
283 1 1 . 1 1 61 61 ALA CB C 61 18.304 18.304 18.426 -0.122 17355
284 1 1 . 1 1 61 61 ALA H H 61 8.044 8.044 7.446 0.598 17355
285 1 1 . 1 1 62 62 MET N N 62 114.725 114.725 116.543 -1.818 17355
286 1 1 . 1 1 62 62 MET HA H 62 4.297 4.297 4.314 -0.017 17355
287 1 1 . 1 1 62 62 MET CA C 62 56.392 56.392 56.278 0.114 17355
288 1 1 . 1 1 62 62 MET CB C 62 34.827 34.827 33.089 1.738 17355
289 1 1 . 1 1 62 62 MET H H 62 7.710 7.710 8.079 -0.369 17355
290 1 1 . 1 1 63 63 GLY N N 63 108.268 108.268 107.432 0.836 17355
291 1 1 . 1 1 63 63 GLY CA C 63 46.079 46.079 45.269 0.810 17355
292 1 1 . 1 1 63 63 GLY H H 63 7.846 7.846 7.543 0.303 17355
293 1 1 . 1 1 64 64 LEU N N 64 119.547 119.547 119.603 -0.056 17355
294 1 1 . 1 1 64 64 LEU HA H 64 4.526 4.526 4.622 -0.096 17355
295 1 1 . 1 1 64 64 LEU CA C 64 53.605 53.605 54.329 -0.724 17355
296 1 1 . 1 1 64 64 LEU CB C 64 43.784 43.784 42.814 0.970 17355
297 1 1 . 1 1 64 64 LEU H H 64 8.183 8.183 8.146 0.037 17355
298 1 1 . 1 1 65 65 SER N N 65 115.418 115.418 113.312 2.106 17355
299 1 1 . 1 1 65 65 SER HA H 65 4.328 4.328 4.496 -0.168 17355
300 1 1 . 1 1 65 65 SER CA C 65 58.319 58.319 58.275 0.044 17355
301 1 1 . 1 1 65 65 SER CB C 65 64.181 64.181 63.642 0.539 17355
302 1 1 . 1 1 65 65 SER H H 65 8.302 8.302 8.184 0.118 17355
303 1 1 . 1 1 66 66 ALA N N 66 124.266 124.266 124.571 -0.305 17355
304 1 1 . 1 1 66 66 ALA HA H 66 4.212 4.212 4.625 -0.413 17355
305 1 1 . 1 1 66 66 ALA CA C 66 52.624 52.624 52.905 -0.281 17355
306 1 1 . 1 1 66 66 ALA CB C 66 19.309 19.309 19.299 0.010 17355
307 1 1 . 1 1 66 66 ALA H H 66 8.262 8.262 8.149 0.113 17355
308 1 1 . 1 1 67 67 VAL N N 67 118.373 118.373 118.013 0.360 17355
309 1 1 . 1 1 67 67 VAL HA H 67 4.049 4.049 4.097 -0.048 17355
310 1 1 . 1 1 67 67 VAL CA C 67 62.010 62.010 63.293 -1.283 17355
311 1 1 . 1 1 67 67 VAL CB C 67 33.495 33.495 32.191 1.304 17355
312 1 1 . 1 1 67 67 VAL H H 67 7.949 7.949 7.402 0.547 17355
313 1 1 . 1 1 68 68 ALA N N 68 127.696 127.696 119.714 7.982 17355
314 1 1 . 1 1 68 68 ALA HA H 68 4.308 4.308 4.006 0.302 17355
315 1 1 . 1 1 68 68 ALA CA C 68 52.070 52.070 54.350 -2.280 17355
316 1 1 . 1 1 68 68 ALA CB C 68 19.220 19.220 17.585 1.635 17355
317 1 1 . 1 1 68 68 ALA H H 68 8.319 8.319 8.235 0.084 17355
318 1 1 . 1 1 69 69 MET N N 69 120.285 120.285 113.838 6.447 17355
319 1 1 . 1 1 69 69 MET HA H 69 4.664 4.664 5.077 -0.413 17355
320 1 1 . 1 1 69 69 MET CA C 69 53.004 53.004 53.229 -0.225 17355
321 1 1 . 1 1 69 69 MET CB C 69 32.678 32.678 34.137 -1.459 17355
322 1 1 . 1 1 69 69 MET H H 69 8.224 8.224 7.993 0.231 17355
323 1 1 . 1 1 70 70 PRO HA H 70 4.446 4.446 4.414 0.032 17355
324 1 1 . 1 1 70 70 PRO CA C 70 63.452 63.452 64.684 -1.232 17355
325 1 1 . 1 1 70 70 PRO CB C 70 32.012 32.012 32.140 -0.128 17355
326 1 1 . 1 1 71 71 THR N N 71 112.663 112.663 109.301 3.362 17355
327 1 1 . 1 1 71 71 THR HA H 71 4.074 4.074 3.763 0.311 17355
328 1 1 . 1 1 71 71 THR CA C 71 62.869 62.869 61.459 1.410 17355
329 1 1 . 1 1 71 71 THR CB C 71 69.516 69.516 69.738 -0.222 17355
330 1 1 . 1 1 71 71 THR H H 71 7.957 7.957 7.500 0.457 17355
331 1 1 . 1 1 72 72 ASN N N 72 120.054 120.054 118.942 1.112 17355
332 1 1 . 1 1 72 72 ASN HA H 72 4.695 4.695 3.929 0.766 17355
333 1 1 . 1 1 72 72 ASN CA C 72 52.856 52.856 56.138 -3.281 17355
334 1 1 . 1 1 72 72 ASN CB C 72 38.165 38.165 37.581 0.584 17355
335 1 1 . 1 1 72 72 ASN H H 72 8.227 8.227 8.237 -0.010 17355
336 1 1 . 1 1 73 73 PHE N N 73 121.570 121.570 115.245 6.325 17355
337 1 1 . 1 1 73 73 PHE HA H 73 4.342 4.342 3.741 0.601 17355
338 1 1 . 1 1 73 73 PHE CA C 73 59.609 59.609 60.438 -0.829 17355
339 1 1 . 1 1 73 73 PHE CB C 73 39.000 39.000 36.755 2.245 17355
340 1 1 . 1 1 73 73 PHE H H 73 8.331 8.331 8.249 0.082 17355
341 1 1 . 1 1 74 74 ALA N N 74 121.047 121.047 122.123 -1.076 17355
342 1 1 . 1 1 74 74 ALA HA H 74 4.074 4.074 4.161 -0.087 17355
343 1 1 . 1 1 74 74 ALA CA C 74 54.705 54.705 54.892 -0.187 17355
344 1 1 . 1 1 74 74 ALA CB C 74 19.159 19.159 19.023 0.136 17355
345 1 1 . 1 1 74 74 ALA H H 74 8.163 8.163 8.042 0.121 17355
346 1 1 . 1 1 75 75 THR N N 75 104.824 104.824 113.199 -8.375 17355
347 1 1 . 1 1 75 75 THR HA H 75 4.475 4.475 4.372 0.103 17355
348 1 1 . 1 1 75 75 THR CA C 75 60.669 60.669 61.737 -1.068 17355
349 1 1 . 1 1 75 75 THR CB C 75 69.543 69.543 66.821 2.722 17355
350 1 1 . 1 1 75 75 THR H H 75 7.581 7.581 8.332 -0.751 17355
351 1 1 . 1 1 76 76 ALA N N 76 124.548 124.548 125.531 -0.983 17355
352 1 1 . 1 1 76 76 ALA HA H 76 4.714 4.714 4.802 -0.088 17355
353 1 1 . 1 1 76 76 ALA CA C 76 52.929 52.929 50.848 2.081 17355
354 1 1 . 1 1 76 76 ALA CB C 76 20.661 20.661 21.643 -0.982 17355
355 1 1 . 1 1 76 76 ALA H H 76 7.689 7.689 7.920 -0.231 17355
356 1 1 . 1 1 77 77 THR N N 77 108.654 108.654 111.197 -2.543 17355
357 1 1 . 1 1 77 77 THR HA H 77 5.017 5.017 4.584 0.433 17355
358 1 1 . 1 1 77 77 THR CA C 77 58.847 58.847 59.710 -0.863 17355
359 1 1 . 1 1 77 77 THR CB C 77 73.369 73.369 71.751 1.618 17355
360 1 1 . 1 1 77 77 THR H H 77 7.495 7.495 8.216 -0.721 17355
361 1 1 . 1 1 78 78 VAL N N 78 120.107 120.107 118.151 1.956 17355
362 1 1 . 1 1 78 78 VAL HA H 78 3.418 3.418 3.992 -0.574 17355
363 1 1 . 1 1 78 78 VAL CA C 78 67.446 67.446 66.621 0.825 17355
364 1 1 . 1 1 78 78 VAL CB C 78 31.949 31.949 31.139 0.810 17355
365 1 1 . 1 1 78 78 VAL H H 78 7.373 7.373 8.223 -0.850 17355
366 1 1 . 1 1 79 79 ARG N N 79 117.131 117.131 119.195 -2.064 17355
367 1 1 . 1 1 79 79 ARG HA H 79 3.877 3.877 4.155 -0.278 17355
368 1 1 . 1 1 79 79 ARG CA C 79 59.566 59.566 58.065 1.501 17355
369 1 1 . 1 1 79 79 ARG CB C 79 30.174 30.174 29.417 0.757 17355
370 1 1 . 1 1 79 79 ARG H H 79 8.518 8.518 7.802 0.716 17355
371 1 1 . 1 1 80 80 GLU N N 80 118.542 118.542 120.544 -2.002 17355
372 1 1 . 1 1 80 80 GLU HA H 80 4.033 4.033 4.101 -0.068 17355
373 1 1 . 1 1 80 80 GLU CA C 80 59.427 59.427 59.611 -0.184 17355
374 1 1 . 1 1 80 80 GLU CB C 80 30.206 30.206 29.564 0.642 17355
375 1 1 . 1 1 80 80 GLU H H 80 7.847 7.847 7.965 -0.118 17355
376 1 1 . 1 1 81 81 MET N N 81 119.630 119.630 119.021 0.609 17355
377 1 1 . 1 1 81 81 MET HA H 81 4.158 4.158 4.133 0.025 17355
378 1 1 . 1 1 81 81 MET CA C 81 59.025 59.025 59.062 -0.037 17355
379 1 1 . 1 1 81 81 MET CB C 81 32.916 32.916 32.626 0.290 17355
380 1 1 . 1 1 81 81 MET H H 81 8.211 8.211 8.329 -0.118 17355
381 1 1 . 1 1 82 82 ALA N N 82 120.463 120.463 121.828 -1.365 17355
382 1 1 . 1 1 82 82 ALA HA H 82 3.911 3.911 4.162 -0.251 17355
383 1 1 . 1 1 82 82 ALA CA C 82 56.004 56.004 54.539 1.465 17355
384 1 1 . 1 1 82 82 ALA CB C 82 18.430 18.430 18.315 0.115 17355
385 1 1 . 1 1 82 82 ALA H H 82 7.978 7.978 7.457 0.521 17355
386 1 1 . 1 1 83 83 GLU N N 83 116.663 116.663 119.786 -3.123 17355
387 1 1 . 1 1 83 83 GLU HA H 83 4.034 4.034 3.891 0.143 17355
388 1 1 . 1 1 83 83 GLU CA C 83 59.476 59.476 59.655 -0.179 17355
389 1 1 . 1 1 83 83 GLU CB C 83 29.470 29.470 29.669 -0.199 17355
390 1 1 . 1 1 83 83 GLU H H 83 8.608 8.608 8.136 0.472 17355
391 1 1 . 1 1 84 84 ALA N N 84 122.742 122.742 121.220 1.522 17355
392 1 1 . 1 1 84 84 ALA HA H 84 4.241 4.241 3.987 0.254 17355
393 1 1 . 1 1 84 84 ALA CA C 84 54.970 54.970 55.291 -0.321 17355
394 1 1 . 1 1 84 84 ALA CB C 84 18.150 18.150 18.121 0.029 17355
395 1 1 . 1 1 84 84 ALA H H 84 7.918 7.918 8.061 -0.143 17355
396 1 1 . 1 1 85 85 LEU N N 85 119.158 119.158 118.633 0.525 17355
397 1 1 . 1 1 85 85 LEU HA H 85 3.945 3.945 3.899 0.046 17355
398 1 1 . 1 1 85 85 LEU CA C 85 57.849 57.849 57.529 0.320 17355
399 1 1 . 1 1 85 85 LEU CB C 85 41.884 41.884 41.710 0.174 17355
400 1 1 . 1 1 85 85 LEU H H 85 7.692 7.692 7.695 -0.003 17355
401 1 1 . 1 1 86 86 GLU N N 86 118.441 118.441 120.389 -1.948 17355
402 1 1 . 1 1 86 86 GLU HA H 86 4.053 4.053 4.299 -0.246 17355
403 1 1 . 1 1 86 86 GLU CA C 86 59.131 59.131 58.867 0.264 17355
404 1 1 . 1 1 86 86 GLU CB C 86 29.868 29.868 29.374 0.494 17355
405 1 1 . 1 1 86 86 GLU H H 86 8.152 8.152 8.475 -0.323 17355
406 1 1 . 1 1 87 87 ALA N N 87 120.690 120.690 121.125 -0.435 17355
407 1 1 . 1 1 87 87 ALA HA H 87 4.139 4.139 4.434 -0.295 17355
408 1 1 . 1 1 87 87 ALA CA C 87 54.506 54.506 53.300 1.206 17355
409 1 1 . 1 1 87 87 ALA CB C 87 18.435 18.435 19.218 -0.783 17355
410 1 1 . 1 1 87 87 ALA H H 87 7.899 7.899 8.062 -0.163 17355
411 1 1 . 1 1 88 88 ARG N N 88 117.642 117.642 119.933 -2.291 17355
412 1 1 . 1 1 88 88 ARG HA H 88 4.204 4.204 3.941 0.263 17355
413 1 1 . 1 1 88 88 ARG CA C 88 57.435 57.435 59.542 -2.107 17355
414 1 1 . 1 1 88 88 ARG CB C 88 30.106 30.106 29.733 0.373 17355
415 1 1 . 1 1 88 88 ARG H H 88 7.593 7.593 8.478 -0.885 17355
416 1 1 . 1 1 89 89 GLU N N 89 121.080 121.080 118.565 2.515 17355
417 1 1 . 1 1 89 89 GLU HA H 89 4.047 4.047 3.981 0.066 17355
418 1 1 . 1 1 89 89 GLU CA C 89 58.858 58.858 59.246 -0.388 17355
419 1 1 . 1 1 89 89 GLU CB C 89 29.912 29.912 29.024 0.888 17355
420 1 1 . 1 1 89 89 GLU H H 89 8.222 8.222 7.917 0.305 17355
421 1 1 . 1 1 90 90 ARG N N 90 117.834 117.834 119.205 -1.371 17355
422 1 1 . 1 1 90 90 ARG HA H 90 4.212 4.212 4.093 0.118 17355
423 1 1 . 1 1 90 90 ARG CA C 90 57.409 57.409 58.281 -0.872 17355
424 1 1 . 1 1 90 90 ARG CB C 90 30.906 30.906 30.319 0.587 17355
425 1 1 . 1 1 90 90 ARG H H 90 7.924 7.924 7.804 0.120 17355
426 1 1 . 1 1 91 91 GLU N N 91 118.786 118.786 117.706 1.080 17355
427 1 1 . 1 1 91 91 GLU HA H 91 4.254 4.254 4.521 -0.267 17355
428 1 1 . 1 1 91 91 GLU CA C 91 56.693 56.693 54.837 1.856 17355
429 1 1 . 1 1 91 91 GLU CB C 91 30.416 30.416 28.970 1.446 17355
430 1 1 . 1 1 91 91 GLU H H 91 7.749 7.749 7.776 -0.027 17355
431 1 1 . 1 1 92 92 ALA N N 92 125.247 125.247 124.478 0.769 17355
432 1 1 . 1 1 92 92 ALA HA H 92 4.551 4.551 4.221 0.330 17355
433 1 1 . 1 1 92 92 ALA CA C 92 51.073 51.073 54.016 -2.942 17355
434 1 1 . 1 1 92 92 ALA CB C 92 18.443 18.443 17.147 1.296 17355
435 1 1 . 1 1 92 92 ALA H H 92 7.888 7.888 7.867 0.021 17355
436 1 1 . 1 1 93 93 PRO HA H 93 4.383 4.383 4.417 -0.034 17355
437 1 1 . 1 1 93 93 PRO CA C 93 63.744 63.744 63.613 0.131 17355
438 1 1 . 1 1 93 93 PRO CB C 93 32.122 32.122 31.582 0.540 17355
439 1 1 . 1 1 94 94 HIS N N 94 118.597 118.597 119.553 -0.956 17355
440 1 1 . 1 1 94 94 HIS HA H 94 4.639 4.639 4.638 0.001 17355
441 1 1 . 1 1 94 94 HIS CA C 94 56.044 56.044 55.543 0.501 17355
442 1 1 . 1 1 94 94 HIS CB C 94 29.789 29.789 31.660 -1.871 17355
443 1 1 . 1 1 94 94 HIS H H 94 8.392 8.392 8.391 0.001 17355
444 1 1 . 1 1 95 95 LEU N N 95 123.443 123.443 125.210 -1.767 17355
445 1 1 . 1 1 95 95 LEU HA H 95 4.287 4.287 4.396 -0.109 17355
446 1 1 . 1 1 95 95 LEU CA C 95 55.233 55.233 56.522 -1.289 17355
447 1 1 . 1 1 95 95 LEU CB C 95 42.710 42.710 43.109 -0.399 17355
448 1 1 . 1 1 95 95 LEU H H 95 8.061 8.061 8.858 -0.797 17355
449 1 1 . 1 1 96 96 GLU N N 96 121.295 121.295 120.580 0.715 17355
450 1 1 . 1 1 96 96 GLU HA H 96 4.176 4.176 4.441 -0.265 17355
451 1 1 . 1 1 96 96 GLU CA C 96 56.706 56.706 55.904 0.802 17355
452 1 1 . 1 1 96 96 GLU CB C 96 30.319 30.319 31.830 -1.511 17355
453 1 1 . 1 1 96 96 GLU H H 96 8.346 8.346 8.409 -0.063 17355
454 1 1 . 1 1 97 97 HIS N N 97 119.932 119.932 121.936 -2.004 17355
455 1 1 . 1 1 97 97 HIS HA H 97 4.555 4.555 5.099 -0.544 17355
456 1 1 . 1 1 97 97 HIS CA C 97 56.042 56.042 56.181 -0.139 17355
457 1 1 . 1 1 97 97 HIS H H 97 8.251 8.251 8.968 -0.717 17355
458 1 1 . 1 1 98 98 HIS N N 98 125.446 125.446 119.348 6.098 17355
459 1 1 . 1 1 98 98 HIS HA H 98 4.363 4.363 4.569 -0.206 17355
460 1 1 . 1 1 98 98 HIS CA C 98 57.303 57.303 56.575 0.728 17355
461 1 1 . 1 1 98 98 HIS CB C 98 30.319 30.319 31.343 -1.024 17355
462 1 1 . 1 1 98 98 HIS H H 98 8.054 8.054 8.782 -0.728 17355
463 1 2 . 1 1 3 3 ARG HA H 3 4.321 4.321 4.415 -0.094 17355
464 1 2 . 1 1 3 3 ARG CA C 3 56.560 56.560 55.859 0.701 17355
465 1 2 . 1 1 4 4 ALA N N 4 125.797 125.797 124.028 1.769 17355
466 1 2 . 1 1 4 4 ALA HA H 4 4.283 4.283 4.532 -0.249 17355
467 1 2 . 1 1 4 4 ALA CA C 4 52.900 52.900 51.715 1.185 17355
468 1 2 . 1 1 4 4 ALA CB C 4 19.411 19.411 19.506 -0.095 17355
469 1 2 . 1 1 4 4 ALA H H 4 8.563 8.563 7.792 0.771 17355
470 1 2 . 1 1 5 5 ASP N N 5 118.416 118.416 120.827 -2.411 17355
471 1 2 . 1 1 5 5 ASP HA H 5 4.584 4.584 4.731 -0.147 17355
472 1 2 . 1 1 5 5 ASP CA C 5 54.337 54.337 53.325 1.012 17355
473 1 2 . 1 1 5 5 ASP CB C 5 41.186 41.186 41.368 -0.182 17355
474 1 2 . 1 1 5 5 ASP H H 5 8.208 8.208 8.031 0.177 17355
475 1 2 . 1 1 6 6 ASP N N 6 120.632 120.632 123.260 -2.628 17355
476 1 2 . 1 1 6 6 ASP HA H 6 4.578 4.578 4.484 0.094 17355
477 1 2 . 1 1 6 6 ASP CA C 6 54.589 54.589 53.693 0.896 17355
478 1 2 . 1 1 6 6 ASP CB C 6 41.239 41.239 41.081 0.158 17355
479 1 2 . 1 1 6 6 ASP H H 6 8.140 8.140 8.288 -0.148 17355
480 1 2 . 1 1 7 7 THR N N 7 113.693 113.693 110.039 3.654 17355
481 1 2 . 1 1 7 7 THR HA H 7 4.245 4.245 4.417 -0.172 17355
482 1 2 . 1 1 7 7 THR CA C 7 62.392 62.392 61.236 1.156 17355
483 1 2 . 1 1 7 7 THR CB C 7 69.721 69.721 67.374 2.347 17355
484 1 2 . 1 1 7 7 THR H H 7 8.045 8.045 8.291 -0.246 17355
485 1 2 . 1 1 8 8 ALA N N 8 126.414 126.414 128.174 -1.760 17355
486 1 2 . 1 1 8 8 ALA HA H 8 4.314 4.314 4.375 -0.061 17355
487 1 2 . 1 1 8 8 ALA CA C 8 52.253 52.253 52.071 0.182 17355
488 1 2 . 1 1 8 8 ALA CB C 8 19.464 19.464 19.263 0.201 17355
489 1 2 . 1 1 8 8 ALA H H 8 8.139 8.139 7.852 0.287 17355
490 1 2 . 1 1 9 9 LEU N N 9 122.921 122.921 120.827 2.094 17355
491 1 2 . 1 1 9 9 LEU HA H 9 4.559 4.559 4.117 0.442 17355
492 1 2 . 1 1 9 9 LEU CA C 9 53.088 53.088 55.066 -1.978 17355
493 1 2 . 1 1 9 9 LEU CB C 9 41.929 41.929 41.928 0.001 17355
494 1 2 . 1 1 9 9 LEU H H 9 8.113 8.113 8.170 -0.057 17355
495 1 2 . 1 1 10 10 PRO HA H 10 4.367 4.367 4.393 -0.026 17355
496 1 2 . 1 1 10 10 PRO CA C 10 63.373 63.373 63.837 -0.465 17355
497 1 2 . 1 1 10 10 PRO CB C 10 31.975 31.975 32.237 -0.262 17355
498 1 2 . 1 1 11 11 ALA N N 11 124.349 124.349 120.114 4.235 17355
499 1 2 . 1 1 11 11 ALA HA H 11 4.262 4.262 4.394 -0.132 17355
500 1 2 . 1 1 11 11 ALA CA C 11 52.496 52.496 51.477 1.019 17355
501 1 2 . 1 1 11 11 ALA CB C 11 19.424 19.424 20.218 -0.794 17355
502 1 2 . 1 1 11 11 ALA H H 11 8.317 8.317 7.451 0.866 17355
503 1 2 . 1 1 12 12 ALA N N 12 123.291 123.291 120.806 2.485 17355
504 1 2 . 1 1 12 12 ALA HA H 12 4.380 4.380 4.790 -0.410 17355
505 1 2 . 1 1 12 12 ALA CA C 12 52.461 52.461 51.770 0.691 17355
506 1 2 . 1 1 12 12 ALA CB C 12 19.557 19.557 20.510 -0.953 17355
507 1 2 . 1 1 12 12 ALA H H 12 8.287 8.287 8.219 0.068 17355
508 1 2 . 1 1 13 13 THR N N 13 112.758 112.758 112.369 0.389 17355
509 1 2 . 1 1 13 13 THR HA H 13 4.350 4.350 4.367 -0.017 17355
510 1 2 . 1 1 13 13 THR CA C 13 62.074 62.074 62.729 -0.655 17355
511 1 2 . 1 1 13 13 THR CB C 13 70.070 70.070 70.838 -0.769 17355
512 1 2 . 1 1 13 13 THR H H 13 8.074 8.074 8.519 -0.445 17355
513 1 2 . 1 1 14 14 GLY N N 14 110.774 110.774 109.426 1.348 17355
514 1 2 . 1 1 14 14 GLY CA C 14 45.692 45.692 45.094 0.598 17355
515 1 2 . 1 1 14 14 GLY H H 14 8.405 8.405 7.879 0.526 17355
516 1 2 . 1 1 15 15 ALA N N 15 124.127 124.127 125.192 -1.065 17355
517 1 2 . 1 1 15 15 ALA HA H 15 4.137 4.137 4.233 -0.096 17355
518 1 2 . 1 1 15 15 ALA CA C 15 55.368 55.368 54.261 1.107 17355
519 1 2 . 1 1 15 15 ALA CB C 15 20.100 20.100 19.102 0.998 17355
520 1 2 . 1 1 15 15 ALA H H 15 8.866 8.866 8.313 0.553 17355
521 1 2 . 1 1 16 16 LEU N N 16 118.013 118.013 119.759 -1.746 17355
522 1 2 . 1 1 16 16 LEU HA H 16 3.870 3.870 3.995 -0.125 17355
523 1 2 . 1 1 16 16 LEU CA C 16 58.820 58.820 57.832 0.988 17355
524 1 2 . 1 1 16 16 LEU CB C 16 41.332 41.332 41.380 -0.048 17355
525 1 2 . 1 1 16 16 LEU H H 16 8.414 8.414 8.601 -0.187 17355
526 1 2 . 1 1 17 17 GLU N N 17 117.730 117.730 115.379 2.351 17355
527 1 2 . 1 1 17 17 GLU HA H 17 3.978 3.978 4.149 -0.171 17355
528 1 2 . 1 1 17 17 GLU CA C 17 59.909 59.909 57.862 2.047 17355
529 1 2 . 1 1 17 17 GLU CB C 17 29.212 29.212 28.711 0.501 17355
530 1 2 . 1 1 17 17 GLU H H 17 8.088 8.088 8.113 -0.025 17355
531 1 2 . 1 1 18 18 LEU N N 18 121.355 121.355 120.503 0.852 17355
532 1 2 . 1 1 18 18 LEU HA H 18 4.165 4.165 4.094 0.071 17355
533 1 2 . 1 1 18 18 LEU CA C 18 58.469 58.469 57.870 0.599 17355
534 1 2 . 1 1 18 18 LEU CB C 18 42.459 42.459 42.245 0.214 17355
535 1 2 . 1 1 18 18 LEU H H 18 7.767 7.767 7.180 0.587 17355
536 1 2 . 1 1 19 19 VAL N N 19 118.522 118.522 116.720 1.802 17355
537 1 2 . 1 1 19 19 VAL HA H 19 3.424 3.424 3.759 -0.335 17355
538 1 2 . 1 1 19 19 VAL CA C 19 67.958 67.958 65.954 2.003 17355
539 1 2 . 1 1 19 19 VAL CB C 19 31.922 31.922 31.922 0.000 17355
540 1 2 . 1 1 19 19 VAL H H 19 8.661 8.661 7.572 1.089 17355
541 1 2 . 1 1 20 20 ARG N N 20 117.959 117.959 117.689 0.270 17355
542 1 2 . 1 1 20 20 ARG HA H 20 3.576 3.576 4.290 -0.714 17355
543 1 2 . 1 1 20 20 ARG CA C 20 60.994 60.994 57.073 3.921 17355
544 1 2 . 1 1 20 20 ARG CB C 20 30.703 30.703 28.110 2.593 17355
545 1 2 . 1 1 20 20 ARG H H 20 8.705 8.705 8.167 0.538 17355
546 1 2 . 1 1 21 21 HIS N N 21 115.245 115.245 116.202 -0.957 17355
547 1 2 . 1 1 21 21 HIS HA H 21 4.144 4.144 4.585 -0.441 17355
548 1 2 . 1 1 21 21 HIS CA C 21 60.536 60.536 56.961 3.575 17355
549 1 2 . 1 1 21 21 HIS CB C 21 29.099 29.099 32.360 -3.261 17355
550 1 2 . 1 1 21 21 HIS H H 21 7.811 7.811 8.396 -0.585 17355
551 1 2 . 1 1 22 22 LEU N N 22 119.884 119.884 121.580 -1.696 17355
552 1 2 . 1 1 22 22 LEU HA H 22 4.078 4.078 4.213 -0.135 17355
553 1 2 . 1 1 22 22 LEU CA C 22 58.164 58.164 57.648 0.516 17355
554 1 2 . 1 1 22 22 LEU CB C 22 42.889 42.889 42.387 0.502 17355
555 1 2 . 1 1 22 22 LEU H H 22 8.301 8.301 7.732 0.569 17355
556 1 2 . 1 1 23 23 VAL N N 23 119.391 119.391 118.775 0.616 17355
557 1 2 . 1 1 23 23 VAL HA H 23 3.429 3.429 3.570 -0.141 17355
558 1 2 . 1 1 23 23 VAL CA C 23 67.179 67.179 67.128 0.051 17355
559 1 2 . 1 1 23 23 VAL CB C 23 31.366 31.366 31.147 0.219 17355
560 1 2 . 1 1 23 23 VAL H H 23 8.897 8.897 7.429 1.468 17355
561 1 2 . 1 1 24 24 ALA N N 24 121.610 121.610 120.217 1.393 17355
562 1 2 . 1 1 24 24 ALA HA H 24 3.851 3.851 3.997 -0.146 17355
563 1 2 . 1 1 24 24 ALA CA C 24 55.944 55.944 55.326 0.618 17355
564 1 2 . 1 1 24 24 ALA CB C 24 18.042 18.042 18.154 -0.112 17355
565 1 2 . 1 1 24 24 ALA H H 24 8.276 8.276 8.429 -0.153 17355
566 1 2 . 1 1 25 25 GLU N N 25 114.822 114.822 115.862 -1.040 17355
567 1 2 . 1 1 25 25 GLU HA H 25 4.042 4.042 4.079 -0.037 17355
568 1 2 . 1 1 25 25 GLU CA C 25 59.255 59.255 58.530 0.725 17355
569 1 2 . 1 1 25 25 GLU CB C 25 29.951 29.951 29.432 0.519 17355
570 1 2 . 1 1 25 25 GLU H H 25 7.693 7.693 8.022 -0.329 17355
571 1 2 . 1 1 26 26 ARG N N 26 118.510 118.510 116.111 2.399 17355
572 1 2 . 1 1 26 26 ARG HA H 26 4.252 4.252 4.351 -0.099 17355
573 1 2 . 1 1 26 26 ARG CA C 26 57.090 57.090 56.220 0.870 17355
574 1 2 . 1 1 26 26 ARG CB C 26 30.080 30.080 31.038 -0.958 17355
575 1 2 . 1 1 26 26 ARG H H 26 7.783 7.783 7.804 -0.021 17355
576 1 2 . 1 1 27 27 ALA N N 27 120.375 120.375 120.908 -0.533 17355
577 1 2 . 1 1 27 27 ALA HA H 27 4.342 4.342 4.546 -0.204 17355
578 1 2 . 1 1 27 27 ALA CA C 27 52.134 52.134 51.287 0.847 17355
579 1 2 . 1 1 27 27 ALA CB C 27 19.283 19.283 20.330 -1.047 17355
580 1 2 . 1 1 27 27 ALA H H 27 8.638 8.638 7.934 0.704 17355
581 1 2 . 1 1 28 28 GLU N N 28 115.494 115.494 117.547 -2.053 17355
582 1 2 . 1 1 28 28 GLU HA H 28 3.873 3.873 4.055 -0.182 17355
583 1 2 . 1 1 28 28 GLU CA C 28 56.940 56.940 57.275 -0.335 17355
584 1 2 . 1 1 28 28 GLU CB C 28 27.058 27.058 28.119 -1.061 17355
585 1 2 . 1 1 28 28 GLU H H 28 7.734 7.734 8.221 -0.487 17355
586 1 2 . 1 1 29 29 LEU N N 29 119.978 119.978 121.105 -1.127 17355
587 1 2 . 1 1 29 29 LEU HA H 29 4.898 4.898 4.877 0.021 17355
588 1 2 . 1 1 29 29 LEU CA C 29 51.498 51.498 51.538 -0.040 17355
589 1 2 . 1 1 29 29 LEU CB C 29 45.348 45.348 44.935 0.413 17355
590 1 2 . 1 1 29 29 LEU H H 29 8.075 8.075 7.671 0.404 17355
591 1 2 . 1 1 30 30 PRO HA H 30 4.461 4.461 4.432 0.029 17355
592 1 2 . 1 1 30 30 PRO CA C 30 62.524 62.524 62.980 -0.456 17355
593 1 2 . 1 1 30 30 PRO CB C 30 32.015 32.015 30.509 1.506 17355
594 1 2 . 1 1 31 31 VAL N N 31 123.773 123.773 119.317 4.456 17355
595 1 2 . 1 1 31 31 VAL HA H 31 3.540 3.540 3.742 -0.202 17355
596 1 2 . 1 1 31 31 VAL CA C 31 65.493 65.493 63.716 1.777 17355
597 1 2 . 1 1 31 31 VAL CB C 31 31.865 31.865 31.547 0.318 17355
598 1 2 . 1 1 31 31 VAL H H 31 8.432 8.432 7.760 0.672 17355
599 1 2 . 1 1 32 32 GLU N N 32 117.215 117.215 121.546 -4.331 17355
600 1 2 . 1 1 32 32 GLU HA H 32 4.053 4.053 4.427 -0.374 17355
601 1 2 . 1 1 32 32 GLU CA C 32 59.131 59.131 56.991 2.140 17355
602 1 2 . 1 1 32 32 GLU CB C 32 28.781 28.781 30.176 -1.395 17355
603 1 2 . 1 1 32 32 GLU H H 32 8.971 8.971 8.149 0.822 17355
604 1 2 . 1 1 33 33 VAL N N 33 113.611 113.611 120.306 -6.695 17355
605 1 2 . 1 1 33 33 VAL HA H 33 4.214 4.214 3.975 0.239 17355
606 1 2 . 1 1 33 33 VAL CA C 33 61.795 61.795 63.150 -1.355 17355
607 1 2 . 1 1 33 33 VAL CB C 33 32.094 32.094 31.949 0.145 17355
608 1 2 . 1 1 33 33 VAL H H 33 7.470 7.470 7.806 -0.336 17355
609 1 2 . 1 1 34 34 LEU N N 34 123.533 123.533 119.557 3.976 17355
610 1 2 . 1 1 34 34 LEU HA H 34 4.114 4.114 4.107 0.007 17355
611 1 2 . 1 1 34 34 LEU CA C 34 54.877 54.877 55.232 -0.355 17355
612 1 2 . 1 1 34 34 LEU CB C 34 42.590 42.590 41.489 1.101 17355
613 1 2 . 1 1 34 34 LEU H H 34 7.300 7.300 7.715 -0.415 17355
614 1 2 . 1 1 35 35 ARG N N 35 125.820 125.820 126.167 -0.347 17355
615 1 2 . 1 1 35 35 ARG HA H 35 4.578 4.578 4.216 0.362 17355
616 1 2 . 1 1 35 35 ARG CA C 35 54.619 54.619 55.913 -1.294 17355
617 1 2 . 1 1 35 35 ARG CB C 35 31.909 31.909 30.792 1.117 17355
618 1 2 . 1 1 35 35 ARG H H 35 8.415 8.415 8.416 -0.001 17355
619 1 2 . 1 1 36 36 ASP N N 36 123.211 123.211 115.376 7.835 17355
620 1 2 . 1 1 36 36 ASP HA H 36 4.156 4.156 4.650 -0.494 17355
621 1 2 . 1 1 36 36 ASP CA C 36 57.258 57.258 55.209 2.049 17355
622 1 2 . 1 1 36 36 ASP CB C 36 40.400 40.400 41.814 -1.414 17355
623 1 2 . 1 1 36 36 ASP H H 36 8.880 8.880 8.469 0.411 17355
624 1 2 . 1 1 37 37 ASP N N 37 112.390 112.390 118.793 -6.403 17355
625 1 2 . 1 1 37 37 ASP HA H 37 4.614 4.614 4.658 -0.044 17355
626 1 2 . 1 1 37 37 ASP CA C 37 52.651 52.651 53.667 -1.016 17355
627 1 2 . 1 1 37 37 ASP CB C 37 40.100 40.100 40.766 -0.666 17355
628 1 2 . 1 1 37 37 ASP H H 37 7.800 7.800 8.154 -0.354 17355
629 1 2 . 1 1 38 38 SER N N 38 116.534 116.534 116.448 0.086 17355
630 1 2 . 1 1 38 38 SER HA H 38 4.147 4.147 4.371 -0.224 17355
631 1 2 . 1 1 38 38 SER CA C 38 61.186 61.186 58.278 2.908 17355
632 1 2 . 1 1 38 38 SER CB C 38 63.946 63.946 63.238 0.708 17355
633 1 2 . 1 1 38 38 SER H H 38 7.376 7.376 7.965 -0.589 17355
634 1 2 . 1 1 39 39 ARG N N 39 124.337 124.337 125.744 -1.407 17355
635 1 2 . 1 1 39 39 ARG HA H 39 4.521 4.521 4.370 0.151 17355
636 1 2 . 1 1 39 39 ARG CA C 39 55.049 55.049 55.275 -0.226 17355
637 1 2 . 1 1 39 39 ARG CB C 39 30.723 30.723 31.225 -0.502 17355
638 1 2 . 1 1 39 39 ARG H H 39 10.095 10.095 8.242 1.853 17355
639 1 2 . 1 1 40 40 PHE N N 40 122.834 122.834 119.157 3.677 17355
640 1 2 . 1 1 40 40 PHE HA H 40 3.916 3.916 4.686 -0.770 17355
641 1 2 . 1 1 40 40 PHE CA C 40 62.869 62.869 58.837 4.032 17355
642 1 2 . 1 1 40 40 PHE CB C 40 39.662 39.662 38.089 1.573 17355
643 1 2 . 1 1 40 40 PHE H H 40 7.498 7.498 8.238 -0.740 17355
644 1 2 . 1 1 41 41 LEU N N 41 117.682 117.682 118.137 -0.455 17355
645 1 2 . 1 1 41 41 LEU HA H 41 4.519 4.519 4.416 0.103 17355
646 1 2 . 1 1 41 41 LEU CA C 41 58.111 58.111 56.171 1.940 17355
647 1 2 . 1 1 41 41 LEU CB C 41 41.087 41.087 42.719 -1.632 17355
648 1 2 . 1 1 41 41 LEU H H 41 8.619 8.619 7.819 0.800 17355
649 1 2 . 1 1 42 42 ASP N N 42 114.800 114.800 120.048 -5.248 17355
650 1 2 . 1 1 42 42 ASP HA H 42 4.185 4.185 4.430 -0.245 17355
651 1 2 . 1 1 42 42 ASP CA C 42 57.713 57.713 56.593 1.120 17355
652 1 2 . 1 1 42 42 ASP CB C 42 41.206 41.206 41.099 0.107 17355
653 1 2 . 1 1 42 42 ASP H H 42 8.239 8.239 8.259 -0.020 17355
654 1 2 . 1 1 43 43 ASP N N 43 111.125 111.125 119.352 -8.227 17355
655 1 2 . 1 1 43 43 ASP HA H 43 4.915 4.915 4.517 0.398 17355
656 1 2 . 1 1 43 43 ASP CA C 43 56.105 56.105 56.315 -0.210 17355
657 1 2 . 1 1 43 43 ASP CB C 43 41.703 41.703 40.802 0.901 17355
658 1 2 . 1 1 43 43 ASP H H 43 7.355 7.355 8.283 -0.928 17355
659 1 2 . 1 1 44 44 LEU N N 44 114.924 114.924 118.190 -3.266 17355
660 1 2 . 1 1 44 44 LEU HA H 44 4.273 4.273 4.071 0.202 17355
661 1 2 . 1 1 44 44 LEU CA C 44 54.480 54.480 56.724 -2.244 17355
662 1 2 . 1 1 44 44 LEU CB C 44 41.671 41.671 42.467 -0.796 17355
663 1 2 . 1 1 44 44 LEU H H 44 7.172 7.172 7.574 -0.402 17355
664 1 2 . 1 1 45 45 HIS N N 45 114.429 114.429 114.551 -0.122 17355
665 1 2 . 1 1 45 45 HIS HA H 45 4.581 4.581 4.327 0.254 17355
666 1 2 . 1 1 45 45 HIS CA C 45 56.189 56.189 56.998 -0.809 17355
667 1 2 . 1 1 45 45 HIS CB C 45 26.073 26.073 28.112 -2.039 17355
668 1 2 . 1 1 45 45 HIS H H 45 7.308 7.308 7.919 -0.611 17355
669 1 2 . 1 1 46 46 MET N N 46 118.597 118.597 121.605 -3.008 17355
670 1 2 . 1 1 46 46 MET HA H 46 4.614 4.614 4.839 -0.225 17355
671 1 2 . 1 1 46 46 MET CA C 46 55.646 55.646 54.363 1.283 17355
672 1 2 . 1 1 46 46 MET CB C 46 35.501 35.501 37.149 -1.648 17355
673 1 2 . 1 1 46 46 MET H H 46 8.618 8.618 8.240 0.378 17355
674 1 2 . 1 1 47 47 SER N N 47 116.110 116.110 113.541 2.569 17355
675 1 2 . 1 1 47 47 SER HA H 47 4.559 4.559 4.956 -0.397 17355
676 1 2 . 1 1 47 47 SER CA C 47 56.696 56.696 57.133 -0.438 17355
677 1 2 . 1 1 47 47 SER CB C 47 65.888 65.888 66.419 -0.531 17355
678 1 2 . 1 1 47 47 SER H H 47 8.446 8.446 8.281 0.165 17355
679 1 2 . 1 1 48 48 SER N N 48 116.756 116.756 117.802 -1.046 17355
680 1 2 . 1 1 48 48 SER HA H 48 3.701 3.701 4.209 -0.508 17355
681 1 2 . 1 1 48 48 SER CA C 48 62.260 62.260 61.538 0.723 17355
682 1 2 . 1 1 48 48 SER CB C 48 62.289 62.289 62.792 -0.503 17355
683 1 2 . 1 1 48 48 SER H H 48 8.948 8.948 8.845 0.103 17355
684 1 2 . 1 1 49 49 ILE N N 49 122.227 122.227 120.913 1.314 17355
685 1 2 . 1 1 49 49 ILE HA H 49 3.806 3.806 3.868 -0.062 17355
686 1 2 . 1 1 49 49 ILE CA C 49 64.215 64.215 64.221 -0.006 17355
687 1 2 . 1 1 49 49 ILE CB C 49 38.059 38.059 36.553 1.506 17355
688 1 2 . 1 1 49 49 ILE H H 49 7.595 7.595 8.271 -0.676 17355
689 1 2 . 1 1 50 50 THR N N 50 120.233 120.233 115.960 4.273 17355
690 1 2 . 1 1 50 50 THR HA H 50 3.878 3.878 3.968 -0.090 17355
691 1 2 . 1 1 50 50 THR CA C 50 66.427 66.427 65.719 0.708 17355
692 1 2 . 1 1 50 50 THR CB C 50 68.223 68.223 68.338 -0.115 17355
693 1 2 . 1 1 50 50 THR H H 50 7.539 7.539 7.951 -0.412 17355
694 1 2 . 1 1 51 51 VAL N N 51 121.320 121.320 121.759 -0.439 17355
695 1 2 . 1 1 51 51 VAL HA H 51 3.090 3.090 3.565 -0.475 17355
696 1 2 . 1 1 51 51 VAL CA C 51 67.440 67.440 66.991 0.449 17355
697 1 2 . 1 1 51 51 VAL CB C 51 31.087 31.087 31.271 -0.184 17355
698 1 2 . 1 1 51 51 VAL H H 51 8.178 8.178 8.635 -0.457 17355
699 1 2 . 1 1 52 52 GLY N N 52 105.968 105.968 104.383 1.585 17355
700 1 2 . 1 1 52 52 GLY CA C 52 47.339 47.339 46.453 0.886 17355
701 1 2 . 1 1 52 52 GLY H H 52 8.004 8.004 7.767 0.237 17355
702 1 2 . 1 1 53 53 GLN N N 53 120.486 120.486 117.802 2.684 17355
703 1 2 . 1 1 53 53 GLN HA H 53 4.086 4.086 4.282 -0.196 17355
704 1 2 . 1 1 53 53 GLN CA C 53 58.919 58.919 57.383 1.536 17355
705 1 2 . 1 1 53 53 GLN CB C 53 27.867 27.867 29.373 -1.506 17355
706 1 2 . 1 1 53 53 GLN H H 53 7.675 7.675 7.824 -0.149 17355
707 1 2 . 1 1 54 54 LEU N N 54 121.901 121.901 115.466 6.435 17355
708 1 2 . 1 1 54 54 LEU HA H 54 4.049 4.049 4.638 -0.589 17355
709 1 2 . 1 1 54 54 LEU CA C 54 58.661 58.661 56.740 1.921 17355
710 1 2 . 1 1 54 54 LEU CB C 54 42.426 42.426 42.512 -0.086 17355
711 1 2 . 1 1 54 54 LEU H H 54 8.038 8.038 7.395 0.643 17355
712 1 2 . 1 1 55 55 VAL N N 55 119.226 119.226 120.956 -1.730 17355
713 1 2 . 1 1 55 55 VAL HA H 55 3.543 3.543 3.713 -0.170 17355
714 1 2 . 1 1 55 55 VAL CA C 55 66.871 66.871 64.845 2.026 17355
715 1 2 . 1 1 55 55 VAL CB C 55 31.392 31.392 31.165 0.227 17355
716 1 2 . 1 1 55 55 VAL H H 55 8.375 8.375 8.561 -0.186 17355
717 1 2 . 1 1 56 56 ASN N N 56 117.987 117.987 117.383 0.604 17355
718 1 2 . 1 1 56 56 ASN HA H 56 4.473 4.473 4.547 -0.074 17355
719 1 2 . 1 1 56 56 ASN CA C 56 56.557 56.557 55.722 0.834 17355
720 1 2 . 1 1 56 56 ASN CB C 56 38.509 38.509 38.372 0.137 17355
721 1 2 . 1 1 56 56 ASN H H 56 7.521 7.521 8.270 -0.749 17355
722 1 2 . 1 1 57 57 GLU N N 57 121.765 121.765 120.009 1.756 17355
723 1 2 . 1 1 57 57 GLU HA H 57 4.070 4.070 4.192 -0.122 17355
724 1 2 . 1 1 57 57 GLU CA C 57 59.496 59.496 58.807 0.689 17355
725 1 2 . 1 1 57 57 GLU CB C 57 29.395 29.395 29.730 -0.335 17355
726 1 2 . 1 1 57 57 GLU H H 57 8.225 8.225 7.707 0.518 17355
727 1 2 . 1 1 58 58 ALA N N 58 123.779 123.779 122.091 1.688 17355
728 1 2 . 1 1 58 58 ALA HA H 58 3.874 3.874 4.284 -0.410 17355
729 1 2 . 1 1 58 58 ALA CA C 58 55.227 55.227 54.941 0.286 17355
730 1 2 . 1 1 58 58 ALA CB C 58 18.388 18.388 18.253 0.135 17355
731 1 2 . 1 1 58 58 ALA H H 58 8.659 8.659 7.438 1.221 17355
732 1 2 . 1 1 59 59 ALA N N 59 118.656 118.656 121.763 -3.107 17355
733 1 2 . 1 1 59 59 ALA HA H 59 3.819 3.819 3.928 -0.109 17355
734 1 2 . 1 1 59 59 ALA CA C 59 55.871 55.871 55.225 0.646 17355
735 1 2 . 1 1 59 59 ALA CB C 59 18.152 18.152 18.529 -0.377 17355
736 1 2 . 1 1 59 59 ALA H H 59 8.537 8.537 7.687 0.850 17355
737 1 2 . 1 1 60 60 ARG N N 60 117.701 117.701 118.176 -0.475 17355
738 1 2 . 1 1 60 60 ARG HA H 60 4.096 4.096 3.906 0.190 17355
739 1 2 . 1 1 60 60 ARG CA C 60 59.609 59.609 58.616 0.993 17355
740 1 2 . 1 1 60 60 ARG CB C 60 29.974 29.974 29.314 0.660 17355
741 1 2 . 1 1 60 60 ARG H H 60 7.923 7.923 7.665 0.258 17355
742 1 2 . 1 1 61 61 ALA N N 61 123.271 123.271 121.948 1.323 17355
743 1 2 . 1 1 61 61 ALA HA H 61 4.137 4.137 4.094 0.043 17355
744 1 2 . 1 1 61 61 ALA CA C 61 54.912 54.912 54.277 0.635 17355
745 1 2 . 1 1 61 61 ALA CB C 61 18.304 18.304 18.420 -0.116 17355
746 1 2 . 1 1 61 61 ALA H H 61 8.044 8.044 7.466 0.578 17355
747 1 2 . 1 1 62 62 MET N N 62 114.725 114.725 116.080 -1.355 17355
748 1 2 . 1 1 62 62 MET HA H 62 4.297 4.297 4.145 0.152 17355
749 1 2 . 1 1 62 62 MET CA C 62 56.392 56.392 57.648 -1.256 17355
750 1 2 . 1 1 62 62 MET CB C 62 34.827 34.827 33.140 1.687 17355
751 1 2 . 1 1 62 62 MET H H 62 7.710 7.710 8.193 -0.483 17355
752 1 2 . 1 1 63 63 GLY N N 63 108.268 108.268 106.208 2.060 17355
753 1 2 . 1 1 63 63 GLY CA C 63 46.079 46.079 44.791 1.288 17355
754 1 2 . 1 1 63 63 GLY H H 63 7.846 7.846 7.584 0.262 17355
755 1 2 . 1 1 64 64 LEU N N 64 119.547 119.547 120.147 -0.600 17355
756 1 2 . 1 1 64 64 LEU HA H 64 4.526 4.526 4.549 -0.023 17355
757 1 2 . 1 1 64 64 LEU CA C 64 53.605 53.605 54.237 -0.632 17355
758 1 2 . 1 1 64 64 LEU CB C 64 43.784 43.784 42.483 1.301 17355
759 1 2 . 1 1 64 64 LEU H H 64 8.183 8.183 8.271 -0.088 17355
760 1 2 . 1 1 65 65 SER N N 65 115.418 115.418 112.320 3.098 17355
761 1 2 . 1 1 65 65 SER HA H 65 4.328 4.328 4.221 0.107 17355
762 1 2 . 1 1 65 65 SER CA C 65 58.319 58.319 59.052 -0.733 17355
763 1 2 . 1 1 65 65 SER CB C 65 64.181 64.181 63.348 0.833 17355
764 1 2 . 1 1 65 65 SER H H 65 8.302 8.302 8.330 -0.028 17355
765 1 2 . 1 1 66 66 ALA N N 66 124.266 124.266 125.322 -1.056 17355
766 1 2 . 1 1 66 66 ALA HA H 66 4.212 4.212 4.584 -0.372 17355
767 1 2 . 1 1 66 66 ALA CA C 66 52.624 52.624 52.497 0.127 17355
768 1 2 . 1 1 66 66 ALA CB C 66 19.309 19.309 18.328 0.981 17355
769 1 2 . 1 1 66 66 ALA H H 66 8.262 8.262 8.558 -0.296 17355
770 1 2 . 1 1 67 67 VAL N N 67 118.373 118.373 117.664 0.709 17355
771 1 2 . 1 1 67 67 VAL HA H 67 4.049 4.049 4.144 -0.095 17355
772 1 2 . 1 1 67 67 VAL CA C 67 62.010 62.010 62.103 -0.094 17355
773 1 2 . 1 1 67 67 VAL CB C 67 33.495 33.495 32.288 1.207 17355
774 1 2 . 1 1 67 67 VAL H H 67 7.949 7.949 7.330 0.619 17355
775 1 2 . 1 1 68 68 ALA N N 68 127.696 127.696 119.886 7.810 17355
776 1 2 . 1 1 68 68 ALA HA H 68 4.308 4.308 4.033 0.275 17355
777 1 2 . 1 1 68 68 ALA CA C 68 52.070 52.070 53.967 -1.897 17355
778 1 2 . 1 1 68 68 ALA CB C 68 19.220 19.220 17.649 1.571 17355
779 1 2 . 1 1 68 68 ALA H H 68 8.319 8.319 8.147 0.172 17355
780 1 2 . 1 1 69 69 MET N N 69 120.285 120.285 111.213 9.072 17355
781 1 2 . 1 1 69 69 MET HA H 69 4.664 4.664 4.797 -0.133 17355
782 1 2 . 1 1 69 69 MET CA C 69 53.004 53.004 54.042 -1.038 17355
783 1 2 . 1 1 69 69 MET CB C 69 32.678 32.678 32.282 0.396 17355
784 1 2 . 1 1 69 69 MET H H 69 8.224 8.224 7.360 0.864 17355
785 1 2 . 1 1 70 70 PRO HA H 70 4.446 4.446 4.437 0.009 17355
786 1 2 . 1 1 70 70 PRO CA C 70 63.452 63.452 64.687 -1.235 17355
787 1 2 . 1 1 70 70 PRO CB C 70 32.012 32.012 32.259 -0.247 17355
788 1 2 . 1 1 71 71 THR N N 71 112.663 112.663 109.584 3.079 17355
789 1 2 . 1 1 71 71 THR HA H 71 4.074 4.074 3.767 0.307 17355
790 1 2 . 1 1 71 71 THR CA C 71 62.869 62.869 61.506 1.363 17355
791 1 2 . 1 1 71 71 THR CB C 71 69.516 69.516 69.807 -0.291 17355
792 1 2 . 1 1 71 71 THR H H 71 7.957 7.957 7.536 0.421 17355
793 1 2 . 1 1 72 72 ASN N N 72 120.054 120.054 119.455 0.599 17355
794 1 2 . 1 1 72 72 ASN HA H 72 4.695 4.695 3.972 0.723 17355
795 1 2 . 1 1 72 72 ASN CA C 72 52.856 52.856 55.896 -3.040 17355
796 1 2 . 1 1 72 72 ASN CB C 72 38.165 38.165 37.692 0.473 17355
797 1 2 . 1 1 72 72 ASN H H 72 8.227 8.227 8.219 0.008 17355
798 1 2 . 1 1 73 73 PHE N N 73 121.570 121.570 115.288 6.282 17355
799 1 2 . 1 1 73 73 PHE HA H 73 4.342 4.342 3.757 0.585 17355
800 1 2 . 1 1 73 73 PHE CA C 73 59.609 59.609 60.477 -0.868 17355
801 1 2 . 1 1 73 73 PHE CB C 73 39.000 39.000 36.772 2.228 17355
802 1 2 . 1 1 73 73 PHE H H 73 8.331 8.331 8.265 0.066 17355
803 1 2 . 1 1 74 74 ALA N N 74 121.047 121.047 122.079 -1.032 17355
804 1 2 . 1 1 74 74 ALA HA H 74 4.074 4.074 4.158 -0.084 17355
805 1 2 . 1 1 74 74 ALA CA C 74 54.705 54.705 54.987 -0.282 17355
806 1 2 . 1 1 74 74 ALA CB C 74 19.159 19.159 19.013 0.146 17355
807 1 2 . 1 1 74 74 ALA H H 74 8.163 8.163 8.087 0.076 17355
808 1 2 . 1 1 75 75 THR N N 75 104.824 104.824 114.057 -9.233 17355
809 1 2 . 1 1 75 75 THR HA H 75 4.475 4.475 4.370 0.105 17355
810 1 2 . 1 1 75 75 THR CA C 75 60.669 60.669 61.472 -0.804 17355
811 1 2 . 1 1 75 75 THR CB C 75 69.543 69.543 66.864 2.679 17355
812 1 2 . 1 1 75 75 THR H H 75 7.581 7.581 8.216 -0.635 17355
813 1 2 . 1 1 76 76 ALA N N 76 124.548 124.548 125.802 -1.254 17355
814 1 2 . 1 1 76 76 ALA HA H 76 4.714 4.714 4.828 -0.114 17355
815 1 2 . 1 1 76 76 ALA CA C 76 52.929 52.929 50.602 2.326 17355
816 1 2 . 1 1 76 76 ALA CB C 76 20.661 20.661 22.195 -1.534 17355
817 1 2 . 1 1 76 76 ALA H H 76 7.689 7.689 7.935 -0.246 17355
818 1 2 . 1 1 77 77 THR N N 77 108.654 108.654 110.911 -2.257 17355
819 1 2 . 1 1 77 77 THR HA H 77 5.017 5.017 4.630 0.387 17355
820 1 2 . 1 1 77 77 THR CA C 77 58.847 58.847 59.813 -0.966 17355
821 1 2 . 1 1 77 77 THR CB C 77 73.369 73.369 71.955 1.414 17355
822 1 2 . 1 1 77 77 THR H H 77 7.495 7.495 8.175 -0.680 17355
823 1 2 . 1 1 78 78 VAL N N 78 120.107 120.107 117.139 2.968 17355
824 1 2 . 1 1 78 78 VAL HA H 78 3.418 3.418 4.050 -0.632 17355
825 1 2 . 1 1 78 78 VAL CA C 78 67.446 67.446 66.494 0.952 17355
826 1 2 . 1 1 78 78 VAL CB C 78 31.949 31.949 31.560 0.389 17355
827 1 2 . 1 1 78 78 VAL H H 78 7.373 7.373 7.955 -0.582 17355
828 1 2 . 1 1 79 79 ARG N N 79 117.131 117.131 118.612 -1.481 17355
829 1 2 . 1 1 79 79 ARG HA H 79 3.877 3.877 4.186 -0.309 17355
830 1 2 . 1 1 79 79 ARG CA C 79 59.566 59.566 57.994 1.572 17355
831 1 2 . 1 1 79 79 ARG CB C 79 30.174 30.174 29.669 0.505 17355
832 1 2 . 1 1 79 79 ARG H H 79 8.518 8.518 7.910 0.608 17355
833 1 2 . 1 1 80 80 GLU N N 80 118.542 118.542 120.757 -2.215 17355
834 1 2 . 1 1 80 80 GLU HA H 80 4.033 4.033 4.133 -0.100 17355
835 1 2 . 1 1 80 80 GLU CA C 80 59.427 59.427 59.335 0.092 17355
836 1 2 . 1 1 80 80 GLU CB C 80 30.206 30.206 29.731 0.475 17355
837 1 2 . 1 1 80 80 GLU H H 80 7.847 7.847 8.063 -0.216 17355
838 1 2 . 1 1 81 81 MET N N 81 119.630 119.630 119.070 0.560 17355
839 1 2 . 1 1 81 81 MET HA H 81 4.158 4.158 4.150 0.008 17355
840 1 2 . 1 1 81 81 MET CA C 81 59.025 59.025 59.051 -0.026 17355
841 1 2 . 1 1 81 81 MET CB C 81 32.916 32.916 32.697 0.219 17355
842 1 2 . 1 1 81 81 MET H H 81 8.211 8.211 8.324 -0.113 17355
843 1 2 . 1 1 82 82 ALA N N 82 120.463 120.463 120.941 -0.478 17355
844 1 2 . 1 1 82 82 ALA HA H 82 3.911 3.911 4.196 -0.285 17355
845 1 2 . 1 1 82 82 ALA CA C 82 56.004 56.004 54.473 1.531 17355
846 1 2 . 1 1 82 82 ALA CB C 82 18.430 18.430 18.378 0.052 17355
847 1 2 . 1 1 82 82 ALA H H 82 7.978 7.978 7.631 0.347 17355
848 1 2 . 1 1 83 83 GLU N N 83 116.663 116.663 119.949 -3.286 17355
849 1 2 . 1 1 83 83 GLU HA H 83 4.034 4.034 3.918 0.116 17355
850 1 2 . 1 1 83 83 GLU CA C 83 59.476 59.476 59.746 -0.270 17355
851 1 2 . 1 1 83 83 GLU CB C 83 29.470 29.470 29.588 -0.118 17355
852 1 2 . 1 1 83 83 GLU H H 83 8.608 8.608 7.846 0.762 17355
853 1 2 . 1 1 84 84 ALA N N 84 122.742 122.742 121.323 1.419 17355
854 1 2 . 1 1 84 84 ALA HA H 84 4.241 4.241 3.924 0.317 17355
855 1 2 . 1 1 84 84 ALA CA C 84 54.970 54.970 55.326 -0.356 17355
856 1 2 . 1 1 84 84 ALA CB C 84 18.150 18.150 18.298 -0.148 17355
857 1 2 . 1 1 84 84 ALA H H 84 7.918 7.918 7.691 0.227 17355
858 1 2 . 1 1 85 85 LEU N N 85 119.158 119.158 118.312 0.846 17355
859 1 2 . 1 1 85 85 LEU HA H 85 3.945 3.945 3.913 0.032 17355
860 1 2 . 1 1 85 85 LEU CA C 85 57.849 57.849 57.390 0.459 17355
861 1 2 . 1 1 85 85 LEU CB C 85 41.884 41.884 41.901 -0.017 17355
862 1 2 . 1 1 85 85 LEU H H 85 7.692 7.692 7.722 -0.030 17355
863 1 2 . 1 1 86 86 GLU N N 86 118.441 118.441 120.066 -1.625 17355
864 1 2 . 1 1 86 86 GLU HA H 86 4.053 4.053 4.055 -0.002 17355
865 1 2 . 1 1 86 86 GLU CA C 86 59.131 59.131 58.900 0.231 17355
866 1 2 . 1 1 86 86 GLU CB C 86 29.868 29.868 28.986 0.882 17355
867 1 2 . 1 1 86 86 GLU H H 86 8.152 8.152 8.684 -0.532 17355
868 1 2 . 1 1 87 87 ALA N N 87 120.690 120.690 121.320 -0.630 17355
869 1 2 . 1 1 87 87 ALA HA H 87 4.139 4.139 4.253 -0.114 17355
870 1 2 . 1 1 87 87 ALA CA C 87 54.506 54.506 54.111 0.396 17355
871 1 2 . 1 1 87 87 ALA CB C 87 18.435 18.435 18.439 -0.004 17355
872 1 2 . 1 1 87 87 ALA H H 87 7.899 7.899 8.198 -0.299 17355
873 1 2 . 1 1 88 88 ARG N N 88 117.642 117.642 118.666 -1.024 17355
874 1 2 . 1 1 88 88 ARG HA H 88 4.204 4.204 4.049 0.155 17355
875 1 2 . 1 1 88 88 ARG CA C 88 57.435 57.435 58.300 -0.865 17355
876 1 2 . 1 1 88 88 ARG CB C 88 30.106 30.106 29.344 0.762 17355
877 1 2 . 1 1 88 88 ARG H H 88 7.593 7.593 7.956 -0.363 17355
878 1 2 . 1 1 89 89 GLU N N 89 121.080 121.080 117.947 3.133 17355
879 1 2 . 1 1 89 89 GLU HA H 89 4.047 4.047 4.038 0.009 17355
880 1 2 . 1 1 89 89 GLU CA C 89 58.858 58.858 58.602 0.256 17355
881 1 2 . 1 1 89 89 GLU CB C 89 29.912 29.912 28.900 1.012 17355
882 1 2 . 1 1 89 89 GLU H H 89 8.222 8.222 7.809 0.413 17355
883 1 2 . 1 1 90 90 ARG N N 90 117.834 117.834 118.420 -0.586 17355
884 1 2 . 1 1 90 90 ARG HA H 90 4.212 4.212 4.149 0.063 17355
885 1 2 . 1 1 90 90 ARG CA C 90 57.409 57.409 58.182 -0.773 17355
886 1 2 . 1 1 90 90 ARG CB C 90 30.906 30.906 30.942 -0.036 17355
887 1 2 . 1 1 90 90 ARG H H 90 7.924 7.924 7.562 0.362 17355
888 1 2 . 1 1 91 91 GLU N N 91 118.786 118.786 117.218 1.568 17355
889 1 2 . 1 1 91 91 GLU HA H 91 4.254 4.254 4.381 -0.127 17355
890 1 2 . 1 1 91 91 GLU CA C 91 56.693 56.693 56.573 0.120 17355
891 1 2 . 1 1 91 91 GLU CB C 91 30.416 30.416 30.748 -0.332 17355
892 1 2 . 1 1 91 91 GLU H H 91 7.749 7.749 7.583 0.166 17355
893 1 2 . 1 1 92 92 ALA N N 92 125.247 125.247 128.222 -2.975 17355
894 1 2 . 1 1 92 92 ALA HA H 92 4.551 4.551 4.930 -0.379 17355
895 1 2 . 1 1 92 92 ALA CA C 92 51.073 51.073 50.251 0.822 17355
896 1 2 . 1 1 92 92 ALA CB C 92 18.443 18.443 19.042 -0.599 17355
897 1 2 . 1 1 92 92 ALA H H 92 7.888 7.888 8.350 -0.462 17355
898 1 2 . 1 1 93 93 PRO HA H 93 4.383 4.383 4.451 -0.068 17355
899 1 2 . 1 1 93 93 PRO CA C 93 63.744 63.744 62.807 0.937 17355
900 1 2 . 1 1 93 93 PRO CB C 93 32.122 32.122 32.217 -0.095 17355
901 1 2 . 1 1 94 94 HIS N N 94 118.597 118.597 117.617 0.980 17355
902 1 2 . 1 1 94 94 HIS HA H 94 4.639 4.639 4.902 -0.263 17355
903 1 2 . 1 1 94 94 HIS CA C 94 56.044 56.044 56.030 0.014 17355
904 1 2 . 1 1 94 94 HIS CB C 94 29.789 29.789 29.491 0.298 17355
905 1 2 . 1 1 94 94 HIS H H 94 8.392 8.392 8.491 -0.099 17355
906 1 2 . 1 1 95 95 LEU N N 95 123.443 123.443 122.799 0.644 17355
907 1 2 . 1 1 95 95 LEU HA H 95 4.287 4.287 4.853 -0.566 17355
908 1 2 . 1 1 95 95 LEU CA C 95 55.233 55.233 53.370 1.863 17355
909 1 2 . 1 1 95 95 LEU CB C 95 42.710 42.710 43.446 -0.736 17355
910 1 2 . 1 1 95 95 LEU H H 95 8.061 8.061 8.168 -0.107 17355
911 1 2 . 1 1 96 96 GLU N N 96 121.295 121.295 120.768 0.527 17355
912 1 2 . 1 1 96 96 GLU HA H 96 4.176 4.176 4.757 -0.581 17355
913 1 2 . 1 1 96 96 GLU CA C 96 56.706 56.706 56.163 0.543 17355
914 1 2 . 1 1 96 96 GLU CB C 96 30.319 30.319 30.766 -0.447 17355
915 1 2 . 1 1 96 96 GLU H H 96 8.346 8.346 8.496 -0.150 17355
916 1 2 . 1 1 97 97 HIS N N 97 119.932 119.932 121.303 -1.371 17355
917 1 2 . 1 1 97 97 HIS HA H 97 4.555 4.555 4.674 -0.119 17355
918 1 2 . 1 1 97 97 HIS CA C 97 56.042 56.042 54.886 1.156 17355
919 1 2 . 1 1 97 97 HIS H H 97 8.251 8.251 8.640 -0.389 17355
920 1 2 . 1 1 98 98 HIS N N 98 125.446 125.446 119.509 5.937 17355
921 1 2 . 1 1 98 98 HIS HA H 98 4.363 4.363 5.045 -0.682 17355
922 1 2 . 1 1 98 98 HIS CA C 98 57.303 57.303 55.063 2.240 17355
923 1 2 . 1 1 98 98 HIS CB C 98 30.319 30.319 30.503 -0.184 17355
924 1 2 . 1 1 98 98 HIS H H 98 8.054 8.054 7.929 0.125 17355
925 1 3 . 1 1 3 3 ARG HA H 3 4.321 4.321 4.099 0.222 17355
926 1 3 . 1 1 3 3 ARG CA C 3 56.560 56.560 56.355 0.205 17355
927 1 3 . 1 1 4 4 ALA N N 4 125.797 125.797 123.158 2.639 17355
928 1 3 . 1 1 4 4 ALA HA H 4 4.283 4.283 4.374 -0.091 17355
929 1 3 . 1 1 4 4 ALA CA C 4 52.900 52.900 51.615 1.285 17355
930 1 3 . 1 1 4 4 ALA CB C 4 19.411 19.411 19.978 -0.567 17355
931 1 3 . 1 1 4 4 ALA H H 4 8.563 8.563 8.239 0.324 17355
932 1 3 . 1 1 5 5 ASP N N 5 118.416 118.416 119.216 -0.800 17355
933 1 3 . 1 1 5 5 ASP HA H 5 4.584 4.584 4.444 0.140 17355
934 1 3 . 1 1 5 5 ASP CA C 5 54.337 54.337 55.437 -1.100 17355
935 1 3 . 1 1 5 5 ASP CB C 5 41.186 41.186 41.086 0.100 17355
936 1 3 . 1 1 5 5 ASP H H 5 8.208 8.208 8.407 -0.199 17355
937 1 3 . 1 1 6 6 ASP N N 6 120.632 120.632 119.854 0.778 17355
938 1 3 . 1 1 6 6 ASP HA H 6 4.578 4.578 4.286 0.292 17355
939 1 3 . 1 1 6 6 ASP CA C 6 54.589 54.589 55.393 -0.804 17355
940 1 3 . 1 1 6 6 ASP CB C 6 41.239 41.239 40.466 0.773 17355
941 1 3 . 1 1 6 6 ASP H H 6 8.140 8.140 8.585 -0.445 17355
942 1 3 . 1 1 7 7 THR N N 7 113.693 113.693 113.580 0.113 17355
943 1 3 . 1 1 7 7 THR HA H 7 4.245 4.245 3.936 0.309 17355
944 1 3 . 1 1 7 7 THR CA C 7 62.392 62.392 63.869 -1.477 17355
945 1 3 . 1 1 7 7 THR CB C 7 69.721 69.721 67.742 1.979 17355
946 1 3 . 1 1 7 7 THR H H 7 8.045 8.045 8.587 -0.542 17355
947 1 3 . 1 1 8 8 ALA N N 8 126.414 126.414 124.470 1.944 17355
948 1 3 . 1 1 8 8 ALA HA H 8 4.314 4.314 4.459 -0.145 17355
949 1 3 . 1 1 8 8 ALA CA C 8 52.253 52.253 51.638 0.615 17355
950 1 3 . 1 1 8 8 ALA CB C 8 19.464 19.464 20.741 -1.278 17355
951 1 3 . 1 1 8 8 ALA H H 8 8.139 8.139 8.197 -0.058 17355
952 1 3 . 1 1 9 9 LEU N N 9 122.921 122.921 117.727 5.194 17355
953 1 3 . 1 1 9 9 LEU HA H 9 4.559 4.559 4.849 -0.290 17355
954 1 3 . 1 1 9 9 LEU CA C 9 53.088 53.088 52.847 0.241 17355
955 1 3 . 1 1 9 9 LEU CB C 9 41.929 41.929 40.502 1.427 17355
956 1 3 . 1 1 9 9 LEU H H 9 8.113 8.113 8.260 -0.147 17355
957 1 3 . 1 1 10 10 PRO HA H 10 4.367 4.367 4.286 0.081 17355
958 1 3 . 1 1 10 10 PRO CA C 10 63.373 63.373 63.582 -0.209 17355
959 1 3 . 1 1 10 10 PRO CB C 10 31.975 31.975 31.891 0.084 17355
960 1 3 . 1 1 11 11 ALA N N 11 124.349 124.349 120.638 3.711 17355
961 1 3 . 1 1 11 11 ALA HA H 11 4.262 4.262 3.997 0.265 17355
962 1 3 . 1 1 11 11 ALA CA C 11 52.496 52.496 52.476 0.020 17355
963 1 3 . 1 1 11 11 ALA CB C 11 19.424 19.424 17.990 1.434 17355
964 1 3 . 1 1 11 11 ALA H H 11 8.317 8.317 8.051 0.266 17355
965 1 3 . 1 1 12 12 ALA N N 12 123.291 123.291 124.865 -1.574 17355
966 1 3 . 1 1 12 12 ALA HA H 12 4.380 4.380 4.406 -0.026 17355
967 1 3 . 1 1 12 12 ALA CA C 12 52.461 52.461 51.904 0.556 17355
968 1 3 . 1 1 12 12 ALA CB C 12 19.557 19.557 19.684 -0.127 17355
969 1 3 . 1 1 12 12 ALA H H 12 8.287 8.287 8.159 0.128 17355
970 1 3 . 1 1 13 13 THR N N 13 112.758 112.758 114.211 -1.453 17355
971 1 3 . 1 1 13 13 THR HA H 13 4.350 4.350 4.462 -0.112 17355
972 1 3 . 1 1 13 13 THR CA C 13 62.074 62.074 61.968 0.107 17355
973 1 3 . 1 1 13 13 THR CB C 13 70.070 70.070 68.606 1.464 17355
974 1 3 . 1 1 13 13 THR H H 13 8.074 8.074 7.862 0.212 17355
975 1 3 . 1 1 14 14 GLY N N 14 110.774 110.774 113.275 -2.501 17355
976 1 3 . 1 1 14 14 GLY CA C 14 45.692 45.692 45.617 0.076 17355
977 1 3 . 1 1 14 14 GLY H H 14 8.405 8.405 8.017 0.388 17355
978 1 3 . 1 1 15 15 ALA N N 15 124.127 124.127 127.045 -2.918 17355
979 1 3 . 1 1 15 15 ALA HA H 15 4.137 4.137 3.855 0.282 17355
980 1 3 . 1 1 15 15 ALA CA C 15 55.368 55.368 54.102 1.266 17355
981 1 3 . 1 1 15 15 ALA CB C 15 20.100 20.100 17.727 2.373 17355
982 1 3 . 1 1 15 15 ALA H H 15 8.866 8.866 8.278 0.588 17355
983 1 3 . 1 1 16 16 LEU N N 16 118.013 118.013 122.225 -4.212 17355
984 1 3 . 1 1 16 16 LEU HA H 16 3.870 3.870 4.004 -0.134 17355
985 1 3 . 1 1 16 16 LEU CA C 16 58.820 58.820 58.059 0.760 17355
986 1 3 . 1 1 16 16 LEU CB C 16 41.332 41.332 41.301 0.031 17355
987 1 3 . 1 1 16 16 LEU H H 16 8.414 8.414 8.310 0.104 17355
988 1 3 . 1 1 17 17 GLU N N 17 117.730 117.730 117.563 0.167 17355
989 1 3 . 1 1 17 17 GLU HA H 17 3.978 3.978 4.147 -0.169 17355
990 1 3 . 1 1 17 17 GLU CA C 17 59.909 59.909 58.211 1.698 17355
991 1 3 . 1 1 17 17 GLU CB C 17 29.212 29.212 28.668 0.544 17355
992 1 3 . 1 1 17 17 GLU H H 17 8.088 8.088 8.352 -0.264 17355
993 1 3 . 1 1 18 18 LEU N N 18 121.355 121.355 120.528 0.827 17355
994 1 3 . 1 1 18 18 LEU HA H 18 4.165 4.165 4.082 0.083 17355
995 1 3 . 1 1 18 18 LEU CA C 18 58.469 58.469 58.011 0.458 17355
996 1 3 . 1 1 18 18 LEU CB C 18 42.459 42.459 42.115 0.344 17355
997 1 3 . 1 1 18 18 LEU H H 18 7.767 7.767 7.585 0.182 17355
998 1 3 . 1 1 19 19 VAL N N 19 118.522 118.522 116.617 1.905 17355
999 1 3 . 1 1 19 19 VAL HA H 19 3.424 3.424 3.758 -0.334 17355
1000 1 3 . 1 1 19 19 VAL CA C 19 67.958 67.958 65.978 1.980 17355
1001 1 3 . 1 1 19 19 VAL CB C 19 31.922 31.922 31.930 -0.007 17355
1002 1 3 . 1 1 19 19 VAL H H 19 8.661 8.661 7.657 1.004 17355
1003 1 3 . 1 1 20 20 ARG N N 20 117.959 117.959 117.640 0.319 17355
1004 1 3 . 1 1 20 20 ARG HA H 20 3.576 3.576 4.281 -0.705 17355
1005 1 3 . 1 1 20 20 ARG CA C 20 60.994 60.994 56.824 4.170 17355
1006 1 3 . 1 1 20 20 ARG CB C 20 30.703 30.703 28.051 2.652 17355
1007 1 3 . 1 1 20 20 ARG H H 20 8.705 8.705 8.260 0.445 17355
1008 1 3 . 1 1 21 21 HIS N N 21 115.245 115.245 116.380 -1.135 17355
1009 1 3 . 1 1 21 21 HIS HA H 21 4.144 4.144 4.572 -0.428 17355
1010 1 3 . 1 1 21 21 HIS CA C 21 60.536 60.536 57.026 3.510 17355
1011 1 3 . 1 1 21 21 HIS CB C 21 29.099 29.099 32.714 -3.615 17355
1012 1 3 . 1 1 21 21 HIS H H 21 7.811 7.811 8.249 -0.438 17355
1013 1 3 . 1 1 22 22 LEU N N 22 119.884 119.884 120.258 -0.374 17355
1014 1 3 . 1 1 22 22 LEU HA H 22 4.078 4.078 4.133 -0.055 17355
1015 1 3 . 1 1 22 22 LEU CA C 22 58.164 58.164 58.121 0.043 17355
1016 1 3 . 1 1 22 22 LEU CB C 22 42.889 42.889 42.107 0.782 17355
1017 1 3 . 1 1 22 22 LEU H H 22 8.301 8.301 7.655 0.646 17355
1018 1 3 . 1 1 23 23 VAL N N 23 119.391 119.391 118.585 0.806 17355
1019 1 3 . 1 1 23 23 VAL HA H 23 3.429 3.429 3.665 -0.236 17355
1020 1 3 . 1 1 23 23 VAL CA C 23 67.179 67.179 66.700 0.479 17355
1021 1 3 . 1 1 23 23 VAL CB C 23 31.366 31.366 31.501 -0.135 17355
1022 1 3 . 1 1 23 23 VAL H H 23 8.897 8.897 7.374 1.523 17355
1023 1 3 . 1 1 24 24 ALA N N 24 121.610 121.610 121.337 0.273 17355
1024 1 3 . 1 1 24 24 ALA HA H 24 3.851 3.851 3.980 -0.129 17355
1025 1 3 . 1 1 24 24 ALA CA C 24 55.944 55.944 55.054 0.890 17355
1026 1 3 . 1 1 24 24 ALA CB C 24 18.042 18.042 18.492 -0.450 17355
1027 1 3 . 1 1 24 24 ALA H H 24 8.276 8.276 8.165 0.111 17355
1028 1 3 . 1 1 25 25 GLU N N 25 114.822 114.822 116.717 -1.895 17355
1029 1 3 . 1 1 25 25 GLU HA H 25 4.042 4.042 4.269 -0.227 17355
1030 1 3 . 1 1 25 25 GLU CA C 25 59.255 59.255 58.436 0.819 17355
1031 1 3 . 1 1 25 25 GLU CB C 25 29.951 29.951 29.177 0.774 17355
1032 1 3 . 1 1 25 25 GLU H H 25 7.693 7.693 8.074 -0.381 17355
1033 1 3 . 1 1 26 26 ARG N N 26 118.510 118.510 117.087 1.423 17355
1034 1 3 . 1 1 26 26 ARG HA H 26 4.252 4.252 4.361 -0.109 17355
1035 1 3 . 1 1 26 26 ARG CA C 26 57.090 57.090 56.394 0.696 17355
1036 1 3 . 1 1 26 26 ARG CB C 26 30.080 30.080 30.081 -0.001 17355
1037 1 3 . 1 1 26 26 ARG H H 26 7.783 7.783 7.488 0.295 17355
1038 1 3 . 1 1 27 27 ALA N N 27 120.375 120.375 119.663 0.712 17355
1039 1 3 . 1 1 27 27 ALA HA H 27 4.342 4.342 4.555 -0.213 17355
1040 1 3 . 1 1 27 27 ALA CA C 27 52.134 52.134 52.355 -0.221 17355
1041 1 3 . 1 1 27 27 ALA CB C 27 19.283 19.283 21.395 -2.112 17355
1042 1 3 . 1 1 27 27 ALA H H 27 8.638 8.638 7.954 0.684 17355
1043 1 3 . 1 1 28 28 GLU N N 28 115.494 115.494 116.268 -0.774 17355
1044 1 3 . 1 1 28 28 GLU HA H 28 3.873 3.873 4.399 -0.526 17355
1045 1 3 . 1 1 28 28 GLU CA C 28 56.940 56.940 57.107 -0.167 17355
1046 1 3 . 1 1 28 28 GLU CB C 28 27.058 27.058 30.687 -3.629 17355
1047 1 3 . 1 1 28 28 GLU H H 28 7.734 7.734 8.076 -0.342 17355
1048 1 3 . 1 1 29 29 LEU N N 29 119.978 119.978 120.812 -0.834 17355
1049 1 3 . 1 1 29 29 LEU HA H 29 4.898 4.898 4.984 -0.086 17355
1050 1 3 . 1 1 29 29 LEU CA C 29 51.498 51.498 51.601 -0.103 17355
1051 1 3 . 1 1 29 29 LEU CB C 29 45.348 45.348 45.254 0.094 17355
1052 1 3 . 1 1 29 29 LEU H H 29 8.075 8.075 7.974 0.101 17355
1053 1 3 . 1 1 30 30 PRO HA H 30 4.461 4.461 4.465 -0.004 17355
1054 1 3 . 1 1 30 30 PRO CA C 30 62.524 62.524 62.798 -0.274 17355
1055 1 3 . 1 1 30 30 PRO CB C 30 32.015 32.015 30.154 1.861 17355
1056 1 3 . 1 1 31 31 VAL N N 31 123.773 123.773 121.247 2.526 17355
1057 1 3 . 1 1 31 31 VAL HA H 31 3.540 3.540 3.886 -0.346 17355
1058 1 3 . 1 1 31 31 VAL CA C 31 65.493 65.493 64.264 1.229 17355
1059 1 3 . 1 1 31 31 VAL CB C 31 31.865 31.865 31.672 0.193 17355
1060 1 3 . 1 1 31 31 VAL H H 31 8.432 8.432 8.219 0.213 17355
1061 1 3 . 1 1 32 32 GLU N N 32 117.215 117.215 120.125 -2.910 17355
1062 1 3 . 1 1 32 32 GLU HA H 32 4.053 4.053 4.682 -0.629 17355
1063 1 3 . 1 1 32 32 GLU CA C 32 59.131 59.131 56.833 2.298 17355
1064 1 3 . 1 1 32 32 GLU CB C 32 28.781 28.781 30.233 -1.452 17355
1065 1 3 . 1 1 32 32 GLU H H 32 8.971 8.971 8.332 0.639 17355
1066 1 3 . 1 1 33 33 VAL N N 33 113.611 113.611 115.953 -2.342 17355
1067 1 3 . 1 1 33 33 VAL HA H 33 4.214 4.214 4.467 -0.253 17355
1068 1 3 . 1 1 33 33 VAL CA C 33 61.795 61.795 61.026 0.769 17355
1069 1 3 . 1 1 33 33 VAL CB C 33 32.094 32.094 31.290 0.804 17355
1070 1 3 . 1 1 33 33 VAL H H 33 7.470 7.470 7.564 -0.094 17355
1071 1 3 . 1 1 34 34 LEU N N 34 123.533 123.533 123.114 0.419 17355
1072 1 3 . 1 1 34 34 LEU HA H 34 4.114 4.114 4.404 -0.290 17355
1073 1 3 . 1 1 34 34 LEU CA C 34 54.877 54.877 54.888 -0.011 17355
1074 1 3 . 1 1 34 34 LEU CB C 34 42.590 42.590 42.111 0.479 17355
1075 1 3 . 1 1 34 34 LEU H H 34 7.300 7.300 7.841 -0.541 17355
1076 1 3 . 1 1 35 35 ARG N N 35 125.820 125.820 126.153 -0.333 17355
1077 1 3 . 1 1 35 35 ARG HA H 35 4.578 4.578 4.089 0.489 17355
1078 1 3 . 1 1 35 35 ARG CA C 35 54.619 54.619 56.620 -2.001 17355
1079 1 3 . 1 1 35 35 ARG CB C 35 31.909 31.909 30.770 1.139 17355
1080 1 3 . 1 1 35 35 ARG H H 35 8.415 8.415 8.440 -0.025 17355
1081 1 3 . 1 1 36 36 ASP N N 36 123.211 123.211 116.886 6.325 17355
1082 1 3 . 1 1 36 36 ASP HA H 36 4.156 4.156 4.609 -0.453 17355
1083 1 3 . 1 1 36 36 ASP CA C 36 57.258 57.258 55.415 1.843 17355
1084 1 3 . 1 1 36 36 ASP CB C 36 40.400 40.400 41.513 -1.113 17355
1085 1 3 . 1 1 36 36 ASP H H 36 8.880 8.880 8.595 0.285 17355
1086 1 3 . 1 1 37 37 ASP N N 37 112.390 112.390 118.603 -6.213 17355
1087 1 3 . 1 1 37 37 ASP HA H 37 4.614 4.614 4.707 -0.093 17355
1088 1 3 . 1 1 37 37 ASP CA C 37 52.651 52.651 53.403 -0.751 17355
1089 1 3 . 1 1 37 37 ASP CB C 37 40.100 40.100 40.890 -0.790 17355
1090 1 3 . 1 1 37 37 ASP H H 37 7.800 7.800 8.086 -0.286 17355
1091 1 3 . 1 1 38 38 SER N N 38 116.534 116.534 116.245 0.289 17355
1092 1 3 . 1 1 38 38 SER HA H 38 4.147 4.147 4.342 -0.195 17355
1093 1 3 . 1 1 38 38 SER CA C 38 61.186 61.186 58.102 3.084 17355
1094 1 3 . 1 1 38 38 SER CB C 38 63.946 63.946 62.461 1.485 17355
1095 1 3 . 1 1 38 38 SER H H 38 7.376 7.376 7.978 -0.602 17355
1096 1 3 . 1 1 39 39 ARG N N 39 124.337 124.337 125.534 -1.197 17355
1097 1 3 . 1 1 39 39 ARG HA H 39 4.521 4.521 4.223 0.298 17355
1098 1 3 . 1 1 39 39 ARG CA C 39 55.049 55.049 55.864 -0.815 17355
1099 1 3 . 1 1 39 39 ARG CB C 39 30.723 30.723 30.910 -0.188 17355
1100 1 3 . 1 1 39 39 ARG H H 39 10.095 10.095 7.874 2.221 17355
1101 1 3 . 1 1 40 40 PHE N N 40 122.834 122.834 118.876 3.958 17355
1102 1 3 . 1 1 40 40 PHE HA H 40 3.916 3.916 4.666 -0.750 17355
1103 1 3 . 1 1 40 40 PHE CA C 40 62.869 62.869 58.761 4.109 17355
1104 1 3 . 1 1 40 40 PHE CB C 40 39.662 39.662 38.054 1.608 17355
1105 1 3 . 1 1 40 40 PHE H H 40 7.498 7.498 8.225 -0.727 17355
1106 1 3 . 1 1 41 41 LEU N N 41 117.682 117.682 117.573 0.109 17355
1107 1 3 . 1 1 41 41 LEU HA H 41 4.519 4.519 4.164 0.355 17355
1108 1 3 . 1 1 41 41 LEU CA C 41 58.111 58.111 55.907 2.204 17355
1109 1 3 . 1 1 41 41 LEU CB C 41 41.087 41.087 42.711 -1.623 17355
1110 1 3 . 1 1 41 41 LEU H H 41 8.619 8.619 7.732 0.887 17355
1111 1 3 . 1 1 42 42 ASP N N 42 114.800 114.800 119.769 -4.969 17355
1112 1 3 . 1 1 42 42 ASP HA H 42 4.185 4.185 4.487 -0.302 17355
1113 1 3 . 1 1 42 42 ASP CA C 42 57.713 57.713 56.754 0.959 17355
1114 1 3 . 1 1 42 42 ASP CB C 42 41.206 41.206 40.863 0.343 17355
1115 1 3 . 1 1 42 42 ASP H H 42 8.239 8.239 8.235 0.004 17355
1116 1 3 . 1 1 43 43 ASP N N 43 111.125 111.125 118.831 -7.706 17355
1117 1 3 . 1 1 43 43 ASP HA H 43 4.915 4.915 4.613 0.302 17355
1118 1 3 . 1 1 43 43 ASP CA C 43 56.105 56.105 55.350 0.755 17355
1119 1 3 . 1 1 43 43 ASP CB C 43 41.703 41.703 40.748 0.955 17355
1120 1 3 . 1 1 43 43 ASP H H 43 7.355 7.355 8.058 -0.703 17355
1121 1 3 . 1 1 44 44 LEU N N 44 114.924 114.924 118.097 -3.173 17355
1122 1 3 . 1 1 44 44 LEU HA H 44 4.273 4.273 4.046 0.227 17355
1123 1 3 . 1 1 44 44 LEU CA C 44 54.480 54.480 57.006 -2.526 17355
1124 1 3 . 1 1 44 44 LEU CB C 44 41.671 41.671 42.440 -0.769 17355
1125 1 3 . 1 1 44 44 LEU H H 44 7.172 7.172 7.598 -0.426 17355
1126 1 3 . 1 1 45 45 HIS N N 45 114.429 114.429 115.746 -1.317 17355
1127 1 3 . 1 1 45 45 HIS HA H 45 4.581 4.581 4.354 0.227 17355
1128 1 3 . 1 1 45 45 HIS CA C 45 56.189 56.189 56.828 -0.639 17355
1129 1 3 . 1 1 45 45 HIS CB C 45 26.073 26.073 28.227 -2.154 17355
1130 1 3 . 1 1 45 45 HIS H H 45 7.308 7.308 7.845 -0.537 17355
1131 1 3 . 1 1 46 46 MET N N 46 118.597 118.597 122.258 -3.661 17355
1132 1 3 . 1 1 46 46 MET HA H 46 4.614 4.614 4.866 -0.252 17355
1133 1 3 . 1 1 46 46 MET CA C 46 55.646 55.646 54.396 1.250 17355
1134 1 3 . 1 1 46 46 MET CB C 46 35.501 35.501 37.319 -1.818 17355
1135 1 3 . 1 1 46 46 MET H H 46 8.618 8.618 8.274 0.344 17355
1136 1 3 . 1 1 47 47 SER N N 47 116.110 116.110 114.941 1.169 17355
1137 1 3 . 1 1 47 47 SER HA H 47 4.559 4.559 4.889 -0.330 17355
1138 1 3 . 1 1 47 47 SER CA C 47 56.696 56.696 56.370 0.326 17355
1139 1 3 . 1 1 47 47 SER CB C 47 65.888 65.888 66.041 -0.153 17355
1140 1 3 . 1 1 47 47 SER H H 47 8.446 8.446 8.459 -0.013 17355
1141 1 3 . 1 1 48 48 SER N N 48 116.756 116.756 118.434 -1.678 17355
1142 1 3 . 1 1 48 48 SER HA H 48 3.701 3.701 4.228 -0.527 17355
1143 1 3 . 1 1 48 48 SER CA C 48 62.260 62.260 62.191 0.069 17355
1144 1 3 . 1 1 48 48 SER CB C 48 62.289 62.289 62.738 -0.449 17355
1145 1 3 . 1 1 48 48 SER H H 48 8.948 8.948 8.816 0.132 17355
1146 1 3 . 1 1 49 49 ILE N N 49 122.227 122.227 121.276 0.951 17355
1147 1 3 . 1 1 49 49 ILE HA H 49 3.806 3.806 3.775 0.031 17355
1148 1 3 . 1 1 49 49 ILE CA C 49 64.215 64.215 64.786 -0.571 17355
1149 1 3 . 1 1 49 49 ILE CB C 49 38.059 38.059 36.144 1.915 17355
1150 1 3 . 1 1 49 49 ILE H H 49 7.595 7.595 8.180 -0.585 17355
1151 1 3 . 1 1 50 50 THR N N 50 120.233 120.233 116.058 4.175 17355
1152 1 3 . 1 1 50 50 THR HA H 50 3.878 3.878 3.972 -0.094 17355
1153 1 3 . 1 1 50 50 THR CA C 50 66.427 66.427 66.325 0.102 17355
1154 1 3 . 1 1 50 50 THR CB C 50 68.223 68.223 68.289 -0.066 17355
1155 1 3 . 1 1 50 50 THR H H 50 7.539 7.539 7.831 -0.292 17355
1156 1 3 . 1 1 51 51 VAL N N 51 121.320 121.320 120.425 0.895 17355
1157 1 3 . 1 1 51 51 VAL HA H 51 3.090 3.090 3.567 -0.477 17355
1158 1 3 . 1 1 51 51 VAL CA C 51 67.440 67.440 66.878 0.562 17355
1159 1 3 . 1 1 51 51 VAL CB C 51 31.087 31.087 31.272 -0.185 17355
1160 1 3 . 1 1 51 51 VAL H H 51 8.178 8.178 8.658 -0.480 17355
1161 1 3 . 1 1 52 52 GLY N N 52 105.968 105.968 105.500 0.468 17355
1162 1 3 . 1 1 52 52 GLY CA C 52 47.339 47.339 46.387 0.952 17355
1163 1 3 . 1 1 52 52 GLY H H 52 8.004 8.004 7.694 0.310 17355
1164 1 3 . 1 1 53 53 GLN N N 53 120.486 120.486 118.720 1.766 17355
1165 1 3 . 1 1 53 53 GLN HA H 53 4.086 4.086 4.262 -0.176 17355
1166 1 3 . 1 1 53 53 GLN CA C 53 58.919 58.919 57.136 1.783 17355
1167 1 3 . 1 1 53 53 GLN CB C 53 27.867 27.867 29.381 -1.514 17355
1168 1 3 . 1 1 53 53 GLN H H 53 7.675 7.675 7.673 0.002 17355
1169 1 3 . 1 1 54 54 LEU N N 54 121.901 121.901 116.963 4.938 17355
1170 1 3 . 1 1 54 54 LEU HA H 54 4.049 4.049 4.572 -0.523 17355
1171 1 3 . 1 1 54 54 LEU CA C 54 58.661 58.661 56.823 1.838 17355
1172 1 3 . 1 1 54 54 LEU CB C 54 42.426 42.426 42.368 0.058 17355
1173 1 3 . 1 1 54 54 LEU H H 54 8.038 8.038 7.333 0.705 17355
1174 1 3 . 1 1 55 55 VAL N N 55 119.226 119.226 120.774 -1.548 17355
1175 1 3 . 1 1 55 55 VAL HA H 55 3.543 3.543 3.692 -0.149 17355
1176 1 3 . 1 1 55 55 VAL CA C 55 66.871 66.871 64.857 2.014 17355
1177 1 3 . 1 1 55 55 VAL CB C 55 31.392 31.392 30.980 0.412 17355
1178 1 3 . 1 1 55 55 VAL H H 55 8.375 8.375 8.518 -0.143 17355
1179 1 3 . 1 1 56 56 ASN N N 56 117.987 117.987 117.305 0.682 17355
1180 1 3 . 1 1 56 56 ASN HA H 56 4.473 4.473 4.454 0.019 17355
1181 1 3 . 1 1 56 56 ASN CA C 56 56.557 56.557 56.135 0.422 17355
1182 1 3 . 1 1 56 56 ASN CB C 56 38.509 38.509 38.393 0.116 17355
1183 1 3 . 1 1 56 56 ASN H H 56 7.521 7.521 8.409 -0.888 17355
1184 1 3 . 1 1 57 57 GLU N N 57 121.765 121.765 120.066 1.699 17355
1185 1 3 . 1 1 57 57 GLU HA H 57 4.070 4.070 4.175 -0.105 17355
1186 1 3 . 1 1 57 57 GLU CA C 57 59.496 59.496 58.597 0.899 17355
1187 1 3 . 1 1 57 57 GLU CB C 57 29.395 29.395 29.654 -0.259 17355
1188 1 3 . 1 1 57 57 GLU H H 57 8.225 8.225 7.546 0.679 17355
1189 1 3 . 1 1 58 58 ALA N N 58 123.779 123.779 121.814 1.965 17355
1190 1 3 . 1 1 58 58 ALA HA H 58 3.874 3.874 4.225 -0.351 17355
1191 1 3 . 1 1 58 58 ALA CA C 58 55.227 55.227 54.909 0.318 17355
1192 1 3 . 1 1 58 58 ALA CB C 58 18.388 18.388 18.224 0.164 17355
1193 1 3 . 1 1 58 58 ALA H H 58 8.659 8.659 7.557 1.102 17355
1194 1 3 . 1 1 59 59 ALA N N 59 118.656 118.656 121.505 -2.849 17355
1195 1 3 . 1 1 59 59 ALA HA H 59 3.819 3.819 3.930 -0.111 17355
1196 1 3 . 1 1 59 59 ALA CA C 59 55.871 55.871 54.783 1.088 17355
1197 1 3 . 1 1 59 59 ALA CB C 59 18.152 18.152 18.152 -0.000 17355
1198 1 3 . 1 1 59 59 ALA H H 59 8.537 8.537 7.603 0.934 17355
1199 1 3 . 1 1 60 60 ARG N N 60 117.701 117.701 118.710 -1.009 17355
1200 1 3 . 1 1 60 60 ARG HA H 60 4.096 4.096 3.879 0.217 17355
1201 1 3 . 1 1 60 60 ARG CA C 60 59.609 59.609 59.478 0.131 17355
1202 1 3 . 1 1 60 60 ARG CB C 60 29.974 29.974 30.321 -0.347 17355
1203 1 3 . 1 1 60 60 ARG H H 60 7.923 7.923 7.643 0.280 17355
1204 1 3 . 1 1 61 61 ALA N N 61 123.271 123.271 120.781 2.490 17355
1205 1 3 . 1 1 61 61 ALA HA H 61 4.137 4.137 4.138 -0.001 17355
1206 1 3 . 1 1 61 61 ALA CA C 61 54.912 54.912 54.261 0.651 17355
1207 1 3 . 1 1 61 61 ALA CB C 61 18.304 18.304 18.540 -0.236 17355
1208 1 3 . 1 1 61 61 ALA H H 61 8.044 8.044 7.432 0.612 17355
1209 1 3 . 1 1 62 62 MET N N 62 114.725 114.725 116.761 -2.036 17355
1210 1 3 . 1 1 62 62 MET HA H 62 4.297 4.297 4.162 0.135 17355
1211 1 3 . 1 1 62 62 MET CA C 62 56.392 56.392 57.204 -0.812 17355
1212 1 3 . 1 1 62 62 MET CB C 62 34.827 34.827 33.107 1.720 17355
1213 1 3 . 1 1 62 62 MET H H 62 7.710 7.710 7.982 -0.272 17355
1214 1 3 . 1 1 63 63 GLY N N 63 108.268 108.268 106.985 1.283 17355
1215 1 3 . 1 1 63 63 GLY CA C 63 46.079 46.079 45.121 0.958 17355
1216 1 3 . 1 1 63 63 GLY H H 63 7.846 7.846 7.700 0.146 17355
1217 1 3 . 1 1 64 64 LEU N N 64 119.547 119.547 119.399 0.148 17355
1218 1 3 . 1 1 64 64 LEU HA H 64 4.526 4.526 4.619 -0.093 17355
1219 1 3 . 1 1 64 64 LEU CA C 64 53.605 53.605 53.810 -0.206 17355
1220 1 3 . 1 1 64 64 LEU CB C 64 43.784 43.784 42.781 1.004 17355
1221 1 3 . 1 1 64 64 LEU H H 64 8.183 8.183 7.860 0.323 17355
1222 1 3 . 1 1 65 65 SER N N 65 115.418 115.418 113.300 2.118 17355
1223 1 3 . 1 1 65 65 SER HA H 65 4.328 4.328 4.439 -0.111 17355
1224 1 3 . 1 1 65 65 SER CA C 65 58.319 58.319 58.465 -0.146 17355
1225 1 3 . 1 1 65 65 SER CB C 65 64.181 64.181 63.682 0.499 17355
1226 1 3 . 1 1 65 65 SER H H 65 8.302 8.302 8.045 0.257 17355
1227 1 3 . 1 1 66 66 ALA N N 66 124.266 124.266 124.451 -0.185 17355
1228 1 3 . 1 1 66 66 ALA HA H 66 4.212 4.212 4.611 -0.399 17355
1229 1 3 . 1 1 66 66 ALA CA C 66 52.624 52.624 52.596 0.028 17355
1230 1 3 . 1 1 66 66 ALA CB C 66 19.309 19.309 19.178 0.131 17355
1231 1 3 . 1 1 66 66 ALA H H 66 8.262 8.262 8.116 0.146 17355
1232 1 3 . 1 1 67 67 VAL N N 67 118.373 118.373 119.134 -0.761 17355
1233 1 3 . 1 1 67 67 VAL HA H 67 4.049 4.049 3.967 0.082 17355
1234 1 3 . 1 1 67 67 VAL CA C 67 62.010 62.010 62.572 -0.562 17355
1235 1 3 . 1 1 67 67 VAL CB C 67 33.495 33.495 31.816 1.679 17355
1236 1 3 . 1 1 67 67 VAL H H 67 7.949 7.949 7.568 0.381 17355
1237 1 3 . 1 1 68 68 ALA N N 68 127.696 127.696 122.761 4.935 17355
1238 1 3 . 1 1 68 68 ALA HA H 68 4.308 4.308 4.066 0.242 17355
1239 1 3 . 1 1 68 68 ALA CA C 68 52.070 52.070 52.748 -0.678 17355
1240 1 3 . 1 1 68 68 ALA CB C 68 19.220 19.220 17.384 1.836 17355
1241 1 3 . 1 1 68 68 ALA H H 68 8.319 8.319 7.986 0.333 17355
1242 1 3 . 1 1 69 69 MET N N 69 120.285 120.285 118.557 1.728 17355
1243 1 3 . 1 1 69 69 MET HA H 69 4.664 4.664 4.130 0.534 17355
1244 1 3 . 1 1 69 69 MET CA C 69 53.004 53.004 55.352 -2.348 17355
1245 1 3 . 1 1 69 69 MET CB C 69 32.678 32.678 31.727 0.951 17355
1246 1 3 . 1 1 69 69 MET H H 69 8.224 8.224 8.402 -0.178 17355
1247 1 3 . 1 1 70 70 PRO HA H 70 4.446 4.446 4.478 -0.032 17355
1248 1 3 . 1 1 70 70 PRO CA C 70 63.452 63.452 65.017 -1.565 17355
1249 1 3 . 1 1 70 70 PRO CB C 70 32.012 32.012 32.371 -0.359 17355
1250 1 3 . 1 1 71 71 THR N N 71 112.663 112.663 109.249 3.414 17355
1251 1 3 . 1 1 71 71 THR HA H 71 4.074 4.074 3.810 0.264 17355
1252 1 3 . 1 1 71 71 THR CA C 71 62.869 62.869 60.996 1.873 17355
1253 1 3 . 1 1 71 71 THR CB C 71 69.516 69.516 69.297 0.219 17355
1254 1 3 . 1 1 71 71 THR H H 71 7.957 7.957 7.401 0.556 17355
1255 1 3 . 1 1 72 72 ASN N N 72 120.054 120.054 118.797 1.257 17355
1256 1 3 . 1 1 72 72 ASN HA H 72 4.695 4.695 3.912 0.783 17355
1257 1 3 . 1 1 72 72 ASN CA C 72 52.856 52.856 56.124 -3.268 17355
1258 1 3 . 1 1 72 72 ASN CB C 72 38.165 38.165 37.544 0.621 17355
1259 1 3 . 1 1 72 72 ASN H H 72 8.227 8.227 8.216 0.011 17355
1260 1 3 . 1 1 73 73 PHE N N 73 121.570 121.570 115.349 6.221 17355
1261 1 3 . 1 1 73 73 PHE HA H 73 4.342 4.342 3.729 0.613 17355
1262 1 3 . 1 1 73 73 PHE CA C 73 59.609 59.609 60.382 -0.773 17355
1263 1 3 . 1 1 73 73 PHE CB C 73 39.000 39.000 36.741 2.259 17355
1264 1 3 . 1 1 73 73 PHE H H 73 8.331 8.331 8.203 0.128 17355
1265 1 3 . 1 1 74 74 ALA N N 74 121.047 121.047 122.082 -1.035 17355
1266 1 3 . 1 1 74 74 ALA HA H 74 4.074 4.074 4.118 -0.044 17355
1267 1 3 . 1 1 74 74 ALA CA C 74 54.705 54.705 54.900 -0.195 17355
1268 1 3 . 1 1 74 74 ALA CB C 74 19.159 19.159 18.987 0.172 17355
1269 1 3 . 1 1 74 74 ALA H H 74 8.163 8.163 8.044 0.119 17355
1270 1 3 . 1 1 75 75 THR N N 75 104.824 104.824 113.458 -8.634 17355
1271 1 3 . 1 1 75 75 THR HA H 75 4.475 4.475 4.292 0.183 17355
1272 1 3 . 1 1 75 75 THR CA C 75 60.669 60.669 61.458 -0.789 17355
1273 1 3 . 1 1 75 75 THR CB C 75 69.543 69.543 66.380 3.163 17355
1274 1 3 . 1 1 75 75 THR H H 75 7.581 7.581 8.433 -0.852 17355
1275 1 3 . 1 1 76 76 ALA N N 76 124.548 124.548 127.187 -2.639 17355
1276 1 3 . 1 1 76 76 ALA HA H 76 4.714 4.714 4.800 -0.086 17355
1277 1 3 . 1 1 76 76 ALA CA C 76 52.929 52.929 51.092 1.837 17355
1278 1 3 . 1 1 76 76 ALA CB C 76 20.661 20.661 22.029 -1.368 17355
1279 1 3 . 1 1 76 76 ALA H H 76 7.689 7.689 7.960 -0.271 17355
1280 1 3 . 1 1 77 77 THR N N 77 108.654 108.654 110.873 -2.219 17355
1281 1 3 . 1 1 77 77 THR HA H 77 5.017 5.017 4.511 0.506 17355
1282 1 3 . 1 1 77 77 THR CA C 77 58.847 58.847 59.844 -0.997 17355
1283 1 3 . 1 1 77 77 THR CB C 77 73.369 73.369 71.727 1.642 17355
1284 1 3 . 1 1 77 77 THR H H 77 7.495 7.495 8.191 -0.696 17355
1285 1 3 . 1 1 78 78 VAL N N 78 120.107 120.107 117.748 2.359 17355
1286 1 3 . 1 1 78 78 VAL HA H 78 3.418 3.418 4.019 -0.601 17355
1287 1 3 . 1 1 78 78 VAL CA C 78 67.446 67.446 66.638 0.808 17355
1288 1 3 . 1 1 78 78 VAL CB C 78 31.949 31.949 31.551 0.398 17355
1289 1 3 . 1 1 78 78 VAL H H 78 7.373 7.373 7.750 -0.377 17355
1290 1 3 . 1 1 79 79 ARG N N 79 117.131 117.131 118.763 -1.632 17355
1291 1 3 . 1 1 79 79 ARG HA H 79 3.877 3.877 4.117 -0.240 17355
1292 1 3 . 1 1 79 79 ARG CA C 79 59.566 59.566 58.186 1.380 17355
1293 1 3 . 1 1 79 79 ARG CB C 79 30.174 30.174 29.407 0.767 17355
1294 1 3 . 1 1 79 79 ARG H H 79 8.518 8.518 7.801 0.717 17355
1295 1 3 . 1 1 80 80 GLU N N 80 118.542 118.542 120.462 -1.920 17355
1296 1 3 . 1 1 80 80 GLU HA H 80 4.033 4.033 4.091 -0.058 17355
1297 1 3 . 1 1 80 80 GLU CA C 80 59.427 59.427 59.583 -0.156 17355
1298 1 3 . 1 1 80 80 GLU CB C 80 30.206 30.206 29.559 0.647 17355
1299 1 3 . 1 1 80 80 GLU H H 80 7.847 7.847 7.977 -0.130 17355
1300 1 3 . 1 1 81 81 MET N N 81 119.630 119.630 119.228 0.402 17355
1301 1 3 . 1 1 81 81 MET HA H 81 4.158 4.158 4.119 0.039 17355
1302 1 3 . 1 1 81 81 MET CA C 81 59.025 59.025 59.136 -0.111 17355
1303 1 3 . 1 1 81 81 MET CB C 81 32.916 32.916 32.655 0.261 17355
1304 1 3 . 1 1 81 81 MET H H 81 8.211 8.211 8.363 -0.152 17355
1305 1 3 . 1 1 82 82 ALA N N 82 120.463 120.463 121.549 -1.086 17355
1306 1 3 . 1 1 82 82 ALA HA H 82 3.911 3.911 4.139 -0.228 17355
1307 1 3 . 1 1 82 82 ALA CA C 82 56.004 56.004 54.565 1.439 17355
1308 1 3 . 1 1 82 82 ALA CB C 82 18.430 18.430 18.260 0.170 17355
1309 1 3 . 1 1 82 82 ALA H H 82 7.978 7.978 7.576 0.402 17355
1310 1 3 . 1 1 83 83 GLU N N 83 116.663 116.663 120.016 -3.353 17355
1311 1 3 . 1 1 83 83 GLU HA H 83 4.034 4.034 3.850 0.184 17355
1312 1 3 . 1 1 83 83 GLU CA C 83 59.476 59.476 59.915 -0.439 17355
1313 1 3 . 1 1 83 83 GLU CB C 83 29.470 29.470 29.701 -0.231 17355
1314 1 3 . 1 1 83 83 GLU H H 83 8.608 8.608 8.042 0.566 17355
1315 1 3 . 1 1 84 84 ALA N N 84 122.742 122.742 121.152 1.590 17355
1316 1 3 . 1 1 84 84 ALA HA H 84 4.241 4.241 3.990 0.251 17355
1317 1 3 . 1 1 84 84 ALA CA C 84 54.970 54.970 55.256 -0.286 17355
1318 1 3 . 1 1 84 84 ALA CB C 84 18.150 18.150 18.178 -0.028 17355
1319 1 3 . 1 1 84 84 ALA H H 84 7.918 7.918 8.040 -0.122 17355
1320 1 3 . 1 1 85 85 LEU N N 85 119.158 119.158 118.389 0.769 17355
1321 1 3 . 1 1 85 85 LEU HA H 85 3.945 3.945 3.914 0.031 17355
1322 1 3 . 1 1 85 85 LEU CA C 85 57.849 57.849 57.495 0.354 17355
1323 1 3 . 1 1 85 85 LEU CB C 85 41.884 41.884 41.699 0.185 17355
1324 1 3 . 1 1 85 85 LEU H H 85 7.692 7.692 7.710 -0.018 17355
1325 1 3 . 1 1 86 86 GLU N N 86 118.441 118.441 120.766 -2.325 17355
1326 1 3 . 1 1 86 86 GLU HA H 86 4.053 4.053 4.332 -0.279 17355
1327 1 3 . 1 1 86 86 GLU CA C 86 59.131 59.131 58.807 0.324 17355
1328 1 3 . 1 1 86 86 GLU CB C 86 29.868 29.868 29.441 0.427 17355
1329 1 3 . 1 1 86 86 GLU H H 86 8.152 8.152 8.456 -0.304 17355
1330 1 3 . 1 1 87 87 ALA N N 87 120.690 120.690 120.665 0.025 17355
1331 1 3 . 1 1 87 87 ALA HA H 87 4.139 4.139 4.504 -0.365 17355
1332 1 3 . 1 1 87 87 ALA CA C 87 54.506 54.506 52.905 1.601 17355
1333 1 3 . 1 1 87 87 ALA CB C 87 18.435 18.435 19.347 -0.912 17355
1334 1 3 . 1 1 87 87 ALA H H 87 7.899 7.899 7.873 0.026 17355
1335 1 3 . 1 1 88 88 ARG N N 88 117.642 117.642 120.304 -2.662 17355
1336 1 3 . 1 1 88 88 ARG HA H 88 4.204 4.204 3.956 0.248 17355
1337 1 3 . 1 1 88 88 ARG CA C 88 57.435 57.435 59.405 -1.970 17355
1338 1 3 . 1 1 88 88 ARG CB C 88 30.106 30.106 29.887 0.219 17355
1339 1 3 . 1 1 88 88 ARG H H 88 7.593 7.593 8.479 -0.886 17355
1340 1 3 . 1 1 89 89 GLU N N 89 121.080 121.080 118.778 2.302 17355
1341 1 3 . 1 1 89 89 GLU HA H 89 4.047 4.047 4.020 0.027 17355
1342 1 3 . 1 1 89 89 GLU CA C 89 58.858 58.858 58.918 -0.060 17355
1343 1 3 . 1 1 89 89 GLU CB C 89 29.912 29.912 29.058 0.854 17355
1344 1 3 . 1 1 89 89 GLU H H 89 8.222 8.222 7.807 0.415 17355
1345 1 3 . 1 1 90 90 ARG N N 90 117.834 117.834 119.581 -1.747 17355
1346 1 3 . 1 1 90 90 ARG HA H 90 4.212 4.212 4.089 0.123 17355
1347 1 3 . 1 1 90 90 ARG CA C 90 57.409 57.409 58.302 -0.893 17355
1348 1 3 . 1 1 90 90 ARG CB C 90 30.906 30.906 30.220 0.686 17355
1349 1 3 . 1 1 90 90 ARG H H 90 7.924 7.924 7.704 0.220 17355
1350 1 3 . 1 1 91 91 GLU N N 91 118.786 118.786 119.621 -0.835 17355
1351 1 3 . 1 1 91 91 GLU HA H 91 4.254 4.254 4.212 0.042 17355
1352 1 3 . 1 1 91 91 GLU CA C 91 56.693 56.693 55.671 1.022 17355
1353 1 3 . 1 1 91 91 GLU CB C 91 30.416 30.416 30.160 0.256 17355
1354 1 3 . 1 1 91 91 GLU H H 91 7.749 7.749 7.756 -0.007 17355
1355 1 3 . 1 1 92 92 ALA N N 92 125.247 125.247 121.031 4.216 17355
1356 1 3 . 1 1 92 92 ALA HA H 92 4.551 4.551 4.052 0.499 17355
1357 1 3 . 1 1 92 92 ALA CA C 92 51.073 51.073 52.017 -0.944 17355
1358 1 3 . 1 1 92 92 ALA CB C 92 18.443 18.443 17.141 1.302 17355
1359 1 3 . 1 1 92 92 ALA H H 92 7.888 7.888 7.578 0.310 17355
1360 1 3 . 1 1 93 93 PRO HA H 93 4.383 4.383 4.290 0.093 17355
1361 1 3 . 1 1 93 93 PRO CA C 93 63.744 63.744 62.528 1.216 17355
1362 1 3 . 1 1 93 93 PRO CB C 93 32.122 32.122 32.237 -0.115 17355
1363 1 3 . 1 1 94 94 HIS N N 94 118.597 118.597 116.187 2.410 17355
1364 1 3 . 1 1 94 94 HIS HA H 94 4.639 4.639 4.540 0.099 17355
1365 1 3 . 1 1 94 94 HIS CA C 94 56.044 56.044 57.571 -1.526 17355
1366 1 3 . 1 1 94 94 HIS CB C 94 29.789 29.789 30.461 -0.672 17355
1367 1 3 . 1 1 94 94 HIS H H 94 8.392 8.392 8.511 -0.119 17355
1368 1 3 . 1 1 95 95 LEU N N 95 123.443 123.443 116.885 6.558 17355
1369 1 3 . 1 1 95 95 LEU HA H 95 4.287 4.287 4.753 -0.466 17355
1370 1 3 . 1 1 95 95 LEU CA C 95 55.233 55.233 53.046 2.187 17355
1371 1 3 . 1 1 95 95 LEU CB C 95 42.710 42.710 44.435 -1.725 17355
1372 1 3 . 1 1 95 95 LEU H H 95 8.061 8.061 7.433 0.628 17355
1373 1 3 . 1 1 96 96 GLU N N 96 121.295 121.295 120.775 0.520 17355
1374 1 3 . 1 1 96 96 GLU HA H 96 4.176 4.176 4.658 -0.482 17355
1375 1 3 . 1 1 96 96 GLU CA C 96 56.706 56.706 56.219 0.487 17355
1376 1 3 . 1 1 96 96 GLU CB C 96 30.319 30.319 30.275 0.044 17355
1377 1 3 . 1 1 96 96 GLU H H 96 8.346 8.346 8.588 -0.242 17355
1378 1 3 . 1 1 97 97 HIS N N 97 119.932 119.932 122.107 -2.175 17355
1379 1 3 . 1 1 97 97 HIS HA H 97 4.555 4.555 4.772 -0.217 17355
1380 1 3 . 1 1 97 97 HIS CA C 97 56.042 56.042 55.246 0.796 17355
1381 1 3 . 1 1 97 97 HIS H H 97 8.251 8.251 8.677 -0.426 17355
1382 1 3 . 1 1 98 98 HIS N N 98 125.446 125.446 117.149 8.297 17355
1383 1 3 . 1 1 98 98 HIS HA H 98 4.363 4.363 4.784 -0.421 17355
1384 1 3 . 1 1 98 98 HIS CA C 98 57.303 57.303 55.030 2.273 17355
1385 1 3 . 1 1 98 98 HIS CB C 98 30.319 30.319 30.825 -0.506 17355
1386 1 3 . 1 1 98 98 HIS H H 98 8.054 8.054 7.960 0.094 17355
1387 1 4 . 1 1 3 3 ARG HA H 3 4.321 4.321 4.432 -0.111 17355
1388 1 4 . 1 1 3 3 ARG CA C 3 56.560 56.560 56.310 0.250 17355
1389 1 4 . 1 1 4 4 ALA N N 4 125.797 125.797 126.485 -0.688 17355
1390 1 4 . 1 1 4 4 ALA HA H 4 4.283 4.283 4.063 0.220 17355
1391 1 4 . 1 1 4 4 ALA CA C 4 52.900 52.900 52.819 0.081 17355
1392 1 4 . 1 1 4 4 ALA CB C 4 19.411 19.411 18.222 1.189 17355
1393 1 4 . 1 1 4 4 ALA H H 4 8.563 8.563 8.742 -0.179 17355
1394 1 4 . 1 1 5 5 ASP N N 5 118.416 118.416 118.975 -0.559 17355
1395 1 4 . 1 1 5 5 ASP HA H 5 4.584 4.584 4.638 -0.054 17355
1396 1 4 . 1 1 5 5 ASP CA C 5 54.337 54.337 53.463 0.874 17355
1397 1 4 . 1 1 5 5 ASP CB C 5 41.186 41.186 41.631 -0.445 17355
1398 1 4 . 1 1 5 5 ASP H H 5 8.208 8.208 8.310 -0.102 17355
1399 1 4 . 1 1 6 6 ASP N N 6 120.632 120.632 121.232 -0.600 17355
1400 1 4 . 1 1 6 6 ASP HA H 6 4.578 4.578 4.490 0.088 17355
1401 1 4 . 1 1 6 6 ASP CA C 6 54.589 54.589 53.854 0.735 17355
1402 1 4 . 1 1 6 6 ASP CB C 6 41.239 41.239 41.334 -0.095 17355
1403 1 4 . 1 1 6 6 ASP H H 6 8.140 8.140 8.238 -0.098 17355
1404 1 4 . 1 1 7 7 THR N N 7 113.693 113.693 112.596 1.097 17355
1405 1 4 . 1 1 7 7 THR HA H 7 4.245 4.245 4.556 -0.311 17355
1406 1 4 . 1 1 7 7 THR CA C 7 62.392 62.392 61.155 1.237 17355
1407 1 4 . 1 1 7 7 THR CB C 7 69.721 69.721 68.168 1.554 17355
1408 1 4 . 1 1 7 7 THR H H 7 8.045 8.045 8.313 -0.268 17355
1409 1 4 . 1 1 8 8 ALA N N 8 126.414 126.414 128.271 -1.857 17355
1410 1 4 . 1 1 8 8 ALA HA H 8 4.314 4.314 4.320 -0.006 17355
1411 1 4 . 1 1 8 8 ALA CA C 8 52.253 52.253 52.945 -0.692 17355
1412 1 4 . 1 1 8 8 ALA CB C 8 19.464 19.464 19.262 0.202 17355
1413 1 4 . 1 1 8 8 ALA H H 8 8.139 8.139 7.876 0.263 17355
1414 1 4 . 1 1 9 9 LEU N N 9 122.921 122.921 121.313 1.608 17355
1415 1 4 . 1 1 9 9 LEU HA H 9 4.559 4.559 4.269 0.290 17355
1416 1 4 . 1 1 9 9 LEU CA C 9 53.088 53.088 58.387 -5.299 17355
1417 1 4 . 1 1 9 9 LEU CB C 9 41.929 41.929 40.235 1.694 17355
1418 1 4 . 1 1 9 9 LEU H H 9 8.113 8.113 8.152 -0.039 17355
1419 1 4 . 1 1 10 10 PRO HA H 10 4.367 4.367 4.342 0.025 17355
1420 1 4 . 1 1 10 10 PRO CA C 10 63.373 63.373 64.468 -1.095 17355
1421 1 4 . 1 1 10 10 PRO CB C 10 31.975 31.975 31.672 0.303 17355
1422 1 4 . 1 1 11 11 ALA N N 11 124.349 124.349 120.082 4.267 17355
1423 1 4 . 1 1 11 11 ALA HA H 11 4.262 4.262 4.224 0.038 17355
1424 1 4 . 1 1 11 11 ALA CA C 11 52.496 52.496 52.274 0.222 17355
1425 1 4 . 1 1 11 11 ALA CB C 11 19.424 19.424 19.738 -0.313 17355
1426 1 4 . 1 1 11 11 ALA H H 11 8.317 8.317 7.646 0.671 17355
1427 1 4 . 1 1 12 12 ALA N N 12 123.291 123.291 119.852 3.439 17355
1428 1 4 . 1 1 12 12 ALA HA H 12 4.380 4.380 3.855 0.525 17355
1429 1 4 . 1 1 12 12 ALA CA C 12 52.461 52.461 54.553 -2.092 17355
1430 1 4 . 1 1 12 12 ALA CB C 12 19.557 19.557 17.172 2.385 17355
1431 1 4 . 1 1 12 12 ALA H H 12 8.287 8.287 8.024 0.263 17355
1432 1 4 . 1 1 13 13 THR N N 13 112.758 112.758 113.620 -0.862 17355
1433 1 4 . 1 1 13 13 THR HA H 13 4.350 4.350 3.867 0.483 17355
1434 1 4 . 1 1 13 13 THR CA C 13 62.074 62.074 64.549 -2.475 17355
1435 1 4 . 1 1 13 13 THR CB C 13 70.070 70.070 68.444 1.626 17355
1436 1 4 . 1 1 13 13 THR H H 13 8.074 8.074 8.650 -0.576 17355
1437 1 4 . 1 1 14 14 GLY N N 14 110.774 110.774 108.832 1.942 17355
1438 1 4 . 1 1 14 14 GLY CA C 14 45.692 45.692 44.751 0.941 17355
1439 1 4 . 1 1 14 14 GLY H H 14 8.405 8.405 7.993 0.412 17355
1440 1 4 . 1 1 15 15 ALA N N 15 124.127 124.127 124.524 -0.397 17355
1441 1 4 . 1 1 15 15 ALA HA H 15 4.137 4.137 4.179 -0.042 17355
1442 1 4 . 1 1 15 15 ALA CA C 15 55.368 55.368 54.395 0.973 17355
1443 1 4 . 1 1 15 15 ALA CB C 15 20.100 20.100 18.917 1.183 17355
1444 1 4 . 1 1 15 15 ALA H H 15 8.866 8.866 8.511 0.355 17355
1445 1 4 . 1 1 16 16 LEU N N 16 118.013 118.013 117.783 0.230 17355
1446 1 4 . 1 1 16 16 LEU HA H 16 3.870 3.870 4.091 -0.221 17355
1447 1 4 . 1 1 16 16 LEU CA C 16 58.820 58.820 57.288 1.532 17355
1448 1 4 . 1 1 16 16 LEU CB C 16 41.332 41.332 41.325 0.007 17355
1449 1 4 . 1 1 16 16 LEU H H 16 8.414 8.414 8.547 -0.133 17355
1450 1 4 . 1 1 17 17 GLU N N 17 117.730 117.730 116.829 0.901 17355
1451 1 4 . 1 1 17 17 GLU HA H 17 3.978 3.978 4.225 -0.247 17355
1452 1 4 . 1 1 17 17 GLU CA C 17 59.909 59.909 57.956 1.952 17355
1453 1 4 . 1 1 17 17 GLU CB C 17 29.212 29.212 29.135 0.077 17355
1454 1 4 . 1 1 17 17 GLU H H 17 8.088 8.088 7.580 0.508 17355
1455 1 4 . 1 1 18 18 LEU N N 18 121.355 121.355 121.276 0.079 17355
1456 1 4 . 1 1 18 18 LEU HA H 18 4.165 4.165 4.101 0.064 17355
1457 1 4 . 1 1 18 18 LEU CA C 18 58.469 58.469 57.950 0.520 17355
1458 1 4 . 1 1 18 18 LEU CB C 18 42.459 42.459 42.324 0.135 17355
1459 1 4 . 1 1 18 18 LEU H H 18 7.767 7.767 7.543 0.224 17355
1460 1 4 . 1 1 19 19 VAL N N 19 118.522 118.522 116.794 1.728 17355
1461 1 4 . 1 1 19 19 VAL HA H 19 3.424 3.424 3.766 -0.342 17355
1462 1 4 . 1 1 19 19 VAL CA C 19 67.958 67.958 66.015 1.943 17355
1463 1 4 . 1 1 19 19 VAL CB C 19 31.922 31.922 31.924 -0.002 17355
1464 1 4 . 1 1 19 19 VAL H H 19 8.661 8.661 7.512 1.149 17355
1465 1 4 . 1 1 20 20 ARG N N 20 117.959 117.959 117.551 0.408 17355
1466 1 4 . 1 1 20 20 ARG HA H 20 3.576 3.576 4.285 -0.709 17355
1467 1 4 . 1 1 20 20 ARG CA C 20 60.994 60.994 56.883 4.112 17355
1468 1 4 . 1 1 20 20 ARG CB C 20 30.703 30.703 28.067 2.636 17355
1469 1 4 . 1 1 20 20 ARG H H 20 8.705 8.705 8.235 0.470 17355
1470 1 4 . 1 1 21 21 HIS N N 21 115.245 115.245 116.467 -1.222 17355
1471 1 4 . 1 1 21 21 HIS HA H 21 4.144 4.144 4.587 -0.443 17355
1472 1 4 . 1 1 21 21 HIS CA C 21 60.536 60.536 57.056 3.480 17355
1473 1 4 . 1 1 21 21 HIS CB C 21 29.099 29.099 32.748 -3.649 17355
1474 1 4 . 1 1 21 21 HIS H H 21 7.811 7.811 8.258 -0.447 17355
1475 1 4 . 1 1 22 22 LEU N N 22 119.884 119.884 120.308 -0.424 17355
1476 1 4 . 1 1 22 22 LEU HA H 22 4.078 4.078 4.123 -0.045 17355
1477 1 4 . 1 1 22 22 LEU CA C 22 58.164 58.164 57.960 0.204 17355
1478 1 4 . 1 1 22 22 LEU CB C 22 42.889 42.889 41.753 1.136 17355
1479 1 4 . 1 1 22 22 LEU H H 22 8.301 8.301 7.620 0.681 17355
1480 1 4 . 1 1 23 23 VAL N N 23 119.391 119.391 118.770 0.621 17355
1481 1 4 . 1 1 23 23 VAL HA H 23 3.429 3.429 3.693 -0.264 17355
1482 1 4 . 1 1 23 23 VAL CA C 23 67.179 67.179 66.474 0.705 17355
1483 1 4 . 1 1 23 23 VAL CB C 23 31.366 31.366 31.375 -0.009 17355
1484 1 4 . 1 1 23 23 VAL H H 23 8.897 8.897 7.397 1.500 17355
1485 1 4 . 1 1 24 24 ALA N N 24 121.610 121.610 121.307 0.303 17355
1486 1 4 . 1 1 24 24 ALA HA H 24 3.851 3.851 3.968 -0.117 17355
1487 1 4 . 1 1 24 24 ALA CA C 24 55.944 55.944 55.187 0.757 17355
1488 1 4 . 1 1 24 24 ALA CB C 24 18.042 18.042 18.542 -0.500 17355
1489 1 4 . 1 1 24 24 ALA H H 24 8.276 8.276 8.241 0.035 17355
1490 1 4 . 1 1 25 25 GLU N N 25 114.822 114.822 116.992 -2.170 17355
1491 1 4 . 1 1 25 25 GLU HA H 25 4.042 4.042 4.338 -0.296 17355
1492 1 4 . 1 1 25 25 GLU CA C 25 59.255 59.255 58.453 0.803 17355
1493 1 4 . 1 1 25 25 GLU CB C 25 29.951 29.951 29.140 0.811 17355
1494 1 4 . 1 1 25 25 GLU H H 25 7.693 7.693 7.912 -0.219 17355
1495 1 4 . 1 1 26 26 ARG N N 26 118.510 118.510 117.650 0.860 17355
1496 1 4 . 1 1 26 26 ARG HA H 26 4.252 4.252 4.316 -0.064 17355
1497 1 4 . 1 1 26 26 ARG CA C 26 57.090 57.090 56.410 0.680 17355
1498 1 4 . 1 1 26 26 ARG CB C 26 30.080 30.080 29.990 0.090 17355
1499 1 4 . 1 1 26 26 ARG H H 26 7.783 7.783 7.630 0.153 17355
1500 1 4 . 1 1 27 27 ALA N N 27 120.375 120.375 118.825 1.550 17355
1501 1 4 . 1 1 27 27 ALA HA H 27 4.342 4.342 4.553 -0.211 17355
1502 1 4 . 1 1 27 27 ALA CA C 27 52.134 52.134 52.193 -0.059 17355
1503 1 4 . 1 1 27 27 ALA CB C 27 19.283 19.283 21.694 -2.411 17355
1504 1 4 . 1 1 27 27 ALA H H 27 8.638 8.638 7.672 0.966 17355
1505 1 4 . 1 1 28 28 GLU N N 28 115.494 115.494 116.503 -1.009 17355
1506 1 4 . 1 1 28 28 GLU HA H 28 3.873 3.873 4.421 -0.548 17355
1507 1 4 . 1 1 28 28 GLU CA C 28 56.940 56.940 56.916 0.024 17355
1508 1 4 . 1 1 28 28 GLU CB C 28 27.058 27.058 30.817 -3.759 17355
1509 1 4 . 1 1 28 28 GLU H H 28 7.734 7.734 8.177 -0.443 17355
1510 1 4 . 1 1 29 29 LEU N N 29 119.978 119.978 120.656 -0.678 17355
1511 1 4 . 1 1 29 29 LEU HA H 29 4.898 4.898 4.938 -0.040 17355
1512 1 4 . 1 1 29 29 LEU CA C 29 51.498 51.498 51.724 -0.226 17355
1513 1 4 . 1 1 29 29 LEU CB C 29 45.348 45.348 45.224 0.124 17355
1514 1 4 . 1 1 29 29 LEU H H 29 8.075 8.075 8.293 -0.218 17355
1515 1 4 . 1 1 30 30 PRO HA H 30 4.461 4.461 4.467 -0.006 17355
1516 1 4 . 1 1 30 30 PRO CA C 30 62.524 62.524 62.875 -0.351 17355
1517 1 4 . 1 1 30 30 PRO CB C 30 32.015 32.015 30.188 1.827 17355
1518 1 4 . 1 1 31 31 VAL N N 31 123.773 123.773 120.719 3.054 17355
1519 1 4 . 1 1 31 31 VAL HA H 31 3.540 3.540 3.879 -0.339 17355
1520 1 4 . 1 1 31 31 VAL CA C 31 65.493 65.493 64.153 1.340 17355
1521 1 4 . 1 1 31 31 VAL CB C 31 31.865 31.865 31.584 0.281 17355
1522 1 4 . 1 1 31 31 VAL H H 31 8.432 8.432 8.234 0.198 17355
1523 1 4 . 1 1 32 32 GLU N N 32 117.215 117.215 122.493 -5.278 17355
1524 1 4 . 1 1 32 32 GLU HA H 32 4.053 4.053 4.710 -0.657 17355
1525 1 4 . 1 1 32 32 GLU CA C 32 59.131 59.131 56.726 2.405 17355
1526 1 4 . 1 1 32 32 GLU CB C 32 28.781 28.781 30.491 -1.710 17355
1527 1 4 . 1 1 32 32 GLU H H 32 8.971 8.971 8.363 0.608 17355
1528 1 4 . 1 1 33 33 VAL N N 33 113.611 113.611 123.132 -9.521 17355
1529 1 4 . 1 1 33 33 VAL HA H 33 4.214 4.214 4.228 -0.014 17355
1530 1 4 . 1 1 33 33 VAL CA C 33 61.795 61.795 61.465 0.330 17355
1531 1 4 . 1 1 33 33 VAL CB C 33 32.094 32.094 30.881 1.213 17355
1532 1 4 . 1 1 33 33 VAL H H 33 7.470 7.470 8.169 -0.699 17355
1533 1 4 . 1 1 34 34 LEU N N 34 123.533 123.533 125.426 -1.893 17355
1534 1 4 . 1 1 34 34 LEU HA H 34 4.114 4.114 4.645 -0.531 17355
1535 1 4 . 1 1 34 34 LEU CA C 34 54.877 54.877 53.522 1.355 17355
1536 1 4 . 1 1 34 34 LEU CB C 34 42.590 42.590 43.268 -0.678 17355
1537 1 4 . 1 1 34 34 LEU H H 34 7.300 7.300 7.772 -0.472 17355
1538 1 4 . 1 1 35 35 ARG N N 35 125.820 125.820 125.755 0.065 17355
1539 1 4 . 1 1 35 35 ARG HA H 35 4.578 4.578 4.115 0.463 17355
1540 1 4 . 1 1 35 35 ARG CA C 35 54.619 54.619 57.385 -2.766 17355
1541 1 4 . 1 1 35 35 ARG CB C 35 31.909 31.909 30.688 1.221 17355
1542 1 4 . 1 1 35 35 ARG H H 35 8.415 8.415 8.542 -0.127 17355
1543 1 4 . 1 1 36 36 ASP N N 36 123.211 123.211 116.635 6.576 17355
1544 1 4 . 1 1 36 36 ASP HA H 36 4.156 4.156 4.594 -0.438 17355
1545 1 4 . 1 1 36 36 ASP CA C 36 57.258 57.258 55.926 1.332 17355
1546 1 4 . 1 1 36 36 ASP CB C 36 40.400 40.400 41.655 -1.255 17355
1547 1 4 . 1 1 36 36 ASP H H 36 8.880 8.880 8.604 0.276 17355
1548 1 4 . 1 1 37 37 ASP N N 37 112.390 112.390 119.087 -6.697 17355
1549 1 4 . 1 1 37 37 ASP HA H 37 4.614 4.614 4.691 -0.077 17355
1550 1 4 . 1 1 37 37 ASP CA C 37 52.651 52.651 53.925 -1.274 17355
1551 1 4 . 1 1 37 37 ASP CB C 37 40.100 40.100 40.834 -0.734 17355
1552 1 4 . 1 1 37 37 ASP H H 37 7.800 7.800 8.278 -0.478 17355
1553 1 4 . 1 1 38 38 SER N N 38 116.534 116.534 115.786 0.748 17355
1554 1 4 . 1 1 38 38 SER HA H 38 4.147 4.147 4.301 -0.154 17355
1555 1 4 . 1 1 38 38 SER CA C 38 61.186 61.186 58.518 2.668 17355
1556 1 4 . 1 1 38 38 SER CB C 38 63.946 63.946 63.395 0.551 17355
1557 1 4 . 1 1 38 38 SER H H 38 7.376 7.376 7.880 -0.504 17355
1558 1 4 . 1 1 39 39 ARG N N 39 124.337 124.337 123.898 0.439 17355
1559 1 4 . 1 1 39 39 ARG HA H 39 4.521 4.521 4.687 -0.166 17355
1560 1 4 . 1 1 39 39 ARG CA C 39 55.049 55.049 54.724 0.326 17355
1561 1 4 . 1 1 39 39 ARG CB C 39 30.723 30.723 31.994 -1.271 17355
1562 1 4 . 1 1 39 39 ARG H H 39 10.095 10.095 8.551 1.544 17355
1563 1 4 . 1 1 40 40 PHE N N 40 122.834 122.834 120.149 2.685 17355
1564 1 4 . 1 1 40 40 PHE HA H 40 3.916 3.916 4.695 -0.779 17355
1565 1 4 . 1 1 40 40 PHE CA C 40 62.869 62.869 58.542 4.327 17355
1566 1 4 . 1 1 40 40 PHE CB C 40 39.662 39.662 37.536 2.126 17355
1567 1 4 . 1 1 40 40 PHE H H 40 7.498 7.498 8.384 -0.886 17355
1568 1 4 . 1 1 41 41 LEU N N 41 117.682 117.682 117.416 0.266 17355
1569 1 4 . 1 1 41 41 LEU HA H 41 4.519 4.519 4.548 -0.029 17355
1570 1 4 . 1 1 41 41 LEU CA C 41 58.111 58.111 55.767 2.344 17355
1571 1 4 . 1 1 41 41 LEU CB C 41 41.087 41.087 43.518 -2.431 17355
1572 1 4 . 1 1 41 41 LEU H H 41 8.619 8.619 7.156 1.463 17355
1573 1 4 . 1 1 42 42 ASP N N 42 114.800 114.800 120.727 -5.927 17355
1574 1 4 . 1 1 42 42 ASP HA H 42 4.185 4.185 4.356 -0.171 17355
1575 1 4 . 1 1 42 42 ASP CA C 42 57.713 57.713 55.489 2.224 17355
1576 1 4 . 1 1 42 42 ASP CB C 42 41.206 41.206 41.120 0.086 17355
1577 1 4 . 1 1 42 42 ASP H H 42 8.239 8.239 8.320 -0.081 17355
1578 1 4 . 1 1 43 43 ASP N N 43 111.125 111.125 120.028 -8.903 17355
1579 1 4 . 1 1 43 43 ASP HA H 43 4.915 4.915 4.479 0.436 17355
1580 1 4 . 1 1 43 43 ASP CA C 43 56.105 56.105 56.425 -0.320 17355
1581 1 4 . 1 1 43 43 ASP CB C 43 41.703 41.703 40.843 0.860 17355
1582 1 4 . 1 1 43 43 ASP H H 43 7.355 7.355 8.240 -0.885 17355
1583 1 4 . 1 1 44 44 LEU N N 44 114.924 114.924 116.721 -1.797 17355
1584 1 4 . 1 1 44 44 LEU HA H 44 4.273 4.273 4.243 0.030 17355
1585 1 4 . 1 1 44 44 LEU CA C 44 54.480 54.480 55.715 -1.235 17355
1586 1 4 . 1 1 44 44 LEU CB C 44 41.671 41.671 42.699 -1.028 17355
1587 1 4 . 1 1 44 44 LEU H H 44 7.172 7.172 7.799 -0.627 17355
1588 1 4 . 1 1 45 45 HIS N N 45 114.429 114.429 114.982 -0.553 17355
1589 1 4 . 1 1 45 45 HIS HA H 45 4.581 4.581 4.265 0.316 17355
1590 1 4 . 1 1 45 45 HIS CA C 45 56.189 56.189 55.662 0.527 17355
1591 1 4 . 1 1 45 45 HIS CB C 45 26.073 26.073 28.756 -2.683 17355
1592 1 4 . 1 1 45 45 HIS H H 45 7.308 7.308 7.825 -0.517 17355
1593 1 4 . 1 1 46 46 MET N N 46 118.597 118.597 117.375 1.222 17355
1594 1 4 . 1 1 46 46 MET HA H 46 4.614 4.614 4.739 -0.125 17355
1595 1 4 . 1 1 46 46 MET CA C 46 55.646 55.646 54.772 0.874 17355
1596 1 4 . 1 1 46 46 MET CB C 46 35.501 35.501 35.296 0.205 17355
1597 1 4 . 1 1 46 46 MET H H 46 8.618 8.618 8.186 0.432 17355
1598 1 4 . 1 1 47 47 SER N N 47 116.110 116.110 112.739 3.371 17355
1599 1 4 . 1 1 47 47 SER HA H 47 4.559 4.559 4.836 -0.277 17355
1600 1 4 . 1 1 47 47 SER CA C 47 56.696 56.696 57.246 -0.550 17355
1601 1 4 . 1 1 47 47 SER CB C 47 65.888 65.888 66.172 -0.284 17355
1602 1 4 . 1 1 47 47 SER H H 47 8.446 8.446 8.254 0.192 17355
1603 1 4 . 1 1 48 48 SER N N 48 116.756 116.756 117.795 -1.039 17355
1604 1 4 . 1 1 48 48 SER HA H 48 3.701 3.701 4.220 -0.519 17355
1605 1 4 . 1 1 48 48 SER CA C 48 62.260 62.260 61.805 0.455 17355
1606 1 4 . 1 1 48 48 SER CB C 48 62.289 62.289 63.054 -0.765 17355
1607 1 4 . 1 1 48 48 SER H H 48 8.948 8.948 8.800 0.148 17355
1608 1 4 . 1 1 49 49 ILE N N 49 122.227 122.227 121.246 0.981 17355
1609 1 4 . 1 1 49 49 ILE HA H 49 3.806 3.806 3.922 -0.116 17355
1610 1 4 . 1 1 49 49 ILE CA C 49 64.215 64.215 64.048 0.167 17355
1611 1 4 . 1 1 49 49 ILE CB C 49 38.059 38.059 35.943 2.116 17355
1612 1 4 . 1 1 49 49 ILE H H 49 7.595 7.595 8.063 -0.468 17355
1613 1 4 . 1 1 50 50 THR N N 50 120.233 120.233 116.911 3.322 17355
1614 1 4 . 1 1 50 50 THR HA H 50 3.878 3.878 3.994 -0.116 17355
1615 1 4 . 1 1 50 50 THR CA C 50 66.427 66.427 66.500 -0.073 17355
1616 1 4 . 1 1 50 50 THR CB C 50 68.223 68.223 68.037 0.186 17355
1617 1 4 . 1 1 50 50 THR H H 50 7.539 7.539 8.151 -0.612 17355
1618 1 4 . 1 1 51 51 VAL N N 51 121.320 121.320 121.046 0.274 17355
1619 1 4 . 1 1 51 51 VAL HA H 51 3.090 3.090 3.564 -0.474 17355
1620 1 4 . 1 1 51 51 VAL CA C 51 67.440 67.440 66.923 0.517 17355
1621 1 4 . 1 1 51 51 VAL CB C 51 31.087 31.087 31.509 -0.423 17355
1622 1 4 . 1 1 51 51 VAL H H 51 8.178 8.178 8.518 -0.340 17355
1623 1 4 . 1 1 52 52 GLY N N 52 105.968 105.968 106.624 -0.656 17355
1624 1 4 . 1 1 52 52 GLY CA C 52 47.339 47.339 47.127 0.212 17355
1625 1 4 . 1 1 52 52 GLY H H 52 8.004 8.004 7.540 0.464 17355
1626 1 4 . 1 1 53 53 GLN N N 53 120.486 120.486 120.859 -0.373 17355
1627 1 4 . 1 1 53 53 GLN HA H 53 4.086 4.086 4.088 -0.002 17355
1628 1 4 . 1 1 53 53 GLN CA C 53 58.919 58.919 58.264 0.655 17355
1629 1 4 . 1 1 53 53 GLN CB C 53 27.867 27.867 28.093 -0.226 17355
1630 1 4 . 1 1 53 53 GLN H H 53 7.675 7.675 8.139 -0.464 17355
1631 1 4 . 1 1 54 54 LEU N N 54 121.901 121.901 117.909 3.992 17355
1632 1 4 . 1 1 54 54 LEU HA H 54 4.049 4.049 4.290 -0.241 17355
1633 1 4 . 1 1 54 54 LEU CA C 54 58.661 58.661 57.521 1.140 17355
1634 1 4 . 1 1 54 54 LEU CB C 54 42.426 42.426 41.513 0.913 17355
1635 1 4 . 1 1 54 54 LEU H H 54 8.038 8.038 7.573 0.465 17355
1636 1 4 . 1 1 55 55 VAL N N 55 119.226 119.226 119.881 -0.655 17355
1637 1 4 . 1 1 55 55 VAL HA H 55 3.543 3.543 3.731 -0.188 17355
1638 1 4 . 1 1 55 55 VAL CA C 55 66.871 66.871 64.540 2.331 17355
1639 1 4 . 1 1 55 55 VAL CB C 55 31.392 31.392 30.429 0.963 17355
1640 1 4 . 1 1 55 55 VAL H H 55 8.375 8.375 8.336 0.039 17355
1641 1 4 . 1 1 56 56 ASN N N 56 117.987 117.987 116.535 1.452 17355
1642 1 4 . 1 1 56 56 ASN HA H 56 4.473 4.473 4.566 -0.093 17355
1643 1 4 . 1 1 56 56 ASN CA C 56 56.557 56.557 55.562 0.995 17355
1644 1 4 . 1 1 56 56 ASN CB C 56 38.509 38.509 38.722 -0.213 17355
1645 1 4 . 1 1 56 56 ASN H H 56 7.521 7.521 7.722 -0.201 17355
1646 1 4 . 1 1 57 57 GLU N N 57 121.765 121.765 118.472 3.293 17355
1647 1 4 . 1 1 57 57 GLU HA H 57 4.070 4.070 4.342 -0.272 17355
1648 1 4 . 1 1 57 57 GLU CA C 57 59.496 59.496 57.400 2.096 17355
1649 1 4 . 1 1 57 57 GLU CB C 57 29.395 29.395 30.388 -0.993 17355
1650 1 4 . 1 1 57 57 GLU H H 57 8.225 8.225 7.461 0.764 17355
1651 1 4 . 1 1 58 58 ALA N N 58 123.779 123.779 122.622 1.157 17355
1652 1 4 . 1 1 58 58 ALA HA H 58 3.874 3.874 4.369 -0.495 17355
1653 1 4 . 1 1 58 58 ALA CA C 58 55.227 55.227 54.731 0.496 17355
1654 1 4 . 1 1 58 58 ALA CB C 58 18.388 18.388 18.663 -0.275 17355
1655 1 4 . 1 1 58 58 ALA H H 58 8.659 8.659 7.339 1.320 17355
1656 1 4 . 1 1 59 59 ALA N N 59 118.656 118.656 121.140 -2.484 17355
1657 1 4 . 1 1 59 59 ALA HA H 59 3.819 3.819 3.934 -0.115 17355
1658 1 4 . 1 1 59 59 ALA CA C 59 55.871 55.871 55.620 0.251 17355
1659 1 4 . 1 1 59 59 ALA CB C 59 18.152 18.152 18.485 -0.333 17355
1660 1 4 . 1 1 59 59 ALA H H 59 8.537 8.537 7.799 0.738 17355
1661 1 4 . 1 1 60 60 ARG N N 60 117.701 117.701 117.850 -0.149 17355
1662 1 4 . 1 1 60 60 ARG HA H 60 4.096 4.096 4.000 0.096 17355
1663 1 4 . 1 1 60 60 ARG CA C 60 59.609 59.609 58.745 0.864 17355
1664 1 4 . 1 1 60 60 ARG CB C 60 29.974 29.974 29.051 0.923 17355
1665 1 4 . 1 1 60 60 ARG H H 60 7.923 7.923 8.193 -0.270 17355
1666 1 4 . 1 1 61 61 ALA N N 61 123.271 123.271 121.442 1.829 17355
1667 1 4 . 1 1 61 61 ALA HA H 61 4.137 4.137 4.178 -0.041 17355
1668 1 4 . 1 1 61 61 ALA CA C 61 54.912 54.912 54.037 0.875 17355
1669 1 4 . 1 1 61 61 ALA CB C 61 18.304 18.304 18.264 0.040 17355
1670 1 4 . 1 1 61 61 ALA H H 61 8.044 8.044 7.394 0.650 17355
1671 1 4 . 1 1 62 62 MET N N 62 114.725 114.725 116.704 -1.979 17355
1672 1 4 . 1 1 62 62 MET HA H 62 4.297 4.297 4.360 -0.063 17355
1673 1 4 . 1 1 62 62 MET CA C 62 56.392 56.392 56.191 0.201 17355
1674 1 4 . 1 1 62 62 MET CB C 62 34.827 34.827 33.077 1.750 17355
1675 1 4 . 1 1 62 62 MET H H 62 7.710 7.710 8.225 -0.515 17355
1676 1 4 . 1 1 63 63 GLY N N 63 108.268 108.268 107.613 0.655 17355
1677 1 4 . 1 1 63 63 GLY CA C 63 46.079 46.079 45.478 0.601 17355
1678 1 4 . 1 1 63 63 GLY H H 63 7.846 7.846 7.550 0.296 17355
1679 1 4 . 1 1 64 64 LEU N N 64 119.547 119.547 119.193 0.354 17355
1680 1 4 . 1 1 64 64 LEU HA H 64 4.526 4.526 4.583 -0.057 17355
1681 1 4 . 1 1 64 64 LEU CA C 64 53.605 53.605 54.717 -1.112 17355
1682 1 4 . 1 1 64 64 LEU CB C 64 43.784 43.784 42.873 0.911 17355
1683 1 4 . 1 1 64 64 LEU H H 64 8.183 8.183 8.094 0.089 17355
1684 1 4 . 1 1 65 65 SER N N 65 115.418 115.418 113.145 2.273 17355
1685 1 4 . 1 1 65 65 SER HA H 65 4.328 4.328 4.543 -0.215 17355
1686 1 4 . 1 1 65 65 SER CA C 65 58.319 58.319 58.514 -0.195 17355
1687 1 4 . 1 1 65 65 SER CB C 65 64.181 64.181 63.761 0.420 17355
1688 1 4 . 1 1 65 65 SER H H 65 8.302 8.302 8.344 -0.042 17355
1689 1 4 . 1 1 66 66 ALA N N 66 124.266 124.266 123.385 0.881 17355
1690 1 4 . 1 1 66 66 ALA HA H 66 4.212 4.212 4.554 -0.342 17355
1691 1 4 . 1 1 66 66 ALA CA C 66 52.624 52.624 52.755 -0.131 17355
1692 1 4 . 1 1 66 66 ALA CB C 66 19.309 19.309 19.283 0.026 17355
1693 1 4 . 1 1 66 66 ALA H H 66 8.262 8.262 8.004 0.258 17355
1694 1 4 . 1 1 67 67 VAL N N 67 118.373 118.373 116.731 1.642 17355
1695 1 4 . 1 1 67 67 VAL HA H 67 4.049 4.049 4.090 -0.041 17355
1696 1 4 . 1 1 67 67 VAL CA C 67 62.010 62.010 62.431 -0.421 17355
1697 1 4 . 1 1 67 67 VAL CB C 67 33.495 33.495 32.933 0.562 17355
1698 1 4 . 1 1 67 67 VAL H H 67 7.949 7.949 7.574 0.375 17355
1699 1 4 . 1 1 68 68 ALA N N 68 127.696 127.696 120.006 7.690 17355
1700 1 4 . 1 1 68 68 ALA HA H 68 4.308 4.308 4.120 0.188 17355
1701 1 4 . 1 1 68 68 ALA CA C 68 52.070 52.070 54.456 -2.386 17355
1702 1 4 . 1 1 68 68 ALA CB C 68 19.220 19.220 17.742 1.478 17355
1703 1 4 . 1 1 68 68 ALA H H 68 8.319 8.319 8.267 0.052 17355
1704 1 4 . 1 1 69 69 MET N N 69 120.285 120.285 114.332 5.953 17355
1705 1 4 . 1 1 69 69 MET HA H 69 4.664 4.664 5.058 -0.394 17355
1706 1 4 . 1 1 69 69 MET CA C 69 53.004 53.004 53.194 -0.190 17355
1707 1 4 . 1 1 69 69 MET CB C 69 32.678 32.678 34.089 -1.411 17355
1708 1 4 . 1 1 69 69 MET H H 69 8.224 8.224 7.998 0.226 17355
1709 1 4 . 1 1 70 70 PRO HA H 70 4.446 4.446 4.425 0.021 17355
1710 1 4 . 1 1 70 70 PRO CA C 70 63.452 63.452 64.549 -1.097 17355
1711 1 4 . 1 1 70 70 PRO CB C 70 32.012 32.012 32.200 -0.188 17355
1712 1 4 . 1 1 71 71 THR N N 71 112.663 112.663 109.765 2.898 17355
1713 1 4 . 1 1 71 71 THR HA H 71 4.074 4.074 3.758 0.316 17355
1714 1 4 . 1 1 71 71 THR CA C 71 62.869 62.869 61.505 1.363 17355
1715 1 4 . 1 1 71 71 THR CB C 71 69.516 69.516 69.806 -0.291 17355
1716 1 4 . 1 1 71 71 THR H H 71 7.957 7.957 7.550 0.407 17355
1717 1 4 . 1 1 72 72 ASN N N 72 120.054 120.054 119.181 0.873 17355
1718 1 4 . 1 1 72 72 ASN HA H 72 4.695 4.695 3.976 0.719 17355
1719 1 4 . 1 1 72 72 ASN CA C 72 52.856 52.856 55.877 -3.021 17355
1720 1 4 . 1 1 72 72 ASN CB C 72 38.165 38.165 37.688 0.477 17355
1721 1 4 . 1 1 72 72 ASN H H 72 8.227 8.227 8.221 0.006 17355
1722 1 4 . 1 1 73 73 PHE N N 73 121.570 121.570 115.281 6.289 17355
1723 1 4 . 1 1 73 73 PHE HA H 73 4.342 4.342 3.750 0.592 17355
1724 1 4 . 1 1 73 73 PHE CA C 73 59.609 59.609 60.451 -0.842 17355
1725 1 4 . 1 1 73 73 PHE CB C 73 39.000 39.000 36.765 2.235 17355
1726 1 4 . 1 1 73 73 PHE H H 73 8.331 8.331 8.258 0.073 17355
1727 1 4 . 1 1 74 74 ALA N N 74 121.047 121.047 122.083 -1.036 17355
1728 1 4 . 1 1 74 74 ALA HA H 74 4.074 4.074 4.167 -0.093 17355
1729 1 4 . 1 1 74 74 ALA CA C 74 54.705 54.705 54.996 -0.291 17355
1730 1 4 . 1 1 74 74 ALA CB C 74 19.159 19.159 19.025 0.134 17355
1731 1 4 . 1 1 74 74 ALA H H 74 8.163 8.163 8.075 0.088 17355
1732 1 4 . 1 1 75 75 THR N N 75 104.824 104.824 114.113 -9.289 17355
1733 1 4 . 1 1 75 75 THR HA H 75 4.475 4.475 4.403 0.072 17355
1734 1 4 . 1 1 75 75 THR CA C 75 60.669 60.669 61.725 -1.056 17355
1735 1 4 . 1 1 75 75 THR CB C 75 69.543 69.543 66.619 2.924 17355
1736 1 4 . 1 1 75 75 THR H H 75 7.581 7.581 8.110 -0.529 17355
1737 1 4 . 1 1 76 76 ALA N N 76 124.548 124.548 127.177 -2.629 17355
1738 1 4 . 1 1 76 76 ALA HA H 76 4.714 4.714 4.795 -0.081 17355
1739 1 4 . 1 1 76 76 ALA CA C 76 52.929 52.929 50.802 2.127 17355
1740 1 4 . 1 1 76 76 ALA CB C 76 20.661 20.661 22.276 -1.615 17355
1741 1 4 . 1 1 76 76 ALA H H 76 7.689 7.689 7.863 -0.174 17355
1742 1 4 . 1 1 77 77 THR N N 77 108.654 108.654 111.402 -2.748 17355
1743 1 4 . 1 1 77 77 THR HA H 77 5.017 5.017 4.790 0.227 17355
1744 1 4 . 1 1 77 77 THR CA C 77 58.847 58.847 59.754 -0.907 17355
1745 1 4 . 1 1 77 77 THR CB C 77 73.369 73.369 71.788 1.581 17355
1746 1 4 . 1 1 77 77 THR H H 77 7.495 7.495 8.212 -0.717 17355
1747 1 4 . 1 1 78 78 VAL N N 78 120.107 120.107 117.408 2.699 17355
1748 1 4 . 1 1 78 78 VAL HA H 78 3.418 3.418 4.001 -0.583 17355
1749 1 4 . 1 1 78 78 VAL CA C 78 67.446 67.446 66.418 1.028 17355
1750 1 4 . 1 1 78 78 VAL CB C 78 31.949 31.949 31.401 0.548 17355
1751 1 4 . 1 1 78 78 VAL H H 78 7.373 7.373 8.274 -0.901 17355
1752 1 4 . 1 1 79 79 ARG N N 79 117.131 117.131 119.135 -2.004 17355
1753 1 4 . 1 1 79 79 ARG HA H 79 3.877 3.877 4.117 -0.240 17355
1754 1 4 . 1 1 79 79 ARG CA C 79 59.566 59.566 58.599 0.967 17355
1755 1 4 . 1 1 79 79 ARG CB C 79 30.174 30.174 29.642 0.531 17355
1756 1 4 . 1 1 79 79 ARG H H 79 8.518 8.518 7.813 0.705 17355
1757 1 4 . 1 1 80 80 GLU N N 80 118.542 118.542 120.432 -1.890 17355
1758 1 4 . 1 1 80 80 GLU HA H 80 4.033 4.033 4.075 -0.042 17355
1759 1 4 . 1 1 80 80 GLU CA C 80 59.427 59.427 59.622 -0.195 17355
1760 1 4 . 1 1 80 80 GLU CB C 80 30.206 30.206 29.539 0.667 17355
1761 1 4 . 1 1 80 80 GLU H H 80 7.847 7.847 7.960 -0.113 17355
1762 1 4 . 1 1 81 81 MET N N 81 119.630 119.630 119.069 0.561 17355
1763 1 4 . 1 1 81 81 MET HA H 81 4.158 4.158 4.137 0.021 17355
1764 1 4 . 1 1 81 81 MET CA C 81 59.025 59.025 59.076 -0.051 17355
1765 1 4 . 1 1 81 81 MET CB C 81 32.916 32.916 32.648 0.269 17355
1766 1 4 . 1 1 81 81 MET H H 81 8.211 8.211 8.337 -0.126 17355
1767 1 4 . 1 1 82 82 ALA N N 82 120.463 120.463 121.831 -1.368 17355
1768 1 4 . 1 1 82 82 ALA HA H 82 3.911 3.911 4.169 -0.258 17355
1769 1 4 . 1 1 82 82 ALA CA C 82 56.004 56.004 54.532 1.472 17355
1770 1 4 . 1 1 82 82 ALA CB C 82 18.430 18.430 18.317 0.113 17355
1771 1 4 . 1 1 82 82 ALA H H 82 7.978 7.978 7.465 0.513 17355
1772 1 4 . 1 1 83 83 GLU N N 83 116.663 116.663 119.841 -3.178 17355
1773 1 4 . 1 1 83 83 GLU HA H 83 4.034 4.034 3.899 0.135 17355
1774 1 4 . 1 1 83 83 GLU CA C 83 59.476 59.476 59.662 -0.186 17355
1775 1 4 . 1 1 83 83 GLU CB C 83 29.470 29.470 29.744 -0.274 17355
1776 1 4 . 1 1 83 83 GLU H H 83 8.608 8.608 8.078 0.530 17355
1777 1 4 . 1 1 84 84 ALA N N 84 122.742 122.742 121.215 1.527 17355
1778 1 4 . 1 1 84 84 ALA HA H 84 4.241 4.241 3.999 0.242 17355
1779 1 4 . 1 1 84 84 ALA CA C 84 54.970 54.970 55.285 -0.315 17355
1780 1 4 . 1 1 84 84 ALA CB C 84 18.150 18.150 18.161 -0.011 17355
1781 1 4 . 1 1 84 84 ALA H H 84 7.918 7.918 8.164 -0.246 17355
1782 1 4 . 1 1 85 85 LEU N N 85 119.158 119.158 118.709 0.449 17355
1783 1 4 . 1 1 85 85 LEU HA H 85 3.945 3.945 3.916 0.029 17355
1784 1 4 . 1 1 85 85 LEU CA C 85 57.849 57.849 57.639 0.210 17355
1785 1 4 . 1 1 85 85 LEU CB C 85 41.884 41.884 41.748 0.136 17355
1786 1 4 . 1 1 85 85 LEU H H 85 7.692 7.692 7.740 -0.048 17355
1787 1 4 . 1 1 86 86 GLU N N 86 118.441 118.441 120.460 -2.019 17355
1788 1 4 . 1 1 86 86 GLU HA H 86 4.053 4.053 4.281 -0.228 17355
1789 1 4 . 1 1 86 86 GLU CA C 86 59.131 59.131 58.822 0.309 17355
1790 1 4 . 1 1 86 86 GLU CB C 86 29.868 29.868 29.491 0.377 17355
1791 1 4 . 1 1 86 86 GLU H H 86 8.152 8.152 8.490 -0.338 17355
1792 1 4 . 1 1 87 87 ALA N N 87 120.690 120.690 121.067 -0.377 17355
1793 1 4 . 1 1 87 87 ALA HA H 87 4.139 4.139 4.522 -0.383 17355
1794 1 4 . 1 1 87 87 ALA CA C 87 54.506 54.506 53.150 1.356 17355
1795 1 4 . 1 1 87 87 ALA CB C 87 18.435 18.435 19.470 -1.035 17355
1796 1 4 . 1 1 87 87 ALA H H 87 7.899 7.899 8.001 -0.102 17355
1797 1 4 . 1 1 88 88 ARG N N 88 117.642 117.642 119.528 -1.886 17355
1798 1 4 . 1 1 88 88 ARG HA H 88 4.204 4.204 4.006 0.198 17355
1799 1 4 . 1 1 88 88 ARG CA C 88 57.435 57.435 59.289 -1.854 17355
1800 1 4 . 1 1 88 88 ARG CB C 88 30.106 30.106 30.140 -0.034 17355
1801 1 4 . 1 1 88 88 ARG H H 88 7.593 7.593 8.340 -0.747 17355
1802 1 4 . 1 1 89 89 GLU N N 89 121.080 121.080 116.358 4.722 17355
1803 1 4 . 1 1 89 89 GLU HA H 89 4.047 4.047 4.110 -0.063 17355
1804 1 4 . 1 1 89 89 GLU CA C 89 58.858 58.858 58.692 0.166 17355
1805 1 4 . 1 1 89 89 GLU CB C 89 29.912 29.912 29.513 0.399 17355
1806 1 4 . 1 1 89 89 GLU H H 89 8.222 8.222 7.693 0.529 17355
1807 1 4 . 1 1 90 90 ARG N N 90 117.834 117.834 119.442 -1.608 17355
1808 1 4 . 1 1 90 90 ARG HA H 90 4.212 4.212 4.298 -0.086 17355
1809 1 4 . 1 1 90 90 ARG CA C 90 57.409 57.409 57.510 -0.100 17355
1810 1 4 . 1 1 90 90 ARG CB C 90 30.906 30.906 30.967 -0.061 17355
1811 1 4 . 1 1 90 90 ARG H H 90 7.924 7.924 7.780 0.144 17355
1812 1 4 . 1 1 91 91 GLU N N 91 118.786 118.786 120.147 -1.361 17355
1813 1 4 . 1 1 91 91 GLU HA H 91 4.254 4.254 4.170 0.084 17355
1814 1 4 . 1 1 91 91 GLU CA C 91 56.693 56.693 56.916 -0.223 17355
1815 1 4 . 1 1 91 91 GLU CB C 91 30.416 30.416 30.024 0.392 17355
1816 1 4 . 1 1 91 91 GLU H H 91 7.749 7.749 8.107 -0.358 17355
1817 1 4 . 1 1 92 92 ALA N N 92 125.247 125.247 120.955 4.292 17355
1818 1 4 . 1 1 92 92 ALA HA H 92 4.551 4.551 4.195 0.356 17355
1819 1 4 . 1 1 92 92 ALA CA C 92 51.073 51.073 52.106 -1.033 17355
1820 1 4 . 1 1 92 92 ALA CB C 92 18.443 18.443 17.552 0.891 17355
1821 1 4 . 1 1 92 92 ALA H H 92 7.888 7.888 7.576 0.312 17355
1822 1 4 . 1 1 93 93 PRO HA H 93 4.383 4.383 4.280 0.103 17355
1823 1 4 . 1 1 93 93 PRO CA C 93 63.744 63.744 65.176 -1.432 17355
1824 1 4 . 1 1 93 93 PRO CB C 93 32.122 32.122 32.307 -0.185 17355
1825 1 4 . 1 1 94 94 HIS N N 94 118.597 118.597 114.451 4.146 17355
1826 1 4 . 1 1 94 94 HIS HA H 94 4.639 4.639 4.659 -0.020 17355
1827 1 4 . 1 1 94 94 HIS CA C 94 56.044 56.044 56.473 -0.429 17355
1828 1 4 . 1 1 94 94 HIS CB C 94 29.789 29.789 30.817 -1.028 17355
1829 1 4 . 1 1 94 94 HIS H H 94 8.392 8.392 7.911 0.481 17355
1830 1 4 . 1 1 95 95 LEU N N 95 123.443 123.443 121.679 1.764 17355
1831 1 4 . 1 1 95 95 LEU HA H 95 4.287 4.287 4.592 -0.305 17355
1832 1 4 . 1 1 95 95 LEU CA C 95 55.233 55.233 55.038 0.195 17355
1833 1 4 . 1 1 95 95 LEU CB C 95 42.710 42.710 45.320 -2.610 17355
1834 1 4 . 1 1 95 95 LEU H H 95 8.061 8.061 8.280 -0.219 17355
1835 1 4 . 1 1 96 96 GLU N N 96 121.295 121.295 122.798 -1.503 17355
1836 1 4 . 1 1 96 96 GLU HA H 96 4.176 4.176 4.725 -0.549 17355
1837 1 4 . 1 1 96 96 GLU CA C 96 56.706 56.706 56.168 0.538 17355
1838 1 4 . 1 1 96 96 GLU CB C 96 30.319 30.319 31.844 -1.525 17355
1839 1 4 . 1 1 96 96 GLU H H 96 8.346 8.346 8.678 -0.332 17355
1840 1 4 . 1 1 97 97 HIS N N 97 119.932 119.932 116.544 3.388 17355
1841 1 4 . 1 1 97 97 HIS HA H 97 4.555 4.555 4.702 -0.147 17355
1842 1 4 . 1 1 97 97 HIS CA C 97 56.042 56.042 55.864 0.178 17355
1843 1 4 . 1 1 97 97 HIS H H 97 8.251 8.251 8.662 -0.411 17355
1844 1 4 . 1 1 98 98 HIS N N 98 125.446 125.446 118.359 7.087 17355
1845 1 4 . 1 1 98 98 HIS HA H 98 4.363 4.363 4.461 -0.098 17355
1846 1 4 . 1 1 98 98 HIS CA C 98 57.303 57.303 55.344 1.959 17355
1847 1 4 . 1 1 98 98 HIS CB C 98 30.319 30.319 31.808 -1.489 17355
1848 1 4 . 1 1 98 98 HIS H H 98 8.054 8.054 7.815 0.239 17355
1849 1 5 . 1 1 3 3 ARG HA H 3 4.321 4.321 4.476 -0.155 17355
1850 1 5 . 1 1 3 3 ARG CA C 3 56.560 56.560 55.700 0.860 17355
1851 1 5 . 1 1 4 4 ALA N N 4 125.797 125.797 123.589 2.208 17355
1852 1 5 . 1 1 4 4 ALA HA H 4 4.283 4.283 4.688 -0.405 17355
1853 1 5 . 1 1 4 4 ALA CA C 4 52.900 52.900 52.302 0.598 17355
1854 1 5 . 1 1 4 4 ALA CB C 4 19.411 19.411 19.367 0.043 17355
1855 1 5 . 1 1 4 4 ALA H H 4 8.563 8.563 8.529 0.034 17355
1856 1 5 . 1 1 5 5 ASP N N 5 118.416 118.416 118.004 0.412 17355
1857 1 5 . 1 1 5 5 ASP HA H 5 4.584 4.584 4.759 -0.175 17355
1858 1 5 . 1 1 5 5 ASP CA C 5 54.337 54.337 53.582 0.755 17355
1859 1 5 . 1 1 5 5 ASP CB C 5 41.186 41.186 40.663 0.523 17355
1860 1 5 . 1 1 5 5 ASP H H 5 8.208 8.208 8.235 -0.027 17355
1861 1 5 . 1 1 6 6 ASP N N 6 120.632 120.632 119.998 0.634 17355
1862 1 5 . 1 1 6 6 ASP HA H 6 4.578 4.578 4.615 -0.037 17355
1863 1 5 . 1 1 6 6 ASP CA C 6 54.589 54.589 54.784 -0.195 17355
1864 1 5 . 1 1 6 6 ASP CB C 6 41.239 41.239 42.322 -1.083 17355
1865 1 5 . 1 1 6 6 ASP H H 6 8.140 8.140 7.985 0.155 17355
1866 1 5 . 1 1 7 7 THR N N 7 113.693 113.693 109.979 3.714 17355
1867 1 5 . 1 1 7 7 THR HA H 7 4.245 4.245 4.247 -0.002 17355
1868 1 5 . 1 1 7 7 THR CA C 7 62.392 62.392 63.318 -0.926 17355
1869 1 5 . 1 1 7 7 THR CB C 7 69.721 69.721 69.021 0.700 17355
1870 1 5 . 1 1 7 7 THR H H 7 8.045 8.045 8.201 -0.156 17355
1871 1 5 . 1 1 8 8 ALA N N 8 126.414 126.414 125.873 0.541 17355
1872 1 5 . 1 1 8 8 ALA HA H 8 4.314 4.314 4.163 0.151 17355
1873 1 5 . 1 1 8 8 ALA CA C 8 52.253 52.253 54.233 -1.980 17355
1874 1 5 . 1 1 8 8 ALA CB C 8 19.464 19.464 18.994 0.470 17355
1875 1 5 . 1 1 8 8 ALA H H 8 8.139 8.139 8.146 -0.007 17355
1876 1 5 . 1 1 9 9 LEU N N 9 122.921 122.921 119.782 3.139 17355
1877 1 5 . 1 1 9 9 LEU HA H 9 4.559 4.559 4.679 -0.120 17355
1878 1 5 . 1 1 9 9 LEU CA C 9 53.088 53.088 53.466 -0.378 17355
1879 1 5 . 1 1 9 9 LEU CB C 9 41.929 41.929 41.312 0.617 17355
1880 1 5 . 1 1 9 9 LEU H H 9 8.113 8.113 8.001 0.112 17355
1881 1 5 . 1 1 10 10 PRO HA H 10 4.367 4.367 4.795 -0.428 17355
1882 1 5 . 1 1 10 10 PRO CA C 10 63.373 63.373 62.651 0.722 17355
1883 1 5 . 1 1 10 10 PRO CB C 10 31.975 31.975 32.868 -0.893 17355
1884 1 5 . 1 1 11 11 ALA N N 11 124.349 124.349 120.668 3.681 17355
1885 1 5 . 1 1 11 11 ALA HA H 11 4.262 4.262 4.394 -0.132 17355
1886 1 5 . 1 1 11 11 ALA CA C 11 52.496 52.496 51.793 0.703 17355
1887 1 5 . 1 1 11 11 ALA CB C 11 19.424 19.424 19.161 0.263 17355
1888 1 5 . 1 1 11 11 ALA H H 11 8.317 8.317 8.477 -0.160 17355
1889 1 5 . 1 1 12 12 ALA N N 12 123.291 123.291 121.747 1.544 17355
1890 1 5 . 1 1 12 12 ALA HA H 12 4.380 4.380 4.014 0.366 17355
1891 1 5 . 1 1 12 12 ALA CA C 12 52.461 52.461 52.728 -0.267 17355
1892 1 5 . 1 1 12 12 ALA CB C 12 19.557 19.557 18.296 1.261 17355
1893 1 5 . 1 1 12 12 ALA H H 12 8.287 8.287 7.908 0.379 17355
1894 1 5 . 1 1 13 13 THR N N 13 112.758 112.758 112.727 0.031 17355
1895 1 5 . 1 1 13 13 THR HA H 13 4.350 4.350 4.320 0.030 17355
1896 1 5 . 1 1 13 13 THR CA C 13 62.074 62.074 62.186 -0.112 17355
1897 1 5 . 1 1 13 13 THR CB C 13 70.070 70.070 70.109 -0.039 17355
1898 1 5 . 1 1 13 13 THR H H 13 8.074 8.074 8.350 -0.276 17355
1899 1 5 . 1 1 14 14 GLY N N 14 110.774 110.774 108.626 2.148 17355
1900 1 5 . 1 1 14 14 GLY CA C 14 45.692 45.692 45.895 -0.203 17355
1901 1 5 . 1 1 14 14 GLY H H 14 8.405 8.405 7.645 0.760 17355
1902 1 5 . 1 1 15 15 ALA N N 15 124.127 124.127 124.003 0.124 17355
1903 1 5 . 1 1 15 15 ALA HA H 15 4.137 4.137 4.235 -0.098 17355
1904 1 5 . 1 1 15 15 ALA CA C 15 55.368 55.368 54.538 0.830 17355
1905 1 5 . 1 1 15 15 ALA CB C 15 20.100 20.100 19.180 0.920 17355
1906 1 5 . 1 1 15 15 ALA H H 15 8.866 8.866 8.454 0.412 17355
1907 1 5 . 1 1 16 16 LEU N N 16 118.013 118.013 119.694 -1.681 17355
1908 1 5 . 1 1 16 16 LEU HA H 16 3.870 3.870 3.996 -0.126 17355
1909 1 5 . 1 1 16 16 LEU CA C 16 58.820 58.820 57.901 0.919 17355
1910 1 5 . 1 1 16 16 LEU CB C 16 41.332 41.332 41.388 -0.056 17355
1911 1 5 . 1 1 16 16 LEU H H 16 8.414 8.414 8.570 -0.156 17355
1912 1 5 . 1 1 17 17 GLU N N 17 117.730 117.730 115.811 1.919 17355
1913 1 5 . 1 1 17 17 GLU HA H 17 3.978 3.978 4.138 -0.160 17355
1914 1 5 . 1 1 17 17 GLU CA C 17 59.909 59.909 57.954 1.955 17355
1915 1 5 . 1 1 17 17 GLU CB C 17 29.212 29.212 28.656 0.556 17355
1916 1 5 . 1 1 17 17 GLU H H 17 8.088 8.088 8.149 -0.061 17355
1917 1 5 . 1 1 18 18 LEU N N 18 121.355 121.355 120.765 0.590 17355
1918 1 5 . 1 1 18 18 LEU HA H 18 4.165 4.165 4.091 0.074 17355
1919 1 5 . 1 1 18 18 LEU CA C 18 58.469 58.469 57.892 0.577 17355
1920 1 5 . 1 1 18 18 LEU CB C 18 42.459 42.459 42.214 0.245 17355
1921 1 5 . 1 1 18 18 LEU H H 18 7.767 7.767 7.117 0.650 17355
1922 1 5 . 1 1 19 19 VAL N N 19 118.522 118.522 116.684 1.838 17355
1923 1 5 . 1 1 19 19 VAL HA H 19 3.424 3.424 3.759 -0.335 17355
1924 1 5 . 1 1 19 19 VAL CA C 19 67.958 67.958 65.902 2.056 17355
1925 1 5 . 1 1 19 19 VAL CB C 19 31.922 31.922 31.916 0.007 17355
1926 1 5 . 1 1 19 19 VAL H H 19 8.661 8.661 7.579 1.082 17355
1927 1 5 . 1 1 20 20 ARG N N 20 117.959 117.959 118.595 -0.636 17355
1928 1 5 . 1 1 20 20 ARG HA H 20 3.576 3.576 4.221 -0.645 17355
1929 1 5 . 1 1 20 20 ARG CA C 20 60.994 60.994 56.946 4.048 17355
1930 1 5 . 1 1 20 20 ARG CB C 20 30.703 30.703 28.339 2.364 17355
1931 1 5 . 1 1 20 20 ARG H H 20 8.705 8.705 8.154 0.551 17355
1932 1 5 . 1 1 21 21 HIS N N 21 115.245 115.245 116.580 -1.335 17355
1933 1 5 . 1 1 21 21 HIS HA H 21 4.144 4.144 4.572 -0.428 17355
1934 1 5 . 1 1 21 21 HIS CA C 21 60.536 60.536 57.152 3.384 17355
1935 1 5 . 1 1 21 21 HIS CB C 21 29.099 29.099 32.449 -3.349 17355
1936 1 5 . 1 1 21 21 HIS H H 21 7.811 7.811 8.332 -0.521 17355
1937 1 5 . 1 1 22 22 LEU N N 22 119.884 119.884 120.368 -0.484 17355
1938 1 5 . 1 1 22 22 LEU HA H 22 4.078 4.078 4.120 -0.042 17355
1939 1 5 . 1 1 22 22 LEU CA C 22 58.164 58.164 57.882 0.282 17355
1940 1 5 . 1 1 22 22 LEU CB C 22 42.889 42.889 41.590 1.299 17355
1941 1 5 . 1 1 22 22 LEU H H 22 8.301 8.301 7.693 0.608 17355
1942 1 5 . 1 1 23 23 VAL N N 23 119.391 119.391 118.866 0.525 17355
1943 1 5 . 1 1 23 23 VAL HA H 23 3.429 3.429 3.739 -0.310 17355
1944 1 5 . 1 1 23 23 VAL CA C 23 67.179 67.179 66.361 0.818 17355
1945 1 5 . 1 1 23 23 VAL CB C 23 31.366 31.366 31.421 -0.055 17355
1946 1 5 . 1 1 23 23 VAL H H 23 8.897 8.897 7.516 1.381 17355
1947 1 5 . 1 1 24 24 ALA N N 24 121.610 121.610 121.825 -0.215 17355
1948 1 5 . 1 1 24 24 ALA HA H 24 3.851 3.851 3.996 -0.145 17355
1949 1 5 . 1 1 24 24 ALA CA C 24 55.944 55.944 55.350 0.594 17355
1950 1 5 . 1 1 24 24 ALA CB C 24 18.042 18.042 18.232 -0.190 17355
1951 1 5 . 1 1 24 24 ALA H H 24 8.276 8.276 7.761 0.515 17355
1952 1 5 . 1 1 25 25 GLU N N 25 114.822 114.822 116.271 -1.449 17355
1953 1 5 . 1 1 25 25 GLU HA H 25 4.042 4.042 4.233 -0.191 17355
1954 1 5 . 1 1 25 25 GLU CA C 25 59.255 59.255 58.551 0.704 17355
1955 1 5 . 1 1 25 25 GLU CB C 25 29.951 29.951 29.095 0.856 17355
1956 1 5 . 1 1 25 25 GLU H H 25 7.693 7.693 7.933 -0.240 17355
1957 1 5 . 1 1 26 26 ARG N N 26 118.510 118.510 117.366 1.144 17355
1958 1 5 . 1 1 26 26 ARG HA H 26 4.252 4.252 4.251 0.001 17355
1959 1 5 . 1 1 26 26 ARG CA C 26 57.090 57.090 56.842 0.248 17355
1960 1 5 . 1 1 26 26 ARG CB C 26 30.080 30.080 30.230 -0.150 17355
1961 1 5 . 1 1 26 26 ARG H H 26 7.783 7.783 7.885 -0.102 17355
1962 1 5 . 1 1 27 27 ALA N N 27 120.375 120.375 119.370 1.005 17355
1963 1 5 . 1 1 27 27 ALA HA H 27 4.342 4.342 4.449 -0.107 17355
1964 1 5 . 1 1 27 27 ALA CA C 27 52.134 52.134 52.913 -0.778 17355
1965 1 5 . 1 1 27 27 ALA CB C 27 19.283 19.283 21.052 -1.769 17355
1966 1 5 . 1 1 27 27 ALA H H 27 8.638 8.638 7.938 0.700 17355
1967 1 5 . 1 1 28 28 GLU N N 28 115.494 115.494 114.021 1.473 17355
1968 1 5 . 1 1 28 28 GLU HA H 28 3.873 3.873 4.335 -0.463 17355
1969 1 5 . 1 1 28 28 GLU CA C 28 56.940 56.940 56.806 0.134 17355
1970 1 5 . 1 1 28 28 GLU CB C 28 27.058 27.058 32.024 -4.966 17355
1971 1 5 . 1 1 28 28 GLU H H 28 7.734 7.734 8.459 -0.725 17355
1972 1 5 . 1 1 29 29 LEU N N 29 119.978 119.978 122.856 -2.878 17355
1973 1 5 . 1 1 29 29 LEU HA H 29 4.898 4.898 4.446 0.452 17355
1974 1 5 . 1 1 29 29 LEU CA C 29 51.498 51.498 53.818 -2.320 17355
1975 1 5 . 1 1 29 29 LEU CB C 29 45.348 45.348 41.766 3.582 17355
1976 1 5 . 1 1 29 29 LEU H H 29 8.075 8.075 7.854 0.221 17355
1977 1 5 . 1 1 30 30 PRO HA H 30 4.461 4.461 4.457 0.004 17355
1978 1 5 . 1 1 30 30 PRO CA C 30 62.524 62.524 62.544 -0.020 17355
1979 1 5 . 1 1 30 30 PRO CB C 30 32.015 32.015 30.135 1.880 17355
1980 1 5 . 1 1 31 31 VAL N N 31 123.773 123.773 121.223 2.550 17355
1981 1 5 . 1 1 31 31 VAL HA H 31 3.540 3.540 3.801 -0.261 17355
1982 1 5 . 1 1 31 31 VAL CA C 31 65.493 65.493 64.277 1.216 17355
1983 1 5 . 1 1 31 31 VAL CB C 31 31.865 31.865 31.653 0.212 17355
1984 1 5 . 1 1 31 31 VAL H H 31 8.432 8.432 8.222 0.210 17355
1985 1 5 . 1 1 32 32 GLU N N 32 117.215 117.215 119.687 -2.472 17355
1986 1 5 . 1 1 32 32 GLU HA H 32 4.053 4.053 4.668 -0.615 17355
1987 1 5 . 1 1 32 32 GLU CA C 32 59.131 59.131 56.698 2.433 17355
1988 1 5 . 1 1 32 32 GLU CB C 32 28.781 28.781 30.275 -1.494 17355
1989 1 5 . 1 1 32 32 GLU H H 32 8.971 8.971 8.214 0.757 17355
1990 1 5 . 1 1 33 33 VAL N N 33 113.611 113.611 115.375 -1.764 17355
1991 1 5 . 1 1 33 33 VAL HA H 33 4.214 4.214 4.233 -0.019 17355
1992 1 5 . 1 1 33 33 VAL CA C 33 61.795 61.795 61.963 -0.168 17355
1993 1 5 . 1 1 33 33 VAL CB C 33 32.094 32.094 31.707 0.387 17355
1994 1 5 . 1 1 33 33 VAL H H 33 7.470 7.470 7.475 -0.005 17355
1995 1 5 . 1 1 34 34 LEU N N 34 123.533 123.533 122.266 1.267 17355
1996 1 5 . 1 1 34 34 LEU HA H 34 4.114 4.114 4.180 -0.066 17355
1997 1 5 . 1 1 34 34 LEU CA C 34 54.877 54.877 56.061 -1.184 17355
1998 1 5 . 1 1 34 34 LEU CB C 34 42.590 42.590 42.383 0.207 17355
1999 1 5 . 1 1 34 34 LEU H H 34 7.300 7.300 7.656 -0.356 17355
2000 1 5 . 1 1 35 35 ARG N N 35 125.820 125.820 126.064 -0.244 17355
2001 1 5 . 1 1 35 35 ARG HA H 35 4.578 4.578 4.191 0.387 17355
2002 1 5 . 1 1 35 35 ARG CA C 35 54.619 54.619 56.942 -2.323 17355
2003 1 5 . 1 1 35 35 ARG CB C 35 31.909 31.909 31.063 0.846 17355
2004 1 5 . 1 1 35 35 ARG H H 35 8.415 8.415 8.489 -0.074 17355
2005 1 5 . 1 1 36 36 ASP N N 36 123.211 123.211 116.625 6.586 17355
2006 1 5 . 1 1 36 36 ASP HA H 36 4.156 4.156 4.588 -0.432 17355
2007 1 5 . 1 1 36 36 ASP CA C 36 57.258 57.258 55.644 1.614 17355
2008 1 5 . 1 1 36 36 ASP CB C 36 40.400 40.400 41.666 -1.266 17355
2009 1 5 . 1 1 36 36 ASP H H 36 8.880 8.880 8.493 0.387 17355
2010 1 5 . 1 1 37 37 ASP N N 37 112.390 112.390 118.343 -5.953 17355
2011 1 5 . 1 1 37 37 ASP HA H 37 4.614 4.614 4.741 -0.127 17355
2012 1 5 . 1 1 37 37 ASP CA C 37 52.651 52.651 53.323 -0.672 17355
2013 1 5 . 1 1 37 37 ASP CB C 37 40.100 40.100 40.689 -0.589 17355
2014 1 5 . 1 1 37 37 ASP H H 37 7.800 7.800 8.229 -0.429 17355
2015 1 5 . 1 1 38 38 SER N N 38 116.534 116.534 115.734 0.800 17355
2016 1 5 . 1 1 38 38 SER HA H 38 4.147 4.147 4.276 -0.129 17355
2017 1 5 . 1 1 38 38 SER CA C 38 61.186 61.186 58.797 2.389 17355
2018 1 5 . 1 1 38 38 SER CB C 38 63.946 63.946 63.164 0.782 17355
2019 1 5 . 1 1 38 38 SER H H 38 7.376 7.376 7.743 -0.367 17355
2020 1 5 . 1 1 39 39 ARG N N 39 124.337 124.337 124.083 0.254 17355
2021 1 5 . 1 1 39 39 ARG HA H 39 4.521 4.521 4.632 -0.111 17355
2022 1 5 . 1 1 39 39 ARG CA C 39 55.049 55.049 54.767 0.282 17355
2023 1 5 . 1 1 39 39 ARG CB C 39 30.723 30.723 31.764 -1.041 17355
2024 1 5 . 1 1 39 39 ARG H H 39 10.095 10.095 8.141 1.954 17355
2025 1 5 . 1 1 40 40 PHE N N 40 122.834 122.834 119.286 3.548 17355
2026 1 5 . 1 1 40 40 PHE HA H 40 3.916 3.916 4.688 -0.772 17355
2027 1 5 . 1 1 40 40 PHE CA C 40 62.869 62.869 58.753 4.116 17355
2028 1 5 . 1 1 40 40 PHE CB C 40 39.662 39.662 38.137 1.525 17355
2029 1 5 . 1 1 40 40 PHE H H 40 7.498 7.498 8.277 -0.779 17355
2030 1 5 . 1 1 41 41 LEU N N 41 117.682 117.682 117.722 -0.040 17355
2031 1 5 . 1 1 41 41 LEU HA H 41 4.519 4.519 4.281 0.238 17355
2032 1 5 . 1 1 41 41 LEU CA C 41 58.111 58.111 55.991 2.120 17355
2033 1 5 . 1 1 41 41 LEU CB C 41 41.087 41.087 42.570 -1.483 17355
2034 1 5 . 1 1 41 41 LEU H H 41 8.619 8.619 7.724 0.895 17355
2035 1 5 . 1 1 42 42 ASP N N 42 114.800 114.800 119.521 -4.721 17355
2036 1 5 . 1 1 42 42 ASP HA H 42 4.185 4.185 4.415 -0.230 17355
2037 1 5 . 1 1 42 42 ASP CA C 42 57.713 57.713 56.721 0.993 17355
2038 1 5 . 1 1 42 42 ASP CB C 42 41.206 41.206 40.762 0.444 17355
2039 1 5 . 1 1 42 42 ASP H H 42 8.239 8.239 8.331 -0.092 17355
2040 1 5 . 1 1 43 43 ASP N N 43 111.125 111.125 119.159 -8.034 17355
2041 1 5 . 1 1 43 43 ASP HA H 43 4.915 4.915 4.616 0.299 17355
2042 1 5 . 1 1 43 43 ASP CA C 43 56.105 56.105 55.585 0.520 17355
2043 1 5 . 1 1 43 43 ASP CB C 43 41.703 41.703 41.367 0.336 17355
2044 1 5 . 1 1 43 43 ASP H H 43 7.355 7.355 8.032 -0.677 17355
2045 1 5 . 1 1 44 44 LEU N N 44 114.924 114.924 118.153 -3.229 17355
2046 1 5 . 1 1 44 44 LEU HA H 44 4.273 4.273 4.082 0.191 17355
2047 1 5 . 1 1 44 44 LEU CA C 44 54.480 54.480 56.726 -2.246 17355
2048 1 5 . 1 1 44 44 LEU CB C 44 41.671 41.671 42.542 -0.871 17355
2049 1 5 . 1 1 44 44 LEU H H 44 7.172 7.172 7.587 -0.415 17355
2050 1 5 . 1 1 45 45 HIS N N 45 114.429 114.429 114.786 -0.357 17355
2051 1 5 . 1 1 45 45 HIS HA H 45 4.581 4.581 4.310 0.271 17355
2052 1 5 . 1 1 45 45 HIS CA C 45 56.189 56.189 55.935 0.254 17355
2053 1 5 . 1 1 45 45 HIS CB C 45 26.073 26.073 28.721 -2.648 17355
2054 1 5 . 1 1 45 45 HIS H H 45 7.308 7.308 7.959 -0.651 17355
2055 1 5 . 1 1 46 46 MET N N 46 118.597 118.597 121.732 -3.135 17355
2056 1 5 . 1 1 46 46 MET HA H 46 4.614 4.614 4.776 -0.162 17355
2057 1 5 . 1 1 46 46 MET CA C 46 55.646 55.646 54.475 1.171 17355
2058 1 5 . 1 1 46 46 MET CB C 46 35.501 35.501 36.291 -0.790 17355
2059 1 5 . 1 1 46 46 MET H H 46 8.618 8.618 8.058 0.560 17355
2060 1 5 . 1 1 47 47 SER N N 47 116.110 116.110 118.621 -2.511 17355
2061 1 5 . 1 1 47 47 SER HA H 47 4.559 4.559 4.737 -0.178 17355
2062 1 5 . 1 1 47 47 SER CA C 47 56.696 56.696 57.902 -1.206 17355
2063 1 5 . 1 1 47 47 SER CB C 47 65.888 65.888 64.496 1.391 17355
2064 1 5 . 1 1 47 47 SER H H 47 8.446 8.446 9.081 -0.635 17355
2065 1 5 . 1 1 48 48 SER N N 48 116.756 116.756 117.183 -0.427 17355
2066 1 5 . 1 1 48 48 SER HA H 48 3.701 3.701 4.171 -0.470 17355
2067 1 5 . 1 1 48 48 SER CA C 48 62.260 62.260 61.709 0.551 17355
2068 1 5 . 1 1 48 48 SER CB C 48 62.289 62.289 63.102 -0.813 17355
2069 1 5 . 1 1 48 48 SER H H 48 8.948 8.948 8.819 0.129 17355
2070 1 5 . 1 1 49 49 ILE N N 49 122.227 122.227 120.630 1.597 17355
2071 1 5 . 1 1 49 49 ILE HA H 49 3.806 3.806 3.725 0.081 17355
2072 1 5 . 1 1 49 49 ILE CA C 49 64.215 64.215 64.788 -0.573 17355
2073 1 5 . 1 1 49 49 ILE CB C 49 38.059 38.059 36.135 1.924 17355
2074 1 5 . 1 1 49 49 ILE H H 49 7.595 7.595 8.127 -0.532 17355
2075 1 5 . 1 1 50 50 THR N N 50 120.233 120.233 115.620 4.613 17355
2076 1 5 . 1 1 50 50 THR HA H 50 3.878 3.878 4.001 -0.123 17355
2077 1 5 . 1 1 50 50 THR CA C 50 66.427 66.427 66.102 0.325 17355
2078 1 5 . 1 1 50 50 THR CB C 50 68.223 68.223 68.290 -0.066 17355
2079 1 5 . 1 1 50 50 THR H H 50 7.539 7.539 7.899 -0.360 17355
2080 1 5 . 1 1 51 51 VAL N N 51 121.320 121.320 121.726 -0.406 17355
2081 1 5 . 1 1 51 51 VAL HA H 51 3.090 3.090 3.553 -0.463 17355
2082 1 5 . 1 1 51 51 VAL CA C 51 67.440 67.440 66.812 0.628 17355
2083 1 5 . 1 1 51 51 VAL CB C 51 31.087 31.087 31.242 -0.155 17355
2084 1 5 . 1 1 51 51 VAL H H 51 8.178 8.178 8.549 -0.371 17355
2085 1 5 . 1 1 52 52 GLY N N 52 105.968 105.968 105.735 0.233 17355
2086 1 5 . 1 1 52 52 GLY CA C 52 47.339 47.339 46.398 0.941 17355
2087 1 5 . 1 1 52 52 GLY H H 52 8.004 8.004 7.964 0.040 17355
2088 1 5 . 1 1 53 53 GLN N N 53 120.486 120.486 118.282 2.204 17355
2089 1 5 . 1 1 53 53 GLN HA H 53 4.086 4.086 4.273 -0.187 17355
2090 1 5 . 1 1 53 53 GLN CA C 53 58.919 58.919 57.077 1.842 17355
2091 1 5 . 1 1 53 53 GLN CB C 53 27.867 27.867 29.411 -1.544 17355
2092 1 5 . 1 1 53 53 GLN H H 53 7.675 7.675 7.872 -0.197 17355
2093 1 5 . 1 1 54 54 LEU N N 54 121.901 121.901 116.601 5.300 17355
2094 1 5 . 1 1 54 54 LEU HA H 54 4.049 4.049 4.527 -0.478 17355
2095 1 5 . 1 1 54 54 LEU CA C 54 58.661 58.661 56.913 1.748 17355
2096 1 5 . 1 1 54 54 LEU CB C 54 42.426 42.426 42.168 0.258 17355
2097 1 5 . 1 1 54 54 LEU H H 54 8.038 8.038 7.216 0.822 17355
2098 1 5 . 1 1 55 55 VAL N N 55 119.226 119.226 120.819 -1.593 17355
2099 1 5 . 1 1 55 55 VAL HA H 55 3.543 3.543 3.687 -0.144 17355
2100 1 5 . 1 1 55 55 VAL CA C 55 66.871 66.871 64.897 1.974 17355
2101 1 5 . 1 1 55 55 VAL CB C 55 31.392 31.392 31.015 0.377 17355
2102 1 5 . 1 1 55 55 VAL H H 55 8.375 8.375 8.510 -0.135 17355
2103 1 5 . 1 1 56 56 ASN N N 56 117.987 117.987 117.666 0.321 17355
2104 1 5 . 1 1 56 56 ASN HA H 56 4.473 4.473 4.492 -0.019 17355
2105 1 5 . 1 1 56 56 ASN CA C 56 56.557 56.557 55.492 1.065 17355
2106 1 5 . 1 1 56 56 ASN CB C 56 38.509 38.509 38.318 0.191 17355
2107 1 5 . 1 1 56 56 ASN H H 56 7.521 7.521 8.398 -0.877 17355
2108 1 5 . 1 1 57 57 GLU N N 57 121.765 121.765 120.229 1.536 17355
2109 1 5 . 1 1 57 57 GLU HA H 57 4.070 4.070 4.193 -0.123 17355
2110 1 5 . 1 1 57 57 GLU CA C 57 59.496 59.496 58.773 0.723 17355
2111 1 5 . 1 1 57 57 GLU CB C 57 29.395 29.395 29.730 -0.335 17355
2112 1 5 . 1 1 57 57 GLU H H 57 8.225 8.225 7.649 0.576 17355
2113 1 5 . 1 1 58 58 ALA N N 58 123.779 123.779 121.721 2.058 17355
2114 1 5 . 1 1 58 58 ALA HA H 58 3.874 3.874 4.263 -0.389 17355
2115 1 5 . 1 1 58 58 ALA CA C 58 55.227 55.227 54.942 0.285 17355
2116 1 5 . 1 1 58 58 ALA CB C 58 18.388 18.388 18.157 0.231 17355
2117 1 5 . 1 1 58 58 ALA H H 58 8.659 8.659 7.566 1.093 17355
2118 1 5 . 1 1 59 59 ALA N N 59 118.656 118.656 122.420 -3.764 17355
2119 1 5 . 1 1 59 59 ALA HA H 59 3.819 3.819 3.985 -0.166 17355
2120 1 5 . 1 1 59 59 ALA CA C 59 55.871 55.871 55.120 0.751 17355
2121 1 5 . 1 1 59 59 ALA CB C 59 18.152 18.152 18.504 -0.352 17355
2122 1 5 . 1 1 59 59 ALA H H 59 8.537 8.537 7.655 0.882 17355
2123 1 5 . 1 1 60 60 ARG N N 60 117.701 117.701 118.432 -0.731 17355
2124 1 5 . 1 1 60 60 ARG HA H 60 4.096 4.096 3.981 0.115 17355
2125 1 5 . 1 1 60 60 ARG CA C 60 59.609 59.609 58.875 0.734 17355
2126 1 5 . 1 1 60 60 ARG CB C 60 29.974 29.974 29.543 0.431 17355
2127 1 5 . 1 1 60 60 ARG H H 60 7.923 7.923 7.764 0.159 17355
2128 1 5 . 1 1 61 61 ALA N N 61 123.271 123.271 121.330 1.941 17355
2129 1 5 . 1 1 61 61 ALA HA H 61 4.137 4.137 4.247 -0.110 17355
2130 1 5 . 1 1 61 61 ALA CA C 61 54.912 54.912 53.775 1.137 17355
2131 1 5 . 1 1 61 61 ALA CB C 61 18.304 18.304 18.603 -0.299 17355
2132 1 5 . 1 1 61 61 ALA H H 61 8.044 8.044 7.487 0.557 17355
2133 1 5 . 1 1 62 62 MET N N 62 114.725 114.725 116.409 -1.684 17355
2134 1 5 . 1 1 62 62 MET HA H 62 4.297 4.297 4.193 0.104 17355
2135 1 5 . 1 1 62 62 MET CA C 62 56.392 56.392 57.070 -0.678 17355
2136 1 5 . 1 1 62 62 MET CB C 62 34.827 34.827 33.196 1.631 17355
2137 1 5 . 1 1 62 62 MET H H 62 7.710 7.710 8.084 -0.374 17355
2138 1 5 . 1 1 63 63 GLY N N 63 108.268 108.268 106.971 1.297 17355
2139 1 5 . 1 1 63 63 GLY CA C 63 46.079 46.079 45.137 0.942 17355
2140 1 5 . 1 1 63 63 GLY H H 63 7.846 7.846 7.759 0.087 17355
2141 1 5 . 1 1 64 64 LEU N N 64 119.547 119.547 119.807 -0.260 17355
2142 1 5 . 1 1 64 64 LEU HA H 64 4.526 4.526 4.692 -0.167 17355
2143 1 5 . 1 1 64 64 LEU CA C 64 53.605 53.605 54.298 -0.693 17355
2144 1 5 . 1 1 64 64 LEU CB C 64 43.784 43.784 42.646 1.138 17355
2145 1 5 . 1 1 64 64 LEU H H 64 8.183 8.183 8.034 0.149 17355
2146 1 5 . 1 1 65 65 SER N N 65 115.418 115.418 114.245 1.173 17355
2147 1 5 . 1 1 65 65 SER HA H 65 4.328 4.328 4.511 -0.183 17355
2148 1 5 . 1 1 65 65 SER CA C 65 58.319 58.319 58.534 -0.215 17355
2149 1 5 . 1 1 65 65 SER CB C 65 64.181 64.181 63.757 0.424 17355
2150 1 5 . 1 1 65 65 SER H H 65 8.302 8.302 8.451 -0.149 17355
2151 1 5 . 1 1 66 66 ALA N N 66 124.266 124.266 124.447 -0.181 17355
2152 1 5 . 1 1 66 66 ALA HA H 66 4.212 4.212 4.634 -0.422 17355
2153 1 5 . 1 1 66 66 ALA CA C 66 52.624 52.624 52.474 0.150 17355
2154 1 5 . 1 1 66 66 ALA CB C 66 19.309 19.309 19.224 0.085 17355
2155 1 5 . 1 1 66 66 ALA H H 66 8.262 8.262 8.175 0.087 17355
2156 1 5 . 1 1 67 67 VAL N N 67 118.373 118.373 117.409 0.964 17355
2157 1 5 . 1 1 67 67 VAL HA H 67 4.049 4.049 4.087 -0.038 17355
2158 1 5 . 1 1 67 67 VAL CA C 67 62.010 62.010 61.881 0.129 17355
2159 1 5 . 1 1 67 67 VAL CB C 67 33.495 33.495 32.075 1.420 17355
2160 1 5 . 1 1 67 67 VAL H H 67 7.949 7.949 7.508 0.441 17355
2161 1 5 . 1 1 68 68 ALA N N 68 127.696 127.696 119.048 8.648 17355
2162 1 5 . 1 1 68 68 ALA HA H 68 4.308 4.308 4.143 0.165 17355
2163 1 5 . 1 1 68 68 ALA CA C 68 52.070 52.070 53.855 -1.785 17355
2164 1 5 . 1 1 68 68 ALA CB C 68 19.220 19.220 17.988 1.232 17355
2165 1 5 . 1 1 68 68 ALA H H 68 8.319 8.319 8.219 0.100 17355
2166 1 5 . 1 1 69 69 MET N N 69 120.285 120.285 111.152 9.133 17355
2167 1 5 . 1 1 69 69 MET HA H 69 4.664 4.664 4.794 -0.130 17355
2168 1 5 . 1 1 69 69 MET CA C 69 53.004 53.004 53.995 -0.991 17355
2169 1 5 . 1 1 69 69 MET CB C 69 32.678 32.678 32.272 0.406 17355
2170 1 5 . 1 1 69 69 MET H H 69 8.224 8.224 7.354 0.870 17355
2171 1 5 . 1 1 70 70 PRO HA H 70 4.446 4.446 4.417 0.029 17355
2172 1 5 . 1 1 70 70 PRO CA C 70 63.452 63.452 64.677 -1.225 17355
2173 1 5 . 1 1 70 70 PRO CB C 70 32.012 32.012 32.242 -0.230 17355
2174 1 5 . 1 1 71 71 THR N N 71 112.663 112.663 109.585 3.078 17355
2175 1 5 . 1 1 71 71 THR HA H 71 4.074 4.074 3.740 0.334 17355
2176 1 5 . 1 1 71 71 THR CA C 71 62.869 62.869 61.461 1.408 17355
2177 1 5 . 1 1 71 71 THR CB C 71 69.516 69.516 69.789 -0.273 17355
2178 1 5 . 1 1 71 71 THR H H 71 7.957 7.957 7.519 0.438 17355
2179 1 5 . 1 1 72 72 ASN N N 72 120.054 120.054 119.307 0.747 17355
2180 1 5 . 1 1 72 72 ASN HA H 72 4.695 4.695 3.961 0.734 17355
2181 1 5 . 1 1 72 72 ASN CA C 72 52.856 52.856 55.876 -3.020 17355
2182 1 5 . 1 1 72 72 ASN CB C 72 38.165 38.165 37.677 0.488 17355
2183 1 5 . 1 1 72 72 ASN H H 72 8.227 8.227 8.202 0.025 17355
2184 1 5 . 1 1 73 73 PHE N N 73 121.570 121.570 115.233 6.337 17355
2185 1 5 . 1 1 73 73 PHE HA H 73 4.342 4.342 3.747 0.595 17355
2186 1 5 . 1 1 73 73 PHE CA C 73 59.609 59.609 60.452 -0.843 17355
2187 1 5 . 1 1 73 73 PHE CB C 73 39.000 39.000 36.755 2.245 17355
2188 1 5 . 1 1 73 73 PHE H H 73 8.331 8.331 8.256 0.075 17355
2189 1 5 . 1 1 74 74 ALA N N 74 121.047 121.047 122.119 -1.072 17355
2190 1 5 . 1 1 74 74 ALA HA H 74 4.074 4.074 4.165 -0.091 17355
2191 1 5 . 1 1 74 74 ALA CA C 74 54.705 54.705 54.904 -0.199 17355
2192 1 5 . 1 1 74 74 ALA CB C 74 19.159 19.159 19.024 0.135 17355
2193 1 5 . 1 1 74 74 ALA H H 74 8.163 8.163 8.053 0.110 17355
2194 1 5 . 1 1 75 75 THR N N 75 104.824 104.824 113.411 -8.587 17355
2195 1 5 . 1 1 75 75 THR HA H 75 4.475 4.475 4.370 0.105 17355
2196 1 5 . 1 1 75 75 THR CA C 75 60.669 60.669 61.638 -0.969 17355
2197 1 5 . 1 1 75 75 THR CB C 75 69.543 69.543 66.796 2.747 17355
2198 1 5 . 1 1 75 75 THR H H 75 7.581 7.581 8.269 -0.688 17355
2199 1 5 . 1 1 76 76 ALA N N 76 124.548 124.548 125.461 -0.913 17355
2200 1 5 . 1 1 76 76 ALA HA H 76 4.714 4.714 4.779 -0.065 17355
2201 1 5 . 1 1 76 76 ALA CA C 76 52.929 52.929 50.836 2.093 17355
2202 1 5 . 1 1 76 76 ALA CB C 76 20.661 20.661 21.812 -1.151 17355
2203 1 5 . 1 1 76 76 ALA H H 76 7.689 7.689 7.872 -0.183 17355
2204 1 5 . 1 1 77 77 THR N N 77 108.654 108.654 111.253 -2.599 17355
2205 1 5 . 1 1 77 77 THR HA H 77 5.017 5.017 4.768 0.249 17355
2206 1 5 . 1 1 77 77 THR CA C 77 58.847 58.847 59.748 -0.902 17355
2207 1 5 . 1 1 77 77 THR CB C 77 73.369 73.369 71.783 1.586 17355
2208 1 5 . 1 1 77 77 THR H H 77 7.495 7.495 8.181 -0.686 17355
2209 1 5 . 1 1 78 78 VAL N N 78 120.107 120.107 117.472 2.635 17355
2210 1 5 . 1 1 78 78 VAL HA H 78 3.418 3.418 4.008 -0.590 17355
2211 1 5 . 1 1 78 78 VAL CA C 78 67.446 67.446 66.493 0.953 17355
2212 1 5 . 1 1 78 78 VAL CB C 78 31.949 31.949 31.477 0.472 17355
2213 1 5 . 1 1 78 78 VAL H H 78 7.373 7.373 8.305 -0.932 17355
2214 1 5 . 1 1 79 79 ARG N N 79 117.131 117.131 118.898 -1.767 17355
2215 1 5 . 1 1 79 79 ARG HA H 79 3.877 3.877 4.133 -0.256 17355
2216 1 5 . 1 1 79 79 ARG CA C 79 59.566 59.566 58.148 1.418 17355
2217 1 5 . 1 1 79 79 ARG CB C 79 30.174 30.174 29.420 0.754 17355
2218 1 5 . 1 1 79 79 ARG H H 79 8.518 8.518 7.819 0.699 17355
2219 1 5 . 1 1 80 80 GLU N N 80 118.542 118.542 120.832 -2.290 17355
2220 1 5 . 1 1 80 80 GLU HA H 80 4.033 4.033 4.086 -0.053 17355
2221 1 5 . 1 1 80 80 GLU CA C 80 59.427 59.427 59.790 -0.363 17355
2222 1 5 . 1 1 80 80 GLU CB C 80 30.206 30.206 29.540 0.666 17355
2223 1 5 . 1 1 80 80 GLU H H 80 7.847 7.847 8.037 -0.190 17355
2224 1 5 . 1 1 81 81 MET N N 81 119.630 119.630 119.114 0.516 17355
2225 1 5 . 1 1 81 81 MET HA H 81 4.158 4.158 4.129 0.029 17355
2226 1 5 . 1 1 81 81 MET CA C 81 59.025 59.025 59.093 -0.068 17355
2227 1 5 . 1 1 81 81 MET CB C 81 32.916 32.916 32.630 0.286 17355
2228 1 5 . 1 1 81 81 MET H H 81 8.211 8.211 8.378 -0.167 17355
2229 1 5 . 1 1 82 82 ALA N N 82 120.463 120.463 121.757 -1.294 17355
2230 1 5 . 1 1 82 82 ALA HA H 82 3.911 3.911 4.163 -0.252 17355
2231 1 5 . 1 1 82 82 ALA CA C 82 56.004 56.004 54.591 1.413 17355
2232 1 5 . 1 1 82 82 ALA CB C 82 18.430 18.430 18.285 0.145 17355
2233 1 5 . 1 1 82 82 ALA H H 82 7.978 7.978 7.495 0.483 17355
2234 1 5 . 1 1 83 83 GLU N N 83 116.663 116.663 119.870 -3.207 17355
2235 1 5 . 1 1 83 83 GLU HA H 83 4.034 4.034 3.898 0.136 17355
2236 1 5 . 1 1 83 83 GLU CA C 83 59.476 59.476 59.684 -0.208 17355
2237 1 5 . 1 1 83 83 GLU CB C 83 29.470 29.470 29.746 -0.276 17355
2238 1 5 . 1 1 83 83 GLU H H 83 8.608 8.608 8.118 0.490 17355
2239 1 5 . 1 1 84 84 ALA N N 84 122.742 122.742 121.224 1.518 17355
2240 1 5 . 1 1 84 84 ALA HA H 84 4.241 4.241 3.991 0.250 17355
2241 1 5 . 1 1 84 84 ALA CA C 84 54.970 54.970 55.295 -0.325 17355
2242 1 5 . 1 1 84 84 ALA CB C 84 18.150 18.150 18.107 0.043 17355
2243 1 5 . 1 1 84 84 ALA H H 84 7.918 7.918 8.125 -0.207 17355
2244 1 5 . 1 1 85 85 LEU N N 85 119.158 119.158 118.679 0.479 17355
2245 1 5 . 1 1 85 85 LEU HA H 85 3.945 3.945 3.890 0.055 17355
2246 1 5 . 1 1 85 85 LEU CA C 85 57.849 57.849 57.547 0.302 17355
2247 1 5 . 1 1 85 85 LEU CB C 85 41.884 41.884 41.729 0.155 17355
2248 1 5 . 1 1 85 85 LEU H H 85 7.692 7.692 7.580 0.112 17355
2249 1 5 . 1 1 86 86 GLU N N 86 118.441 118.441 119.989 -1.548 17355
2250 1 5 . 1 1 86 86 GLU HA H 86 4.053 4.053 4.090 -0.037 17355
2251 1 5 . 1 1 86 86 GLU CA C 86 59.131 59.131 58.882 0.249 17355
2252 1 5 . 1 1 86 86 GLU CB C 86 29.868 29.868 29.318 0.550 17355
2253 1 5 . 1 1 86 86 GLU H H 86 8.152 8.152 8.464 -0.312 17355
2254 1 5 . 1 1 87 87 ALA N N 87 120.690 120.690 121.338 -0.648 17355
2255 1 5 . 1 1 87 87 ALA HA H 87 4.139 4.139 4.414 -0.275 17355
2256 1 5 . 1 1 87 87 ALA CA C 87 54.506 54.506 53.450 1.056 17355
2257 1 5 . 1 1 87 87 ALA CB C 87 18.435 18.435 19.118 -0.683 17355
2258 1 5 . 1 1 87 87 ALA H H 87 7.899 7.899 7.971 -0.072 17355
2259 1 5 . 1 1 88 88 ARG N N 88 117.642 117.642 119.886 -2.244 17355
2260 1 5 . 1 1 88 88 ARG HA H 88 4.204 4.204 3.953 0.251 17355
2261 1 5 . 1 1 88 88 ARG CA C 88 57.435 57.435 59.411 -1.976 17355
2262 1 5 . 1 1 88 88 ARG CB C 88 30.106 30.106 29.615 0.491 17355
2263 1 5 . 1 1 88 88 ARG H H 88 7.593 7.593 8.406 -0.813 17355
2264 1 5 . 1 1 89 89 GLU N N 89 121.080 121.080 118.125 2.955 17355
2265 1 5 . 1 1 89 89 GLU HA H 89 4.047 4.047 3.949 0.098 17355
2266 1 5 . 1 1 89 89 GLU CA C 89 58.858 58.858 59.193 -0.335 17355
2267 1 5 . 1 1 89 89 GLU CB C 89 29.912 29.912 29.094 0.818 17355
2268 1 5 . 1 1 89 89 GLU H H 89 8.222 8.222 7.912 0.310 17355
2269 1 5 . 1 1 90 90 ARG N N 90 117.834 117.834 118.883 -1.049 17355
2270 1 5 . 1 1 90 90 ARG HA H 90 4.212 4.212 4.115 0.097 17355
2271 1 5 . 1 1 90 90 ARG CA C 90 57.409 57.409 58.400 -0.991 17355
2272 1 5 . 1 1 90 90 ARG CB C 90 30.906 30.906 30.309 0.597 17355
2273 1 5 . 1 1 90 90 ARG H H 90 7.924 7.924 7.638 0.286 17355
2274 1 5 . 1 1 91 91 GLU N N 91 118.786 118.786 118.839 -0.053 17355
2275 1 5 . 1 1 91 91 GLU HA H 91 4.254 4.254 4.492 -0.238 17355
2276 1 5 . 1 1 91 91 GLU CA C 91 56.693 56.693 54.876 1.817 17355
2277 1 5 . 1 1 91 91 GLU CB C 91 30.416 30.416 29.808 0.608 17355
2278 1 5 . 1 1 91 91 GLU H H 91 7.749 7.749 7.821 -0.071 17355
2279 1 5 . 1 1 92 92 ALA N N 92 125.247 125.247 126.510 -1.263 17355
2280 1 5 . 1 1 92 92 ALA HA H 92 4.551 4.551 4.236 0.315 17355
2281 1 5 . 1 1 92 92 ALA CA C 92 51.073 51.073 54.187 -3.114 17355
2282 1 5 . 1 1 92 92 ALA CB C 92 18.443 18.443 16.803 1.640 17355
2283 1 5 . 1 1 92 92 ALA H H 92 7.888 7.888 7.942 -0.054 17355
2284 1 5 . 1 1 93 93 PRO HA H 93 4.383 4.383 4.381 0.002 17355
2285 1 5 . 1 1 93 93 PRO CA C 93 63.744 63.744 62.358 1.386 17355
2286 1 5 . 1 1 93 93 PRO CB C 93 32.122 32.122 32.053 0.069 17355
2287 1 5 . 1 1 94 94 HIS N N 94 118.597 118.597 115.115 3.482 17355
2288 1 5 . 1 1 94 94 HIS HA H 94 4.639 4.639 4.278 0.361 17355
2289 1 5 . 1 1 94 94 HIS CA C 94 56.044 56.044 56.192 -0.148 17355
2290 1 5 . 1 1 94 94 HIS CB C 94 29.789 29.789 29.700 0.089 17355
2291 1 5 . 1 1 94 94 HIS H H 94 8.392 8.392 8.439 -0.047 17355
2292 1 5 . 1 1 95 95 LEU N N 95 123.443 123.443 121.395 2.048 17355
2293 1 5 . 1 1 95 95 LEU HA H 95 4.287 4.287 4.564 -0.277 17355
2294 1 5 . 1 1 95 95 LEU CA C 95 55.233 55.233 54.515 0.718 17355
2295 1 5 . 1 1 95 95 LEU CB C 95 42.710 42.710 43.740 -1.030 17355
2296 1 5 . 1 1 95 95 LEU H H 95 8.061 8.061 7.675 0.386 17355
2297 1 5 . 1 1 96 96 GLU N N 96 121.295 121.295 123.329 -2.034 17355
2298 1 5 . 1 1 96 96 GLU HA H 96 4.176 4.176 4.819 -0.643 17355
2299 1 5 . 1 1 96 96 GLU CA C 96 56.706 56.706 55.728 0.978 17355
2300 1 5 . 1 1 96 96 GLU CB C 96 30.319 30.319 31.502 -1.183 17355
2301 1 5 . 1 1 96 96 GLU H H 96 8.346 8.346 8.602 -0.256 17355
2302 1 5 . 1 1 97 97 HIS N N 97 119.932 119.932 118.067 1.865 17355
2303 1 5 . 1 1 97 97 HIS HA H 97 4.555 4.555 4.675 -0.120 17355
2304 1 5 . 1 1 97 97 HIS CA C 97 56.042 56.042 55.851 0.191 17355
2305 1 5 . 1 1 97 97 HIS H H 97 8.251 8.251 8.584 -0.333 17355
2306 1 5 . 1 1 98 98 HIS N N 98 125.446 125.446 117.999 7.447 17355
2307 1 5 . 1 1 98 98 HIS HA H 98 4.363 4.363 4.823 -0.460 17355
2308 1 5 . 1 1 98 98 HIS CA C 98 57.303 57.303 55.500 1.803 17355
2309 1 5 . 1 1 98 98 HIS CB C 98 30.319 30.319 30.723 -0.404 17355
2310 1 5 . 1 1 98 98 HIS H H 98 8.054 8.054 8.287 -0.233 17355
2311 1 6 . 1 1 3 3 ARG HA H 3 4.321 4.321 3.876 0.445 17355
2312 1 6 . 1 1 3 3 ARG CA C 3 56.560 56.560 56.537 0.023 17355
2313 1 6 . 1 1 4 4 ALA N N 4 125.797 125.797 121.284 4.513 17355
2314 1 6 . 1 1 4 4 ALA HA H 4 4.283 4.283 3.992 0.291 17355
2315 1 6 . 1 1 4 4 ALA CA C 4 52.900 52.900 53.444 -0.543 17355
2316 1 6 . 1 1 4 4 ALA CB C 4 19.411 19.411 18.452 0.959 17355
2317 1 6 . 1 1 4 4 ALA H H 4 8.563 8.563 8.923 -0.360 17355
2318 1 6 . 1 1 5 5 ASP N N 5 118.416 118.416 118.355 0.061 17355
2319 1 6 . 1 1 5 5 ASP HA H 5 4.584 4.584 4.748 -0.164 17355
2320 1 6 . 1 1 5 5 ASP CA C 5 54.337 54.337 54.475 -0.138 17355
2321 1 6 . 1 1 5 5 ASP CB C 5 41.186 41.186 41.606 -0.420 17355
2322 1 6 . 1 1 5 5 ASP H H 5 8.208 8.208 8.428 -0.220 17355
2323 1 6 . 1 1 6 6 ASP N N 6 120.632 120.632 119.195 1.437 17355
2324 1 6 . 1 1 6 6 ASP HA H 6 4.578 4.578 4.708 -0.130 17355
2325 1 6 . 1 1 6 6 ASP CA C 6 54.589 54.589 53.873 0.716 17355
2326 1 6 . 1 1 6 6 ASP CB C 6 41.239 41.239 41.287 -0.048 17355
2327 1 6 . 1 1 6 6 ASP H H 6 8.140 8.140 8.297 -0.157 17355
2328 1 6 . 1 1 7 7 THR N N 7 113.693 113.693 110.730 2.963 17355
2329 1 6 . 1 1 7 7 THR HA H 7 4.245 4.245 4.813 -0.568 17355
2330 1 6 . 1 1 7 7 THR CA C 7 62.392 62.392 61.093 1.299 17355
2331 1 6 . 1 1 7 7 THR CB C 7 69.721 69.721 71.348 -1.627 17355
2332 1 6 . 1 1 7 7 THR H H 7 8.045 8.045 7.434 0.611 17355
2333 1 6 . 1 1 8 8 ALA N N 8 126.414 126.414 125.908 0.506 17355
2334 1 6 . 1 1 8 8 ALA HA H 8 4.314 4.314 4.064 0.250 17355
2335 1 6 . 1 1 8 8 ALA CA C 8 52.253 52.253 54.230 -1.977 17355
2336 1 6 . 1 1 8 8 ALA CB C 8 19.464 19.464 18.025 1.439 17355
2337 1 6 . 1 1 8 8 ALA H H 8 8.139 8.139 8.963 -0.824 17355
2338 1 6 . 1 1 9 9 LEU N N 9 122.921 122.921 120.184 2.737 17355
2339 1 6 . 1 1 9 9 LEU HA H 9 4.559 4.559 4.670 -0.111 17355
2340 1 6 . 1 1 9 9 LEU CA C 9 53.088 53.088 53.957 -0.869 17355
2341 1 6 . 1 1 9 9 LEU CB C 9 41.929 41.929 42.897 -0.968 17355
2342 1 6 . 1 1 9 9 LEU H H 9 8.113 8.113 8.154 -0.041 17355
2343 1 6 . 1 1 10 10 PRO HA H 10 4.367 4.367 4.501 -0.134 17355
2344 1 6 . 1 1 10 10 PRO CA C 10 63.373 63.373 64.359 -0.986 17355
2345 1 6 . 1 1 10 10 PRO CB C 10 31.975 31.975 32.568 -0.593 17355
2346 1 6 . 1 1 11 11 ALA N N 11 124.349 124.349 119.384 4.965 17355
2347 1 6 . 1 1 11 11 ALA HA H 11 4.262 4.262 4.369 -0.107 17355
2348 1 6 . 1 1 11 11 ALA CA C 11 52.496 52.496 52.742 -0.246 17355
2349 1 6 . 1 1 11 11 ALA CB C 11 19.424 19.424 19.145 0.279 17355
2350 1 6 . 1 1 11 11 ALA H H 11 8.317 8.317 7.814 0.503 17355
2351 1 6 . 1 1 12 12 ALA N N 12 123.291 123.291 123.582 -0.291 17355
2352 1 6 . 1 1 12 12 ALA HA H 12 4.380 4.380 4.708 -0.328 17355
2353 1 6 . 1 1 12 12 ALA CA C 12 52.461 52.461 52.168 0.293 17355
2354 1 6 . 1 1 12 12 ALA CB C 12 19.557 19.557 20.002 -0.445 17355
2355 1 6 . 1 1 12 12 ALA H H 12 8.287 8.287 8.021 0.266 17355
2356 1 6 . 1 1 13 13 THR N N 13 112.758 112.758 117.454 -4.696 17355
2357 1 6 . 1 1 13 13 THR HA H 13 4.350 4.350 4.227 0.123 17355
2358 1 6 . 1 1 13 13 THR CA C 13 62.074 62.074 62.605 -0.531 17355
2359 1 6 . 1 1 13 13 THR CB C 13 70.070 70.070 69.187 0.883 17355
2360 1 6 . 1 1 13 13 THR H H 13 8.074 8.074 8.381 -0.307 17355
2361 1 6 . 1 1 14 14 GLY N N 14 110.774 110.774 107.905 2.869 17355
2362 1 6 . 1 1 14 14 GLY CA C 14 45.692 45.692 44.647 1.045 17355
2363 1 6 . 1 1 14 14 GLY H H 14 8.405 8.405 7.823 0.582 17355
2364 1 6 . 1 1 15 15 ALA N N 15 124.127 124.127 125.966 -1.839 17355
2365 1 6 . 1 1 15 15 ALA HA H 15 4.137 4.137 3.965 0.172 17355
2366 1 6 . 1 1 15 15 ALA CA C 15 55.368 55.368 54.855 0.513 17355
2367 1 6 . 1 1 15 15 ALA CB C 15 20.100 20.100 18.868 1.232 17355
2368 1 6 . 1 1 15 15 ALA H H 15 8.866 8.866 8.808 0.058 17355
2369 1 6 . 1 1 16 16 LEU N N 16 118.013 118.013 118.787 -0.774 17355
2370 1 6 . 1 1 16 16 LEU HA H 16 3.870 3.870 4.047 -0.177 17355
2371 1 6 . 1 1 16 16 LEU CA C 16 58.820 58.820 57.753 1.067 17355
2372 1 6 . 1 1 16 16 LEU CB C 16 41.332 41.332 41.182 0.150 17355
2373 1 6 . 1 1 16 16 LEU H H 16 8.414 8.414 8.381 0.033 17355
2374 1 6 . 1 1 17 17 GLU N N 17 117.730 117.730 117.844 -0.114 17355
2375 1 6 . 1 1 17 17 GLU HA H 17 3.978 3.978 4.186 -0.208 17355
2376 1 6 . 1 1 17 17 GLU CA C 17 59.909 59.909 58.146 1.763 17355
2377 1 6 . 1 1 17 17 GLU CB C 17 29.212 29.212 29.319 -0.107 17355
2378 1 6 . 1 1 17 17 GLU H H 17 8.088 8.088 7.842 0.246 17355
2379 1 6 . 1 1 18 18 LEU N N 18 121.355 121.355 120.878 0.477 17355
2380 1 6 . 1 1 18 18 LEU HA H 18 4.165 4.165 4.018 0.147 17355
2381 1 6 . 1 1 18 18 LEU CA C 18 58.469 58.469 58.029 0.440 17355
2382 1 6 . 1 1 18 18 LEU CB C 18 42.459 42.459 42.406 0.053 17355
2383 1 6 . 1 1 18 18 LEU H H 18 7.767 7.767 7.716 0.051 17355
2384 1 6 . 1 1 19 19 VAL N N 19 118.522 118.522 116.333 2.189 17355
2385 1 6 . 1 1 19 19 VAL HA H 19 3.424 3.424 3.783 -0.359 17355
2386 1 6 . 1 1 19 19 VAL CA C 19 67.958 67.958 65.991 1.967 17355
2387 1 6 . 1 1 19 19 VAL CB C 19 31.922 31.922 31.938 -0.016 17355
2388 1 6 . 1 1 19 19 VAL H H 19 8.661 8.661 7.776 0.885 17355
2389 1 6 . 1 1 20 20 ARG N N 20 117.959 117.959 118.609 -0.650 17355
2390 1 6 . 1 1 20 20 ARG HA H 20 3.576 3.576 4.259 -0.683 17355
2391 1 6 . 1 1 20 20 ARG CA C 20 60.994 60.994 56.833 4.161 17355
2392 1 6 . 1 1 20 20 ARG CB C 20 30.703 30.703 28.405 2.298 17355
2393 1 6 . 1 1 20 20 ARG H H 20 8.705 8.705 8.082 0.623 17355
2394 1 6 . 1 1 21 21 HIS N N 21 115.245 115.245 117.217 -1.972 17355
2395 1 6 . 1 1 21 21 HIS HA H 21 4.144 4.144 4.566 -0.422 17355
2396 1 6 . 1 1 21 21 HIS CA C 21 60.536 60.536 57.036 3.500 17355
2397 1 6 . 1 1 21 21 HIS CB C 21 29.099 29.099 32.743 -3.644 17355
2398 1 6 . 1 1 21 21 HIS H H 21 7.811 7.811 8.302 -0.491 17355
2399 1 6 . 1 1 22 22 LEU N N 22 119.884 119.884 120.153 -0.269 17355
2400 1 6 . 1 1 22 22 LEU HA H 22 4.078 4.078 4.112 -0.034 17355
2401 1 6 . 1 1 22 22 LEU CA C 22 58.164 58.164 58.035 0.129 17355
2402 1 6 . 1 1 22 22 LEU CB C 22 42.889 42.889 41.718 1.171 17355
2403 1 6 . 1 1 22 22 LEU H H 22 8.301 8.301 7.681 0.620 17355
2404 1 6 . 1 1 23 23 VAL N N 23 119.391 119.391 117.719 1.672 17355
2405 1 6 . 1 1 23 23 VAL HA H 23 3.429 3.429 3.751 -0.322 17355
2406 1 6 . 1 1 23 23 VAL CA C 23 67.179 67.179 65.980 1.199 17355
2407 1 6 . 1 1 23 23 VAL CB C 23 31.366 31.366 31.587 -0.222 17355
2408 1 6 . 1 1 23 23 VAL H H 23 8.897 8.897 7.595 1.302 17355
2409 1 6 . 1 1 24 24 ALA N N 24 121.610 121.610 121.966 -0.356 17355
2410 1 6 . 1 1 24 24 ALA HA H 24 3.851 3.851 4.029 -0.178 17355
2411 1 6 . 1 1 24 24 ALA CA C 24 55.944 55.944 55.267 0.677 17355
2412 1 6 . 1 1 24 24 ALA CB C 24 18.042 18.042 18.108 -0.066 17355
2413 1 6 . 1 1 24 24 ALA H H 24 8.276 8.276 7.670 0.606 17355
2414 1 6 . 1 1 25 25 GLU N N 25 114.822 114.822 116.539 -1.717 17355
2415 1 6 . 1 1 25 25 GLU HA H 25 4.042 4.042 4.330 -0.288 17355
2416 1 6 . 1 1 25 25 GLU CA C 25 59.255 59.255 58.502 0.753 17355
2417 1 6 . 1 1 25 25 GLU CB C 25 29.951 29.951 29.052 0.899 17355
2418 1 6 . 1 1 25 25 GLU H H 25 7.693 7.693 8.033 -0.340 17355
2419 1 6 . 1 1 26 26 ARG N N 26 118.510 118.510 116.871 1.639 17355
2420 1 6 . 1 1 26 26 ARG HA H 26 4.252 4.252 4.366 -0.114 17355
2421 1 6 . 1 1 26 26 ARG CA C 26 57.090 57.090 56.331 0.759 17355
2422 1 6 . 1 1 26 26 ARG CB C 26 30.080 30.080 30.927 -0.847 17355
2423 1 6 . 1 1 26 26 ARG H H 26 7.783 7.783 7.834 -0.051 17355
2424 1 6 . 1 1 27 27 ALA N N 27 120.375 120.375 120.566 -0.191 17355
2425 1 6 . 1 1 27 27 ALA HA H 27 4.342 4.342 4.547 -0.205 17355
2426 1 6 . 1 1 27 27 ALA CA C 27 52.134 52.134 50.987 1.147 17355
2427 1 6 . 1 1 27 27 ALA CB C 27 19.283 19.283 19.855 -0.572 17355
2428 1 6 . 1 1 27 27 ALA H H 27 8.638 8.638 7.751 0.887 17355
2429 1 6 . 1 1 28 28 GLU N N 28 115.494 115.494 117.496 -2.002 17355
2430 1 6 . 1 1 28 28 GLU HA H 28 3.873 3.873 4.047 -0.174 17355
2431 1 6 . 1 1 28 28 GLU CA C 28 56.940 56.940 57.216 -0.276 17355
2432 1 6 . 1 1 28 28 GLU CB C 28 27.058 27.058 27.940 -0.882 17355
2433 1 6 . 1 1 28 28 GLU H H 28 7.734 7.734 8.435 -0.701 17355
2434 1 6 . 1 1 29 29 LEU N N 29 119.978 119.978 120.055 -0.077 17355
2435 1 6 . 1 1 29 29 LEU HA H 29 4.898 4.898 4.831 0.067 17355
2436 1 6 . 1 1 29 29 LEU CA C 29 51.498 51.498 51.694 -0.195 17355
2437 1 6 . 1 1 29 29 LEU CB C 29 45.348 45.348 45.702 -0.354 17355
2438 1 6 . 1 1 29 29 LEU H H 29 8.075 8.075 7.668 0.407 17355
2439 1 6 . 1 1 30 30 PRO HA H 30 4.461 4.461 4.464 -0.003 17355
2440 1 6 . 1 1 30 30 PRO CA C 30 62.524 62.524 62.863 -0.339 17355
2441 1 6 . 1 1 30 30 PRO CB C 30 32.015 32.015 30.215 1.800 17355
2442 1 6 . 1 1 31 31 VAL N N 31 123.773 123.773 119.532 4.241 17355
2443 1 6 . 1 1 31 31 VAL HA H 31 3.540 3.540 3.723 -0.183 17355
2444 1 6 . 1 1 31 31 VAL CA C 31 65.493 65.493 64.148 1.345 17355
2445 1 6 . 1 1 31 31 VAL CB C 31 31.865 31.865 31.521 0.344 17355
2446 1 6 . 1 1 31 31 VAL H H 31 8.432 8.432 8.035 0.397 17355
2447 1 6 . 1 1 32 32 GLU N N 32 117.215 117.215 119.209 -1.994 17355
2448 1 6 . 1 1 32 32 GLU HA H 32 4.053 4.053 4.692 -0.639 17355
2449 1 6 . 1 1 32 32 GLU CA C 32 59.131 59.131 56.645 2.486 17355
2450 1 6 . 1 1 32 32 GLU CB C 32 28.781 28.781 30.262 -1.481 17355
2451 1 6 . 1 1 32 32 GLU H H 32 8.971 8.971 8.189 0.782 17355
2452 1 6 . 1 1 33 33 VAL N N 33 113.611 113.611 120.231 -6.620 17355
2453 1 6 . 1 1 33 33 VAL HA H 33 4.214 4.214 4.061 0.153 17355
2454 1 6 . 1 1 33 33 VAL CA C 33 61.795 61.795 62.011 -0.216 17355
2455 1 6 . 1 1 33 33 VAL CB C 33 32.094 32.094 32.023 0.071 17355
2456 1 6 . 1 1 33 33 VAL H H 33 7.470 7.470 7.707 -0.237 17355
2457 1 6 . 1 1 34 34 LEU N N 34 123.533 123.533 122.174 1.359 17355
2458 1 6 . 1 1 34 34 LEU HA H 34 4.114 4.114 4.144 -0.030 17355
2459 1 6 . 1 1 34 34 LEU CA C 34 54.877 54.877 55.476 -0.599 17355
2460 1 6 . 1 1 34 34 LEU CB C 34 42.590 42.590 40.523 2.067 17355
2461 1 6 . 1 1 34 34 LEU H H 34 7.300 7.300 7.983 -0.683 17355
2462 1 6 . 1 1 35 35 ARG N N 35 125.820 125.820 124.954 0.866 17355
2463 1 6 . 1 1 35 35 ARG HA H 35 4.578 4.578 4.130 0.448 17355
2464 1 6 . 1 1 35 35 ARG CA C 35 54.619 54.619 56.358 -1.740 17355
2465 1 6 . 1 1 35 35 ARG CB C 35 31.909 31.909 30.717 1.192 17355
2466 1 6 . 1 1 35 35 ARG H H 35 8.415 8.415 7.977 0.438 17355
2467 1 6 . 1 1 36 36 ASP N N 36 123.211 123.211 116.944 6.267 17355
2468 1 6 . 1 1 36 36 ASP HA H 36 4.156 4.156 4.568 -0.412 17355
2469 1 6 . 1 1 36 36 ASP CA C 36 57.258 57.258 56.126 1.133 17355
2470 1 6 . 1 1 36 36 ASP CB C 36 40.400 40.400 41.359 -0.959 17355
2471 1 6 . 1 1 36 36 ASP H H 36 8.880 8.880 8.628 0.252 17355
2472 1 6 . 1 1 37 37 ASP N N 37 112.390 112.390 119.118 -6.728 17355
2473 1 6 . 1 1 37 37 ASP HA H 37 4.614 4.614 4.662 -0.048 17355
2474 1 6 . 1 1 37 37 ASP CA C 37 52.651 52.651 53.527 -0.876 17355
2475 1 6 . 1 1 37 37 ASP CB C 37 40.100 40.100 40.556 -0.456 17355
2476 1 6 . 1 1 37 37 ASP H H 37 7.800 7.800 8.185 -0.385 17355
2477 1 6 . 1 1 38 38 SER N N 38 116.534 116.534 116.499 0.035 17355
2478 1 6 . 1 1 38 38 SER HA H 38 4.147 4.147 4.321 -0.174 17355
2479 1 6 . 1 1 38 38 SER CA C 38 61.186 61.186 58.128 3.058 17355
2480 1 6 . 1 1 38 38 SER CB C 38 63.946 63.946 63.097 0.849 17355
2481 1 6 . 1 1 38 38 SER H H 38 7.376 7.376 7.971 -0.595 17355
2482 1 6 . 1 1 39 39 ARG N N 39 124.337 124.337 124.470 -0.133 17355
2483 1 6 . 1 1 39 39 ARG HA H 39 4.521 4.521 4.515 0.006 17355
2484 1 6 . 1 1 39 39 ARG CA C 39 55.049 55.049 55.659 -0.610 17355
2485 1 6 . 1 1 39 39 ARG CB C 39 30.723 30.723 31.710 -0.987 17355
2486 1 6 . 1 1 39 39 ARG H H 39 10.095 10.095 7.811 2.284 17355
2487 1 6 . 1 1 40 40 PHE N N 40 122.834 122.834 119.603 3.231 17355
2488 1 6 . 1 1 40 40 PHE HA H 40 3.916 3.916 4.677 -0.761 17355
2489 1 6 . 1 1 40 40 PHE CA C 40 62.869 62.869 59.070 3.799 17355
2490 1 6 . 1 1 40 40 PHE CB C 40 39.662 39.662 38.249 1.413 17355
2491 1 6 . 1 1 40 40 PHE H H 40 7.498 7.498 8.142 -0.644 17355
2492 1 6 . 1 1 41 41 LEU N N 41 117.682 117.682 118.510 -0.828 17355
2493 1 6 . 1 1 41 41 LEU HA H 41 4.519 4.519 4.430 0.089 17355
2494 1 6 . 1 1 41 41 LEU CA C 41 58.111 58.111 56.267 1.844 17355
2495 1 6 . 1 1 41 41 LEU CB C 41 41.087 41.087 42.658 -1.571 17355
2496 1 6 . 1 1 41 41 LEU H H 41 8.619 8.619 7.667 0.952 17355
2497 1 6 . 1 1 42 42 ASP N N 42 114.800 114.800 120.738 -5.938 17355
2498 1 6 . 1 1 42 42 ASP HA H 42 4.185 4.185 4.405 -0.220 17355
2499 1 6 . 1 1 42 42 ASP CA C 42 57.713 57.713 56.030 1.683 17355
2500 1 6 . 1 1 42 42 ASP CB C 42 41.206 41.206 40.961 0.245 17355
2501 1 6 . 1 1 42 42 ASP H H 42 8.239 8.239 8.306 -0.067 17355
2502 1 6 . 1 1 43 43 ASP N N 43 111.125 111.125 119.743 -8.618 17355
2503 1 6 . 1 1 43 43 ASP HA H 43 4.915 4.915 4.469 0.446 17355
2504 1 6 . 1 1 43 43 ASP CA C 43 56.105 56.105 56.638 -0.533 17355
2505 1 6 . 1 1 43 43 ASP CB C 43 41.703 41.703 40.780 0.923 17355
2506 1 6 . 1 1 43 43 ASP H H 43 7.355 7.355 8.350 -0.995 17355
2507 1 6 . 1 1 44 44 LEU N N 44 114.924 114.924 117.392 -2.468 17355
2508 1 6 . 1 1 44 44 LEU HA H 44 4.273 4.273 4.114 0.159 17355
2509 1 6 . 1 1 44 44 LEU CA C 44 54.480 54.480 56.260 -1.780 17355
2510 1 6 . 1 1 44 44 LEU CB C 44 41.671 41.671 42.666 -0.995 17355
2511 1 6 . 1 1 44 44 LEU H H 44 7.172 7.172 7.811 -0.639 17355
2512 1 6 . 1 1 45 45 HIS N N 45 114.429 114.429 115.075 -0.646 17355
2513 1 6 . 1 1 45 45 HIS HA H 45 4.581 4.581 4.308 0.273 17355
2514 1 6 . 1 1 45 45 HIS CA C 45 56.189 56.189 57.047 -0.858 17355
2515 1 6 . 1 1 45 45 HIS CB C 45 26.073 26.073 27.610 -1.538 17355
2516 1 6 . 1 1 45 45 HIS H H 45 7.308 7.308 7.803 -0.495 17355
2517 1 6 . 1 1 46 46 MET N N 46 118.597 118.597 120.826 -2.229 17355
2518 1 6 . 1 1 46 46 MET HA H 46 4.614 4.614 4.868 -0.254 17355
2519 1 6 . 1 1 46 46 MET CA C 46 55.646 55.646 54.371 1.275 17355
2520 1 6 . 1 1 46 46 MET CB C 46 35.501 35.501 36.637 -1.136 17355
2521 1 6 . 1 1 46 46 MET H H 46 8.618 8.618 8.273 0.345 17355
2522 1 6 . 1 1 47 47 SER N N 47 116.110 116.110 113.411 2.699 17355
2523 1 6 . 1 1 47 47 SER HA H 47 4.559 4.559 4.925 -0.366 17355
2524 1 6 . 1 1 47 47 SER CA C 47 56.696 56.696 56.986 -0.290 17355
2525 1 6 . 1 1 47 47 SER CB C 47 65.888 65.888 66.068 -0.180 17355
2526 1 6 . 1 1 47 47 SER H H 47 8.446 8.446 8.297 0.149 17355
2527 1 6 . 1 1 48 48 SER N N 48 116.756 116.756 117.327 -0.571 17355
2528 1 6 . 1 1 48 48 SER HA H 48 3.701 3.701 4.208 -0.507 17355
2529 1 6 . 1 1 48 48 SER CA C 48 62.260 62.260 62.025 0.235 17355
2530 1 6 . 1 1 48 48 SER CB C 48 62.289 62.289 63.147 -0.858 17355
2531 1 6 . 1 1 48 48 SER H H 48 8.948 8.948 8.771 0.177 17355
2532 1 6 . 1 1 49 49 ILE N N 49 122.227 122.227 120.519 1.708 17355
2533 1 6 . 1 1 49 49 ILE HA H 49 3.806 3.806 3.715 0.091 17355
2534 1 6 . 1 1 49 49 ILE CA C 49 64.215 64.215 65.036 -0.821 17355
2535 1 6 . 1 1 49 49 ILE CB C 49 38.059 38.059 37.251 0.808 17355
2536 1 6 . 1 1 49 49 ILE H H 49 7.595 7.595 7.904 -0.309 17355
2537 1 6 . 1 1 50 50 THR N N 50 120.233 120.233 115.557 4.676 17355
2538 1 6 . 1 1 50 50 THR HA H 50 3.878 3.878 4.018 -0.140 17355
2539 1 6 . 1 1 50 50 THR CA C 50 66.427 66.427 66.186 0.241 17355
2540 1 6 . 1 1 50 50 THR CB C 50 68.223 68.223 68.091 0.132 17355
2541 1 6 . 1 1 50 50 THR H H 50 7.539 7.539 7.808 -0.269 17355
2542 1 6 . 1 1 51 51 VAL N N 51 121.320 121.320 120.997 0.323 17355
2543 1 6 . 1 1 51 51 VAL HA H 51 3.090 3.090 3.694 -0.604 17355
2544 1 6 . 1 1 51 51 VAL CA C 51 67.440 67.440 65.577 1.863 17355
2545 1 6 . 1 1 51 51 VAL CB C 51 31.087 31.087 30.376 0.711 17355
2546 1 6 . 1 1 51 51 VAL H H 51 8.178 8.178 8.650 -0.472 17355
2547 1 6 . 1 1 52 52 GLY N N 52 105.968 105.968 104.201 1.767 17355
2548 1 6 . 1 1 52 52 GLY CA C 52 47.339 47.339 46.392 0.947 17355
2549 1 6 . 1 1 52 52 GLY H H 52 8.004 8.004 7.524 0.480 17355
2550 1 6 . 1 1 53 53 GLN N N 53 120.486 120.486 117.901 2.585 17355
2551 1 6 . 1 1 53 53 GLN HA H 53 4.086 4.086 4.255 -0.169 17355
2552 1 6 . 1 1 53 53 GLN CA C 53 58.919 58.919 57.481 1.438 17355
2553 1 6 . 1 1 53 53 GLN CB C 53 27.867 27.867 29.286 -1.419 17355
2554 1 6 . 1 1 53 53 GLN H H 53 7.675 7.675 7.818 -0.143 17355
2555 1 6 . 1 1 54 54 LEU N N 54 121.901 121.901 116.790 5.111 17355
2556 1 6 . 1 1 54 54 LEU HA H 54 4.049 4.049 4.540 -0.491 17355
2557 1 6 . 1 1 54 54 LEU CA C 54 58.661 58.661 56.920 1.741 17355
2558 1 6 . 1 1 54 54 LEU CB C 54 42.426 42.426 42.142 0.284 17355
2559 1 6 . 1 1 54 54 LEU H H 54 8.038 8.038 7.329 0.709 17355
2560 1 6 . 1 1 55 55 VAL N N 55 119.226 119.226 120.740 -1.514 17355
2561 1 6 . 1 1 55 55 VAL HA H 55 3.543 3.543 3.676 -0.133 17355
2562 1 6 . 1 1 55 55 VAL CA C 55 66.871 66.871 64.755 2.116 17355
2563 1 6 . 1 1 55 55 VAL CB C 55 31.392 31.392 31.092 0.300 17355
2564 1 6 . 1 1 55 55 VAL H H 55 8.375 8.375 8.417 -0.042 17355
2565 1 6 . 1 1 56 56 ASN N N 56 117.987 117.987 117.520 0.467 17355
2566 1 6 . 1 1 56 56 ASN HA H 56 4.473 4.473 4.477 -0.004 17355
2567 1 6 . 1 1 56 56 ASN CA C 56 56.557 56.557 55.814 0.743 17355
2568 1 6 . 1 1 56 56 ASN CB C 56 38.509 38.509 38.201 0.308 17355
2569 1 6 . 1 1 56 56 ASN H H 56 7.521 7.521 8.256 -0.735 17355
2570 1 6 . 1 1 57 57 GLU N N 57 121.765 121.765 120.163 1.602 17355
2571 1 6 . 1 1 57 57 GLU HA H 57 4.070 4.070 4.163 -0.093 17355
2572 1 6 . 1 1 57 57 GLU CA C 57 59.496 59.496 58.769 0.727 17355
2573 1 6 . 1 1 57 57 GLU CB C 57 29.395 29.395 29.667 -0.272 17355
2574 1 6 . 1 1 57 57 GLU H H 57 8.225 8.225 7.663 0.562 17355
2575 1 6 . 1 1 58 58 ALA N N 58 123.779 123.779 121.758 2.021 17355
2576 1 6 . 1 1 58 58 ALA HA H 58 3.874 3.874 4.238 -0.364 17355
2577 1 6 . 1 1 58 58 ALA CA C 58 55.227 55.227 54.922 0.305 17355
2578 1 6 . 1 1 58 58 ALA CB C 58 18.388 18.388 18.242 0.146 17355
2579 1 6 . 1 1 58 58 ALA H H 58 8.659 8.659 7.419 1.240 17355
2580 1 6 . 1 1 59 59 ALA N N 59 118.656 118.656 121.418 -2.762 17355
2581 1 6 . 1 1 59 59 ALA HA H 59 3.819 3.819 3.965 -0.146 17355
2582 1 6 . 1 1 59 59 ALA CA C 59 55.871 55.871 54.709 1.161 17355
2583 1 6 . 1 1 59 59 ALA CB C 59 18.152 18.152 18.240 -0.088 17355
2584 1 6 . 1 1 59 59 ALA H H 59 8.537 8.537 7.532 1.005 17355
2585 1 6 . 1 1 60 60 ARG N N 60 117.701 117.701 119.429 -1.728 17355
2586 1 6 . 1 1 60 60 ARG HA H 60 4.096 4.096 3.948 0.148 17355
2587 1 6 . 1 1 60 60 ARG CA C 60 59.609 59.609 59.568 0.041 17355
2588 1 6 . 1 1 60 60 ARG CB C 60 29.974 29.974 30.241 -0.267 17355
2589 1 6 . 1 1 60 60 ARG H H 60 7.923 7.923 7.768 0.155 17355
2590 1 6 . 1 1 61 61 ALA N N 61 123.271 123.271 121.989 1.282 17355
2591 1 6 . 1 1 61 61 ALA HA H 61 4.137 4.137 4.094 0.043 17355
2592 1 6 . 1 1 61 61 ALA CA C 61 54.912 54.912 54.634 0.278 17355
2593 1 6 . 1 1 61 61 ALA CB C 61 18.304 18.304 18.380 -0.076 17355
2594 1 6 . 1 1 61 61 ALA H H 61 8.044 8.044 7.634 0.410 17355
2595 1 6 . 1 1 62 62 MET N N 62 114.725 114.725 115.077 -0.352 17355
2596 1 6 . 1 1 62 62 MET HA H 62 4.297 4.297 4.198 0.099 17355
2597 1 6 . 1 1 62 62 MET CA C 62 56.392 56.392 56.790 -0.398 17355
2598 1 6 . 1 1 62 62 MET CB C 62 34.827 34.827 33.025 1.802 17355
2599 1 6 . 1 1 62 62 MET H H 62 7.710 7.710 7.799 -0.089 17355
2600 1 6 . 1 1 63 63 GLY N N 63 108.268 108.268 107.213 1.055 17355
2601 1 6 . 1 1 63 63 GLY CA C 63 46.079 46.079 45.227 0.852 17355
2602 1 6 . 1 1 63 63 GLY H H 63 7.846 7.846 7.865 -0.019 17355
2603 1 6 . 1 1 64 64 LEU N N 64 119.547 119.547 119.832 -0.285 17355
2604 1 6 . 1 1 64 64 LEU HA H 64 4.526 4.526 4.514 0.012 17355
2605 1 6 . 1 1 64 64 LEU CA C 64 53.605 53.605 54.536 -0.931 17355
2606 1 6 . 1 1 64 64 LEU CB C 64 43.784 43.784 42.464 1.320 17355
2607 1 6 . 1 1 64 64 LEU H H 64 8.183 8.183 8.223 -0.040 17355
2608 1 6 . 1 1 65 65 SER N N 65 115.418 115.418 114.344 1.074 17355
2609 1 6 . 1 1 65 65 SER HA H 65 4.328 4.328 4.440 -0.112 17355
2610 1 6 . 1 1 65 65 SER CA C 65 58.319 58.319 59.338 -1.019 17355
2611 1 6 . 1 1 65 65 SER CB C 65 64.181 64.181 63.827 0.354 17355
2612 1 6 . 1 1 65 65 SER H H 65 8.302 8.302 8.362 -0.060 17355
2613 1 6 . 1 1 66 66 ALA N N 66 124.266 124.266 124.539 -0.273 17355
2614 1 6 . 1 1 66 66 ALA HA H 66 4.212 4.212 4.571 -0.359 17355
2615 1 6 . 1 1 66 66 ALA CA C 66 52.624 52.624 53.088 -0.464 17355
2616 1 6 . 1 1 66 66 ALA CB C 66 19.309 19.309 18.885 0.424 17355
2617 1 6 . 1 1 66 66 ALA H H 66 8.262 8.262 8.021 0.241 17355
2618 1 6 . 1 1 67 67 VAL N N 67 118.373 118.373 117.477 0.896 17355
2619 1 6 . 1 1 67 67 VAL HA H 67 4.049 4.049 4.080 -0.031 17355
2620 1 6 . 1 1 67 67 VAL CA C 67 62.010 62.010 62.586 -0.576 17355
2621 1 6 . 1 1 67 67 VAL CB C 67 33.495 33.495 32.615 0.880 17355
2622 1 6 . 1 1 67 67 VAL H H 67 7.949 7.949 7.514 0.435 17355
2623 1 6 . 1 1 68 68 ALA N N 68 127.696 127.696 119.693 8.003 17355
2624 1 6 . 1 1 68 68 ALA HA H 68 4.308 4.308 4.022 0.286 17355
2625 1 6 . 1 1 68 68 ALA CA C 68 52.070 52.070 54.355 -2.285 17355
2626 1 6 . 1 1 68 68 ALA CB C 68 19.220 19.220 17.715 1.505 17355
2627 1 6 . 1 1 68 68 ALA H H 68 8.319 8.319 8.251 0.068 17355
2628 1 6 . 1 1 69 69 MET N N 69 120.285 120.285 113.422 6.863 17355
2629 1 6 . 1 1 69 69 MET HA H 69 4.664 4.664 5.059 -0.395 17355
2630 1 6 . 1 1 69 69 MET CA C 69 53.004 53.004 53.386 -0.382 17355
2631 1 6 . 1 1 69 69 MET CB C 69 32.678 32.678 34.080 -1.402 17355
2632 1 6 . 1 1 69 69 MET H H 69 8.224 8.224 7.951 0.273 17355
2633 1 6 . 1 1 70 70 PRO HA H 70 4.446 4.446 4.418 0.028 17355
2634 1 6 . 1 1 70 70 PRO CA C 70 63.452 63.452 64.547 -1.095 17355
2635 1 6 . 1 1 70 70 PRO CB C 70 32.012 32.012 32.198 -0.186 17355
2636 1 6 . 1 1 71 71 THR N N 71 112.663 112.663 109.810 2.853 17355
2637 1 6 . 1 1 71 71 THR HA H 71 4.074 4.074 3.751 0.323 17355
2638 1 6 . 1 1 71 71 THR CA C 71 62.869 62.869 61.511 1.358 17355
2639 1 6 . 1 1 71 71 THR CB C 71 69.516 69.516 69.797 -0.281 17355
2640 1 6 . 1 1 71 71 THR H H 71 7.957 7.957 7.541 0.416 17355
2641 1 6 . 1 1 72 72 ASN N N 72 120.054 120.054 119.264 0.790 17355
2642 1 6 . 1 1 72 72 ASN HA H 72 4.695 4.695 3.964 0.731 17355
2643 1 6 . 1 1 72 72 ASN CA C 72 52.856 52.856 55.875 -3.019 17355
2644 1 6 . 1 1 72 72 ASN CB C 72 38.165 38.165 37.651 0.514 17355
2645 1 6 . 1 1 72 72 ASN H H 72 8.227 8.227 8.201 0.026 17355
2646 1 6 . 1 1 73 73 PHE N N 73 121.570 121.570 115.259 6.311 17355
2647 1 6 . 1 1 73 73 PHE HA H 73 4.342 4.342 3.715 0.627 17355
2648 1 6 . 1 1 73 73 PHE CA C 73 59.609 59.609 60.452 -0.843 17355
2649 1 6 . 1 1 73 73 PHE CB C 73 39.000 39.000 36.760 2.240 17355
2650 1 6 . 1 1 73 73 PHE H H 73 8.331 8.331 8.207 0.124 17355
2651 1 6 . 1 1 74 74 ALA N N 74 121.047 121.047 121.877 -0.830 17355
2652 1 6 . 1 1 74 74 ALA HA H 74 4.074 4.074 4.139 -0.065 17355
2653 1 6 . 1 1 74 74 ALA CA C 74 54.705 54.705 54.938 -0.233 17355
2654 1 6 . 1 1 74 74 ALA CB C 74 19.159 19.159 19.014 0.145 17355
2655 1 6 . 1 1 74 74 ALA H H 74 8.163 8.163 8.069 0.094 17355
2656 1 6 . 1 1 75 75 THR N N 75 104.824 104.824 114.158 -9.334 17355
2657 1 6 . 1 1 75 75 THR HA H 75 4.475 4.475 4.381 0.094 17355
2658 1 6 . 1 1 75 75 THR CA C 75 60.669 60.669 61.869 -1.200 17355
2659 1 6 . 1 1 75 75 THR CB C 75 69.543 69.543 66.629 2.914 17355
2660 1 6 . 1 1 75 75 THR H H 75 7.581 7.581 8.084 -0.503 17355
2661 1 6 . 1 1 76 76 ALA N N 76 124.548 124.548 128.239 -3.691 17355
2662 1 6 . 1 1 76 76 ALA HA H 76 4.714 4.714 4.921 -0.207 17355
2663 1 6 . 1 1 76 76 ALA CA C 76 52.929 52.929 50.784 2.145 17355
2664 1 6 . 1 1 76 76 ALA CB C 76 20.661 20.661 22.380 -1.719 17355
2665 1 6 . 1 1 76 76 ALA H H 76 7.689 7.689 8.022 -0.333 17355
2666 1 6 . 1 1 77 77 THR N N 77 108.654 108.654 111.139 -2.485 17355
2667 1 6 . 1 1 77 77 THR HA H 77 5.017 5.017 4.699 0.318 17355
2668 1 6 . 1 1 77 77 THR CA C 77 58.847 58.847 59.803 -0.956 17355
2669 1 6 . 1 1 77 77 THR CB C 77 73.369 73.369 72.041 1.328 17355
2670 1 6 . 1 1 77 77 THR H H 77 7.495 7.495 8.156 -0.661 17355
2671 1 6 . 1 1 78 78 VAL N N 78 120.107 120.107 118.031 2.076 17355
2672 1 6 . 1 1 78 78 VAL HA H 78 3.418 3.418 3.987 -0.569 17355
2673 1 6 . 1 1 78 78 VAL CA C 78 67.446 67.446 66.499 0.947 17355
2674 1 6 . 1 1 78 78 VAL CB C 78 31.949 31.949 31.498 0.451 17355
2675 1 6 . 1 1 78 78 VAL H H 78 7.373 7.373 8.039 -0.666 17355
2676 1 6 . 1 1 79 79 ARG N N 79 117.131 117.131 119.345 -2.214 17355
2677 1 6 . 1 1 79 79 ARG HA H 79 3.877 3.877 4.102 -0.225 17355
2678 1 6 . 1 1 79 79 ARG CA C 79 59.566 59.566 58.972 0.594 17355
2679 1 6 . 1 1 79 79 ARG CB C 79 30.174 30.174 29.915 0.259 17355
2680 1 6 . 1 1 79 79 ARG H H 79 8.518 8.518 7.791 0.727 17355
2681 1 6 . 1 1 80 80 GLU N N 80 118.542 118.542 120.618 -2.076 17355
2682 1 6 . 1 1 80 80 GLU HA H 80 4.033 4.033 4.046 -0.013 17355
2683 1 6 . 1 1 80 80 GLU CA C 80 59.427 59.427 59.484 -0.057 17355
2684 1 6 . 1 1 80 80 GLU CB C 80 30.206 30.206 29.545 0.661 17355
2685 1 6 . 1 1 80 80 GLU H H 80 7.847 7.847 8.077 -0.230 17355
2686 1 6 . 1 1 81 81 MET N N 81 119.630 119.630 119.002 0.628 17355
2687 1 6 . 1 1 81 81 MET HA H 81 4.158 4.158 4.145 0.013 17355
2688 1 6 . 1 1 81 81 MET CA C 81 59.025 59.025 58.956 0.069 17355
2689 1 6 . 1 1 81 81 MET CB C 81 32.916 32.916 32.651 0.265 17355
2690 1 6 . 1 1 81 81 MET H H 81 8.211 8.211 8.141 0.070 17355
2691 1 6 . 1 1 82 82 ALA N N 82 120.463 120.463 122.121 -1.658 17355
2692 1 6 . 1 1 82 82 ALA HA H 82 3.911 3.911 4.171 -0.260 17355
2693 1 6 . 1 1 82 82 ALA CA C 82 56.004 56.004 54.587 1.417 17355
2694 1 6 . 1 1 82 82 ALA CB C 82 18.430 18.430 18.254 0.176 17355
2695 1 6 . 1 1 82 82 ALA H H 82 7.978 7.978 7.520 0.458 17355
2696 1 6 . 1 1 83 83 GLU N N 83 116.663 116.663 119.875 -3.212 17355
2697 1 6 . 1 1 83 83 GLU HA H 83 4.034 4.034 3.885 0.149 17355
2698 1 6 . 1 1 83 83 GLU CA C 83 59.476 59.476 59.619 -0.143 17355
2699 1 6 . 1 1 83 83 GLU CB C 83 29.470 29.470 29.144 0.326 17355
2700 1 6 . 1 1 83 83 GLU H H 83 8.608 8.608 8.200 0.408 17355
2701 1 6 . 1 1 84 84 ALA N N 84 122.742 122.742 121.242 1.500 17355
2702 1 6 . 1 1 84 84 ALA HA H 84 4.241 4.241 4.000 0.241 17355
2703 1 6 . 1 1 84 84 ALA CA C 84 54.970 54.970 55.217 -0.247 17355
2704 1 6 . 1 1 84 84 ALA CB C 84 18.150 18.150 18.170 -0.020 17355
2705 1 6 . 1 1 84 84 ALA H H 84 7.918 7.918 7.818 0.100 17355
2706 1 6 . 1 1 85 85 LEU N N 85 119.158 119.158 118.702 0.456 17355
2707 1 6 . 1 1 85 85 LEU HA H 85 3.945 3.945 3.909 0.036 17355
2708 1 6 . 1 1 85 85 LEU CA C 85 57.849 57.849 57.395 0.453 17355
2709 1 6 . 1 1 85 85 LEU CB C 85 41.884 41.884 41.784 0.100 17355
2710 1 6 . 1 1 85 85 LEU H H 85 7.692 7.692 7.681 0.011 17355
2711 1 6 . 1 1 86 86 GLU N N 86 118.441 118.441 119.969 -1.528 17355
2712 1 6 . 1 1 86 86 GLU HA H 86 4.053 4.053 4.226 -0.173 17355
2713 1 6 . 1 1 86 86 GLU CA C 86 59.131 59.131 58.762 0.369 17355
2714 1 6 . 1 1 86 86 GLU CB C 86 29.868 29.868 29.276 0.592 17355
2715 1 6 . 1 1 86 86 GLU H H 86 8.152 8.152 8.424 -0.272 17355
2716 1 6 . 1 1 87 87 ALA N N 87 120.690 120.690 121.818 -1.128 17355
2717 1 6 . 1 1 87 87 ALA HA H 87 4.139 4.139 4.172 -0.033 17355
2718 1 6 . 1 1 87 87 ALA CA C 87 54.506 54.506 54.386 0.120 17355
2719 1 6 . 1 1 87 87 ALA CB C 87 18.435 18.435 19.131 -0.696 17355
2720 1 6 . 1 1 87 87 ALA H H 87 7.899 7.899 8.062 -0.163 17355
2721 1 6 . 1 1 88 88 ARG N N 88 117.642 117.642 118.696 -1.054 17355
2722 1 6 . 1 1 88 88 ARG HA H 88 4.204 4.204 4.102 0.102 17355
2723 1 6 . 1 1 88 88 ARG CA C 88 57.435 57.435 58.614 -1.179 17355
2724 1 6 . 1 1 88 88 ARG CB C 88 30.106 30.106 30.221 -0.115 17355
2725 1 6 . 1 1 88 88 ARG H H 88 7.593 7.593 8.265 -0.672 17355
2726 1 6 . 1 1 89 89 GLU N N 89 121.080 121.080 116.055 5.025 17355
2727 1 6 . 1 1 89 89 GLU HA H 89 4.047 4.047 4.205 -0.158 17355
2728 1 6 . 1 1 89 89 GLU CA C 89 58.858 58.858 57.953 0.905 17355
2729 1 6 . 1 1 89 89 GLU CB C 89 29.912 29.912 29.161 0.751 17355
2730 1 6 . 1 1 89 89 GLU H H 89 8.222 8.222 7.778 0.444 17355
2731 1 6 . 1 1 90 90 ARG N N 90 117.834 117.834 118.667 -0.833 17355
2732 1 6 . 1 1 90 90 ARG HA H 90 4.212 4.212 4.256 -0.044 17355
2733 1 6 . 1 1 90 90 ARG CA C 90 57.409 57.409 57.731 -0.322 17355
2734 1 6 . 1 1 90 90 ARG CB C 90 30.906 30.906 31.425 -0.519 17355
2735 1 6 . 1 1 90 90 ARG H H 90 7.924 7.924 7.425 0.499 17355
2736 1 6 . 1 1 91 91 GLU N N 91 118.786 118.786 118.657 0.129 17355
2737 1 6 . 1 1 91 91 GLU HA H 91 4.254 4.254 4.411 -0.157 17355
2738 1 6 . 1 1 91 91 GLU CA C 91 56.693 56.693 56.892 -0.199 17355
2739 1 6 . 1 1 91 91 GLU CB C 91 30.416 30.416 32.062 -1.646 17355
2740 1 6 . 1 1 91 91 GLU H H 91 7.749 7.749 7.904 -0.155 17355
2741 1 6 . 1 1 92 92 ALA N N 92 125.247 125.247 127.720 -2.473 17355
2742 1 6 . 1 1 92 92 ALA HA H 92 4.551 4.551 4.874 -0.323 17355
2743 1 6 . 1 1 92 92 ALA CA C 92 51.073 51.073 49.372 1.701 17355
2744 1 6 . 1 1 92 92 ALA CB C 92 18.443 18.443 19.402 -0.959 17355
2745 1 6 . 1 1 92 92 ALA H H 92 7.888 7.888 8.112 -0.224 17355
2746 1 6 . 1 1 93 93 PRO HA H 93 4.383 4.383 4.383 -0.000 17355
2747 1 6 . 1 1 93 93 PRO CA C 93 63.744 63.744 63.767 -0.023 17355
2748 1 6 . 1 1 93 93 PRO CB C 93 32.122 32.122 32.305 -0.183 17355
2749 1 6 . 1 1 94 94 HIS N N 94 118.597 118.597 114.721 3.876 17355
2750 1 6 . 1 1 94 94 HIS HA H 94 4.639 4.639 4.619 0.020 17355
2751 1 6 . 1 1 94 94 HIS CA C 94 56.044 56.044 55.343 0.701 17355
2752 1 6 . 1 1 94 94 HIS CB C 94 29.789 29.789 30.242 -0.453 17355
2753 1 6 . 1 1 94 94 HIS H H 94 8.392 8.392 7.785 0.607 17355
2754 1 6 . 1 1 95 95 LEU N N 95 123.443 123.443 121.035 2.408 17355
2755 1 6 . 1 1 95 95 LEU HA H 95 4.287 4.287 4.564 -0.277 17355
2756 1 6 . 1 1 95 95 LEU CA C 95 55.233 55.233 54.383 0.850 17355
2757 1 6 . 1 1 95 95 LEU CB C 95 42.710 42.710 43.115 -0.405 17355
2758 1 6 . 1 1 95 95 LEU H H 95 8.061 8.061 8.022 0.039 17355
2759 1 6 . 1 1 96 96 GLU N N 96 121.295 121.295 118.882 2.413 17355
2760 1 6 . 1 1 96 96 GLU HA H 96 4.176 4.176 4.513 -0.337 17355
2761 1 6 . 1 1 96 96 GLU CA C 96 56.706 56.706 55.939 0.767 17355
2762 1 6 . 1 1 96 96 GLU CB C 96 30.319 30.319 30.916 -0.597 17355
2763 1 6 . 1 1 96 96 GLU H H 96 8.346 8.346 8.651 -0.305 17355
2764 1 6 . 1 1 97 97 HIS N N 97 119.932 119.932 117.018 2.914 17355
2765 1 6 . 1 1 97 97 HIS HA H 97 4.555 4.555 4.694 -0.139 17355
2766 1 6 . 1 1 97 97 HIS CA C 97 56.042 56.042 56.293 -0.251 17355
2767 1 6 . 1 1 97 97 HIS H H 97 8.251 8.251 8.646 -0.395 17355
2768 1 6 . 1 1 98 98 HIS N N 98 125.446 125.446 116.114 9.332 17355
2769 1 6 . 1 1 98 98 HIS HA H 98 4.363 4.363 4.459 -0.096 17355
2770 1 6 . 1 1 98 98 HIS CA C 98 57.303 57.303 55.810 1.492 17355
2771 1 6 . 1 1 98 98 HIS CB C 98 30.319 30.319 29.815 0.504 17355
2772 1 6 . 1 1 98 98 HIS H H 98 8.054 8.054 7.825 0.229 17355
2773 1 7 . 1 1 3 3 ARG HA H 3 4.321 4.321 4.355 -0.034 17355
2774 1 7 . 1 1 3 3 ARG CA C 3 56.560 56.560 56.821 -0.261 17355
2775 1 7 . 1 1 4 4 ALA N N 4 125.797 125.797 124.056 1.741 17355
2776 1 7 . 1 1 4 4 ALA HA H 4 4.283 4.283 4.406 -0.123 17355
2777 1 7 . 1 1 4 4 ALA CA C 4 52.900 52.900 52.019 0.881 17355
2778 1 7 . 1 1 4 4 ALA CB C 4 19.411 19.411 19.627 -0.216 17355
2779 1 7 . 1 1 4 4 ALA H H 4 8.563 8.563 8.134 0.429 17355
2780 1 7 . 1 1 5 5 ASP N N 5 118.416 118.416 121.228 -2.812 17355
2781 1 7 . 1 1 5 5 ASP HA H 5 4.584 4.584 4.775 -0.191 17355
2782 1 7 . 1 1 5 5 ASP CA C 5 54.337 54.337 53.859 0.478 17355
2783 1 7 . 1 1 5 5 ASP CB C 5 41.186 41.186 42.762 -1.576 17355
2784 1 7 . 1 1 5 5 ASP H H 5 8.208 8.208 7.985 0.223 17355
2785 1 7 . 1 1 6 6 ASP N N 6 120.632 120.632 122.737 -2.105 17355
2786 1 7 . 1 1 6 6 ASP HA H 6 4.578 4.578 4.495 0.083 17355
2787 1 7 . 1 1 6 6 ASP CA C 6 54.589 54.589 54.094 0.494 17355
2788 1 7 . 1 1 6 6 ASP CB C 6 41.239 41.239 41.771 -0.532 17355
2789 1 7 . 1 1 6 6 ASP H H 6 8.140 8.140 8.420 -0.280 17355
2790 1 7 . 1 1 7 7 THR N N 7 113.693 113.693 109.104 4.589 17355
2791 1 7 . 1 1 7 7 THR HA H 7 4.245 4.245 4.262 -0.017 17355
2792 1 7 . 1 1 7 7 THR CA C 7 62.392 62.392 63.665 -1.273 17355
2793 1 7 . 1 1 7 7 THR CB C 7 69.721 69.721 69.109 0.612 17355
2794 1 7 . 1 1 7 7 THR H H 7 8.045 8.045 8.293 -0.248 17355
2795 1 7 . 1 1 8 8 ALA N N 8 126.414 126.414 125.999 0.415 17355
2796 1 7 . 1 1 8 8 ALA HA H 8 4.314 4.314 4.210 0.104 17355
2797 1 7 . 1 1 8 8 ALA CA C 8 52.253 52.253 54.215 -1.962 17355
2798 1 7 . 1 1 8 8 ALA CB C 8 19.464 19.464 19.136 0.328 17355
2799 1 7 . 1 1 8 8 ALA H H 8 8.139 8.139 7.928 0.211 17355
2800 1 7 . 1 1 9 9 LEU N N 9 122.921 122.921 116.939 5.982 17355
2801 1 7 . 1 1 9 9 LEU HA H 9 4.559 4.559 4.670 -0.111 17355
2802 1 7 . 1 1 9 9 LEU CA C 9 53.088 53.088 54.311 -1.223 17355
2803 1 7 . 1 1 9 9 LEU CB C 9 41.929 41.929 44.019 -2.090 17355
2804 1 7 . 1 1 9 9 LEU H H 9 8.113 8.113 7.856 0.257 17355
2805 1 7 . 1 1 10 10 PRO HA H 10 4.367 4.367 4.419 -0.052 17355
2806 1 7 . 1 1 10 10 PRO CA C 10 63.373 63.373 63.792 -0.419 17355
2807 1 7 . 1 1 10 10 PRO CB C 10 31.975 31.975 32.395 -0.420 17355
2808 1 7 . 1 1 11 11 ALA N N 11 124.349 124.349 119.595 4.754 17355
2809 1 7 . 1 1 11 11 ALA HA H 11 4.262 4.262 4.337 -0.075 17355
2810 1 7 . 1 1 11 11 ALA CA C 11 52.496 52.496 51.361 1.135 17355
2811 1 7 . 1 1 11 11 ALA CB C 11 19.424 19.424 19.937 -0.513 17355
2812 1 7 . 1 1 11 11 ALA H H 11 8.317 8.317 7.460 0.857 17355
2813 1 7 . 1 1 12 12 ALA N N 12 123.291 123.291 121.587 1.704 17355
2814 1 7 . 1 1 12 12 ALA HA H 12 4.380 4.380 4.749 -0.369 17355
2815 1 7 . 1 1 12 12 ALA CA C 12 52.461 52.461 52.021 0.440 17355
2816 1 7 . 1 1 12 12 ALA CB C 12 19.557 19.557 19.858 -0.301 17355
2817 1 7 . 1 1 12 12 ALA H H 12 8.287 8.287 8.350 -0.063 17355
2818 1 7 . 1 1 13 13 THR N N 13 112.758 112.758 113.016 -0.258 17355
2819 1 7 . 1 1 13 13 THR HA H 13 4.350 4.350 4.426 -0.076 17355
2820 1 7 . 1 1 13 13 THR CA C 13 62.074 62.074 62.368 -0.294 17355
2821 1 7 . 1 1 13 13 THR CB C 13 70.070 70.070 70.161 -0.091 17355
2822 1 7 . 1 1 13 13 THR H H 13 8.074 8.074 8.592 -0.518 17355
2823 1 7 . 1 1 14 14 GLY N N 14 110.774 110.774 109.220 1.554 17355
2824 1 7 . 1 1 14 14 GLY CA C 14 45.692 45.692 45.020 0.672 17355
2825 1 7 . 1 1 14 14 GLY H H 14 8.405 8.405 7.633 0.772 17355
2826 1 7 . 1 1 15 15 ALA N N 15 124.127 124.127 124.324 -0.197 17355
2827 1 7 . 1 1 15 15 ALA HA H 15 4.137 4.137 4.272 -0.135 17355
2828 1 7 . 1 1 15 15 ALA CA C 15 55.368 55.368 54.324 1.044 17355
2829 1 7 . 1 1 15 15 ALA CB C 15 20.100 20.100 19.064 1.036 17355
2830 1 7 . 1 1 15 15 ALA H H 15 8.866 8.866 8.399 0.467 17355
2831 1 7 . 1 1 16 16 LEU N N 16 118.013 118.013 119.342 -1.329 17355
2832 1 7 . 1 1 16 16 LEU HA H 16 3.870 3.870 4.001 -0.131 17355
2833 1 7 . 1 1 16 16 LEU CA C 16 58.820 58.820 58.069 0.751 17355
2834 1 7 . 1 1 16 16 LEU CB C 16 41.332 41.332 41.370 -0.038 17355
2835 1 7 . 1 1 16 16 LEU H H 16 8.414 8.414 8.650 -0.236 17355
2836 1 7 . 1 1 17 17 GLU N N 17 117.730 117.730 115.635 2.095 17355
2837 1 7 . 1 1 17 17 GLU HA H 17 3.978 3.978 4.157 -0.178 17355
2838 1 7 . 1 1 17 17 GLU CA C 17 59.909 59.909 57.737 2.172 17355
2839 1 7 . 1 1 17 17 GLU CB C 17 29.212 29.212 28.667 0.545 17355
2840 1 7 . 1 1 17 17 GLU H H 17 8.088 8.088 7.900 0.188 17355
2841 1 7 . 1 1 18 18 LEU N N 18 121.355 121.355 121.230 0.125 17355
2842 1 7 . 1 1 18 18 LEU HA H 18 4.165 4.165 4.048 0.117 17355
2843 1 7 . 1 1 18 18 LEU CA C 18 58.469 58.469 57.730 0.739 17355
2844 1 7 . 1 1 18 18 LEU CB C 18 42.459 42.459 42.220 0.239 17355
2845 1 7 . 1 1 18 18 LEU H H 18 7.767 7.767 7.417 0.350 17355
2846 1 7 . 1 1 19 19 VAL N N 19 118.522 118.522 116.867 1.655 17355
2847 1 7 . 1 1 19 19 VAL HA H 19 3.424 3.424 3.758 -0.334 17355
2848 1 7 . 1 1 19 19 VAL CA C 19 67.958 67.958 65.971 1.987 17355
2849 1 7 . 1 1 19 19 VAL CB C 19 31.922 31.922 31.970 -0.048 17355
2850 1 7 . 1 1 19 19 VAL H H 19 8.661 8.661 7.595 1.066 17355
2851 1 7 . 1 1 20 20 ARG N N 20 117.959 117.959 117.946 0.013 17355
2852 1 7 . 1 1 20 20 ARG HA H 20 3.576 3.576 4.268 -0.692 17355
2853 1 7 . 1 1 20 20 ARG CA C 20 60.994 60.994 57.025 3.969 17355
2854 1 7 . 1 1 20 20 ARG CB C 20 30.703 30.703 28.104 2.599 17355
2855 1 7 . 1 1 20 20 ARG H H 20 8.705 8.705 8.381 0.324 17355
2856 1 7 . 1 1 21 21 HIS N N 21 115.245 115.245 116.840 -1.595 17355
2857 1 7 . 1 1 21 21 HIS HA H 21 4.144 4.144 4.557 -0.413 17355
2858 1 7 . 1 1 21 21 HIS CA C 21 60.536 60.536 57.126 3.410 17355
2859 1 7 . 1 1 21 21 HIS CB C 21 29.099 29.099 32.449 -3.350 17355
2860 1 7 . 1 1 21 21 HIS H H 21 7.811 7.811 8.415 -0.604 17355
2861 1 7 . 1 1 22 22 LEU N N 22 119.884 119.884 120.730 -0.846 17355
2862 1 7 . 1 1 22 22 LEU HA H 22 4.078 4.078 4.172 -0.094 17355
2863 1 7 . 1 1 22 22 LEU CA C 22 58.164 58.164 58.185 -0.021 17355
2864 1 7 . 1 1 22 22 LEU CB C 22 42.889 42.889 41.965 0.924 17355
2865 1 7 . 1 1 22 22 LEU H H 22 8.301 8.301 7.693 0.608 17355
2866 1 7 . 1 1 23 23 VAL N N 23 119.391 119.391 119.093 0.298 17355
2867 1 7 . 1 1 23 23 VAL HA H 23 3.429 3.429 3.678 -0.249 17355
2868 1 7 . 1 1 23 23 VAL CA C 23 67.179 67.179 67.160 0.019 17355
2869 1 7 . 1 1 23 23 VAL CB C 23 31.366 31.366 31.500 -0.134 17355
2870 1 7 . 1 1 23 23 VAL H H 23 8.897 8.897 7.503 1.394 17355
2871 1 7 . 1 1 24 24 ALA N N 24 121.610 121.610 122.252 -0.642 17355
2872 1 7 . 1 1 24 24 ALA HA H 24 3.851 3.851 3.997 -0.146 17355
2873 1 7 . 1 1 24 24 ALA CA C 24 55.944 55.944 55.161 0.783 17355
2874 1 7 . 1 1 24 24 ALA CB C 24 18.042 18.042 18.321 -0.279 17355
2875 1 7 . 1 1 24 24 ALA H H 24 8.276 8.276 7.940 0.336 17355
2876 1 7 . 1 1 25 25 GLU N N 25 114.822 114.822 116.533 -1.711 17355
2877 1 7 . 1 1 25 25 GLU HA H 25 4.042 4.042 4.259 -0.217 17355
2878 1 7 . 1 1 25 25 GLU CA C 25 59.255 59.255 58.592 0.663 17355
2879 1 7 . 1 1 25 25 GLU CB C 25 29.951 29.951 29.004 0.947 17355
2880 1 7 . 1 1 25 25 GLU H H 25 7.693 7.693 8.056 -0.363 17355
2881 1 7 . 1 1 26 26 ARG N N 26 118.510 118.510 117.080 1.430 17355
2882 1 7 . 1 1 26 26 ARG HA H 26 4.252 4.252 4.299 -0.047 17355
2883 1 7 . 1 1 26 26 ARG CA C 26 57.090 57.090 56.758 0.332 17355
2884 1 7 . 1 1 26 26 ARG CB C 26 30.080 30.080 30.709 -0.628 17355
2885 1 7 . 1 1 26 26 ARG H H 26 7.783 7.783 7.778 0.005 17355
2886 1 7 . 1 1 27 27 ALA N N 27 120.375 120.375 120.326 0.049 17355
2887 1 7 . 1 1 27 27 ALA HA H 27 4.342 4.342 4.502 -0.160 17355
2888 1 7 . 1 1 27 27 ALA CA C 27 52.134 52.134 51.206 0.928 17355
2889 1 7 . 1 1 27 27 ALA CB C 27 19.283 19.283 19.652 -0.369 17355
2890 1 7 . 1 1 27 27 ALA H H 27 8.638 8.638 7.785 0.853 17355
2891 1 7 . 1 1 28 28 GLU N N 28 115.494 115.494 117.812 -2.318 17355
2892 1 7 . 1 1 28 28 GLU HA H 28 3.873 3.873 4.038 -0.165 17355
2893 1 7 . 1 1 28 28 GLU CA C 28 56.940 56.940 57.218 -0.278 17355
2894 1 7 . 1 1 28 28 GLU CB C 28 27.058 27.058 27.938 -0.880 17355
2895 1 7 . 1 1 28 28 GLU H H 28 7.734 7.734 8.265 -0.531 17355
2896 1 7 . 1 1 29 29 LEU N N 29 119.978 119.978 120.294 -0.316 17355
2897 1 7 . 1 1 29 29 LEU HA H 29 4.898 4.898 4.891 0.007 17355
2898 1 7 . 1 1 29 29 LEU CA C 29 51.498 51.498 51.701 -0.203 17355
2899 1 7 . 1 1 29 29 LEU CB C 29 45.348 45.348 45.568 -0.220 17355
2900 1 7 . 1 1 29 29 LEU H H 29 8.075 8.075 7.623 0.452 17355
2901 1 7 . 1 1 30 30 PRO HA H 30 4.461 4.461 4.422 0.039 17355
2902 1 7 . 1 1 30 30 PRO CA C 30 62.524 62.524 63.528 -1.004 17355
2903 1 7 . 1 1 30 30 PRO CB C 30 32.015 32.015 31.592 0.423 17355
2904 1 7 . 1 1 31 31 VAL N N 31 123.773 123.773 119.267 4.506 17355
2905 1 7 . 1 1 31 31 VAL HA H 31 3.540 3.540 3.861 -0.321 17355
2906 1 7 . 1 1 31 31 VAL CA C 31 65.493 65.493 64.474 1.019 17355
2907 1 7 . 1 1 31 31 VAL CB C 31 31.865 31.865 31.679 0.186 17355
2908 1 7 . 1 1 31 31 VAL H H 31 8.432 8.432 7.856 0.576 17355
2909 1 7 . 1 1 32 32 GLU N N 32 117.215 117.215 119.226 -2.011 17355
2910 1 7 . 1 1 32 32 GLU HA H 32 4.053 4.053 4.608 -0.555 17355
2911 1 7 . 1 1 32 32 GLU CA C 32 59.131 59.131 56.468 2.663 17355
2912 1 7 . 1 1 32 32 GLU CB C 32 28.781 28.781 30.232 -1.451 17355
2913 1 7 . 1 1 32 32 GLU H H 32 8.971 8.971 8.196 0.775 17355
2914 1 7 . 1 1 33 33 VAL N N 33 113.611 113.611 116.552 -2.941 17355
2915 1 7 . 1 1 33 33 VAL HA H 33 4.214 4.214 4.138 0.076 17355
2916 1 7 . 1 1 33 33 VAL CA C 33 61.795 61.795 62.362 -0.567 17355
2917 1 7 . 1 1 33 33 VAL CB C 33 32.094 32.094 31.569 0.525 17355
2918 1 7 . 1 1 33 33 VAL H H 33 7.470 7.470 7.525 -0.055 17355
2919 1 7 . 1 1 34 34 LEU N N 34 123.533 123.533 120.877 2.656 17355
2920 1 7 . 1 1 34 34 LEU HA H 34 4.114 4.114 4.193 -0.079 17355
2921 1 7 . 1 1 34 34 LEU CA C 34 54.877 54.877 55.560 -0.683 17355
2922 1 7 . 1 1 34 34 LEU CB C 34 42.590 42.590 42.196 0.394 17355
2923 1 7 . 1 1 34 34 LEU H H 34 7.300 7.300 7.793 -0.493 17355
2924 1 7 . 1 1 35 35 ARG N N 35 125.820 125.820 126.240 -0.420 17355
2925 1 7 . 1 1 35 35 ARG HA H 35 4.578 4.578 4.236 0.342 17355
2926 1 7 . 1 1 35 35 ARG CA C 35 54.619 54.619 56.360 -1.741 17355
2927 1 7 . 1 1 35 35 ARG CB C 35 31.909 31.909 30.996 0.913 17355
2928 1 7 . 1 1 35 35 ARG H H 35 8.415 8.415 8.346 0.069 17355
2929 1 7 . 1 1 36 36 ASP N N 36 123.211 123.211 116.913 6.298 17355
2930 1 7 . 1 1 36 36 ASP HA H 36 4.156 4.156 4.619 -0.463 17355
2931 1 7 . 1 1 36 36 ASP CA C 36 57.258 57.258 55.679 1.579 17355
2932 1 7 . 1 1 36 36 ASP CB C 36 40.400 40.400 41.640 -1.240 17355
2933 1 7 . 1 1 36 36 ASP H H 36 8.880 8.880 8.516 0.364 17355
2934 1 7 . 1 1 37 37 ASP N N 37 112.390 112.390 118.370 -5.980 17355
2935 1 7 . 1 1 37 37 ASP HA H 37 4.614 4.614 4.712 -0.098 17355
2936 1 7 . 1 1 37 37 ASP CA C 37 52.651 52.651 53.602 -0.952 17355
2937 1 7 . 1 1 37 37 ASP CB C 37 40.100 40.100 41.015 -0.915 17355
2938 1 7 . 1 1 37 37 ASP H H 37 7.800 7.800 8.154 -0.354 17355
2939 1 7 . 1 1 38 38 SER N N 38 116.534 116.534 116.322 0.212 17355
2940 1 7 . 1 1 38 38 SER HA H 38 4.147 4.147 4.267 -0.120 17355
2941 1 7 . 1 1 38 38 SER CA C 38 61.186 61.186 58.274 2.912 17355
2942 1 7 . 1 1 38 38 SER CB C 38 63.946 63.946 63.251 0.695 17355
2943 1 7 . 1 1 38 38 SER H H 38 7.376 7.376 7.933 -0.557 17355
2944 1 7 . 1 1 39 39 ARG N N 39 124.337 124.337 126.283 -1.946 17355
2945 1 7 . 1 1 39 39 ARG HA H 39 4.521 4.521 4.430 0.091 17355
2946 1 7 . 1 1 39 39 ARG CA C 39 55.049 55.049 54.944 0.105 17355
2947 1 7 . 1 1 39 39 ARG CB C 39 30.723 30.723 31.249 -0.526 17355
2948 1 7 . 1 1 39 39 ARG H H 39 10.095 10.095 8.237 1.858 17355
2949 1 7 . 1 1 40 40 PHE N N 40 122.834 122.834 119.222 3.612 17355
2950 1 7 . 1 1 40 40 PHE HA H 40 3.916 3.916 4.678 -0.762 17355
2951 1 7 . 1 1 40 40 PHE CA C 40 62.869 62.869 58.761 4.108 17355
2952 1 7 . 1 1 40 40 PHE CB C 40 39.662 39.662 38.083 1.579 17355
2953 1 7 . 1 1 40 40 PHE H H 40 7.498 7.498 8.283 -0.785 17355
2954 1 7 . 1 1 41 41 LEU N N 41 117.682 117.682 118.004 -0.322 17355
2955 1 7 . 1 1 41 41 LEU HA H 41 4.519 4.519 4.175 0.344 17355
2956 1 7 . 1 1 41 41 LEU CA C 41 58.111 58.111 55.946 2.165 17355
2957 1 7 . 1 1 41 41 LEU CB C 41 41.087 41.087 42.557 -1.470 17355
2958 1 7 . 1 1 41 41 LEU H H 41 8.619 8.619 7.678 0.941 17355
2959 1 7 . 1 1 42 42 ASP N N 42 114.800 114.800 120.422 -5.622 17355
2960 1 7 . 1 1 42 42 ASP HA H 42 4.185 4.185 4.383 -0.198 17355
2961 1 7 . 1 1 42 42 ASP CA C 42 57.713 57.713 55.832 1.881 17355
2962 1 7 . 1 1 42 42 ASP CB C 42 41.206 41.206 41.024 0.182 17355
2963 1 7 . 1 1 42 42 ASP H H 42 8.239 8.239 8.354 -0.115 17355
2964 1 7 . 1 1 43 43 ASP N N 43 111.125 111.125 120.091 -8.966 17355
2965 1 7 . 1 1 43 43 ASP HA H 43 4.915 4.915 4.568 0.347 17355
2966 1 7 . 1 1 43 43 ASP CA C 43 56.105 56.105 55.838 0.267 17355
2967 1 7 . 1 1 43 43 ASP CB C 43 41.703 41.703 40.841 0.862 17355
2968 1 7 . 1 1 43 43 ASP H H 43 7.355 7.355 8.252 -0.897 17355
2969 1 7 . 1 1 44 44 LEU N N 44 114.924 114.924 118.336 -3.412 17355
2970 1 7 . 1 1 44 44 LEU HA H 44 4.273 4.273 4.120 0.153 17355
2971 1 7 . 1 1 44 44 LEU CA C 44 54.480 54.480 56.446 -1.966 17355
2972 1 7 . 1 1 44 44 LEU CB C 44 41.671 41.671 42.414 -0.743 17355
2973 1 7 . 1 1 44 44 LEU H H 44 7.172 7.172 7.578 -0.406 17355
2974 1 7 . 1 1 45 45 HIS N N 45 114.429 114.429 115.667 -1.238 17355
2975 1 7 . 1 1 45 45 HIS HA H 45 4.581 4.581 4.324 0.258 17355
2976 1 7 . 1 1 45 45 HIS CA C 45 56.189 56.189 56.243 -0.055 17355
2977 1 7 . 1 1 45 45 HIS CB C 45 26.073 26.073 28.742 -2.670 17355
2978 1 7 . 1 1 45 45 HIS H H 45 7.308 7.308 7.906 -0.598 17355
2979 1 7 . 1 1 46 46 MET N N 46 118.597 118.597 123.289 -4.692 17355
2980 1 7 . 1 1 46 46 MET HA H 46 4.614 4.614 4.814 -0.200 17355
2981 1 7 . 1 1 46 46 MET CA C 46 55.646 55.646 54.325 1.321 17355
2982 1 7 . 1 1 46 46 MET CB C 46 35.501 35.501 35.943 -0.442 17355
2983 1 7 . 1 1 46 46 MET H H 46 8.618 8.618 8.073 0.545 17355
2984 1 7 . 1 1 47 47 SER N N 47 116.110 116.110 119.728 -3.618 17355
2985 1 7 . 1 1 47 47 SER HA H 47 4.559 4.559 4.509 0.050 17355
2986 1 7 . 1 1 47 47 SER CA C 47 56.696 56.696 58.625 -1.929 17355
2987 1 7 . 1 1 47 47 SER CB C 47 65.888 65.888 63.870 2.018 17355
2988 1 7 . 1 1 47 47 SER H H 47 8.446 8.446 9.041 -0.595 17355
2989 1 7 . 1 1 48 48 SER N N 48 116.756 116.756 118.928 -2.172 17355
2990 1 7 . 1 1 48 48 SER HA H 48 3.701 3.701 4.126 -0.425 17355
2991 1 7 . 1 1 48 48 SER CA C 48 62.260 62.260 62.203 0.057 17355
2992 1 7 . 1 1 48 48 SER CB C 48 62.289 62.289 63.024 -0.735 17355
2993 1 7 . 1 1 48 48 SER H H 48 8.948 8.948 8.854 0.094 17355
2994 1 7 . 1 1 49 49 ILE N N 49 122.227 122.227 119.961 2.266 17355
2995 1 7 . 1 1 49 49 ILE HA H 49 3.806 3.806 3.790 0.016 17355
2996 1 7 . 1 1 49 49 ILE CA C 49 64.215 64.215 64.692 -0.477 17355
2997 1 7 . 1 1 49 49 ILE CB C 49 38.059 38.059 36.512 1.547 17355
2998 1 7 . 1 1 49 49 ILE H H 49 7.595 7.595 8.172 -0.577 17355
2999 1 7 . 1 1 50 50 THR N N 50 120.233 120.233 116.859 3.374 17355
3000 1 7 . 1 1 50 50 THR HA H 50 3.878 3.878 4.024 -0.146 17355
3001 1 7 . 1 1 50 50 THR CA C 50 66.427 66.427 66.195 0.232 17355
3002 1 7 . 1 1 50 50 THR CB C 50 68.223 68.223 68.255 -0.032 17355
3003 1 7 . 1 1 50 50 THR H H 50 7.539 7.539 7.448 0.091 17355
3004 1 7 . 1 1 51 51 VAL N N 51 121.320 121.320 121.370 -0.050 17355
3005 1 7 . 1 1 51 51 VAL HA H 51 3.090 3.090 3.535 -0.445 17355
3006 1 7 . 1 1 51 51 VAL CA C 51 67.440 67.440 66.232 1.208 17355
3007 1 7 . 1 1 51 51 VAL CB C 51 31.087 31.087 30.674 0.413 17355
3008 1 7 . 1 1 51 51 VAL H H 51 8.178 8.178 8.492 -0.314 17355
3009 1 7 . 1 1 52 52 GLY N N 52 105.968 105.968 106.061 -0.093 17355
3010 1 7 . 1 1 52 52 GLY CA C 52 47.339 47.339 47.078 0.261 17355
3011 1 7 . 1 1 52 52 GLY H H 52 8.004 8.004 7.793 0.211 17355
3012 1 7 . 1 1 53 53 GLN N N 53 120.486 120.486 120.101 0.385 17355
3013 1 7 . 1 1 53 53 GLN HA H 53 4.086 4.086 3.971 0.115 17355
3014 1 7 . 1 1 53 53 GLN CA C 53 58.919 58.919 58.735 0.184 17355
3015 1 7 . 1 1 53 53 GLN CB C 53 27.867 27.867 28.527 -0.660 17355
3016 1 7 . 1 1 53 53 GLN H H 53 7.675 7.675 7.795 -0.120 17355
3017 1 7 . 1 1 54 54 LEU N N 54 121.901 121.901 114.640 7.261 17355
3018 1 7 . 1 1 54 54 LEU HA H 54 4.049 4.049 4.507 -0.458 17355
3019 1 7 . 1 1 54 54 LEU CA C 54 58.661 58.661 56.596 2.065 17355
3020 1 7 . 1 1 54 54 LEU CB C 54 42.426 42.426 42.173 0.253 17355
3021 1 7 . 1 1 54 54 LEU H H 54 8.038 8.038 7.510 0.528 17355
3022 1 7 . 1 1 55 55 VAL N N 55 119.226 119.226 120.444 -1.218 17355
3023 1 7 . 1 1 55 55 VAL HA H 55 3.543 3.543 3.698 -0.155 17355
3024 1 7 . 1 1 55 55 VAL CA C 55 66.871 66.871 64.429 2.442 17355
3025 1 7 . 1 1 55 55 VAL CB C 55 31.392 31.392 30.753 0.639 17355
3026 1 7 . 1 1 55 55 VAL H H 55 8.375 8.375 7.958 0.417 17355
3027 1 7 . 1 1 56 56 ASN N N 56 117.987 117.987 117.252 0.735 17355
3028 1 7 . 1 1 56 56 ASN HA H 56 4.473 4.473 4.433 0.040 17355
3029 1 7 . 1 1 56 56 ASN CA C 56 56.557 56.557 56.149 0.408 17355
3030 1 7 . 1 1 56 56 ASN CB C 56 38.509 38.509 38.827 -0.318 17355
3031 1 7 . 1 1 56 56 ASN H H 56 7.521 7.521 8.454 -0.933 17355
3032 1 7 . 1 1 57 57 GLU N N 57 121.765 121.765 119.499 2.266 17355
3033 1 7 . 1 1 57 57 GLU HA H 57 4.070 4.070 4.280 -0.210 17355
3034 1 7 . 1 1 57 57 GLU CA C 57 59.496 59.496 58.627 0.869 17355
3035 1 7 . 1 1 57 57 GLU CB C 57 29.395 29.395 29.207 0.188 17355
3036 1 7 . 1 1 57 57 GLU H H 57 8.225 8.225 7.487 0.738 17355
3037 1 7 . 1 1 58 58 ALA N N 58 123.779 123.779 122.790 0.989 17355
3038 1 7 . 1 1 58 58 ALA HA H 58 3.874 3.874 4.169 -0.295 17355
3039 1 7 . 1 1 58 58 ALA CA C 58 55.227 55.227 54.936 0.291 17355
3040 1 7 . 1 1 58 58 ALA CB C 58 18.388 18.388 18.085 0.302 17355
3041 1 7 . 1 1 58 58 ALA H H 58 8.659 8.659 7.559 1.100 17355
3042 1 7 . 1 1 59 59 ALA N N 59 118.656 118.656 120.684 -2.028 17355
3043 1 7 . 1 1 59 59 ALA HA H 59 3.819 3.819 3.924 -0.105 17355
3044 1 7 . 1 1 59 59 ALA CA C 59 55.871 55.871 55.016 0.855 17355
3045 1 7 . 1 1 59 59 ALA CB C 59 18.152 18.152 18.275 -0.123 17355
3046 1 7 . 1 1 59 59 ALA H H 59 8.537 8.537 7.695 0.842 17355
3047 1 7 . 1 1 60 60 ARG N N 60 117.701 117.701 119.008 -1.307 17355
3048 1 7 . 1 1 60 60 ARG HA H 60 4.096 4.096 3.946 0.150 17355
3049 1 7 . 1 1 60 60 ARG CA C 60 59.609 59.609 59.470 0.139 17355
3050 1 7 . 1 1 60 60 ARG CB C 60 29.974 29.974 30.309 -0.335 17355
3051 1 7 . 1 1 60 60 ARG H H 60 7.923 7.923 7.670 0.253 17355
3052 1 7 . 1 1 61 61 ALA N N 61 123.271 123.271 121.674 1.597 17355
3053 1 7 . 1 1 61 61 ALA HA H 61 4.137 4.137 4.123 0.014 17355
3054 1 7 . 1 1 61 61 ALA CA C 61 54.912 54.912 54.541 0.371 17355
3055 1 7 . 1 1 61 61 ALA CB C 61 18.304 18.304 18.484 -0.180 17355
3056 1 7 . 1 1 61 61 ALA H H 61 8.044 8.044 7.620 0.424 17355
3057 1 7 . 1 1 62 62 MET N N 62 114.725 114.725 115.702 -0.977 17355
3058 1 7 . 1 1 62 62 MET HA H 62 4.297 4.297 4.201 0.096 17355
3059 1 7 . 1 1 62 62 MET CA C 62 56.392 56.392 56.862 -0.471 17355
3060 1 7 . 1 1 62 62 MET CB C 62 34.827 34.827 32.872 1.955 17355
3061 1 7 . 1 1 62 62 MET H H 62 7.710 7.710 8.011 -0.301 17355
3062 1 7 . 1 1 63 63 GLY N N 63 108.268 108.268 106.349 1.919 17355
3063 1 7 . 1 1 63 63 GLY CA C 63 46.079 46.079 45.034 1.045 17355
3064 1 7 . 1 1 63 63 GLY H H 63 7.846 7.846 7.735 0.111 17355
3065 1 7 . 1 1 64 64 LEU N N 64 119.547 119.547 119.756 -0.209 17355
3066 1 7 . 1 1 64 64 LEU HA H 64 4.526 4.526 4.451 0.075 17355
3067 1 7 . 1 1 64 64 LEU CA C 64 53.605 53.605 54.760 -1.155 17355
3068 1 7 . 1 1 64 64 LEU CB C 64 43.784 43.784 42.202 1.583 17355
3069 1 7 . 1 1 64 64 LEU H H 64 8.183 8.183 8.038 0.145 17355
3070 1 7 . 1 1 65 65 SER N N 65 115.418 115.418 113.281 2.137 17355
3071 1 7 . 1 1 65 65 SER HA H 65 4.328 4.328 4.491 -0.163 17355
3072 1 7 . 1 1 65 65 SER CA C 65 58.319 58.319 58.175 0.144 17355
3073 1 7 . 1 1 65 65 SER CB C 65 64.181 64.181 63.619 0.562 17355
3074 1 7 . 1 1 65 65 SER H H 65 8.302 8.302 8.122 0.180 17355
3075 1 7 . 1 1 66 66 ALA N N 66 124.266 124.266 123.587 0.679 17355
3076 1 7 . 1 1 66 66 ALA HA H 66 4.212 4.212 4.656 -0.444 17355
3077 1 7 . 1 1 66 66 ALA CA C 66 52.624 52.624 52.699 -0.075 17355
3078 1 7 . 1 1 66 66 ALA CB C 66 19.309 19.309 19.219 0.090 17355
3079 1 7 . 1 1 66 66 ALA H H 66 8.262 8.262 8.123 0.139 17355
3080 1 7 . 1 1 67 67 VAL N N 67 118.373 118.373 118.577 -0.204 17355
3081 1 7 . 1 1 67 67 VAL HA H 67 4.049 4.049 4.097 -0.048 17355
3082 1 7 . 1 1 67 67 VAL CA C 67 62.010 62.010 63.578 -1.568 17355
3083 1 7 . 1 1 67 67 VAL CB C 67 33.495 33.495 32.229 1.266 17355
3084 1 7 . 1 1 67 67 VAL H H 67 7.949 7.949 7.515 0.434 17355
3085 1 7 . 1 1 68 68 ALA N N 68 127.696 127.696 119.875 7.821 17355
3086 1 7 . 1 1 68 68 ALA HA H 68 4.308 4.308 4.032 0.276 17355
3087 1 7 . 1 1 68 68 ALA CA C 68 52.070 52.070 54.362 -2.292 17355
3088 1 7 . 1 1 68 68 ALA CB C 68 19.220 19.220 17.730 1.490 17355
3089 1 7 . 1 1 68 68 ALA H H 68 8.319 8.319 8.234 0.085 17355
3090 1 7 . 1 1 69 69 MET N N 69 120.285 120.285 114.041 6.244 17355
3091 1 7 . 1 1 69 69 MET HA H 69 4.664 4.664 5.000 -0.336 17355
3092 1 7 . 1 1 69 69 MET CA C 69 53.004 53.004 53.348 -0.344 17355
3093 1 7 . 1 1 69 69 MET CB C 69 32.678 32.678 33.938 -1.260 17355
3094 1 7 . 1 1 69 69 MET H H 69 8.224 8.224 7.994 0.231 17355
3095 1 7 . 1 1 70 70 PRO HA H 70 4.446 4.446 4.434 0.012 17355
3096 1 7 . 1 1 70 70 PRO CA C 70 63.452 63.452 64.548 -1.096 17355
3097 1 7 . 1 1 70 70 PRO CB C 70 32.012 32.012 32.222 -0.210 17355
3098 1 7 . 1 1 71 71 THR N N 71 112.663 112.663 110.262 2.401 17355
3099 1 7 . 1 1 71 71 THR HA H 71 4.074 4.074 3.746 0.328 17355
3100 1 7 . 1 1 71 71 THR CA C 71 62.869 62.869 61.008 1.861 17355
3101 1 7 . 1 1 71 71 THR CB C 71 69.516 69.516 70.002 -0.486 17355
3102 1 7 . 1 1 71 71 THR H H 71 7.957 7.957 7.590 0.367 17355
3103 1 7 . 1 1 72 72 ASN N N 72 120.054 120.054 119.084 0.970 17355
3104 1 7 . 1 1 72 72 ASN HA H 72 4.695 4.695 3.919 0.776 17355
3105 1 7 . 1 1 72 72 ASN CA C 72 52.856 52.856 56.126 -3.270 17355
3106 1 7 . 1 1 72 72 ASN CB C 72 38.165 38.165 37.548 0.617 17355
3107 1 7 . 1 1 72 72 ASN H H 72 8.227 8.227 8.227 0.000 17355
3108 1 7 . 1 1 73 73 PHE N N 73 121.570 121.570 115.204 6.366 17355
3109 1 7 . 1 1 73 73 PHE HA H 73 4.342 4.342 3.746 0.596 17355
3110 1 7 . 1 1 73 73 PHE CA C 73 59.609 59.609 60.404 -0.795 17355
3111 1 7 . 1 1 73 73 PHE CB C 73 39.000 39.000 36.760 2.240 17355
3112 1 7 . 1 1 73 73 PHE H H 73 8.331 8.331 8.276 0.055 17355
3113 1 7 . 1 1 74 74 ALA N N 74 121.047 121.047 122.040 -0.993 17355
3114 1 7 . 1 1 74 74 ALA HA H 74 4.074 4.074 4.160 -0.086 17355
3115 1 7 . 1 1 74 74 ALA CA C 74 54.705 54.705 54.881 -0.176 17355
3116 1 7 . 1 1 74 74 ALA CB C 74 19.159 19.159 19.023 0.137 17355
3117 1 7 . 1 1 74 74 ALA H H 74 8.163 8.163 8.037 0.126 17355
3118 1 7 . 1 1 75 75 THR N N 75 104.824 104.824 113.430 -8.606 17355
3119 1 7 . 1 1 75 75 THR HA H 75 4.475 4.475 4.356 0.119 17355
3120 1 7 . 1 1 75 75 THR CA C 75 60.669 60.669 61.786 -1.117 17355
3121 1 7 . 1 1 75 75 THR CB C 75 69.543 69.543 66.765 2.778 17355
3122 1 7 . 1 1 75 75 THR H H 75 7.581 7.581 8.283 -0.702 17355
3123 1 7 . 1 1 76 76 ALA N N 76 124.548 124.548 125.650 -1.102 17355
3124 1 7 . 1 1 76 76 ALA HA H 76 4.714 4.714 4.811 -0.097 17355
3125 1 7 . 1 1 76 76 ALA CA C 76 52.929 52.929 50.796 2.133 17355
3126 1 7 . 1 1 76 76 ALA CB C 76 20.661 20.661 21.797 -1.136 17355
3127 1 7 . 1 1 76 76 ALA H H 76 7.689 7.689 8.020 -0.331 17355
3128 1 7 . 1 1 77 77 THR N N 77 108.654 108.654 111.142 -2.488 17355
3129 1 7 . 1 1 77 77 THR HA H 77 5.017 5.017 4.686 0.331 17355
3130 1 7 . 1 1 77 77 THR CA C 77 58.847 58.847 59.804 -0.957 17355
3131 1 7 . 1 1 77 77 THR CB C 77 73.369 73.369 71.796 1.573 17355
3132 1 7 . 1 1 77 77 THR H H 77 7.495 7.495 8.191 -0.696 17355
3133 1 7 . 1 1 78 78 VAL N N 78 120.107 120.107 117.559 2.548 17355
3134 1 7 . 1 1 78 78 VAL HA H 78 3.418 3.418 4.025 -0.607 17355
3135 1 7 . 1 1 78 78 VAL CA C 78 67.446 67.446 66.540 0.906 17355
3136 1 7 . 1 1 78 78 VAL CB C 78 31.949 31.949 31.524 0.425 17355
3137 1 7 . 1 1 78 78 VAL H H 78 7.373 7.373 8.177 -0.804 17355
3138 1 7 . 1 1 79 79 ARG N N 79 117.131 117.131 118.882 -1.751 17355
3139 1 7 . 1 1 79 79 ARG HA H 79 3.877 3.877 4.128 -0.251 17355
3140 1 7 . 1 1 79 79 ARG CA C 79 59.566 59.566 58.404 1.162 17355
3141 1 7 . 1 1 79 79 ARG CB C 79 30.174 30.174 29.584 0.590 17355
3142 1 7 . 1 1 79 79 ARG H H 79 8.518 8.518 7.857 0.661 17355
3143 1 7 . 1 1 80 80 GLU N N 80 118.542 118.542 120.739 -2.197 17355
3144 1 7 . 1 1 80 80 GLU HA H 80 4.033 4.033 4.086 -0.053 17355
3145 1 7 . 1 1 80 80 GLU CA C 80 59.427 59.427 59.778 -0.351 17355
3146 1 7 . 1 1 80 80 GLU CB C 80 30.206 30.206 29.569 0.637 17355
3147 1 7 . 1 1 80 80 GLU H H 80 7.847 7.847 8.062 -0.215 17355
3148 1 7 . 1 1 81 81 MET N N 81 119.630 119.630 119.133 0.497 17355
3149 1 7 . 1 1 81 81 MET HA H 81 4.158 4.158 4.138 0.020 17355
3150 1 7 . 1 1 81 81 MET CA C 81 59.025 59.025 59.066 -0.041 17355
3151 1 7 . 1 1 81 81 MET CB C 81 32.916 32.916 32.647 0.269 17355
3152 1 7 . 1 1 81 81 MET H H 81 8.211 8.211 8.254 -0.043 17355
3153 1 7 . 1 1 82 82 ALA N N 82 120.463 120.463 121.334 -0.871 17355
3154 1 7 . 1 1 82 82 ALA HA H 82 3.911 3.911 4.189 -0.278 17355
3155 1 7 . 1 1 82 82 ALA CA C 82 56.004 56.004 54.485 1.519 17355
3156 1 7 . 1 1 82 82 ALA CB C 82 18.430 18.430 18.353 0.077 17355
3157 1 7 . 1 1 82 82 ALA H H 82 7.978 7.978 7.583 0.395 17355
3158 1 7 . 1 1 83 83 GLU N N 83 116.663 116.663 119.717 -3.054 17355
3159 1 7 . 1 1 83 83 GLU HA H 83 4.034 4.034 3.911 0.123 17355
3160 1 7 . 1 1 83 83 GLU CA C 83 59.476 59.476 59.610 -0.134 17355
3161 1 7 . 1 1 83 83 GLU CB C 83 29.470 29.470 29.740 -0.270 17355
3162 1 7 . 1 1 83 83 GLU H H 83 8.608 8.608 8.022 0.586 17355
3163 1 7 . 1 1 84 84 ALA N N 84 122.742 122.742 121.516 1.226 17355
3164 1 7 . 1 1 84 84 ALA HA H 84 4.241 4.241 4.016 0.225 17355
3165 1 7 . 1 1 84 84 ALA CA C 84 54.970 54.970 55.255 -0.285 17355
3166 1 7 . 1 1 84 84 ALA CB C 84 18.150 18.150 18.107 0.043 17355
3167 1 7 . 1 1 84 84 ALA H H 84 7.918 7.918 7.861 0.057 17355
3168 1 7 . 1 1 85 85 LEU N N 85 119.158 119.158 118.503 0.655 17355
3169 1 7 . 1 1 85 85 LEU HA H 85 3.945 3.945 3.897 0.048 17355
3170 1 7 . 1 1 85 85 LEU CA C 85 57.849 57.849 57.287 0.562 17355
3171 1 7 . 1 1 85 85 LEU CB C 85 41.884 41.884 41.458 0.426 17355
3172 1 7 . 1 1 85 85 LEU H H 85 7.692 7.692 7.862 -0.170 17355
3173 1 7 . 1 1 86 86 GLU N N 86 118.441 118.441 119.398 -0.957 17355
3174 1 7 . 1 1 86 86 GLU HA H 86 4.053 4.053 4.098 -0.045 17355
3175 1 7 . 1 1 86 86 GLU CA C 86 59.131 59.131 58.856 0.275 17355
3176 1 7 . 1 1 86 86 GLU CB C 86 29.868 29.868 29.424 0.444 17355
3177 1 7 . 1 1 86 86 GLU H H 86 8.152 8.152 8.278 -0.126 17355
3178 1 7 . 1 1 87 87 ALA N N 87 120.690 120.690 120.252 0.438 17355
3179 1 7 . 1 1 87 87 ALA HA H 87 4.139 4.139 4.579 -0.440 17355
3180 1 7 . 1 1 87 87 ALA CA C 87 54.506 54.506 52.757 1.749 17355
3181 1 7 . 1 1 87 87 ALA CB C 87 18.435 18.435 19.776 -1.341 17355
3182 1 7 . 1 1 87 87 ALA H H 87 7.899 7.899 7.917 -0.018 17355
3183 1 7 . 1 1 88 88 ARG N N 88 117.642 117.642 119.936 -2.294 17355
3184 1 7 . 1 1 88 88 ARG HA H 88 4.204 4.204 3.963 0.241 17355
3185 1 7 . 1 1 88 88 ARG CA C 88 57.435 57.435 59.512 -2.077 17355
3186 1 7 . 1 1 88 88 ARG CB C 88 30.106 30.106 30.003 0.103 17355
3187 1 7 . 1 1 88 88 ARG H H 88 7.593 7.593 8.445 -0.852 17355
3188 1 7 . 1 1 89 89 GLU N N 89 121.080 121.080 116.956 4.124 17355
3189 1 7 . 1 1 89 89 GLU HA H 89 4.047 4.047 4.085 -0.038 17355
3190 1 7 . 1 1 89 89 GLU CA C 89 58.858 58.858 58.475 0.383 17355
3191 1 7 . 1 1 89 89 GLU CB C 89 29.912 29.912 29.522 0.390 17355
3192 1 7 . 1 1 89 89 GLU H H 89 8.222 8.222 7.508 0.714 17355
3193 1 7 . 1 1 90 90 ARG N N 90 117.834 117.834 118.201 -0.367 17355
3194 1 7 . 1 1 90 90 ARG HA H 90 4.212 4.212 4.135 0.077 17355
3195 1 7 . 1 1 90 90 ARG CA C 90 57.409 57.409 58.299 -0.890 17355
3196 1 7 . 1 1 90 90 ARG CB C 90 30.906 30.906 29.869 1.037 17355
3197 1 7 . 1 1 90 90 ARG H H 90 7.924 7.924 8.039 -0.115 17355
3198 1 7 . 1 1 91 91 GLU N N 91 118.786 118.786 116.707 2.079 17355
3199 1 7 . 1 1 91 91 GLU HA H 91 4.254 4.254 4.369 -0.115 17355
3200 1 7 . 1 1 91 91 GLU CA C 91 56.693 56.693 56.828 -0.135 17355
3201 1 7 . 1 1 91 91 GLU CB C 91 30.416 30.416 31.370 -0.954 17355
3202 1 7 . 1 1 91 91 GLU H H 91 7.749 7.749 7.644 0.105 17355
3203 1 7 . 1 1 92 92 ALA N N 92 125.247 125.247 124.278 0.969 17355
3204 1 7 . 1 1 92 92 ALA HA H 92 4.551 4.551 4.351 0.200 17355
3205 1 7 . 1 1 92 92 ALA CA C 92 51.073 51.073 50.795 0.278 17355
3206 1 7 . 1 1 92 92 ALA CB C 92 18.443 18.443 18.377 0.066 17355
3207 1 7 . 1 1 92 92 ALA H H 92 7.888 7.888 7.453 0.435 17355
3208 1 7 . 1 1 93 93 PRO HA H 93 4.383 4.383 4.223 0.160 17355
3209 1 7 . 1 1 93 93 PRO CA C 93 63.744 63.744 62.366 1.378 17355
3210 1 7 . 1 1 93 93 PRO CB C 93 32.122 32.122 32.277 -0.155 17355
3211 1 7 . 1 1 94 94 HIS N N 94 118.597 118.597 118.633 -0.036 17355
3212 1 7 . 1 1 94 94 HIS HA H 94 4.639 4.639 4.663 -0.024 17355
3213 1 7 . 1 1 94 94 HIS CA C 94 56.044 56.044 55.728 0.316 17355
3214 1 7 . 1 1 94 94 HIS CB C 94 29.789 29.789 30.382 -0.593 17355
3215 1 7 . 1 1 94 94 HIS H H 94 8.392 8.392 8.281 0.111 17355
3216 1 7 . 1 1 95 95 LEU N N 95 123.443 123.443 125.397 -1.954 17355
3217 1 7 . 1 1 95 95 LEU HA H 95 4.287 4.287 4.167 0.120 17355
3218 1 7 . 1 1 95 95 LEU CA C 95 55.233 55.233 55.956 -0.723 17355
3219 1 7 . 1 1 95 95 LEU CB C 95 42.710 42.710 42.733 -0.023 17355
3220 1 7 . 1 1 95 95 LEU H H 95 8.061 8.061 8.644 -0.583 17355
3221 1 7 . 1 1 96 96 GLU N N 96 121.295 121.295 117.636 3.659 17355
3222 1 7 . 1 1 96 96 GLU HA H 96 4.176 4.176 4.264 -0.088 17355
3223 1 7 . 1 1 96 96 GLU CA C 96 56.706 56.706 56.834 -0.128 17355
3224 1 7 . 1 1 96 96 GLU CB C 96 30.319 30.319 30.613 -0.294 17355
3225 1 7 . 1 1 96 96 GLU H H 96 8.346 8.346 7.974 0.372 17355
3226 1 7 . 1 1 97 97 HIS N N 97 119.932 119.932 123.280 -3.348 17355
3227 1 7 . 1 1 97 97 HIS HA H 97 4.555 4.555 4.770 -0.215 17355
3228 1 7 . 1 1 97 97 HIS CA C 97 56.042 56.042 56.228 -0.186 17355
3229 1 7 . 1 1 97 97 HIS H H 97 8.251 8.251 8.856 -0.605 17355
3230 1 7 . 1 1 98 98 HIS N N 98 125.446 125.446 125.331 0.115 17355
3231 1 7 . 1 1 98 98 HIS HA H 98 4.363 4.363 4.812 -0.449 17355
3232 1 7 . 1 1 98 98 HIS CA C 98 57.303 57.303 56.114 1.189 17355
3233 1 7 . 1 1 98 98 HIS CB C 98 30.319 30.319 31.550 -1.231 17355
3234 1 7 . 1 1 98 98 HIS H H 98 8.054 8.054 8.800 -0.746 17355
3235 1 8 . 1 1 3 3 ARG HA H 3 4.321 4.321 4.539 -0.218 17355
3236 1 8 . 1 1 3 3 ARG CA C 3 56.560 56.560 55.861 0.699 17355
3237 1 8 . 1 1 4 4 ALA N N 4 125.797 125.797 126.849 -1.052 17355
3238 1 8 . 1 1 4 4 ALA HA H 4 4.283 4.283 4.443 -0.160 17355
3239 1 8 . 1 1 4 4 ALA CA C 4 52.900 52.900 52.278 0.622 17355
3240 1 8 . 1 1 4 4 ALA CB C 4 19.411 19.411 19.382 0.029 17355
3241 1 8 . 1 1 4 4 ALA H H 4 8.563 8.563 8.651 -0.088 17355
3242 1 8 . 1 1 5 5 ASP N N 5 118.416 118.416 119.779 -1.363 17355
3243 1 8 . 1 1 5 5 ASP HA H 5 4.584 4.584 4.415 0.169 17355
3244 1 8 . 1 1 5 5 ASP CA C 5 54.337 54.337 54.842 -0.504 17355
3245 1 8 . 1 1 5 5 ASP CB C 5 41.186 41.186 40.866 0.320 17355
3246 1 8 . 1 1 5 5 ASP H H 5 8.208 8.208 8.401 -0.193 17355
3247 1 8 . 1 1 6 6 ASP N N 6 120.632 120.632 116.327 4.305 17355
3248 1 8 . 1 1 6 6 ASP HA H 6 4.578 4.578 4.468 0.110 17355
3249 1 8 . 1 1 6 6 ASP CA C 6 54.589 54.589 54.539 0.050 17355
3250 1 8 . 1 1 6 6 ASP CB C 6 41.239 41.239 41.598 -0.359 17355
3251 1 8 . 1 1 6 6 ASP H H 6 8.140 8.140 7.980 0.160 17355
3252 1 8 . 1 1 7 7 THR N N 7 113.693 113.693 115.236 -1.543 17355
3253 1 8 . 1 1 7 7 THR HA H 7 4.245 4.245 4.532 -0.287 17355
3254 1 8 . 1 1 7 7 THR CA C 7 62.392 62.392 62.169 0.223 17355
3255 1 8 . 1 1 7 7 THR CB C 7 69.721 69.721 68.498 1.223 17355
3256 1 8 . 1 1 7 7 THR H H 7 8.045 8.045 8.379 -0.334 17355
3257 1 8 . 1 1 8 8 ALA N N 8 126.414 126.414 129.752 -3.338 17355
3258 1 8 . 1 1 8 8 ALA HA H 8 4.314 4.314 4.374 -0.060 17355
3259 1 8 . 1 1 8 8 ALA CA C 8 52.253 52.253 53.158 -0.905 17355
3260 1 8 . 1 1 8 8 ALA CB C 8 19.464 19.464 20.077 -0.613 17355
3261 1 8 . 1 1 8 8 ALA H H 8 8.139 8.139 8.635 -0.496 17355
3262 1 8 . 1 1 9 9 LEU N N 9 122.921 122.921 121.126 1.795 17355
3263 1 8 . 1 1 9 9 LEU HA H 9 4.559 4.559 4.636 -0.077 17355
3264 1 8 . 1 1 9 9 LEU CA C 9 53.088 53.088 54.260 -1.172 17355
3265 1 8 . 1 1 9 9 LEU CB C 9 41.929 41.929 43.375 -1.446 17355
3266 1 8 . 1 1 9 9 LEU H H 9 8.113 8.113 8.136 -0.023 17355
3267 1 8 . 1 1 10 10 PRO HA H 10 4.367 4.367 4.473 -0.106 17355
3268 1 8 . 1 1 10 10 PRO CA C 10 63.373 63.373 63.520 -0.146 17355
3269 1 8 . 1 1 10 10 PRO CB C 10 31.975 31.975 32.368 -0.393 17355
3270 1 8 . 1 1 11 11 ALA N N 11 124.349 124.349 120.941 3.408 17355
3271 1 8 . 1 1 11 11 ALA HA H 11 4.262 4.262 4.356 -0.095 17355
3272 1 8 . 1 1 11 11 ALA CA C 11 52.496 52.496 51.556 0.940 17355
3273 1 8 . 1 1 11 11 ALA CB C 11 19.424 19.424 20.588 -1.165 17355
3274 1 8 . 1 1 11 11 ALA H H 11 8.317 8.317 7.356 0.961 17355
3275 1 8 . 1 1 12 12 ALA N N 12 123.291 123.291 121.737 1.554 17355
3276 1 8 . 1 1 12 12 ALA HA H 12 4.380 4.380 4.836 -0.456 17355
3277 1 8 . 1 1 12 12 ALA CA C 12 52.461 52.461 52.437 0.024 17355
3278 1 8 . 1 1 12 12 ALA CB C 12 19.557 19.557 20.114 -0.557 17355
3279 1 8 . 1 1 12 12 ALA H H 12 8.287 8.287 8.160 0.127 17355
3280 1 8 . 1 1 13 13 THR N N 13 112.758 112.758 115.885 -3.127 17355
3281 1 8 . 1 1 13 13 THR HA H 13 4.350 4.350 4.402 -0.052 17355
3282 1 8 . 1 1 13 13 THR CA C 13 62.074 62.074 61.878 0.196 17355
3283 1 8 . 1 1 13 13 THR CB C 13 70.070 70.070 69.303 0.767 17355
3284 1 8 . 1 1 13 13 THR H H 13 8.074 8.074 8.343 -0.269 17355
3285 1 8 . 1 1 14 14 GLY N N 14 110.774 110.774 110.083 0.691 17355
3286 1 8 . 1 1 14 14 GLY CA C 14 45.692 45.692 45.313 0.379 17355
3287 1 8 . 1 1 14 14 GLY H H 14 8.405 8.405 8.016 0.389 17355
3288 1 8 . 1 1 15 15 ALA N N 15 124.127 124.127 125.558 -1.431 17355
3289 1 8 . 1 1 15 15 ALA HA H 15 4.137 4.137 4.171 -0.034 17355
3290 1 8 . 1 1 15 15 ALA CA C 15 55.368 55.368 54.291 1.077 17355
3291 1 8 . 1 1 15 15 ALA CB C 15 20.100 20.100 19.149 0.951 17355
3292 1 8 . 1 1 15 15 ALA H H 15 8.866 8.866 8.094 0.772 17355
3293 1 8 . 1 1 16 16 LEU N N 16 118.013 118.013 118.959 -0.946 17355
3294 1 8 . 1 1 16 16 LEU HA H 16 3.870 3.870 4.092 -0.222 17355
3295 1 8 . 1 1 16 16 LEU CA C 16 58.820 58.820 57.818 1.002 17355
3296 1 8 . 1 1 16 16 LEU CB C 16 41.332 41.332 41.372 -0.040 17355
3297 1 8 . 1 1 16 16 LEU H H 16 8.414 8.414 8.013 0.401 17355
3298 1 8 . 1 1 17 17 GLU N N 17 117.730 117.730 117.312 0.418 17355
3299 1 8 . 1 1 17 17 GLU HA H 17 3.978 3.978 4.226 -0.248 17355
3300 1 8 . 1 1 17 17 GLU CA C 17 59.909 59.909 58.005 1.904 17355
3301 1 8 . 1 1 17 17 GLU CB C 17 29.212 29.212 28.912 0.300 17355
3302 1 8 . 1 1 17 17 GLU H H 17 8.088 8.088 8.203 -0.115 17355
3303 1 8 . 1 1 18 18 LEU N N 18 121.355 121.355 121.389 -0.034 17355
3304 1 8 . 1 1 18 18 LEU HA H 18 4.165 4.165 4.103 0.062 17355
3305 1 8 . 1 1 18 18 LEU CA C 18 58.469 58.469 57.933 0.536 17355
3306 1 8 . 1 1 18 18 LEU CB C 18 42.459 42.459 42.239 0.220 17355
3307 1 8 . 1 1 18 18 LEU H H 18 7.767 7.767 7.400 0.367 17355
3308 1 8 . 1 1 19 19 VAL N N 19 118.522 118.522 116.850 1.672 17355
3309 1 8 . 1 1 19 19 VAL HA H 19 3.424 3.424 3.764 -0.340 17355
3310 1 8 . 1 1 19 19 VAL CA C 19 67.958 67.958 65.977 1.981 17355
3311 1 8 . 1 1 19 19 VAL CB C 19 31.922 31.922 31.937 -0.015 17355
3312 1 8 . 1 1 19 19 VAL H H 19 8.661 8.661 7.530 1.131 17355
3313 1 8 . 1 1 20 20 ARG N N 20 117.959 117.959 118.542 -0.583 17355
3314 1 8 . 1 1 20 20 ARG HA H 20 3.576 3.576 4.235 -0.659 17355
3315 1 8 . 1 1 20 20 ARG CA C 20 60.994 60.994 56.929 4.065 17355
3316 1 8 . 1 1 20 20 ARG CB C 20 30.703 30.703 28.336 2.367 17355
3317 1 8 . 1 1 20 20 ARG H H 20 8.705 8.705 8.251 0.454 17355
3318 1 8 . 1 1 21 21 HIS N N 21 115.245 115.245 116.472 -1.227 17355
3319 1 8 . 1 1 21 21 HIS HA H 21 4.144 4.144 4.569 -0.425 17355
3320 1 8 . 1 1 21 21 HIS CA C 21 60.536 60.536 57.056 3.480 17355
3321 1 8 . 1 1 21 21 HIS CB C 21 29.099 29.099 32.609 -3.510 17355
3322 1 8 . 1 1 21 21 HIS H H 21 7.811 7.811 8.334 -0.523 17355
3323 1 8 . 1 1 22 22 LEU N N 22 119.884 119.884 120.083 -0.199 17355
3324 1 8 . 1 1 22 22 LEU HA H 22 4.078 4.078 4.136 -0.058 17355
3325 1 8 . 1 1 22 22 LEU CA C 22 58.164 58.164 57.924 0.240 17355
3326 1 8 . 1 1 22 22 LEU CB C 22 42.889 42.889 42.043 0.846 17355
3327 1 8 . 1 1 22 22 LEU H H 22 8.301 8.301 7.706 0.595 17355
3328 1 8 . 1 1 23 23 VAL N N 23 119.391 119.391 118.506 0.885 17355
3329 1 8 . 1 1 23 23 VAL HA H 23 3.429 3.429 3.727 -0.298 17355
3330 1 8 . 1 1 23 23 VAL CA C 23 67.179 67.179 66.243 0.936 17355
3331 1 8 . 1 1 23 23 VAL CB C 23 31.366 31.366 31.474 -0.108 17355
3332 1 8 . 1 1 23 23 VAL H H 23 8.897 8.897 7.557 1.340 17355
3333 1 8 . 1 1 24 24 ALA N N 24 121.610 121.610 122.702 -1.092 17355
3334 1 8 . 1 1 24 24 ALA HA H 24 3.851 3.851 4.026 -0.175 17355
3335 1 8 . 1 1 24 24 ALA CA C 24 55.944 55.944 55.171 0.773 17355
3336 1 8 . 1 1 24 24 ALA CB C 24 18.042 18.042 18.348 -0.306 17355
3337 1 8 . 1 1 24 24 ALA H H 24 8.276 8.276 7.782 0.494 17355
3338 1 8 . 1 1 25 25 GLU N N 25 114.822 114.822 116.522 -1.700 17355
3339 1 8 . 1 1 25 25 GLU HA H 25 4.042 4.042 4.325 -0.283 17355
3340 1 8 . 1 1 25 25 GLU CA C 25 59.255 59.255 58.542 0.713 17355
3341 1 8 . 1 1 25 25 GLU CB C 25 29.951 29.951 29.009 0.942 17355
3342 1 8 . 1 1 25 25 GLU H H 25 7.693 7.693 8.142 -0.449 17355
3343 1 8 . 1 1 26 26 ARG N N 26 118.510 118.510 116.898 1.612 17355
3344 1 8 . 1 1 26 26 ARG HA H 26 4.252 4.252 4.338 -0.086 17355
3345 1 8 . 1 1 26 26 ARG CA C 26 57.090 57.090 56.481 0.609 17355
3346 1 8 . 1 1 26 26 ARG CB C 26 30.080 30.080 30.872 -0.792 17355
3347 1 8 . 1 1 26 26 ARG H H 26 7.783 7.783 7.774 0.009 17355
3348 1 8 . 1 1 27 27 ALA N N 27 120.375 120.375 120.525 -0.150 17355
3349 1 8 . 1 1 27 27 ALA HA H 27 4.342 4.342 4.527 -0.185 17355
3350 1 8 . 1 1 27 27 ALA CA C 27 52.134 52.134 51.041 1.093 17355
3351 1 8 . 1 1 27 27 ALA CB C 27 19.283 19.283 19.836 -0.553 17355
3352 1 8 . 1 1 27 27 ALA H H 27 8.638 8.638 7.739 0.899 17355
3353 1 8 . 1 1 28 28 GLU N N 28 115.494 115.494 117.753 -2.259 17355
3354 1 8 . 1 1 28 28 GLU HA H 28 3.873 3.873 4.045 -0.172 17355
3355 1 8 . 1 1 28 28 GLU CA C 28 56.940 56.940 57.253 -0.313 17355
3356 1 8 . 1 1 28 28 GLU CB C 28 27.058 27.058 28.079 -1.021 17355
3357 1 8 . 1 1 28 28 GLU H H 28 7.734 7.734 8.399 -0.665 17355
3358 1 8 . 1 1 29 29 LEU N N 29 119.978 119.978 120.700 -0.722 17355
3359 1 8 . 1 1 29 29 LEU HA H 29 4.898 4.898 4.788 0.110 17355
3360 1 8 . 1 1 29 29 LEU CA C 29 51.498 51.498 51.867 -0.369 17355
3361 1 8 . 1 1 29 29 LEU CB C 29 45.348 45.348 45.637 -0.289 17355
3362 1 8 . 1 1 29 29 LEU H H 29 8.075 8.075 7.622 0.453 17355
3363 1 8 . 1 1 30 30 PRO HA H 30 4.461 4.461 4.469 -0.008 17355
3364 1 8 . 1 1 30 30 PRO CA C 30 62.524 62.524 62.990 -0.466 17355
3365 1 8 . 1 1 30 30 PRO CB C 30 32.015 32.015 30.329 1.686 17355
3366 1 8 . 1 1 31 31 VAL N N 31 123.773 123.773 120.018 3.755 17355
3367 1 8 . 1 1 31 31 VAL HA H 31 3.540 3.540 3.878 -0.338 17355
3368 1 8 . 1 1 31 31 VAL CA C 31 65.493 65.493 64.094 1.399 17355
3369 1 8 . 1 1 31 31 VAL CB C 31 31.865 31.865 31.545 0.320 17355
3370 1 8 . 1 1 31 31 VAL H H 31 8.432 8.432 7.981 0.451 17355
3371 1 8 . 1 1 32 32 GLU N N 32 117.215 117.215 121.767 -4.552 17355
3372 1 8 . 1 1 32 32 GLU HA H 32 4.053 4.053 4.743 -0.690 17355
3373 1 8 . 1 1 32 32 GLU CA C 32 59.131 59.131 57.017 2.114 17355
3374 1 8 . 1 1 32 32 GLU CB C 32 28.781 28.781 30.313 -1.532 17355
3375 1 8 . 1 1 32 32 GLU H H 32 8.971 8.971 8.402 0.569 17355
3376 1 8 . 1 1 33 33 VAL N N 33 113.611 113.611 122.569 -8.958 17355
3377 1 8 . 1 1 33 33 VAL HA H 33 4.214 4.214 4.166 0.048 17355
3378 1 8 . 1 1 33 33 VAL CA C 33 61.795 61.795 61.182 0.613 17355
3379 1 8 . 1 1 33 33 VAL CB C 33 32.094 32.094 31.552 0.542 17355
3380 1 8 . 1 1 33 33 VAL H H 33 7.470 7.470 8.108 -0.638 17355
3381 1 8 . 1 1 34 34 LEU N N 34 123.533 123.533 123.319 0.214 17355
3382 1 8 . 1 1 34 34 LEU HA H 34 4.114 4.114 4.442 -0.328 17355
3383 1 8 . 1 1 34 34 LEU CA C 34 54.877 54.877 53.925 0.952 17355
3384 1 8 . 1 1 34 34 LEU CB C 34 42.590 42.590 42.188 0.402 17355
3385 1 8 . 1 1 34 34 LEU H H 34 7.300 7.300 7.406 -0.106 17355
3386 1 8 . 1 1 35 35 ARG N N 35 125.820 125.820 125.610 0.210 17355
3387 1 8 . 1 1 35 35 ARG HA H 35 4.578 4.578 4.150 0.428 17355
3388 1 8 . 1 1 35 35 ARG CA C 35 54.619 54.619 57.286 -2.667 17355
3389 1 8 . 1 1 35 35 ARG CB C 35 31.909 31.909 31.155 0.754 17355
3390 1 8 . 1 1 35 35 ARG H H 35 8.415 8.415 8.550 -0.135 17355
3391 1 8 . 1 1 36 36 ASP N N 36 123.211 123.211 116.155 7.056 17355
3392 1 8 . 1 1 36 36 ASP HA H 36 4.156 4.156 4.610 -0.454 17355
3393 1 8 . 1 1 36 36 ASP CA C 36 57.258 57.258 55.512 1.746 17355
3394 1 8 . 1 1 36 36 ASP CB C 36 40.400 40.400 41.862 -1.462 17355
3395 1 8 . 1 1 36 36 ASP H H 36 8.880 8.880 8.551 0.329 17355
3396 1 8 . 1 1 37 37 ASP N N 37 112.390 112.390 119.196 -6.806 17355
3397 1 8 . 1 1 37 37 ASP HA H 37 4.614 4.614 4.696 -0.082 17355
3398 1 8 . 1 1 37 37 ASP CA C 37 52.651 52.651 53.854 -1.203 17355
3399 1 8 . 1 1 37 37 ASP CB C 37 40.100 40.100 40.920 -0.820 17355
3400 1 8 . 1 1 37 37 ASP H H 37 7.800 7.800 8.214 -0.414 17355
3401 1 8 . 1 1 38 38 SER N N 38 116.534 116.534 117.063 -0.529 17355
3402 1 8 . 1 1 38 38 SER HA H 38 4.147 4.147 4.385 -0.238 17355
3403 1 8 . 1 1 38 38 SER CA C 38 61.186 61.186 58.294 2.892 17355
3404 1 8 . 1 1 38 38 SER CB C 38 63.946 63.946 62.818 1.128 17355
3405 1 8 . 1 1 38 38 SER H H 38 7.376 7.376 7.894 -0.518 17355
3406 1 8 . 1 1 39 39 ARG N N 39 124.337 124.337 124.442 -0.105 17355
3407 1 8 . 1 1 39 39 ARG HA H 39 4.521 4.521 4.374 0.147 17355
3408 1 8 . 1 1 39 39 ARG CA C 39 55.049 55.049 55.571 -0.522 17355
3409 1 8 . 1 1 39 39 ARG CB C 39 30.723 30.723 31.193 -0.470 17355
3410 1 8 . 1 1 39 39 ARG H H 39 10.095 10.095 8.118 1.977 17355
3411 1 8 . 1 1 40 40 PHE N N 40 122.834 122.834 118.853 3.981 17355
3412 1 8 . 1 1 40 40 PHE HA H 40 3.916 3.916 4.759 -0.843 17355
3413 1 8 . 1 1 40 40 PHE CA C 40 62.869 62.869 58.453 4.416 17355
3414 1 8 . 1 1 40 40 PHE CB C 40 39.662 39.662 36.907 2.755 17355
3415 1 8 . 1 1 40 40 PHE H H 40 7.498 7.498 8.466 -0.968 17355
3416 1 8 . 1 1 41 41 LEU N N 41 117.682 117.682 117.313 0.369 17355
3417 1 8 . 1 1 41 41 LEU HA H 41 4.519 4.519 4.395 0.124 17355
3418 1 8 . 1 1 41 41 LEU CA C 41 58.111 58.111 56.022 2.089 17355
3419 1 8 . 1 1 41 41 LEU CB C 41 41.087 41.087 43.394 -2.307 17355
3420 1 8 . 1 1 41 41 LEU H H 41 8.619 8.619 7.266 1.353 17355
3421 1 8 . 1 1 42 42 ASP N N 42 114.800 114.800 119.996 -5.196 17355
3422 1 8 . 1 1 42 42 ASP HA H 42 4.185 4.185 4.391 -0.206 17355
3423 1 8 . 1 1 42 42 ASP CA C 42 57.713 57.713 55.064 2.649 17355
3424 1 8 . 1 1 42 42 ASP CB C 42 41.206 41.206 41.159 0.047 17355
3425 1 8 . 1 1 42 42 ASP H H 42 8.239 8.239 8.187 0.052 17355
3426 1 8 . 1 1 43 43 ASP N N 43 111.125 111.125 120.347 -9.222 17355
3427 1 8 . 1 1 43 43 ASP HA H 43 4.915 4.915 4.464 0.451 17355
3428 1 8 . 1 1 43 43 ASP CA C 43 56.105 56.105 56.572 -0.467 17355
3429 1 8 . 1 1 43 43 ASP CB C 43 41.703 41.703 40.878 0.825 17355
3430 1 8 . 1 1 43 43 ASP H H 43 7.355 7.355 8.230 -0.875 17355
3431 1 8 . 1 1 44 44 LEU N N 44 114.924 114.924 116.050 -1.126 17355
3432 1 8 . 1 1 44 44 LEU HA H 44 4.273 4.273 4.237 0.036 17355
3433 1 8 . 1 1 44 44 LEU CA C 44 54.480 54.480 55.712 -1.232 17355
3434 1 8 . 1 1 44 44 LEU CB C 44 41.671 41.671 42.776 -1.105 17355
3435 1 8 . 1 1 44 44 LEU H H 44 7.172 7.172 7.881 -0.709 17355
3436 1 8 . 1 1 45 45 HIS N N 45 114.429 114.429 116.724 -2.295 17355
3437 1 8 . 1 1 45 45 HIS HA H 45 4.581 4.581 4.336 0.245 17355
3438 1 8 . 1 1 45 45 HIS CA C 45 56.189 56.189 55.628 0.561 17355
3439 1 8 . 1 1 45 45 HIS CB C 45 26.073 26.073 28.702 -2.629 17355
3440 1 8 . 1 1 45 45 HIS H H 45 7.308 7.308 7.774 -0.466 17355
3441 1 8 . 1 1 46 46 MET N N 46 118.597 118.597 122.573 -3.976 17355
3442 1 8 . 1 1 46 46 MET HA H 46 4.614 4.614 4.705 -0.091 17355
3443 1 8 . 1 1 46 46 MET CA C 46 55.646 55.646 54.672 0.974 17355
3444 1 8 . 1 1 46 46 MET CB C 46 35.501 35.501 36.761 -1.260 17355
3445 1 8 . 1 1 46 46 MET H H 46 8.618 8.618 7.731 0.887 17355
3446 1 8 . 1 1 47 47 SER N N 47 116.110 116.110 119.002 -2.892 17355
3447 1 8 . 1 1 47 47 SER HA H 47 4.559 4.559 4.729 -0.170 17355
3448 1 8 . 1 1 47 47 SER CA C 47 56.696 56.696 57.837 -1.141 17355
3449 1 8 . 1 1 47 47 SER CB C 47 65.888 65.888 64.211 1.677 17355
3450 1 8 . 1 1 47 47 SER H H 47 8.446 8.446 9.012 -0.566 17355
3451 1 8 . 1 1 48 48 SER N N 48 116.756 116.756 118.639 -1.883 17355
3452 1 8 . 1 1 48 48 SER HA H 48 3.701 3.701 4.128 -0.427 17355
3453 1 8 . 1 1 48 48 SER CA C 48 62.260 62.260 61.675 0.585 17355
3454 1 8 . 1 1 48 48 SER CB C 48 62.289 62.289 62.933 -0.644 17355
3455 1 8 . 1 1 48 48 SER H H 48 8.948 8.948 8.905 0.043 17355
3456 1 8 . 1 1 49 49 ILE N N 49 122.227 122.227 120.778 1.449 17355
3457 1 8 . 1 1 49 49 ILE HA H 49 3.806 3.806 3.665 0.141 17355
3458 1 8 . 1 1 49 49 ILE CA C 49 64.215 64.215 65.000 -0.785 17355
3459 1 8 . 1 1 49 49 ILE CB C 49 38.059 38.059 37.475 0.584 17355
3460 1 8 . 1 1 49 49 ILE H H 49 7.595 7.595 7.880 -0.285 17355
3461 1 8 . 1 1 50 50 THR N N 50 120.233 120.233 115.785 4.448 17355
3462 1 8 . 1 1 50 50 THR HA H 50 3.878 3.878 4.035 -0.157 17355
3463 1 8 . 1 1 50 50 THR CA C 50 66.427 66.427 65.910 0.517 17355
3464 1 8 . 1 1 50 50 THR CB C 50 68.223 68.223 68.179 0.044 17355
3465 1 8 . 1 1 50 50 THR H H 50 7.539 7.539 7.444 0.095 17355
3466 1 8 . 1 1 51 51 VAL N N 51 121.320 121.320 119.770 1.550 17355
3467 1 8 . 1 1 51 51 VAL HA H 51 3.090 3.090 3.773 -0.683 17355
3468 1 8 . 1 1 51 51 VAL CA C 51 67.440 67.440 64.941 2.499 17355
3469 1 8 . 1 1 51 51 VAL CB C 51 31.087 31.087 30.486 0.601 17355
3470 1 8 . 1 1 51 51 VAL H H 51 8.178 8.178 8.394 -0.216 17355
3471 1 8 . 1 1 52 52 GLY N N 52 105.968 105.968 106.515 -0.547 17355
3472 1 8 . 1 1 52 52 GLY CA C 52 47.339 47.339 46.160 1.179 17355
3473 1 8 . 1 1 52 52 GLY H H 52 8.004 8.004 7.867 0.137 17355
3474 1 8 . 1 1 53 53 GLN N N 53 120.486 120.486 118.678 1.808 17355
3475 1 8 . 1 1 53 53 GLN HA H 53 4.086 4.086 4.251 -0.165 17355
3476 1 8 . 1 1 53 53 GLN CA C 53 58.919 58.919 57.298 1.621 17355
3477 1 8 . 1 1 53 53 GLN CB C 53 27.867 27.867 29.265 -1.398 17355
3478 1 8 . 1 1 53 53 GLN H H 53 7.675 7.675 7.391 0.284 17355
3479 1 8 . 1 1 54 54 LEU N N 54 121.901 121.901 116.597 5.304 17355
3480 1 8 . 1 1 54 54 LEU HA H 54 4.049 4.049 4.551 -0.502 17355
3481 1 8 . 1 1 54 54 LEU CA C 54 58.661 58.661 56.948 1.713 17355
3482 1 8 . 1 1 54 54 LEU CB C 54 42.426 42.426 42.128 0.298 17355
3483 1 8 . 1 1 54 54 LEU H H 54 8.038 8.038 7.353 0.685 17355
3484 1 8 . 1 1 55 55 VAL N N 55 119.226 119.226 120.926 -1.700 17355
3485 1 8 . 1 1 55 55 VAL HA H 55 3.543 3.543 3.691 -0.148 17355
3486 1 8 . 1 1 55 55 VAL CA C 55 66.871 66.871 64.688 2.183 17355
3487 1 8 . 1 1 55 55 VAL CB C 55 31.392 31.392 30.946 0.446 17355
3488 1 8 . 1 1 55 55 VAL H H 55 8.375 8.375 7.909 0.466 17355
3489 1 8 . 1 1 56 56 ASN N N 56 117.987 117.987 117.056 0.931 17355
3490 1 8 . 1 1 56 56 ASN HA H 56 4.473 4.473 4.468 0.005 17355
3491 1 8 . 1 1 56 56 ASN CA C 56 56.557 56.557 55.511 1.046 17355
3492 1 8 . 1 1 56 56 ASN CB C 56 38.509 38.509 38.225 0.284 17355
3493 1 8 . 1 1 56 56 ASN H H 56 7.521 7.521 8.435 -0.914 17355
3494 1 8 . 1 1 57 57 GLU N N 57 121.765 121.765 119.832 1.933 17355
3495 1 8 . 1 1 57 57 GLU HA H 57 4.070 4.070 4.209 -0.139 17355
3496 1 8 . 1 1 57 57 GLU CA C 57 59.496 59.496 58.415 1.081 17355
3497 1 8 . 1 1 57 57 GLU CB C 57 29.395 29.395 29.737 -0.342 17355
3498 1 8 . 1 1 57 57 GLU H H 57 8.225 8.225 7.608 0.617 17355
3499 1 8 . 1 1 58 58 ALA N N 58 123.779 123.779 122.100 1.679 17355
3500 1 8 . 1 1 58 58 ALA HA H 58 3.874 3.874 4.319 -0.445 17355
3501 1 8 . 1 1 58 58 ALA CA C 58 55.227 55.227 54.815 0.412 17355
3502 1 8 . 1 1 58 58 ALA CB C 58 18.388 18.388 18.318 0.070 17355
3503 1 8 . 1 1 58 58 ALA H H 58 8.659 8.659 7.433 1.226 17355
3504 1 8 . 1 1 59 59 ALA N N 59 118.656 118.656 121.887 -3.231 17355
3505 1 8 . 1 1 59 59 ALA HA H 59 3.819 3.819 3.926 -0.107 17355
3506 1 8 . 1 1 59 59 ALA CA C 59 55.871 55.871 55.374 0.497 17355
3507 1 8 . 1 1 59 59 ALA CB C 59 18.152 18.152 18.507 -0.355 17355
3508 1 8 . 1 1 59 59 ALA H H 59 8.537 8.537 7.702 0.835 17355
3509 1 8 . 1 1 60 60 ARG N N 60 117.701 117.701 118.111 -0.410 17355
3510 1 8 . 1 1 60 60 ARG HA H 60 4.096 4.096 3.983 0.113 17355
3511 1 8 . 1 1 60 60 ARG CA C 60 59.609 59.609 58.710 0.899 17355
3512 1 8 . 1 1 60 60 ARG CB C 60 29.974 29.974 29.282 0.692 17355
3513 1 8 . 1 1 60 60 ARG H H 60 7.923 7.923 7.626 0.297 17355
3514 1 8 . 1 1 61 61 ALA N N 61 123.271 123.271 121.429 1.842 17355
3515 1 8 . 1 1 61 61 ALA HA H 61 4.137 4.137 4.126 0.011 17355
3516 1 8 . 1 1 61 61 ALA CA C 61 54.912 54.912 54.124 0.788 17355
3517 1 8 . 1 1 61 61 ALA CB C 61 18.304 18.304 18.381 -0.077 17355
3518 1 8 . 1 1 61 61 ALA H H 61 8.044 8.044 7.395 0.649 17355
3519 1 8 . 1 1 62 62 MET N N 62 114.725 114.725 114.921 -0.196 17355
3520 1 8 . 1 1 62 62 MET HA H 62 4.297 4.297 4.344 -0.047 17355
3521 1 8 . 1 1 62 62 MET CA C 62 56.392 56.392 56.218 0.174 17355
3522 1 8 . 1 1 62 62 MET CB C 62 34.827 34.827 33.137 1.690 17355
3523 1 8 . 1 1 62 62 MET H H 62 7.710 7.710 7.907 -0.197 17355
3524 1 8 . 1 1 63 63 GLY N N 63 108.268 108.268 107.188 1.080 17355
3525 1 8 . 1 1 63 63 GLY CA C 63 46.079 46.079 45.267 0.812 17355
3526 1 8 . 1 1 63 63 GLY H H 63 7.846 7.846 7.514 0.332 17355
3527 1 8 . 1 1 64 64 LEU N N 64 119.547 119.547 119.419 0.128 17355
3528 1 8 . 1 1 64 64 LEU HA H 64 4.526 4.526 4.594 -0.068 17355
3529 1 8 . 1 1 64 64 LEU CA C 64 53.605 53.605 53.894 -0.289 17355
3530 1 8 . 1 1 64 64 LEU CB C 64 43.784 43.784 42.980 0.804 17355
3531 1 8 . 1 1 64 64 LEU H H 64 8.183 8.183 8.096 0.087 17355
3532 1 8 . 1 1 65 65 SER N N 65 115.418 115.418 113.071 2.347 17355
3533 1 8 . 1 1 65 65 SER HA H 65 4.328 4.328 4.476 -0.148 17355
3534 1 8 . 1 1 65 65 SER CA C 65 58.319 58.319 58.704 -0.385 17355
3535 1 8 . 1 1 65 65 SER CB C 65 64.181 64.181 63.413 0.768 17355
3536 1 8 . 1 1 65 65 SER H H 65 8.302 8.302 8.316 -0.014 17355
3537 1 8 . 1 1 66 66 ALA N N 66 124.266 124.266 124.801 -0.535 17355
3538 1 8 . 1 1 66 66 ALA HA H 66 4.212 4.212 4.582 -0.370 17355
3539 1 8 . 1 1 66 66 ALA CA C 66 52.624 52.624 52.697 -0.073 17355
3540 1 8 . 1 1 66 66 ALA CB C 66 19.309 19.309 19.257 0.052 17355
3541 1 8 . 1 1 66 66 ALA H H 66 8.262 8.262 8.163 0.099 17355
3542 1 8 . 1 1 67 67 VAL N N 67 118.373 118.373 117.401 0.972 17355
3543 1 8 . 1 1 67 67 VAL HA H 67 4.049 4.049 4.129 -0.080 17355
3544 1 8 . 1 1 67 67 VAL CA C 67 62.010 62.010 62.880 -0.870 17355
3545 1 8 . 1 1 67 67 VAL CB C 67 33.495 33.495 32.288 1.207 17355
3546 1 8 . 1 1 67 67 VAL H H 67 7.949 7.949 7.332 0.617 17355
3547 1 8 . 1 1 68 68 ALA N N 68 127.696 127.696 119.757 7.939 17355
3548 1 8 . 1 1 68 68 ALA HA H 68 4.308 4.308 4.053 0.255 17355
3549 1 8 . 1 1 68 68 ALA CA C 68 52.070 52.070 53.965 -1.895 17355
3550 1 8 . 1 1 68 68 ALA CB C 68 19.220 19.220 17.653 1.567 17355
3551 1 8 . 1 1 68 68 ALA H H 68 8.319 8.319 8.183 0.136 17355
3552 1 8 . 1 1 69 69 MET N N 69 120.285 120.285 111.275 9.010 17355
3553 1 8 . 1 1 69 69 MET HA H 69 4.664 4.664 4.796 -0.132 17355
3554 1 8 . 1 1 69 69 MET CA C 69 53.004 53.004 54.033 -1.029 17355
3555 1 8 . 1 1 69 69 MET CB C 69 32.678 32.678 32.291 0.388 17355
3556 1 8 . 1 1 69 69 MET H H 69 8.224 8.224 7.365 0.859 17355
3557 1 8 . 1 1 70 70 PRO HA H 70 4.446 4.446 4.443 0.003 17355
3558 1 8 . 1 1 70 70 PRO CA C 70 63.452 63.452 64.684 -1.232 17355
3559 1 8 . 1 1 70 70 PRO CB C 70 32.012 32.012 32.259 -0.247 17355
3560 1 8 . 1 1 71 71 THR N N 71 112.663 112.663 109.659 3.004 17355
3561 1 8 . 1 1 71 71 THR HA H 71 4.074 4.074 3.785 0.289 17355
3562 1 8 . 1 1 71 71 THR CA C 71 62.869 62.869 61.528 1.341 17355
3563 1 8 . 1 1 71 71 THR CB C 71 69.516 69.516 69.822 -0.306 17355
3564 1 8 . 1 1 71 71 THR H H 71 7.957 7.957 7.537 0.420 17355
3565 1 8 . 1 1 72 72 ASN N N 72 120.054 120.054 119.854 0.200 17355
3566 1 8 . 1 1 72 72 ASN HA H 72 4.695 4.695 3.960 0.735 17355
3567 1 8 . 1 1 72 72 ASN CA C 72 52.856 52.856 55.887 -3.031 17355
3568 1 8 . 1 1 72 72 ASN CB C 72 38.165 38.165 37.699 0.466 17355
3569 1 8 . 1 1 72 72 ASN H H 72 8.227 8.227 8.209 0.018 17355
3570 1 8 . 1 1 73 73 PHE N N 73 121.570 121.570 115.244 6.326 17355
3571 1 8 . 1 1 73 73 PHE HA H 73 4.342 4.342 3.738 0.604 17355
3572 1 8 . 1 1 73 73 PHE CA C 73 59.609 59.609 60.482 -0.873 17355
3573 1 8 . 1 1 73 73 PHE CB C 73 39.000 39.000 36.757 2.243 17355
3574 1 8 . 1 1 73 73 PHE H H 73 8.331 8.331 8.260 0.071 17355
3575 1 8 . 1 1 74 74 ALA N N 74 121.047 121.047 122.084 -1.037 17355
3576 1 8 . 1 1 74 74 ALA HA H 74 4.074 4.074 4.280 -0.206 17355
3577 1 8 . 1 1 74 74 ALA CA C 74 54.705 54.705 55.009 -0.304 17355
3578 1 8 . 1 1 74 74 ALA CB C 74 19.159 19.159 18.993 0.166 17355
3579 1 8 . 1 1 74 74 ALA H H 74 8.163 8.163 8.076 0.087 17355
3580 1 8 . 1 1 75 75 THR N N 75 104.824 104.824 114.156 -9.332 17355
3581 1 8 . 1 1 75 75 THR HA H 75 4.475 4.475 4.386 0.089 17355
3582 1 8 . 1 1 75 75 THR CA C 75 60.669 60.669 61.842 -1.173 17355
3583 1 8 . 1 1 75 75 THR CB C 75 69.543 69.543 66.602 2.941 17355
3584 1 8 . 1 1 75 75 THR H H 75 7.581 7.581 8.110 -0.529 17355
3585 1 8 . 1 1 76 76 ALA N N 76 124.548 124.548 127.264 -2.716 17355
3586 1 8 . 1 1 76 76 ALA HA H 76 4.714 4.714 4.937 -0.223 17355
3587 1 8 . 1 1 76 76 ALA CA C 76 52.929 52.929 50.734 2.195 17355
3588 1 8 . 1 1 76 76 ALA CB C 76 20.661 20.661 22.356 -1.695 17355
3589 1 8 . 1 1 76 76 ALA H H 76 7.689 7.689 8.061 -0.372 17355
3590 1 8 . 1 1 77 77 THR N N 77 108.654 108.654 110.709 -2.055 17355
3591 1 8 . 1 1 77 77 THR HA H 77 5.017 5.017 4.539 0.478 17355
3592 1 8 . 1 1 77 77 THR CA C 77 58.847 58.847 59.950 -1.103 17355
3593 1 8 . 1 1 77 77 THR CB C 77 73.369 73.369 72.110 1.259 17355
3594 1 8 . 1 1 77 77 THR H H 77 7.495 7.495 8.195 -0.700 17355
3595 1 8 . 1 1 78 78 VAL N N 78 120.107 120.107 118.042 2.065 17355
3596 1 8 . 1 1 78 78 VAL HA H 78 3.418 3.418 4.006 -0.588 17355
3597 1 8 . 1 1 78 78 VAL CA C 78 67.446 67.446 66.670 0.776 17355
3598 1 8 . 1 1 78 78 VAL CB C 78 31.949 31.949 31.770 0.179 17355
3599 1 8 . 1 1 78 78 VAL H H 78 7.373 7.373 7.736 -0.363 17355
3600 1 8 . 1 1 79 79 ARG N N 79 117.131 117.131 118.069 -0.938 17355
3601 1 8 . 1 1 79 79 ARG HA H 79 3.877 3.877 4.191 -0.314 17355
3602 1 8 . 1 1 79 79 ARG CA C 79 59.566 59.566 58.322 1.244 17355
3603 1 8 . 1 1 79 79 ARG CB C 79 30.174 30.174 29.828 0.346 17355
3604 1 8 . 1 1 79 79 ARG H H 79 8.518 8.518 8.097 0.421 17355
3605 1 8 . 1 1 80 80 GLU N N 80 118.542 118.542 121.007 -2.465 17355
3606 1 8 . 1 1 80 80 GLU HA H 80 4.033 4.033 4.160 -0.127 17355
3607 1 8 . 1 1 80 80 GLU CA C 80 59.427 59.427 59.294 0.133 17355
3608 1 8 . 1 1 80 80 GLU CB C 80 30.206 30.206 29.794 0.412 17355
3609 1 8 . 1 1 80 80 GLU H H 80 7.847 7.847 8.174 -0.327 17355
3610 1 8 . 1 1 81 81 MET N N 81 119.630 119.630 119.253 0.377 17355
3611 1 8 . 1 1 81 81 MET HA H 81 4.158 4.158 4.143 0.015 17355
3612 1 8 . 1 1 81 81 MET CA C 81 59.025 59.025 59.100 -0.075 17355
3613 1 8 . 1 1 81 81 MET CB C 81 32.916 32.916 32.695 0.221 17355
3614 1 8 . 1 1 81 81 MET H H 81 8.211 8.211 8.242 -0.031 17355
3615 1 8 . 1 1 82 82 ALA N N 82 120.463 120.463 121.346 -0.883 17355
3616 1 8 . 1 1 82 82 ALA HA H 82 3.911 3.911 4.162 -0.251 17355
3617 1 8 . 1 1 82 82 ALA CA C 82 56.004 56.004 54.468 1.536 17355
3618 1 8 . 1 1 82 82 ALA CB C 82 18.430 18.430 18.420 0.010 17355
3619 1 8 . 1 1 82 82 ALA H H 82 7.978 7.978 7.630 0.348 17355
3620 1 8 . 1 1 83 83 GLU N N 83 116.663 116.663 120.060 -3.397 17355
3621 1 8 . 1 1 83 83 GLU HA H 83 4.034 4.034 3.877 0.157 17355
3622 1 8 . 1 1 83 83 GLU CA C 83 59.476 59.476 59.837 -0.361 17355
3623 1 8 . 1 1 83 83 GLU CB C 83 29.470 29.470 29.533 -0.063 17355
3624 1 8 . 1 1 83 83 GLU H H 83 8.608 8.608 7.788 0.820 17355
3625 1 8 . 1 1 84 84 ALA N N 84 122.742 122.742 121.343 1.399 17355
3626 1 8 . 1 1 84 84 ALA HA H 84 4.241 4.241 4.002 0.239 17355
3627 1 8 . 1 1 84 84 ALA CA C 84 54.970 54.970 55.274 -0.304 17355
3628 1 8 . 1 1 84 84 ALA CB C 84 18.150 18.150 18.090 0.060 17355
3629 1 8 . 1 1 84 84 ALA H H 84 7.918 7.918 7.946 -0.028 17355
3630 1 8 . 1 1 85 85 LEU N N 85 119.158 119.158 118.573 0.585 17355
3631 1 8 . 1 1 85 85 LEU HA H 85 3.945 3.945 3.897 0.048 17355
3632 1 8 . 1 1 85 85 LEU CA C 85 57.849 57.849 57.453 0.397 17355
3633 1 8 . 1 1 85 85 LEU CB C 85 41.884 41.884 41.657 0.227 17355
3634 1 8 . 1 1 85 85 LEU H H 85 7.692 7.692 7.681 0.011 17355
3635 1 8 . 1 1 86 86 GLU N N 86 118.441 118.441 119.409 -0.968 17355
3636 1 8 . 1 1 86 86 GLU HA H 86 4.053 4.053 4.054 -0.001 17355
3637 1 8 . 1 1 86 86 GLU CA C 86 59.131 59.131 59.000 0.131 17355
3638 1 8 . 1 1 86 86 GLU CB C 86 29.868 29.868 29.166 0.702 17355
3639 1 8 . 1 1 86 86 GLU H H 86 8.152 8.152 8.438 -0.286 17355
3640 1 8 . 1 1 87 87 ALA N N 87 120.690 120.690 121.853 -1.163 17355
3641 1 8 . 1 1 87 87 ALA HA H 87 4.139 4.139 4.170 -0.031 17355
3642 1 8 . 1 1 87 87 ALA CA C 87 54.506 54.506 54.300 0.206 17355
3643 1 8 . 1 1 87 87 ALA CB C 87 18.435 18.435 19.196 -0.761 17355
3644 1 8 . 1 1 87 87 ALA H H 87 7.899 7.899 7.866 0.033 17355
3645 1 8 . 1 1 88 88 ARG N N 88 117.642 117.642 119.025 -1.383 17355
3646 1 8 . 1 1 88 88 ARG HA H 88 4.204 4.204 3.985 0.219 17355
3647 1 8 . 1 1 88 88 ARG CA C 88 57.435 57.435 59.138 -1.703 17355
3648 1 8 . 1 1 88 88 ARG CB C 88 30.106 30.106 29.759 0.347 17355
3649 1 8 . 1 1 88 88 ARG H H 88 7.593 7.593 8.216 -0.623 17355
3650 1 8 . 1 1 89 89 GLU N N 89 121.080 121.080 117.152 3.928 17355
3651 1 8 . 1 1 89 89 GLU HA H 89 4.047 4.047 4.076 -0.029 17355
3652 1 8 . 1 1 89 89 GLU CA C 89 58.858 58.858 58.602 0.256 17355
3653 1 8 . 1 1 89 89 GLU CB C 89 29.912 29.912 29.235 0.677 17355
3654 1 8 . 1 1 89 89 GLU H H 89 8.222 8.222 7.816 0.406 17355
3655 1 8 . 1 1 90 90 ARG N N 90 117.834 117.834 118.289 -0.455 17355
3656 1 8 . 1 1 90 90 ARG HA H 90 4.212 4.212 4.197 0.015 17355
3657 1 8 . 1 1 90 90 ARG CA C 90 57.409 57.409 58.127 -0.718 17355
3658 1 8 . 1 1 90 90 ARG CB C 90 30.906 30.906 30.913 -0.007 17355
3659 1 8 . 1 1 90 90 ARG H H 90 7.924 7.924 7.476 0.448 17355
3660 1 8 . 1 1 91 91 GLU N N 91 118.786 118.786 116.327 2.459 17355
3661 1 8 . 1 1 91 91 GLU HA H 91 4.254 4.254 4.366 -0.112 17355
3662 1 8 . 1 1 91 91 GLU CA C 91 56.693 56.693 56.783 -0.090 17355
3663 1 8 . 1 1 91 91 GLU CB C 91 30.416 30.416 30.799 -0.383 17355
3664 1 8 . 1 1 91 91 GLU H H 91 7.749 7.749 7.615 0.134 17355
3665 1 8 . 1 1 92 92 ALA N N 92 125.247 125.247 127.377 -2.130 17355
3666 1 8 . 1 1 92 92 ALA HA H 92 4.551 4.551 4.449 0.102 17355
3667 1 8 . 1 1 92 92 ALA CA C 92 51.073 51.073 52.575 -1.502 17355
3668 1 8 . 1 1 92 92 ALA CB C 92 18.443 18.443 17.818 0.625 17355
3669 1 8 . 1 1 92 92 ALA H H 92 7.888 7.888 8.454 -0.566 17355
3670 1 8 . 1 1 93 93 PRO HA H 93 4.383 4.383 4.491 -0.108 17355
3671 1 8 . 1 1 93 93 PRO CA C 93 63.744 63.744 62.792 0.952 17355
3672 1 8 . 1 1 93 93 PRO CB C 93 32.122 32.122 32.181 -0.059 17355
3673 1 8 . 1 1 94 94 HIS N N 94 118.597 118.597 116.063 2.534 17355
3674 1 8 . 1 1 94 94 HIS HA H 94 4.639 4.639 4.836 -0.197 17355
3675 1 8 . 1 1 94 94 HIS CA C 94 56.044 56.044 55.837 0.207 17355
3676 1 8 . 1 1 94 94 HIS CB C 94 29.789 29.789 29.713 0.076 17355
3677 1 8 . 1 1 94 94 HIS H H 94 8.392 8.392 8.355 0.037 17355
3678 1 8 . 1 1 95 95 LEU N N 95 123.443 123.443 119.149 4.294 17355
3679 1 8 . 1 1 95 95 LEU HA H 95 4.287 4.287 4.749 -0.462 17355
3680 1 8 . 1 1 95 95 LEU CA C 95 55.233 55.233 53.838 1.395 17355
3681 1 8 . 1 1 95 95 LEU CB C 95 42.710 42.710 44.014 -1.304 17355
3682 1 8 . 1 1 95 95 LEU H H 95 8.061 8.061 7.608 0.453 17355
3683 1 8 . 1 1 96 96 GLU N N 96 121.295 121.295 118.682 2.613 17355
3684 1 8 . 1 1 96 96 GLU HA H 96 4.176 4.176 4.661 -0.485 17355
3685 1 8 . 1 1 96 96 GLU CA C 96 56.706 56.706 55.634 1.072 17355
3686 1 8 . 1 1 96 96 GLU CB C 96 30.319 30.319 31.254 -0.935 17355
3687 1 8 . 1 1 96 96 GLU H H 96 8.346 8.346 8.289 0.057 17355
3688 1 8 . 1 1 97 97 HIS N N 97 119.932 119.932 120.319 -0.387 17355
3689 1 8 . 1 1 97 97 HIS HA H 97 4.555 4.555 4.725 -0.170 17355
3690 1 8 . 1 1 97 97 HIS CA C 97 56.042 56.042 56.674 -0.632 17355
3691 1 8 . 1 1 97 97 HIS H H 97 8.251 8.251 8.497 -0.246 17355
3692 1 8 . 1 1 98 98 HIS N N 98 125.446 125.446 117.495 7.951 17355
3693 1 8 . 1 1 98 98 HIS HA H 98 4.363 4.363 4.416 -0.053 17355
3694 1 8 . 1 1 98 98 HIS CA C 98 57.303 57.303 56.969 0.334 17355
3695 1 8 . 1 1 98 98 HIS CB C 98 30.319 30.319 28.328 1.991 17355
3696 1 8 . 1 1 98 98 HIS H H 98 8.054 8.054 8.811 -0.757 17355
3697 1 9 . 1 1 3 3 ARG HA H 3 4.321 4.321 4.654 -0.333 17355
3698 1 9 . 1 1 3 3 ARG CA C 3 56.560 56.560 55.881 0.679 17355
3699 1 9 . 1 1 4 4 ALA N N 4 125.797 125.797 124.936 0.861 17355
3700 1 9 . 1 1 4 4 ALA HA H 4 4.283 4.283 4.448 -0.165 17355
3701 1 9 . 1 1 4 4 ALA CA C 4 52.900 52.900 51.986 0.915 17355
3702 1 9 . 1 1 4 4 ALA CB C 4 19.411 19.411 20.180 -0.769 17355
3703 1 9 . 1 1 4 4 ALA H H 4 8.563 8.563 8.560 0.003 17355
3704 1 9 . 1 1 5 5 ASP N N 5 118.416 118.416 121.922 -3.506 17355
3705 1 9 . 1 1 5 5 ASP HA H 5 4.584 4.584 4.587 -0.003 17355
3706 1 9 . 1 1 5 5 ASP CA C 5 54.337 54.337 55.237 -0.900 17355
3707 1 9 . 1 1 5 5 ASP CB C 5 41.186 41.186 39.365 1.821 17355
3708 1 9 . 1 1 5 5 ASP H H 5 8.208 8.208 8.404 -0.196 17355
3709 1 9 . 1 1 6 6 ASP N N 6 120.632 120.632 119.009 1.623 17355
3710 1 9 . 1 1 6 6 ASP HA H 6 4.578 4.578 4.705 -0.127 17355
3711 1 9 . 1 1 6 6 ASP CA C 6 54.589 54.589 52.886 1.703 17355
3712 1 9 . 1 1 6 6 ASP CB C 6 41.239 41.239 42.180 -0.941 17355
3713 1 9 . 1 1 6 6 ASP H H 6 8.140 8.140 8.049 0.092 17355
3714 1 9 . 1 1 7 7 THR N N 7 113.693 113.693 112.016 1.677 17355
3715 1 9 . 1 1 7 7 THR HA H 7 4.245 4.245 4.158 0.087 17355
3716 1 9 . 1 1 7 7 THR CA C 7 62.392 62.392 63.713 -1.321 17355
3717 1 9 . 1 1 7 7 THR CB C 7 69.721 69.721 68.121 1.601 17355
3718 1 9 . 1 1 7 7 THR H H 7 8.045 8.045 8.327 -0.282 17355
3719 1 9 . 1 1 8 8 ALA N N 8 126.414 126.414 128.871 -2.457 17355
3720 1 9 . 1 1 8 8 ALA HA H 8 4.314 4.314 4.337 -0.023 17355
3721 1 9 . 1 1 8 8 ALA CA C 8 52.253 52.253 52.641 -0.388 17355
3722 1 9 . 1 1 8 8 ALA CB C 8 19.464 19.464 20.144 -0.680 17355
3723 1 9 . 1 1 8 8 ALA H H 8 8.139 8.139 8.703 -0.564 17355
3724 1 9 . 1 1 9 9 LEU N N 9 122.921 122.921 119.741 3.180 17355
3725 1 9 . 1 1 9 9 LEU HA H 9 4.559 4.559 4.632 -0.073 17355
3726 1 9 . 1 1 9 9 LEU CA C 9 53.088 53.088 55.814 -2.726 17355
3727 1 9 . 1 1 9 9 LEU CB C 9 41.929 41.929 42.081 -0.152 17355
3728 1 9 . 1 1 9 9 LEU H H 9 8.113 8.113 7.928 0.185 17355
3729 1 9 . 1 1 10 10 PRO HA H 10 4.367 4.367 4.515 -0.148 17355
3730 1 9 . 1 1 10 10 PRO CA C 10 63.373 63.373 63.024 0.349 17355
3731 1 9 . 1 1 10 10 PRO CB C 10 31.975 31.975 32.236 -0.261 17355
3732 1 9 . 1 1 11 11 ALA N N 11 124.349 124.349 124.918 -0.569 17355
3733 1 9 . 1 1 11 11 ALA HA H 11 4.262 4.262 4.657 -0.396 17355
3734 1 9 . 1 1 11 11 ALA CA C 11 52.496 52.496 51.805 0.691 17355
3735 1 9 . 1 1 11 11 ALA CB C 11 19.424 19.424 21.085 -1.661 17355
3736 1 9 . 1 1 11 11 ALA H H 11 8.317 8.317 8.141 0.176 17355
3737 1 9 . 1 1 12 12 ALA N N 12 123.291 123.291 123.357 -0.066 17355
3738 1 9 . 1 1 12 12 ALA HA H 12 4.380 4.380 4.316 0.064 17355
3739 1 9 . 1 1 12 12 ALA CA C 12 52.461 52.461 52.872 -0.411 17355
3740 1 9 . 1 1 12 12 ALA CB C 12 19.557 19.557 18.717 0.840 17355
3741 1 9 . 1 1 12 12 ALA H H 12 8.287 8.287 8.162 0.125 17355
3742 1 9 . 1 1 13 13 THR N N 13 112.758 112.758 113.509 -0.751 17355
3743 1 9 . 1 1 13 13 THR HA H 13 4.350 4.350 4.169 0.181 17355
3744 1 9 . 1 1 13 13 THR CA C 13 62.074 62.074 62.867 -0.793 17355
3745 1 9 . 1 1 13 13 THR CB C 13 70.070 70.070 67.774 2.296 17355
3746 1 9 . 1 1 13 13 THR H H 13 8.074 8.074 8.168 -0.094 17355
3747 1 9 . 1 1 14 14 GLY N N 14 110.774 110.774 108.560 2.214 17355
3748 1 9 . 1 1 14 14 GLY CA C 14 45.692 45.692 44.922 0.770 17355
3749 1 9 . 1 1 14 14 GLY H H 14 8.405 8.405 8.134 0.271 17355
3750 1 9 . 1 1 15 15 ALA N N 15 124.127 124.127 127.873 -3.746 17355
3751 1 9 . 1 1 15 15 ALA HA H 15 4.137 4.137 3.877 0.260 17355
3752 1 9 . 1 1 15 15 ALA CA C 15 55.368 55.368 54.129 1.240 17355
3753 1 9 . 1 1 15 15 ALA CB C 15 20.100 20.100 17.773 2.327 17355
3754 1 9 . 1 1 15 15 ALA H H 15 8.866 8.866 8.367 0.499 17355
3755 1 9 . 1 1 16 16 LEU N N 16 118.013 118.013 120.270 -2.257 17355
3756 1 9 . 1 1 16 16 LEU HA H 16 3.870 3.870 4.038 -0.168 17355
3757 1 9 . 1 1 16 16 LEU CA C 16 58.820 58.820 58.239 0.581 17355
3758 1 9 . 1 1 16 16 LEU CB C 16 41.332 41.332 40.982 0.350 17355
3759 1 9 . 1 1 16 16 LEU H H 16 8.414 8.414 8.399 0.015 17355
3760 1 9 . 1 1 17 17 GLU N N 17 117.730 117.730 117.391 0.339 17355
3761 1 9 . 1 1 17 17 GLU HA H 17 3.978 3.978 4.180 -0.202 17355
3762 1 9 . 1 1 17 17 GLU CA C 17 59.909 59.909 58.103 1.806 17355
3763 1 9 . 1 1 17 17 GLU CB C 17 29.212 29.212 28.781 0.431 17355
3764 1 9 . 1 1 17 17 GLU H H 17 8.088 8.088 8.382 -0.294 17355
3765 1 9 . 1 1 18 18 LEU N N 18 121.355 121.355 119.836 1.519 17355
3766 1 9 . 1 1 18 18 LEU HA H 18 4.165 4.165 4.142 0.023 17355
3767 1 9 . 1 1 18 18 LEU CA C 18 58.469 58.469 57.951 0.518 17355
3768 1 9 . 1 1 18 18 LEU CB C 18 42.459 42.459 42.196 0.263 17355
3769 1 9 . 1 1 18 18 LEU H H 18 7.767 7.767 7.603 0.164 17355
3770 1 9 . 1 1 19 19 VAL N N 19 118.522 118.522 116.602 1.920 17355
3771 1 9 . 1 1 19 19 VAL HA H 19 3.424 3.424 3.801 -0.377 17355
3772 1 9 . 1 1 19 19 VAL CA C 19 67.958 67.958 66.460 1.498 17355
3773 1 9 . 1 1 19 19 VAL CB C 19 31.922 31.922 31.830 0.092 17355
3774 1 9 . 1 1 19 19 VAL H H 19 8.661 8.661 7.856 0.805 17355
3775 1 9 . 1 1 20 20 ARG N N 20 117.959 117.959 118.061 -0.102 17355
3776 1 9 . 1 1 20 20 ARG HA H 20 3.576 3.576 4.268 -0.692 17355
3777 1 9 . 1 1 20 20 ARG CA C 20 60.994 60.994 56.964 4.030 17355
3778 1 9 . 1 1 20 20 ARG CB C 20 30.703 30.703 27.955 2.748 17355
3779 1 9 . 1 1 20 20 ARG H H 20 8.705 8.705 8.355 0.350 17355
3780 1 9 . 1 1 21 21 HIS N N 21 115.245 115.245 116.970 -1.725 17355
3781 1 9 . 1 1 21 21 HIS HA H 21 4.144 4.144 4.568 -0.424 17355
3782 1 9 . 1 1 21 21 HIS CA C 21 60.536 60.536 56.914 3.622 17355
3783 1 9 . 1 1 21 21 HIS CB C 21 29.099 29.099 32.797 -3.698 17355
3784 1 9 . 1 1 21 21 HIS H H 21 7.811 7.811 8.445 -0.634 17355
3785 1 9 . 1 1 22 22 LEU N N 22 119.884 119.884 120.325 -0.441 17355
3786 1 9 . 1 1 22 22 LEU HA H 22 4.078 4.078 4.132 -0.054 17355
3787 1 9 . 1 1 22 22 LEU CA C 22 58.164 58.164 57.582 0.582 17355
3788 1 9 . 1 1 22 22 LEU CB C 22 42.889 42.889 41.633 1.256 17355
3789 1 9 . 1 1 22 22 LEU H H 22 8.301 8.301 7.920 0.381 17355
3790 1 9 . 1 1 23 23 VAL N N 23 119.391 119.391 119.121 0.270 17355
3791 1 9 . 1 1 23 23 VAL HA H 23 3.429 3.429 3.705 -0.276 17355
3792 1 9 . 1 1 23 23 VAL CA C 23 67.179 67.179 66.619 0.560 17355
3793 1 9 . 1 1 23 23 VAL CB C 23 31.366 31.366 31.238 0.128 17355
3794 1 9 . 1 1 23 23 VAL H H 23 8.897 8.897 7.427 1.470 17355
3795 1 9 . 1 1 24 24 ALA N N 24 121.610 121.610 122.760 -1.150 17355
3796 1 9 . 1 1 24 24 ALA HA H 24 3.851 3.851 3.981 -0.130 17355
3797 1 9 . 1 1 24 24 ALA CA C 24 55.944 55.944 55.211 0.733 17355
3798 1 9 . 1 1 24 24 ALA CB C 24 18.042 18.042 18.425 -0.383 17355
3799 1 9 . 1 1 24 24 ALA H H 24 8.276 8.276 8.367 -0.091 17355
3800 1 9 . 1 1 25 25 GLU N N 25 114.822 114.822 116.330 -1.508 17355
3801 1 9 . 1 1 25 25 GLU HA H 25 4.042 4.042 4.282 -0.240 17355
3802 1 9 . 1 1 25 25 GLU CA C 25 59.255 59.255 58.377 0.878 17355
3803 1 9 . 1 1 25 25 GLU CB C 25 29.951 29.951 29.211 0.740 17355
3804 1 9 . 1 1 25 25 GLU H H 25 7.693 7.693 8.032 -0.339 17355
3805 1 9 . 1 1 26 26 ARG N N 26 118.510 118.510 118.462 0.048 17355
3806 1 9 . 1 1 26 26 ARG HA H 26 4.252 4.252 4.325 -0.073 17355
3807 1 9 . 1 1 26 26 ARG CA C 26 57.090 57.090 56.266 0.824 17355
3808 1 9 . 1 1 26 26 ARG CB C 26 30.080 30.080 30.374 -0.294 17355
3809 1 9 . 1 1 26 26 ARG H H 26 7.783 7.783 7.583 0.200 17355
3810 1 9 . 1 1 27 27 ALA N N 27 120.375 120.375 121.300 -0.925 17355
3811 1 9 . 1 1 27 27 ALA HA H 27 4.342 4.342 4.427 -0.085 17355
3812 1 9 . 1 1 27 27 ALA CA C 27 52.134 52.134 52.964 -0.830 17355
3813 1 9 . 1 1 27 27 ALA CB C 27 19.283 19.283 21.160 -1.877 17355
3814 1 9 . 1 1 27 27 ALA H H 27 8.638 8.638 7.998 0.640 17355
3815 1 9 . 1 1 28 28 GLU N N 28 115.494 115.494 116.335 -0.841 17355
3816 1 9 . 1 1 28 28 GLU HA H 28 3.873 3.873 4.405 -0.532 17355
3817 1 9 . 1 1 28 28 GLU CA C 28 56.940 56.940 57.161 -0.221 17355
3818 1 9 . 1 1 28 28 GLU CB C 28 27.058 27.058 30.676 -3.618 17355
3819 1 9 . 1 1 28 28 GLU H H 28 7.734 7.734 8.088 -0.354 17355
3820 1 9 . 1 1 29 29 LEU N N 29 119.978 119.978 120.756 -0.778 17355
3821 1 9 . 1 1 29 29 LEU HA H 29 4.898 4.898 4.982 -0.084 17355
3822 1 9 . 1 1 29 29 LEU CA C 29 51.498 51.498 51.650 -0.152 17355
3823 1 9 . 1 1 29 29 LEU CB C 29 45.348 45.348 45.532 -0.184 17355
3824 1 9 . 1 1 29 29 LEU H H 29 8.075 8.075 8.247 -0.172 17355
3825 1 9 . 1 1 30 30 PRO HA H 30 4.461 4.461 4.465 -0.004 17355
3826 1 9 . 1 1 30 30 PRO CA C 30 62.524 62.524 62.841 -0.317 17355
3827 1 9 . 1 1 30 30 PRO CB C 30 32.015 32.015 30.185 1.830 17355
3828 1 9 . 1 1 31 31 VAL N N 31 123.773 123.773 120.723 3.050 17355
3829 1 9 . 1 1 31 31 VAL HA H 31 3.540 3.540 3.866 -0.326 17355
3830 1 9 . 1 1 31 31 VAL CA C 31 65.493 65.493 64.170 1.323 17355
3831 1 9 . 1 1 31 31 VAL CB C 31 31.865 31.865 31.578 0.286 17355
3832 1 9 . 1 1 31 31 VAL H H 31 8.432 8.432 8.236 0.196 17355
3833 1 9 . 1 1 32 32 GLU N N 32 117.215 117.215 122.884 -5.669 17355
3834 1 9 . 1 1 32 32 GLU HA H 32 4.053 4.053 4.685 -0.632 17355
3835 1 9 . 1 1 32 32 GLU CA C 32 59.131 59.131 56.661 2.470 17355
3836 1 9 . 1 1 32 32 GLU CB C 32 28.781 28.781 30.459 -1.678 17355
3837 1 9 . 1 1 32 32 GLU H H 32 8.971 8.971 8.351 0.620 17355
3838 1 9 . 1 1 33 33 VAL N N 33 113.611 113.611 122.805 -9.194 17355
3839 1 9 . 1 1 33 33 VAL HA H 33 4.214 4.214 4.181 0.033 17355
3840 1 9 . 1 1 33 33 VAL CA C 33 61.795 61.795 61.664 0.131 17355
3841 1 9 . 1 1 33 33 VAL CB C 33 32.094 32.094 30.322 1.772 17355
3842 1 9 . 1 1 33 33 VAL H H 33 7.470 7.470 8.172 -0.702 17355
3843 1 9 . 1 1 34 34 LEU N N 34 123.533 123.533 125.813 -2.280 17355
3844 1 9 . 1 1 34 34 LEU HA H 34 4.114 4.114 4.758 -0.644 17355
3845 1 9 . 1 1 34 34 LEU CA C 34 54.877 54.877 53.493 1.384 17355
3846 1 9 . 1 1 34 34 LEU CB C 34 42.590 42.590 43.675 -1.085 17355
3847 1 9 . 1 1 34 34 LEU H H 34 7.300 7.300 7.861 -0.561 17355
3848 1 9 . 1 1 35 35 ARG N N 35 125.820 125.820 125.483 0.337 17355
3849 1 9 . 1 1 35 35 ARG HA H 35 4.578 4.578 4.200 0.378 17355
3850 1 9 . 1 1 35 35 ARG CA C 35 54.619 54.619 57.096 -2.477 17355
3851 1 9 . 1 1 35 35 ARG CB C 35 31.909 31.909 30.727 1.182 17355
3852 1 9 . 1 1 35 35 ARG H H 35 8.415 8.415 8.492 -0.077 17355
3853 1 9 . 1 1 36 36 ASP N N 36 123.211 123.211 115.394 7.817 17355
3854 1 9 . 1 1 36 36 ASP HA H 36 4.156 4.156 4.635 -0.479 17355
3855 1 9 . 1 1 36 36 ASP CA C 36 57.258 57.258 55.368 1.890 17355
3856 1 9 . 1 1 36 36 ASP CB C 36 40.400 40.400 41.635 -1.235 17355
3857 1 9 . 1 1 36 36 ASP H H 36 8.880 8.880 8.527 0.353 17355
3858 1 9 . 1 1 37 37 ASP N N 37 112.390 112.390 118.536 -6.146 17355
3859 1 9 . 1 1 37 37 ASP HA H 37 4.614 4.614 4.710 -0.096 17355
3860 1 9 . 1 1 37 37 ASP CA C 37 52.651 52.651 53.486 -0.835 17355
3861 1 9 . 1 1 37 37 ASP CB C 37 40.100 40.100 40.929 -0.829 17355
3862 1 9 . 1 1 37 37 ASP H H 37 7.800 7.800 8.125 -0.325 17355
3863 1 9 . 1 1 38 38 SER N N 38 116.534 116.534 116.280 0.254 17355
3864 1 9 . 1 1 38 38 SER HA H 38 4.147 4.147 4.344 -0.197 17355
3865 1 9 . 1 1 38 38 SER CA C 38 61.186 61.186 58.080 3.106 17355
3866 1 9 . 1 1 38 38 SER CB C 38 63.946 63.946 62.537 1.409 17355
3867 1 9 . 1 1 38 38 SER H H 38 7.376 7.376 7.989 -0.613 17355
3868 1 9 . 1 1 39 39 ARG N N 39 124.337 124.337 125.413 -1.076 17355
3869 1 9 . 1 1 39 39 ARG HA H 39 4.521 4.521 4.131 0.390 17355
3870 1 9 . 1 1 39 39 ARG CA C 39 55.049 55.049 56.096 -1.047 17355
3871 1 9 . 1 1 39 39 ARG CB C 39 30.723 30.723 30.803 -0.080 17355
3872 1 9 . 1 1 39 39 ARG H H 39 10.095 10.095 7.751 2.344 17355
3873 1 9 . 1 1 40 40 PHE N N 40 122.834 122.834 117.350 5.484 17355
3874 1 9 . 1 1 40 40 PHE HA H 40 3.916 3.916 4.744 -0.828 17355
3875 1 9 . 1 1 40 40 PHE CA C 40 62.869 62.869 58.600 4.269 17355
3876 1 9 . 1 1 40 40 PHE CB C 40 39.662 39.662 37.860 1.802 17355
3877 1 9 . 1 1 40 40 PHE H H 40 7.498 7.498 8.219 -0.721 17355
3878 1 9 . 1 1 41 41 LEU N N 41 117.682 117.682 117.661 0.021 17355
3879 1 9 . 1 1 41 41 LEU HA H 41 4.519 4.519 4.163 0.356 17355
3880 1 9 . 1 1 41 41 LEU CA C 41 58.111 58.111 55.768 2.343 17355
3881 1 9 . 1 1 41 41 LEU CB C 41 41.087 41.087 42.901 -1.814 17355
3882 1 9 . 1 1 41 41 LEU H H 41 8.619 8.619 7.634 0.985 17355
3883 1 9 . 1 1 42 42 ASP N N 42 114.800 114.800 119.825 -5.025 17355
3884 1 9 . 1 1 42 42 ASP HA H 42 4.185 4.185 4.414 -0.229 17355
3885 1 9 . 1 1 42 42 ASP CA C 42 57.713 57.713 55.619 2.094 17355
3886 1 9 . 1 1 42 42 ASP CB C 42 41.206 41.206 40.934 0.272 17355
3887 1 9 . 1 1 42 42 ASP H H 42 8.239 8.239 8.089 0.150 17355
3888 1 9 . 1 1 43 43 ASP N N 43 111.125 111.125 119.685 -8.560 17355
3889 1 9 . 1 1 43 43 ASP HA H 43 4.915 4.915 4.490 0.425 17355
3890 1 9 . 1 1 43 43 ASP CA C 43 56.105 56.105 56.220 -0.115 17355
3891 1 9 . 1 1 43 43 ASP CB C 43 41.703 41.703 40.739 0.965 17355
3892 1 9 . 1 1 43 43 ASP H H 43 7.355 7.355 8.343 -0.988 17355
3893 1 9 . 1 1 44 44 LEU N N 44 114.924 114.924 117.948 -3.024 17355
3894 1 9 . 1 1 44 44 LEU HA H 44 4.273 4.273 4.094 0.179 17355
3895 1 9 . 1 1 44 44 LEU CA C 44 54.480 54.480 56.614 -2.134 17355
3896 1 9 . 1 1 44 44 LEU CB C 44 41.671 41.671 42.595 -0.924 17355
3897 1 9 . 1 1 44 44 LEU H H 44 7.172 7.172 7.614 -0.442 17355
3898 1 9 . 1 1 45 45 HIS N N 45 114.429 114.429 116.791 -2.362 17355
3899 1 9 . 1 1 45 45 HIS HA H 45 4.581 4.581 4.374 0.207 17355
3900 1 9 . 1 1 45 45 HIS CA C 45 56.189 56.189 57.023 -0.834 17355
3901 1 9 . 1 1 45 45 HIS CB C 45 26.073 26.073 28.204 -2.131 17355
3902 1 9 . 1 1 45 45 HIS H H 45 7.308 7.308 7.913 -0.605 17355
3903 1 9 . 1 1 46 46 MET N N 46 118.597 118.597 122.387 -3.790 17355
3904 1 9 . 1 1 46 46 MET HA H 46 4.614 4.614 4.821 -0.207 17355
3905 1 9 . 1 1 46 46 MET CA C 46 55.646 55.646 54.962 0.684 17355
3906 1 9 . 1 1 46 46 MET CB C 46 35.501 35.501 37.308 -1.807 17355
3907 1 9 . 1 1 46 46 MET H H 46 8.618 8.618 8.253 0.365 17355
3908 1 9 . 1 1 47 47 SER N N 47 116.110 116.110 113.702 2.408 17355
3909 1 9 . 1 1 47 47 SER HA H 47 4.559 4.559 4.956 -0.397 17355
3910 1 9 . 1 1 47 47 SER CA C 47 56.696 56.696 56.785 -0.089 17355
3911 1 9 . 1 1 47 47 SER CB C 47 65.888 65.888 65.824 0.064 17355
3912 1 9 . 1 1 47 47 SER H H 47 8.446 8.446 8.281 0.165 17355
3913 1 9 . 1 1 48 48 SER N N 48 116.756 116.756 117.264 -0.508 17355
3914 1 9 . 1 1 48 48 SER HA H 48 3.701 3.701 4.123 -0.422 17355
3915 1 9 . 1 1 48 48 SER CA C 48 62.260 62.260 62.224 0.036 17355
3916 1 9 . 1 1 48 48 SER CB C 48 62.289 62.289 63.090 -0.801 17355
3917 1 9 . 1 1 48 48 SER H H 48 8.948 8.948 8.733 0.215 17355
3918 1 9 . 1 1 49 49 ILE N N 49 122.227 122.227 121.093 1.134 17355
3919 1 9 . 1 1 49 49 ILE HA H 49 3.806 3.806 3.880 -0.074 17355
3920 1 9 . 1 1 49 49 ILE CA C 49 64.215 64.215 64.705 -0.490 17355
3921 1 9 . 1 1 49 49 ILE CB C 49 38.059 38.059 36.093 1.966 17355
3922 1 9 . 1 1 49 49 ILE H H 49 7.595 7.595 8.038 -0.443 17355
3923 1 9 . 1 1 50 50 THR N N 50 120.233 120.233 115.890 4.343 17355
3924 1 9 . 1 1 50 50 THR HA H 50 3.878 3.878 3.982 -0.104 17355
3925 1 9 . 1 1 50 50 THR CA C 50 66.427 66.427 66.246 0.182 17355
3926 1 9 . 1 1 50 50 THR CB C 50 68.223 68.223 68.244 -0.021 17355
3927 1 9 . 1 1 50 50 THR H H 50 7.539 7.539 7.884 -0.345 17355
3928 1 9 . 1 1 51 51 VAL N N 51 121.320 121.320 120.310 1.010 17355
3929 1 9 . 1 1 51 51 VAL HA H 51 3.090 3.090 3.561 -0.471 17355
3930 1 9 . 1 1 51 51 VAL CA C 51 67.440 67.440 66.921 0.519 17355
3931 1 9 . 1 1 51 51 VAL CB C 51 31.087 31.087 31.316 -0.229 17355
3932 1 9 . 1 1 51 51 VAL H H 51 8.178 8.178 8.691 -0.513 17355
3933 1 9 . 1 1 52 52 GLY N N 52 105.968 105.968 105.786 0.182 17355
3934 1 9 . 1 1 52 52 GLY CA C 52 47.339 47.339 46.337 1.002 17355
3935 1 9 . 1 1 52 52 GLY H H 52 8.004 8.004 7.843 0.161 17355
3936 1 9 . 1 1 53 53 GLN N N 53 120.486 120.486 118.122 2.364 17355
3937 1 9 . 1 1 53 53 GLN HA H 53 4.086 4.086 4.277 -0.191 17355
3938 1 9 . 1 1 53 53 GLN CA C 53 58.919 58.919 56.885 2.034 17355
3939 1 9 . 1 1 53 53 GLN CB C 53 27.867 27.867 29.469 -1.602 17355
3940 1 9 . 1 1 53 53 GLN H H 53 7.675 7.675 7.633 0.042 17355
3941 1 9 . 1 1 54 54 LEU N N 54 121.901 121.901 116.150 5.751 17355
3942 1 9 . 1 1 54 54 LEU HA H 54 4.049 4.049 4.548 -0.499 17355
3943 1 9 . 1 1 54 54 LEU CA C 54 58.661 58.661 56.775 1.887 17355
3944 1 9 . 1 1 54 54 LEU CB C 54 42.426 42.426 42.361 0.065 17355
3945 1 9 . 1 1 54 54 LEU H H 54 8.038 8.038 7.226 0.812 17355
3946 1 9 . 1 1 55 55 VAL N N 55 119.226 119.226 120.904 -1.678 17355
3947 1 9 . 1 1 55 55 VAL HA H 55 3.543 3.543 3.690 -0.147 17355
3948 1 9 . 1 1 55 55 VAL CA C 55 66.871 66.871 64.871 2.000 17355
3949 1 9 . 1 1 55 55 VAL CB C 55 31.392 31.392 31.036 0.356 17355
3950 1 9 . 1 1 55 55 VAL H H 55 8.375 8.375 8.511 -0.136 17355
3951 1 9 . 1 1 56 56 ASN N N 56 117.987 117.987 117.310 0.677 17355
3952 1 9 . 1 1 56 56 ASN HA H 56 4.473 4.473 4.501 -0.028 17355
3953 1 9 . 1 1 56 56 ASN CA C 56 56.557 56.557 55.250 1.307 17355
3954 1 9 . 1 1 56 56 ASN CB C 56 38.509 38.509 38.340 0.169 17355
3955 1 9 . 1 1 56 56 ASN H H 56 7.521 7.521 8.387 -0.866 17355
3956 1 9 . 1 1 57 57 GLU N N 57 121.765 121.765 119.976 1.789 17355
3957 1 9 . 1 1 57 57 GLU HA H 57 4.070 4.070 4.242 -0.172 17355
3958 1 9 . 1 1 57 57 GLU CA C 57 59.496 59.496 58.512 0.984 17355
3959 1 9 . 1 1 57 57 GLU CB C 57 29.395 29.395 29.801 -0.406 17355
3960 1 9 . 1 1 57 57 GLU H H 57 8.225 8.225 7.641 0.584 17355
3961 1 9 . 1 1 58 58 ALA N N 58 123.779 123.779 121.886 1.893 17355
3962 1 9 . 1 1 58 58 ALA HA H 58 3.874 3.874 4.268 -0.394 17355
3963 1 9 . 1 1 58 58 ALA CA C 58 55.227 55.227 54.925 0.302 17355
3964 1 9 . 1 1 58 58 ALA CB C 58 18.388 18.388 18.309 0.079 17355
3965 1 9 . 1 1 58 58 ALA H H 58 8.659 8.659 7.445 1.214 17355
3966 1 9 . 1 1 59 59 ALA N N 59 118.656 118.656 122.050 -3.394 17355
3967 1 9 . 1 1 59 59 ALA HA H 59 3.819 3.819 3.961 -0.142 17355
3968 1 9 . 1 1 59 59 ALA CA C 59 55.871 55.871 55.169 0.702 17355
3969 1 9 . 1 1 59 59 ALA CB C 59 18.152 18.152 18.547 -0.395 17355
3970 1 9 . 1 1 59 59 ALA H H 59 8.537 8.537 7.676 0.861 17355
3971 1 9 . 1 1 60 60 ARG N N 60 117.701 117.701 118.657 -0.956 17355
3972 1 9 . 1 1 60 60 ARG HA H 60 4.096 4.096 3.960 0.136 17355
3973 1 9 . 1 1 60 60 ARG CA C 60 59.609 59.609 58.908 0.701 17355
3974 1 9 . 1 1 60 60 ARG CB C 60 29.974 29.974 29.261 0.713 17355
3975 1 9 . 1 1 60 60 ARG H H 60 7.923 7.923 7.735 0.188 17355
3976 1 9 . 1 1 61 61 ALA N N 61 123.271 123.271 121.335 1.936 17355
3977 1 9 . 1 1 61 61 ALA HA H 61 4.137 4.137 4.229 -0.092 17355
3978 1 9 . 1 1 61 61 ALA CA C 61 54.912 54.912 54.050 0.862 17355
3979 1 9 . 1 1 61 61 ALA CB C 61 18.304 18.304 18.547 -0.243 17355
3980 1 9 . 1 1 61 61 ALA H H 61 8.044 8.044 7.502 0.542 17355
3981 1 9 . 1 1 62 62 MET N N 62 114.725 114.725 117.275 -2.550 17355
3982 1 9 . 1 1 62 62 MET HA H 62 4.297 4.297 4.187 0.110 17355
3983 1 9 . 1 1 62 62 MET CA C 62 56.392 56.392 57.462 -1.071 17355
3984 1 9 . 1 1 62 62 MET CB C 62 34.827 34.827 33.252 1.575 17355
3985 1 9 . 1 1 62 62 MET H H 62 7.710 7.710 8.149 -0.439 17355
3986 1 9 . 1 1 63 63 GLY N N 63 108.268 108.268 106.359 1.909 17355
3987 1 9 . 1 1 63 63 GLY CA C 63 46.079 46.079 45.595 0.484 17355
3988 1 9 . 1 1 63 63 GLY H H 63 7.846 7.846 7.954 -0.108 17355
3989 1 9 . 1 1 64 64 LEU N N 64 119.547 119.547 120.068 -0.521 17355
3990 1 9 . 1 1 64 64 LEU HA H 64 4.526 4.526 4.603 -0.077 17355
3991 1 9 . 1 1 64 64 LEU CA C 64 53.605 53.605 55.609 -2.004 17355
3992 1 9 . 1 1 64 64 LEU CB C 64 43.784 43.784 42.452 1.332 17355
3993 1 9 . 1 1 64 64 LEU H H 64 8.183 8.183 7.600 0.583 17355
3994 1 9 . 1 1 65 65 SER N N 65 115.418 115.418 114.240 1.178 17355
3995 1 9 . 1 1 65 65 SER HA H 65 4.328 4.328 4.123 0.205 17355
3996 1 9 . 1 1 65 65 SER CA C 65 58.319 58.319 59.973 -1.654 17355
3997 1 9 . 1 1 65 65 SER CB C 65 64.181 64.181 61.818 2.363 17355
3998 1 9 . 1 1 65 65 SER H H 65 8.302 8.302 8.469 -0.167 17355
3999 1 9 . 1 1 66 66 ALA N N 66 124.266 124.266 123.484 0.782 17355
4000 1 9 . 1 1 66 66 ALA HA H 66 4.212 4.212 4.464 -0.252 17355
4001 1 9 . 1 1 66 66 ALA CA C 66 52.624 52.624 52.811 -0.187 17355
4002 1 9 . 1 1 66 66 ALA CB C 66 19.309 19.309 19.490 -0.181 17355
4003 1 9 . 1 1 66 66 ALA H H 66 8.262 8.262 7.974 0.288 17355
4004 1 9 . 1 1 67 67 VAL N N 67 118.373 118.373 116.709 1.664 17355
4005 1 9 . 1 1 67 67 VAL HA H 67 4.049 4.049 4.050 -0.001 17355
4006 1 9 . 1 1 67 67 VAL CA C 67 62.010 62.010 63.511 -1.500 17355
4007 1 9 . 1 1 67 67 VAL CB C 67 33.495 33.495 32.319 1.176 17355
4008 1 9 . 1 1 67 67 VAL H H 67 7.949 7.949 7.313 0.636 17355
4009 1 9 . 1 1 68 68 ALA N N 68 127.696 127.696 120.006 7.690 17355
4010 1 9 . 1 1 68 68 ALA HA H 68 4.308 4.308 4.005 0.303 17355
4011 1 9 . 1 1 68 68 ALA CA C 68 52.070 52.070 54.394 -2.324 17355
4012 1 9 . 1 1 68 68 ALA CB C 68 19.220 19.220 17.660 1.560 17355
4013 1 9 . 1 1 68 68 ALA H H 68 8.319 8.319 8.229 0.090 17355
4014 1 9 . 1 1 69 69 MET N N 69 120.285 120.285 113.749 6.536 17355
4015 1 9 . 1 1 69 69 MET HA H 69 4.664 4.664 5.084 -0.420 17355
4016 1 9 . 1 1 69 69 MET CA C 69 53.004 53.004 53.303 -0.299 17355
4017 1 9 . 1 1 69 69 MET CB C 69 32.678 32.678 34.189 -1.511 17355
4018 1 9 . 1 1 69 69 MET H H 69 8.224 8.224 7.980 0.244 17355
4019 1 9 . 1 1 70 70 PRO HA H 70 4.446 4.446 4.418 0.028 17355
4020 1 9 . 1 1 70 70 PRO CA C 70 63.452 63.452 64.528 -1.076 17355
4021 1 9 . 1 1 70 70 PRO CB C 70 32.012 32.012 32.209 -0.197 17355
4022 1 9 . 1 1 71 71 THR N N 71 112.663 112.663 109.807 2.856 17355
4023 1 9 . 1 1 71 71 THR HA H 71 4.074 4.074 3.749 0.325 17355
4024 1 9 . 1 1 71 71 THR CA C 71 62.869 62.869 61.490 1.379 17355
4025 1 9 . 1 1 71 71 THR CB C 71 69.516 69.516 69.805 -0.289 17355
4026 1 9 . 1 1 71 71 THR H H 71 7.957 7.957 7.550 0.407 17355
4027 1 9 . 1 1 72 72 ASN N N 72 120.054 120.054 119.134 0.920 17355
4028 1 9 . 1 1 72 72 ASN HA H 72 4.695 4.695 3.962 0.733 17355
4029 1 9 . 1 1 72 72 ASN CA C 72 52.856 52.856 55.858 -3.002 17355
4030 1 9 . 1 1 72 72 ASN CB C 72 38.165 38.165 37.678 0.487 17355
4031 1 9 . 1 1 72 72 ASN H H 72 8.227 8.227 8.207 0.020 17355
4032 1 9 . 1 1 73 73 PHE N N 73 121.570 121.570 115.316 6.254 17355
4033 1 9 . 1 1 73 73 PHE HA H 73 4.342 4.342 3.741 0.601 17355
4034 1 9 . 1 1 73 73 PHE CA C 73 59.609 59.609 60.424 -0.815 17355
4035 1 9 . 1 1 73 73 PHE CB C 73 39.000 39.000 36.756 2.244 17355
4036 1 9 . 1 1 73 73 PHE H H 73 8.331 8.331 8.240 0.091 17355
4037 1 9 . 1 1 74 74 ALA N N 74 121.047 121.047 122.052 -1.005 17355
4038 1 9 . 1 1 74 74 ALA HA H 74 4.074 4.074 4.123 -0.049 17355
4039 1 9 . 1 1 74 74 ALA CA C 74 54.705 54.705 54.927 -0.222 17355
4040 1 9 . 1 1 74 74 ALA CB C 74 19.159 19.159 18.979 0.180 17355
4041 1 9 . 1 1 74 74 ALA H H 74 8.163 8.163 8.048 0.115 17355
4042 1 9 . 1 1 75 75 THR N N 75 104.824 104.824 114.179 -9.355 17355
4043 1 9 . 1 1 75 75 THR HA H 75 4.475 4.475 4.337 0.138 17355
4044 1 9 . 1 1 75 75 THR CA C 75 60.669 60.669 61.543 -0.874 17355
4045 1 9 . 1 1 75 75 THR CB C 75 69.543 69.543 66.861 2.682 17355
4046 1 9 . 1 1 75 75 THR H H 75 7.581 7.581 8.220 -0.639 17355
4047 1 9 . 1 1 76 76 ALA N N 76 124.548 124.548 126.000 -1.452 17355
4048 1 9 . 1 1 76 76 ALA HA H 76 4.714 4.714 4.886 -0.172 17355
4049 1 9 . 1 1 76 76 ALA CA C 76 52.929 52.929 50.539 2.390 17355
4050 1 9 . 1 1 76 76 ALA CB C 76 20.661 20.661 22.358 -1.697 17355
4051 1 9 . 1 1 76 76 ALA H H 76 7.689 7.689 8.037 -0.348 17355
4052 1 9 . 1 1 77 77 THR N N 77 108.654 108.654 110.577 -1.923 17355
4053 1 9 . 1 1 77 77 THR HA H 77 5.017 5.017 4.453 0.564 17355
4054 1 9 . 1 1 77 77 THR CA C 77 58.847 58.847 59.940 -1.093 17355
4055 1 9 . 1 1 77 77 THR CB C 77 73.369 73.369 71.863 1.506 17355
4056 1 9 . 1 1 77 77 THR H H 77 7.495 7.495 8.198 -0.703 17355
4057 1 9 . 1 1 78 78 VAL N N 78 120.107 120.107 117.223 2.884 17355
4058 1 9 . 1 1 78 78 VAL HA H 78 3.418 3.418 4.071 -0.653 17355
4059 1 9 . 1 1 78 78 VAL CA C 78 67.446 67.446 66.536 0.910 17355
4060 1 9 . 1 1 78 78 VAL CB C 78 31.949 31.949 31.599 0.350 17355
4061 1 9 . 1 1 78 78 VAL H H 78 7.373 7.373 7.713 -0.340 17355
4062 1 9 . 1 1 79 79 ARG N N 79 117.131 117.131 118.360 -1.229 17355
4063 1 9 . 1 1 79 79 ARG HA H 79 3.877 3.877 4.191 -0.314 17355
4064 1 9 . 1 1 79 79 ARG CA C 79 59.566 59.566 57.784 1.782 17355
4065 1 9 . 1 1 79 79 ARG CB C 79 30.174 30.174 29.611 0.563 17355
4066 1 9 . 1 1 79 79 ARG H H 79 8.518 8.518 7.976 0.542 17355
4067 1 9 . 1 1 80 80 GLU N N 80 118.542 118.542 120.822 -2.280 17355
4068 1 9 . 1 1 80 80 GLU HA H 80 4.033 4.033 4.181 -0.148 17355
4069 1 9 . 1 1 80 80 GLU CA C 80 59.427 59.427 59.398 0.029 17355
4070 1 9 . 1 1 80 80 GLU CB C 80 30.206 30.206 29.823 0.383 17355
4071 1 9 . 1 1 80 80 GLU H H 80 7.847 7.847 8.096 -0.249 17355
4072 1 9 . 1 1 81 81 MET N N 81 119.630 119.630 119.086 0.544 17355
4073 1 9 . 1 1 81 81 MET HA H 81 4.158 4.158 4.176 -0.018 17355
4074 1 9 . 1 1 81 81 MET CA C 81 59.025 59.025 58.908 0.117 17355
4075 1 9 . 1 1 81 81 MET CB C 81 32.916 32.916 32.669 0.247 17355
4076 1 9 . 1 1 81 81 MET H H 81 8.211 8.211 8.378 -0.167 17355
4077 1 9 . 1 1 82 82 ALA N N 82 120.463 120.463 121.731 -1.268 17355
4078 1 9 . 1 1 82 82 ALA HA H 82 3.911 3.911 4.184 -0.273 17355
4079 1 9 . 1 1 82 82 ALA CA C 82 56.004 56.004 54.315 1.689 17355
4080 1 9 . 1 1 82 82 ALA CB C 82 18.430 18.430 18.482 -0.052 17355
4081 1 9 . 1 1 82 82 ALA H H 82 7.978 7.978 7.613 0.365 17355
4082 1 9 . 1 1 83 83 GLU N N 83 116.663 116.663 120.201 -3.538 17355
4083 1 9 . 1 1 83 83 GLU HA H 83 4.034 4.034 3.866 0.168 17355
4084 1 9 . 1 1 83 83 GLU CA C 83 59.476 59.476 59.962 -0.486 17355
4085 1 9 . 1 1 83 83 GLU CB C 83 29.470 29.470 29.627 -0.157 17355
4086 1 9 . 1 1 83 83 GLU H H 83 8.608 8.608 7.793 0.815 17355
4087 1 9 . 1 1 84 84 ALA N N 84 122.742 122.742 121.040 1.702 17355
4088 1 9 . 1 1 84 84 ALA HA H 84 4.241 4.241 4.006 0.235 17355
4089 1 9 . 1 1 84 84 ALA CA C 84 54.970 54.970 55.287 -0.317 17355
4090 1 9 . 1 1 84 84 ALA CB C 84 18.150 18.150 18.143 0.007 17355
4091 1 9 . 1 1 84 84 ALA H H 84 7.918 7.918 7.870 0.048 17355
4092 1 9 . 1 1 85 85 LEU N N 85 119.158 119.158 118.493 0.665 17355
4093 1 9 . 1 1 85 85 LEU HA H 85 3.945 3.945 3.920 0.025 17355
4094 1 9 . 1 1 85 85 LEU CA C 85 57.849 57.849 57.342 0.507 17355
4095 1 9 . 1 1 85 85 LEU CB C 85 41.884 41.884 41.659 0.225 17355
4096 1 9 . 1 1 85 85 LEU H H 85 7.692 7.692 7.831 -0.139 17355
4097 1 9 . 1 1 86 86 GLU N N 86 118.441 118.441 120.442 -2.001 17355
4098 1 9 . 1 1 86 86 GLU HA H 86 4.053 4.053 4.259 -0.206 17355
4099 1 9 . 1 1 86 86 GLU CA C 86 59.131 59.131 58.913 0.218 17355
4100 1 9 . 1 1 86 86 GLU CB C 86 29.868 29.868 29.389 0.479 17355
4101 1 9 . 1 1 86 86 GLU H H 86 8.152 8.152 8.498 -0.346 17355
4102 1 9 . 1 1 87 87 ALA N N 87 120.690 120.690 120.853 -0.163 17355
4103 1 9 . 1 1 87 87 ALA HA H 87 4.139 4.139 4.367 -0.228 17355
4104 1 9 . 1 1 87 87 ALA CA C 87 54.506 54.506 53.199 1.307 17355
4105 1 9 . 1 1 87 87 ALA CB C 87 18.435 18.435 19.550 -1.115 17355
4106 1 9 . 1 1 87 87 ALA H H 87 7.899 7.899 7.777 0.122 17355
4107 1 9 . 1 1 88 88 ARG N N 88 117.642 117.642 120.354 -2.712 17355
4108 1 9 . 1 1 88 88 ARG HA H 88 4.204 4.204 4.012 0.192 17355
4109 1 9 . 1 1 88 88 ARG CA C 88 57.435 57.435 59.383 -1.948 17355
4110 1 9 . 1 1 88 88 ARG CB C 88 30.106 30.106 29.798 0.308 17355
4111 1 9 . 1 1 88 88 ARG H H 88 7.593 7.593 8.449 -0.856 17355
4112 1 9 . 1 1 89 89 GLU N N 89 121.080 121.080 117.795 3.285 17355
4113 1 9 . 1 1 89 89 GLU HA H 89 4.047 4.047 3.964 0.083 17355
4114 1 9 . 1 1 89 89 GLU CA C 89 58.858 58.858 59.065 -0.207 17355
4115 1 9 . 1 1 89 89 GLU CB C 89 29.912 29.912 29.113 0.799 17355
4116 1 9 . 1 1 89 89 GLU H H 89 8.222 8.222 7.855 0.367 17355
4117 1 9 . 1 1 90 90 ARG N N 90 117.834 117.834 118.064 -0.230 17355
4118 1 9 . 1 1 90 90 ARG HA H 90 4.212 4.212 4.122 0.090 17355
4119 1 9 . 1 1 90 90 ARG CA C 90 57.409 57.409 57.968 -0.559 17355
4120 1 9 . 1 1 90 90 ARG CB C 90 30.906 30.906 30.669 0.237 17355
4121 1 9 . 1 1 90 90 ARG H H 90 7.924 7.924 7.620 0.304 17355
4122 1 9 . 1 1 91 91 GLU N N 91 118.786 118.786 118.478 0.308 17355
4123 1 9 . 1 1 91 91 GLU HA H 91 4.254 4.254 4.426 -0.172 17355
4124 1 9 . 1 1 91 91 GLU CA C 91 56.693 56.693 56.879 -0.186 17355
4125 1 9 . 1 1 91 91 GLU CB C 91 30.416 30.416 31.986 -1.570 17355
4126 1 9 . 1 1 91 91 GLU H H 91 7.749 7.749 7.870 -0.121 17355
4127 1 9 . 1 1 92 92 ALA N N 92 125.247 125.247 128.470 -3.223 17355
4128 1 9 . 1 1 92 92 ALA HA H 92 4.551 4.551 4.590 -0.039 17355
4129 1 9 . 1 1 92 92 ALA CA C 92 51.073 51.073 52.843 -1.770 17355
4130 1 9 . 1 1 92 92 ALA CB C 92 18.443 18.443 18.434 0.009 17355
4131 1 9 . 1 1 92 92 ALA H H 92 7.888 7.888 8.291 -0.403 17355
4132 1 9 . 1 1 93 93 PRO HA H 93 4.383 4.383 4.514 -0.131 17355
4133 1 9 . 1 1 93 93 PRO CA C 93 63.744 63.744 63.189 0.555 17355
4134 1 9 . 1 1 93 93 PRO CB C 93 32.122 32.122 32.316 -0.194 17355
4135 1 9 . 1 1 94 94 HIS N N 94 118.597 118.597 118.934 -0.337 17355
4136 1 9 . 1 1 94 94 HIS HA H 94 4.639 4.639 4.726 -0.087 17355
4137 1 9 . 1 1 94 94 HIS CA C 94 56.044 56.044 55.758 0.286 17355
4138 1 9 . 1 1 94 94 HIS CB C 94 29.789 29.789 30.000 -0.211 17355
4139 1 9 . 1 1 94 94 HIS H H 94 8.392 8.392 8.597 -0.205 17355
4140 1 9 . 1 1 95 95 LEU N N 95 123.443 123.443 116.775 6.668 17355
4141 1 9 . 1 1 95 95 LEU HA H 95 4.287 4.287 4.705 -0.418 17355
4142 1 9 . 1 1 95 95 LEU CA C 95 55.233 55.233 54.131 1.102 17355
4143 1 9 . 1 1 95 95 LEU CB C 95 42.710 42.710 42.747 -0.037 17355
4144 1 9 . 1 1 95 95 LEU H H 95 8.061 8.061 7.927 0.134 17355
4145 1 9 . 1 1 96 96 GLU N N 96 121.295 121.295 118.699 2.596 17355
4146 1 9 . 1 1 96 96 GLU HA H 96 4.176 4.176 4.785 -0.609 17355
4147 1 9 . 1 1 96 96 GLU CA C 96 56.706 56.706 55.325 1.381 17355
4148 1 9 . 1 1 96 96 GLU CB C 96 30.319 30.319 31.420 -1.101 17355
4149 1 9 . 1 1 96 96 GLU H H 96 8.346 8.346 8.343 0.003 17355
4150 1 9 . 1 1 97 97 HIS N N 97 119.932 119.932 116.920 3.012 17355
4151 1 9 . 1 1 97 97 HIS HA H 97 4.555 4.555 4.809 -0.254 17355
4152 1 9 . 1 1 97 97 HIS CA C 97 56.042 56.042 55.804 0.238 17355
4153 1 9 . 1 1 97 97 HIS H H 97 8.251 8.251 8.735 -0.484 17355
4154 1 9 . 1 1 98 98 HIS N N 98 125.446 125.446 117.224 8.222 17355
4155 1 9 . 1 1 98 98 HIS HA H 98 4.363 4.363 4.804 -0.441 17355
4156 1 9 . 1 1 98 98 HIS CA C 98 57.303 57.303 55.961 1.342 17355
4157 1 9 . 1 1 98 98 HIS CB C 98 30.319 30.319 29.411 0.908 17355
4158 1 9 . 1 1 98 98 HIS H H 98 8.054 8.054 8.815 -0.761 17355
4159 1 10 . 1 1 3 3 ARG HA H 3 4.321 4.321 4.390 -0.069 17355
4160 1 10 . 1 1 3 3 ARG CA C 3 56.560 56.560 56.532 0.028 17355
4161 1 10 . 1 1 4 4 ALA N N 4 125.797 125.797 122.860 2.937 17355
4162 1 10 . 1 1 4 4 ALA HA H 4 4.283 4.283 4.588 -0.305 17355
4163 1 10 . 1 1 4 4 ALA CA C 4 52.900 52.900 52.257 0.643 17355
4164 1 10 . 1 1 4 4 ALA CB C 4 19.411 19.411 19.946 -0.535 17355
4165 1 10 . 1 1 4 4 ALA H H 4 8.563 8.563 8.166 0.397 17355
4166 1 10 . 1 1 5 5 ASP N N 5 118.416 118.416 118.105 0.311 17355
4167 1 10 . 1 1 5 5 ASP HA H 5 4.584 4.584 4.744 -0.160 17355
4168 1 10 . 1 1 5 5 ASP CA C 5 54.337 54.337 52.875 1.462 17355
4169 1 10 . 1 1 5 5 ASP CB C 5 41.186 41.186 41.883 -0.697 17355
4170 1 10 . 1 1 5 5 ASP H H 5 8.208 8.208 8.034 0.174 17355
4171 1 10 . 1 1 6 6 ASP N N 6 120.632 120.632 121.848 -1.216 17355
4172 1 10 . 1 1 6 6 ASP HA H 6 4.578 4.578 4.474 0.104 17355
4173 1 10 . 1 1 6 6 ASP CA C 6 54.589 54.589 54.776 -0.187 17355
4174 1 10 . 1 1 6 6 ASP CB C 6 41.239 41.239 42.115 -0.876 17355
4175 1 10 . 1 1 6 6 ASP H H 6 8.140 8.140 8.511 -0.371 17355
4176 1 10 . 1 1 7 7 THR N N 7 113.693 113.693 112.134 1.559 17355
4177 1 10 . 1 1 7 7 THR HA H 7 4.245 4.245 4.497 -0.252 17355
4178 1 10 . 1 1 7 7 THR CA C 7 62.392 62.392 61.671 0.721 17355
4179 1 10 . 1 1 7 7 THR CB C 7 69.721 69.721 68.929 0.792 17355
4180 1 10 . 1 1 7 7 THR H H 7 8.045 8.045 8.144 -0.099 17355
4181 1 10 . 1 1 8 8 ALA N N 8 126.414 126.414 123.569 2.845 17355
4182 1 10 . 1 1 8 8 ALA HA H 8 4.314 4.314 4.449 -0.135 17355
4183 1 10 . 1 1 8 8 ALA CA C 8 52.253 52.253 52.665 -0.412 17355
4184 1 10 . 1 1 8 8 ALA CB C 8 19.464 19.464 19.917 -0.453 17355
4185 1 10 . 1 1 8 8 ALA H H 8 8.139 8.139 7.623 0.516 17355
4186 1 10 . 1 1 9 9 LEU N N 9 122.921 122.921 115.926 6.995 17355
4187 1 10 . 1 1 9 9 LEU HA H 9 4.559 4.559 5.005 -0.446 17355
4188 1 10 . 1 1 9 9 LEU CA C 9 53.088 53.088 52.887 0.201 17355
4189 1 10 . 1 1 9 9 LEU CB C 9 41.929 41.929 42.217 -0.288 17355
4190 1 10 . 1 1 9 9 LEU H H 9 8.113 8.113 7.690 0.423 17355
4191 1 10 . 1 1 10 10 PRO HA H 10 4.367 4.367 4.337 0.030 17355
4192 1 10 . 1 1 10 10 PRO CA C 10 63.373 63.373 63.719 -0.346 17355
4193 1 10 . 1 1 10 10 PRO CB C 10 31.975 31.975 32.059 -0.084 17355
4194 1 10 . 1 1 11 11 ALA N N 11 124.349 124.349 119.590 4.759 17355
4195 1 10 . 1 1 11 11 ALA HA H 11 4.262 4.262 4.359 -0.097 17355
4196 1 10 . 1 1 11 11 ALA CA C 11 52.496 52.496 51.404 1.092 17355
4197 1 10 . 1 1 11 11 ALA CB C 11 19.424 19.424 20.058 -0.634 17355
4198 1 10 . 1 1 11 11 ALA H H 11 8.317 8.317 7.395 0.922 17355
4199 1 10 . 1 1 12 12 ALA N N 12 123.291 123.291 123.154 0.137 17355
4200 1 10 . 1 1 12 12 ALA HA H 12 4.380 4.380 4.551 -0.171 17355
4201 1 10 . 1 1 12 12 ALA CA C 12 52.461 52.461 51.791 0.670 17355
4202 1 10 . 1 1 12 12 ALA CB C 12 19.557 19.557 19.062 0.495 17355
4203 1 10 . 1 1 12 12 ALA H H 12 8.287 8.287 8.233 0.054 17355
4204 1 10 . 1 1 13 13 THR N N 13 112.758 112.758 115.605 -2.847 17355
4205 1 10 . 1 1 13 13 THR HA H 13 4.350 4.350 4.152 0.198 17355
4206 1 10 . 1 1 13 13 THR CA C 13 62.074 62.074 63.146 -1.072 17355
4207 1 10 . 1 1 13 13 THR CB C 13 70.070 70.070 68.284 1.786 17355
4208 1 10 . 1 1 13 13 THR H H 13 8.074 8.074 8.518 -0.444 17355
4209 1 10 . 1 1 14 14 GLY N N 14 110.774 110.774 112.710 -1.936 17355
4210 1 10 . 1 1 14 14 GLY CA C 14 45.692 45.692 45.545 0.147 17355
4211 1 10 . 1 1 14 14 GLY H H 14 8.405 8.405 7.865 0.540 17355
4212 1 10 . 1 1 15 15 ALA N N 15 124.127 124.127 128.371 -4.244 17355
4213 1 10 . 1 1 15 15 ALA HA H 15 4.137 4.137 3.915 0.222 17355
4214 1 10 . 1 1 15 15 ALA CA C 15 55.368 55.368 53.876 1.492 17355
4215 1 10 . 1 1 15 15 ALA CB C 15 20.100 20.100 17.743 2.357 17355
4216 1 10 . 1 1 15 15 ALA H H 15 8.866 8.866 8.342 0.524 17355
4217 1 10 . 1 1 16 16 LEU N N 16 118.013 118.013 122.387 -4.374 17355
4218 1 10 . 1 1 16 16 LEU HA H 16 3.870 3.870 4.016 -0.146 17355
4219 1 10 . 1 1 16 16 LEU CA C 16 58.820 58.820 58.108 0.712 17355
4220 1 10 . 1 1 16 16 LEU CB C 16 41.332 41.332 41.249 0.083 17355
4221 1 10 . 1 1 16 16 LEU H H 16 8.414 8.414 8.299 0.115 17355
4222 1 10 . 1 1 17 17 GLU N N 17 117.730 117.730 117.287 0.443 17355
4223 1 10 . 1 1 17 17 GLU HA H 17 3.978 3.978 4.162 -0.184 17355
4224 1 10 . 1 1 17 17 GLU CA C 17 59.909 59.909 58.138 1.771 17355
4225 1 10 . 1 1 17 17 GLU CB C 17 29.212 29.212 28.713 0.499 17355
4226 1 10 . 1 1 17 17 GLU H H 17 8.088 8.088 8.431 -0.343 17355
4227 1 10 . 1 1 18 18 LEU N N 18 121.355 121.355 121.219 0.136 17355
4228 1 10 . 1 1 18 18 LEU HA H 18 4.165 4.165 4.079 0.086 17355
4229 1 10 . 1 1 18 18 LEU CA C 18 58.469 58.469 57.966 0.503 17355
4230 1 10 . 1 1 18 18 LEU CB C 18 42.459 42.459 42.169 0.290 17355
4231 1 10 . 1 1 18 18 LEU H H 18 7.767 7.767 7.439 0.328 17355
4232 1 10 . 1 1 19 19 VAL N N 19 118.522 118.522 116.951 1.571 17355
4233 1 10 . 1 1 19 19 VAL HA H 19 3.424 3.424 3.763 -0.339 17355
4234 1 10 . 1 1 19 19 VAL CA C 19 67.958 67.958 66.100 1.858 17355
4235 1 10 . 1 1 19 19 VAL CB C 19 31.922 31.922 31.943 -0.021 17355
4236 1 10 . 1 1 19 19 VAL H H 19 8.661 8.661 7.741 0.920 17355
4237 1 10 . 1 1 20 20 ARG N N 20 117.959 117.959 117.790 0.169 17355
4238 1 10 . 1 1 20 20 ARG HA H 20 3.576 3.576 4.283 -0.707 17355
4239 1 10 . 1 1 20 20 ARG CA C 20 60.994 60.994 56.943 4.051 17355
4240 1 10 . 1 1 20 20 ARG CB C 20 30.703 30.703 28.113 2.590 17355
4241 1 10 . 1 1 20 20 ARG H H 20 8.705 8.705 8.275 0.430 17355
4242 1 10 . 1 1 21 21 HIS N N 21 115.245 115.245 116.967 -1.722 17355
4243 1 10 . 1 1 21 21 HIS HA H 21 4.144 4.144 4.574 -0.430 17355
4244 1 10 . 1 1 21 21 HIS CA C 21 60.536 60.536 57.127 3.409 17355
4245 1 10 . 1 1 21 21 HIS CB C 21 29.099 29.099 32.733 -3.634 17355
4246 1 10 . 1 1 21 21 HIS H H 21 7.811 7.811 8.363 -0.552 17355
4247 1 10 . 1 1 22 22 LEU N N 22 119.884 119.884 120.305 -0.421 17355
4248 1 10 . 1 1 22 22 LEU HA H 22 4.078 4.078 4.100 -0.022 17355
4249 1 10 . 1 1 22 22 LEU CA C 22 58.164 58.164 58.081 0.083 17355
4250 1 10 . 1 1 22 22 LEU CB C 22 42.889 42.889 41.946 0.943 17355
4251 1 10 . 1 1 22 22 LEU H H 22 8.301 8.301 7.707 0.594 17355
4252 1 10 . 1 1 23 23 VAL N N 23 119.391 119.391 118.430 0.961 17355
4253 1 10 . 1 1 23 23 VAL HA H 23 3.429 3.429 3.723 -0.294 17355
4254 1 10 . 1 1 23 23 VAL CA C 23 67.179 67.179 66.300 0.879 17355
4255 1 10 . 1 1 23 23 VAL CB C 23 31.366 31.366 31.425 -0.059 17355
4256 1 10 . 1 1 23 23 VAL H H 23 8.897 8.897 7.526 1.371 17355
4257 1 10 . 1 1 24 24 ALA N N 24 121.610 121.610 121.777 -0.167 17355
4258 1 10 . 1 1 24 24 ALA HA H 24 3.851 3.851 4.044 -0.193 17355
4259 1 10 . 1 1 24 24 ALA CA C 24 55.944 55.944 55.270 0.674 17355
4260 1 10 . 1 1 24 24 ALA CB C 24 18.042 18.042 18.145 -0.103 17355
4261 1 10 . 1 1 24 24 ALA H H 24 8.276 8.276 7.807 0.469 17355
4262 1 10 . 1 1 25 25 GLU N N 25 114.822 114.822 116.512 -1.690 17355
4263 1 10 . 1 1 25 25 GLU HA H 25 4.042 4.042 4.294 -0.252 17355
4264 1 10 . 1 1 25 25 GLU CA C 25 59.255 59.255 58.550 0.706 17355
4265 1 10 . 1 1 25 25 GLU CB C 25 29.951 29.951 29.034 0.917 17355
4266 1 10 . 1 1 25 25 GLU H H 25 7.693 7.693 8.041 -0.348 17355
4267 1 10 . 1 1 26 26 ARG N N 26 118.510 118.510 116.970 1.540 17355
4268 1 10 . 1 1 26 26 ARG HA H 26 4.252 4.252 4.338 -0.086 17355
4269 1 10 . 1 1 26 26 ARG CA C 26 57.090 57.090 56.530 0.560 17355
4270 1 10 . 1 1 26 26 ARG CB C 26 30.080 30.080 30.898 -0.818 17355
4271 1 10 . 1 1 26 26 ARG H H 26 7.783 7.783 7.841 -0.058 17355
4272 1 10 . 1 1 27 27 ALA N N 27 120.375 120.375 120.663 -0.288 17355
4273 1 10 . 1 1 27 27 ALA HA H 27 4.342 4.342 4.530 -0.188 17355
4274 1 10 . 1 1 27 27 ALA CA C 27 52.134 52.134 50.980 1.154 17355
4275 1 10 . 1 1 27 27 ALA CB C 27 19.283 19.283 19.831 -0.548 17355
4276 1 10 . 1 1 27 27 ALA H H 27 8.638 8.638 7.728 0.910 17355
4277 1 10 . 1 1 28 28 GLU N N 28 115.494 115.494 117.732 -2.238 17355
4278 1 10 . 1 1 28 28 GLU HA H 28 3.873 3.873 4.037 -0.164 17355
4279 1 10 . 1 1 28 28 GLU CA C 28 56.940 56.940 57.247 -0.307 17355
4280 1 10 . 1 1 28 28 GLU CB C 28 27.058 27.058 28.121 -1.063 17355
4281 1 10 . 1 1 28 28 GLU H H 28 7.734 7.734 8.399 -0.665 17355
4282 1 10 . 1 1 29 29 LEU N N 29 119.978 119.978 120.788 -0.810 17355
4283 1 10 . 1 1 29 29 LEU HA H 29 4.898 4.898 4.811 0.087 17355
4284 1 10 . 1 1 29 29 LEU CA C 29 51.498 51.498 51.796 -0.298 17355
4285 1 10 . 1 1 29 29 LEU CB C 29 45.348 45.348 45.588 -0.240 17355
4286 1 10 . 1 1 29 29 LEU H H 29 8.075 8.075 7.629 0.446 17355
4287 1 10 . 1 1 30 30 PRO HA H 30 4.461 4.461 4.467 -0.006 17355
4288 1 10 . 1 1 30 30 PRO CA C 30 62.524 62.524 62.934 -0.410 17355
4289 1 10 . 1 1 30 30 PRO CB C 30 32.015 32.015 30.324 1.691 17355
4290 1 10 . 1 1 31 31 VAL N N 31 123.773 123.773 120.227 3.546 17355
4291 1 10 . 1 1 31 31 VAL HA H 31 3.540 3.540 3.783 -0.243 17355
4292 1 10 . 1 1 31 31 VAL CA C 31 65.493 65.493 64.123 1.370 17355
4293 1 10 . 1 1 31 31 VAL CB C 31 31.865 31.865 31.604 0.261 17355
4294 1 10 . 1 1 31 31 VAL H H 31 8.432 8.432 7.916 0.516 17355
4295 1 10 . 1 1 32 32 GLU N N 32 117.215 117.215 122.383 -5.168 17355
4296 1 10 . 1 1 32 32 GLU HA H 32 4.053 4.053 4.648 -0.595 17355
4297 1 10 . 1 1 32 32 GLU CA C 32 59.131 59.131 57.022 2.109 17355
4298 1 10 . 1 1 32 32 GLU CB C 32 28.781 28.781 30.385 -1.604 17355
4299 1 10 . 1 1 32 32 GLU H H 32 8.971 8.971 8.167 0.804 17355
4300 1 10 . 1 1 33 33 VAL N N 33 113.611 113.611 121.298 -7.687 17355
4301 1 10 . 1 1 33 33 VAL HA H 33 4.214 4.214 4.091 0.123 17355
4302 1 10 . 1 1 33 33 VAL CA C 33 61.795 61.795 62.360 -0.565 17355
4303 1 10 . 1 1 33 33 VAL CB C 33 32.094 32.094 31.851 0.243 17355
4304 1 10 . 1 1 33 33 VAL H H 33 7.470 7.470 7.787 -0.317 17355
4305 1 10 . 1 1 34 34 LEU N N 34 123.533 123.533 120.508 3.025 17355
4306 1 10 . 1 1 34 34 LEU HA H 34 4.114 4.114 4.135 -0.021 17355
4307 1 10 . 1 1 34 34 LEU CA C 34 54.877 54.877 55.289 -0.412 17355
4308 1 10 . 1 1 34 34 LEU CB C 34 42.590 42.590 42.046 0.544 17355
4309 1 10 . 1 1 34 34 LEU H H 34 7.300 7.300 7.759 -0.459 17355
4310 1 10 . 1 1 35 35 ARG N N 35 125.820 125.820 124.062 1.758 17355
4311 1 10 . 1 1 35 35 ARG HA H 35 4.578 4.578 4.308 0.270 17355
4312 1 10 . 1 1 35 35 ARG CA C 35 54.619 54.619 55.410 -0.791 17355
4313 1 10 . 1 1 35 35 ARG CB C 35 31.909 31.909 31.336 0.573 17355
4314 1 10 . 1 1 35 35 ARG H H 35 8.415 8.415 7.998 0.417 17355
4315 1 10 . 1 1 36 36 ASP N N 36 123.211 123.211 116.986 6.225 17355
4316 1 10 . 1 1 36 36 ASP HA H 36 4.156 4.156 4.700 -0.544 17355
4317 1 10 . 1 1 36 36 ASP CA C 36 57.258 57.258 55.215 2.043 17355
4318 1 10 . 1 1 36 36 ASP CB C 36 40.400 40.400 41.552 -1.152 17355
4319 1 10 . 1 1 36 36 ASP H H 36 8.880 8.880 8.716 0.164 17355
4320 1 10 . 1 1 37 37 ASP N N 37 112.390 112.390 119.048 -6.658 17355
4321 1 10 . 1 1 37 37 ASP HA H 37 4.614 4.614 4.754 -0.140 17355
4322 1 10 . 1 1 37 37 ASP CA C 37 52.651 52.651 53.871 -1.220 17355
4323 1 10 . 1 1 37 37 ASP CB C 37 40.100 40.100 41.049 -0.949 17355
4324 1 10 . 1 1 37 37 ASP H H 37 7.800 7.800 8.330 -0.530 17355
4325 1 10 . 1 1 38 38 SER N N 38 116.534 116.534 116.691 -0.157 17355
4326 1 10 . 1 1 38 38 SER HA H 38 4.147 4.147 4.367 -0.220 17355
4327 1 10 . 1 1 38 38 SER CA C 38 61.186 61.186 58.063 3.123 17355
4328 1 10 . 1 1 38 38 SER CB C 38 63.946 63.946 62.503 1.443 17355
4329 1 10 . 1 1 38 38 SER H H 38 7.376 7.376 7.912 -0.536 17355
4330 1 10 . 1 1 39 39 ARG N N 39 124.337 124.337 124.853 -0.516 17355
4331 1 10 . 1 1 39 39 ARG HA H 39 4.521 4.521 4.191 0.331 17355
4332 1 10 . 1 1 39 39 ARG CA C 39 55.049 55.049 55.945 -0.896 17355
4333 1 10 . 1 1 39 39 ARG CB C 39 30.723 30.723 30.946 -0.223 17355
4334 1 10 . 1 1 39 39 ARG H H 39 10.095 10.095 7.769 2.326 17355
4335 1 10 . 1 1 40 40 PHE N N 40 122.834 122.834 119.045 3.789 17355
4336 1 10 . 1 1 40 40 PHE HA H 40 3.916 3.916 4.662 -0.746 17355
4337 1 10 . 1 1 40 40 PHE CA C 40 62.869 62.869 59.097 3.772 17355
4338 1 10 . 1 1 40 40 PHE CB C 40 39.662 39.662 38.131 1.531 17355
4339 1 10 . 1 1 40 40 PHE H H 40 7.498 7.498 8.062 -0.564 17355
4340 1 10 . 1 1 41 41 LEU N N 41 117.682 117.682 117.526 0.156 17355
4341 1 10 . 1 1 41 41 LEU HA H 41 4.519 4.519 4.484 0.035 17355
4342 1 10 . 1 1 41 41 LEU CA C 41 58.111 58.111 56.283 1.828 17355
4343 1 10 . 1 1 41 41 LEU CB C 41 41.087 41.087 42.885 -1.798 17355
4344 1 10 . 1 1 41 41 LEU H H 41 8.619 8.619 7.831 0.788 17355
4345 1 10 . 1 1 42 42 ASP N N 42 114.800 114.800 119.558 -4.758 17355
4346 1 10 . 1 1 42 42 ASP HA H 42 4.185 4.185 4.394 -0.209 17355
4347 1 10 . 1 1 42 42 ASP CA C 42 57.713 57.713 56.536 1.177 17355
4348 1 10 . 1 1 42 42 ASP CB C 42 41.206 41.206 41.129 0.077 17355
4349 1 10 . 1 1 42 42 ASP H H 42 8.239 8.239 8.327 -0.088 17355
4350 1 10 . 1 1 43 43 ASP N N 43 111.125 111.125 119.202 -8.077 17355
4351 1 10 . 1 1 43 43 ASP HA H 43 4.915 4.915 4.571 0.344 17355
4352 1 10 . 1 1 43 43 ASP CA C 43 56.105 56.105 55.698 0.407 17355
4353 1 10 . 1 1 43 43 ASP CB C 43 41.703 41.703 41.191 0.512 17355
4354 1 10 . 1 1 43 43 ASP H H 43 7.355 7.355 8.243 -0.888 17355
4355 1 10 . 1 1 44 44 LEU N N 44 114.924 114.924 116.915 -1.991 17355
4356 1 10 . 1 1 44 44 LEU HA H 44 4.273 4.273 4.058 0.215 17355
4357 1 10 . 1 1 44 44 LEU CA C 44 54.480 54.480 56.597 -2.117 17355
4358 1 10 . 1 1 44 44 LEU CB C 44 41.671 41.671 42.690 -1.019 17355
4359 1 10 . 1 1 44 44 LEU H H 44 7.172 7.172 7.604 -0.432 17355
4360 1 10 . 1 1 45 45 HIS N N 45 114.429 114.429 114.514 -0.085 17355
4361 1 10 . 1 1 45 45 HIS HA H 45 4.581 4.581 4.243 0.338 17355
4362 1 10 . 1 1 45 45 HIS CA C 45 56.189 56.189 55.810 0.379 17355
4363 1 10 . 1 1 45 45 HIS CB C 45 26.073 26.073 28.674 -2.602 17355
4364 1 10 . 1 1 45 45 HIS H H 45 7.308 7.308 7.916 -0.608 17355
4365 1 10 . 1 1 46 46 MET N N 46 118.597 118.597 121.710 -3.113 17355
4366 1 10 . 1 1 46 46 MET HA H 46 4.614 4.614 4.846 -0.232 17355
4367 1 10 . 1 1 46 46 MET CA C 46 55.646 55.646 54.304 1.342 17355
4368 1 10 . 1 1 46 46 MET CB C 46 35.501 35.501 37.028 -1.527 17355
4369 1 10 . 1 1 46 46 MET H H 46 8.618 8.618 8.485 0.133 17355
4370 1 10 . 1 1 47 47 SER N N 47 116.110 116.110 113.313 2.797 17355
4371 1 10 . 1 1 47 47 SER HA H 47 4.559 4.559 4.887 -0.328 17355
4372 1 10 . 1 1 47 47 SER CA C 47 56.696 56.696 56.835 -0.139 17355
4373 1 10 . 1 1 47 47 SER CB C 47 65.888 65.888 66.333 -0.445 17355
4374 1 10 . 1 1 47 47 SER H H 47 8.446 8.446 8.281 0.165 17355
4375 1 10 . 1 1 48 48 SER N N 48 116.756 116.756 118.149 -1.393 17355
4376 1 10 . 1 1 48 48 SER HA H 48 3.701 3.701 4.235 -0.534 17355
4377 1 10 . 1 1 48 48 SER CA C 48 62.260 62.260 62.396 -0.136 17355
4378 1 10 . 1 1 48 48 SER CB C 48 62.289 62.289 63.013 -0.724 17355
4379 1 10 . 1 1 48 48 SER H H 48 8.948 8.948 8.801 0.147 17355
4380 1 10 . 1 1 49 49 ILE N N 49 122.227 122.227 121.359 0.868 17355
4381 1 10 . 1 1 49 49 ILE HA H 49 3.806 3.806 3.735 0.071 17355
4382 1 10 . 1 1 49 49 ILE CA C 49 64.215 64.215 65.161 -0.946 17355
4383 1 10 . 1 1 49 49 ILE CB C 49 38.059 38.059 37.054 1.005 17355
4384 1 10 . 1 1 49 49 ILE H H 49 7.595 7.595 8.010 -0.415 17355
4385 1 10 . 1 1 50 50 THR N N 50 120.233 120.233 115.639 4.594 17355
4386 1 10 . 1 1 50 50 THR HA H 50 3.878 3.878 3.946 -0.068 17355
4387 1 10 . 1 1 50 50 THR CA C 50 66.427 66.427 66.336 0.091 17355
4388 1 10 . 1 1 50 50 THR CB C 50 68.223 68.223 68.045 0.178 17355
4389 1 10 . 1 1 50 50 THR H H 50 7.539 7.539 7.766 -0.227 17355
4390 1 10 . 1 1 51 51 VAL N N 51 121.320 121.320 120.460 0.860 17355
4391 1 10 . 1 1 51 51 VAL HA H 51 3.090 3.090 3.568 -0.478 17355
4392 1 10 . 1 1 51 51 VAL CA C 51 67.440 67.440 66.998 0.442 17355
4393 1 10 . 1 1 51 51 VAL CB C 51 31.087 31.087 31.241 -0.154 17355
4394 1 10 . 1 1 51 51 VAL H H 51 8.178 8.178 8.555 -0.377 17355
4395 1 10 . 1 1 52 52 GLY N N 52 105.968 105.968 105.396 0.572 17355
4396 1 10 . 1 1 52 52 GLY CA C 52 47.339 47.339 46.505 0.834 17355
4397 1 10 . 1 1 52 52 GLY H H 52 8.004 8.004 7.666 0.338 17355
4398 1 10 . 1 1 53 53 GLN N N 53 120.486 120.486 118.875 1.611 17355
4399 1 10 . 1 1 53 53 GLN HA H 53 4.086 4.086 4.222 -0.136 17355
4400 1 10 . 1 1 53 53 GLN CA C 53 58.919 58.919 57.426 1.493 17355
4401 1 10 . 1 1 53 53 GLN CB C 53 27.867 27.867 29.284 -1.417 17355
4402 1 10 . 1 1 53 53 GLN H H 53 7.675 7.675 7.681 -0.006 17355
4403 1 10 . 1 1 54 54 LEU N N 54 121.901 121.901 117.502 4.399 17355
4404 1 10 . 1 1 54 54 LEU HA H 54 4.049 4.049 4.472 -0.423 17355
4405 1 10 . 1 1 54 54 LEU CA C 54 58.661 58.661 57.288 1.373 17355
4406 1 10 . 1 1 54 54 LEU CB C 54 42.426 42.426 42.001 0.425 17355
4407 1 10 . 1 1 54 54 LEU H H 54 8.038 8.038 7.390 0.648 17355
4408 1 10 . 1 1 55 55 VAL N N 55 119.226 119.226 120.415 -1.189 17355
4409 1 10 . 1 1 55 55 VAL HA H 55 3.543 3.543 3.676 -0.133 17355
4410 1 10 . 1 1 55 55 VAL CA C 55 66.871 66.871 65.074 1.797 17355
4411 1 10 . 1 1 55 55 VAL CB C 55 31.392 31.392 30.907 0.485 17355
4412 1 10 . 1 1 55 55 VAL H H 55 8.375 8.375 8.543 -0.168 17355
4413 1 10 . 1 1 56 56 ASN N N 56 117.987 117.987 117.329 0.658 17355
4414 1 10 . 1 1 56 56 ASN HA H 56 4.473 4.473 4.470 0.003 17355
4415 1 10 . 1 1 56 56 ASN CA C 56 56.557 56.557 56.107 0.450 17355
4416 1 10 . 1 1 56 56 ASN CB C 56 38.509 38.509 38.412 0.097 17355
4417 1 10 . 1 1 56 56 ASN H H 56 7.521 7.521 8.383 -0.862 17355
4418 1 10 . 1 1 57 57 GLU N N 57 121.765 121.765 120.054 1.711 17355
4419 1 10 . 1 1 57 57 GLU HA H 57 4.070 4.070 4.198 -0.128 17355
4420 1 10 . 1 1 57 57 GLU CA C 57 59.496 59.496 58.668 0.828 17355
4421 1 10 . 1 1 57 57 GLU CB C 57 29.395 29.395 29.726 -0.331 17355
4422 1 10 . 1 1 57 57 GLU H H 57 8.225 8.225 7.645 0.580 17355
4423 1 10 . 1 1 58 58 ALA N N 58 123.779 123.779 121.542 2.237 17355
4424 1 10 . 1 1 58 58 ALA HA H 58 3.874 3.874 4.260 -0.386 17355
4425 1 10 . 1 1 58 58 ALA CA C 58 55.227 55.227 54.778 0.449 17355
4426 1 10 . 1 1 58 58 ALA CB C 58 18.388 18.388 18.266 0.122 17355
4427 1 10 . 1 1 58 58 ALA H H 58 8.659 8.659 7.509 1.150 17355
4428 1 10 . 1 1 59 59 ALA N N 59 118.656 118.656 121.579 -2.923 17355
4429 1 10 . 1 1 59 59 ALA HA H 59 3.819 3.819 3.981 -0.162 17355
4430 1 10 . 1 1 59 59 ALA CA C 59 55.871 55.871 54.628 1.243 17355
4431 1 10 . 1 1 59 59 ALA CB C 59 18.152 18.152 18.287 -0.135 17355
4432 1 10 . 1 1 59 59 ALA H H 59 8.537 8.537 7.595 0.942 17355
4433 1 10 . 1 1 60 60 ARG N N 60 117.701 117.701 119.045 -1.344 17355
4434 1 10 . 1 1 60 60 ARG HA H 60 4.096 4.096 3.903 0.193 17355
4435 1 10 . 1 1 60 60 ARG CA C 60 59.609 59.609 59.483 0.126 17355
4436 1 10 . 1 1 60 60 ARG CB C 60 29.974 29.974 30.322 -0.348 17355
4437 1 10 . 1 1 60 60 ARG H H 60 7.923 7.923 7.599 0.324 17355
4438 1 10 . 1 1 61 61 ALA N N 61 123.271 123.271 120.785 2.486 17355
4439 1 10 . 1 1 61 61 ALA HA H 61 4.137 4.137 4.092 0.045 17355
4440 1 10 . 1 1 61 61 ALA CA C 61 54.912 54.912 54.492 0.420 17355
4441 1 10 . 1 1 61 61 ALA CB C 61 18.304 18.304 18.426 -0.122 17355
4442 1 10 . 1 1 61 61 ALA H H 61 8.044 8.044 7.473 0.571 17355
4443 1 10 . 1 1 62 62 MET N N 62 114.725 114.725 116.020 -1.295 17355
4444 1 10 . 1 1 62 62 MET HA H 62 4.297 4.297 4.203 0.094 17355
4445 1 10 . 1 1 62 62 MET CA C 62 56.392 56.392 56.608 -0.216 17355
4446 1 10 . 1 1 62 62 MET CB C 62 34.827 34.827 33.005 1.822 17355
4447 1 10 . 1 1 62 62 MET H H 62 7.710 7.710 7.752 -0.042 17355
4448 1 10 . 1 1 63 63 GLY N N 63 108.268 108.268 107.664 0.604 17355
4449 1 10 . 1 1 63 63 GLY CA C 63 46.079 46.079 45.229 0.850 17355
4450 1 10 . 1 1 63 63 GLY H H 63 7.846 7.846 7.622 0.224 17355
4451 1 10 . 1 1 64 64 LEU N N 64 119.547 119.547 119.705 -0.158 17355
4452 1 10 . 1 1 64 64 LEU HA H 64 4.526 4.526 4.613 -0.087 17355
4453 1 10 . 1 1 64 64 LEU CA C 64 53.605 53.605 53.751 -0.146 17355
4454 1 10 . 1 1 64 64 LEU CB C 64 43.784 43.784 43.177 0.607 17355
4455 1 10 . 1 1 64 64 LEU H H 64 8.183 8.183 7.783 0.400 17355
4456 1 10 . 1 1 65 65 SER N N 65 115.418 115.418 113.695 1.723 17355
4457 1 10 . 1 1 65 65 SER HA H 65 4.328 4.328 4.459 -0.131 17355
4458 1 10 . 1 1 65 65 SER CA C 65 58.319 58.319 58.796 -0.477 17355
4459 1 10 . 1 1 65 65 SER CB C 65 64.181 64.181 63.408 0.773 17355
4460 1 10 . 1 1 65 65 SER H H 65 8.302 8.302 8.205 0.097 17355
4461 1 10 . 1 1 66 66 ALA N N 66 124.266 124.266 124.111 0.155 17355
4462 1 10 . 1 1 66 66 ALA HA H 66 4.212 4.212 4.578 -0.366 17355
4463 1 10 . 1 1 66 66 ALA CA C 66 52.624 52.624 52.561 0.063 17355
4464 1 10 . 1 1 66 66 ALA CB C 66 19.309 19.309 19.197 0.112 17355
4465 1 10 . 1 1 66 66 ALA H H 66 8.262 8.262 8.131 0.131 17355
4466 1 10 . 1 1 67 67 VAL N N 67 118.373 118.373 118.694 -0.321 17355
4467 1 10 . 1 1 67 67 VAL HA H 67 4.049 4.049 4.007 0.042 17355
4468 1 10 . 1 1 67 67 VAL CA C 67 62.010 62.010 62.635 -0.625 17355
4469 1 10 . 1 1 67 67 VAL CB C 67 33.495 33.495 31.823 1.673 17355
4470 1 10 . 1 1 67 67 VAL H H 67 7.949 7.949 7.429 0.520 17355
4471 1 10 . 1 1 68 68 ALA N N 68 127.696 127.696 122.764 4.932 17355
4472 1 10 . 1 1 68 68 ALA HA H 68 4.308 4.308 4.018 0.290 17355
4473 1 10 . 1 1 68 68 ALA CA C 68 52.070 52.070 52.882 -0.812 17355
4474 1 10 . 1 1 68 68 ALA CB C 68 19.220 19.220 17.430 1.790 17355
4475 1 10 . 1 1 68 68 ALA H H 68 8.319 8.319 8.041 0.278 17355
4476 1 10 . 1 1 69 69 MET N N 69 120.285 120.285 118.502 1.783 17355
4477 1 10 . 1 1 69 69 MET HA H 69 4.664 4.664 4.143 0.521 17355
4478 1 10 . 1 1 69 69 MET CA C 69 53.004 53.004 55.342 -2.337 17355
4479 1 10 . 1 1 69 69 MET CB C 69 32.678 32.678 31.723 0.955 17355
4480 1 10 . 1 1 69 69 MET H H 69 8.224 8.224 8.393 -0.169 17355
4481 1 10 . 1 1 70 70 PRO HA H 70 4.446 4.446 4.483 -0.037 17355
4482 1 10 . 1 1 70 70 PRO CA C 70 63.452 63.452 65.023 -1.571 17355
4483 1 10 . 1 1 70 70 PRO CB C 70 32.012 32.012 32.382 -0.370 17355
4484 1 10 . 1 1 71 71 THR N N 71 112.663 112.663 109.249 3.414 17355
4485 1 10 . 1 1 71 71 THR HA H 71 4.074 4.074 3.812 0.262 17355
4486 1 10 . 1 1 71 71 THR CA C 71 62.869 62.869 61.002 1.867 17355
4487 1 10 . 1 1 71 71 THR CB C 71 69.516 69.516 69.293 0.223 17355
4488 1 10 . 1 1 71 71 THR H H 71 7.957 7.957 7.398 0.559 17355
4489 1 10 . 1 1 72 72 ASN N N 72 120.054 120.054 118.805 1.249 17355
4490 1 10 . 1 1 72 72 ASN HA H 72 4.695 4.695 3.920 0.775 17355
4491 1 10 . 1 1 72 72 ASN CA C 72 52.856 52.856 56.135 -3.279 17355
4492 1 10 . 1 1 72 72 ASN CB C 72 38.165 38.165 37.542 0.623 17355
4493 1 10 . 1 1 72 72 ASN H H 72 8.227 8.227 8.222 0.005 17355
4494 1 10 . 1 1 73 73 PHE N N 73 121.570 121.570 115.378 6.192 17355
4495 1 10 . 1 1 73 73 PHE HA H 73 4.342 4.342 3.717 0.625 17355
4496 1 10 . 1 1 73 73 PHE CA C 73 59.609 59.609 60.396 -0.787 17355
4497 1 10 . 1 1 73 73 PHE CB C 73 39.000 39.000 36.744 2.256 17355
4498 1 10 . 1 1 73 73 PHE H H 73 8.331 8.331 8.189 0.142 17355
4499 1 10 . 1 1 74 74 ALA N N 74 121.047 121.047 122.122 -1.075 17355
4500 1 10 . 1 1 74 74 ALA HA H 74 4.074 4.074 4.152 -0.078 17355
4501 1 10 . 1 1 74 74 ALA CA C 74 54.705 54.705 54.931 -0.226 17355
4502 1 10 . 1 1 74 74 ALA CB C 74 19.159 19.159 18.995 0.164 17355
4503 1 10 . 1 1 74 74 ALA H H 74 8.163 8.163 8.065 0.098 17355
4504 1 10 . 1 1 75 75 THR N N 75 104.824 104.824 113.219 -8.395 17355
4505 1 10 . 1 1 75 75 THR HA H 75 4.475 4.475 4.316 0.159 17355
4506 1 10 . 1 1 75 75 THR CA C 75 60.669 60.669 61.411 -0.742 17355
4507 1 10 . 1 1 75 75 THR CB C 75 69.543 69.543 66.373 3.170 17355
4508 1 10 . 1 1 75 75 THR H H 75 7.581 7.581 8.304 -0.723 17355
4509 1 10 . 1 1 76 76 ALA N N 76 124.548 124.548 128.889 -4.341 17355
4510 1 10 . 1 1 76 76 ALA HA H 76 4.714 4.714 4.980 -0.266 17355
4511 1 10 . 1 1 76 76 ALA CA C 76 52.929 52.929 50.356 2.573 17355
4512 1 10 . 1 1 76 76 ALA CB C 76 20.661 20.661 22.435 -1.774 17355
4513 1 10 . 1 1 76 76 ALA H H 76 7.689 7.689 8.090 -0.401 17355
4514 1 10 . 1 1 77 77 THR N N 77 108.654 108.654 110.267 -1.613 17355
4515 1 10 . 1 1 77 77 THR HA H 77 5.017 5.017 4.455 0.562 17355
4516 1 10 . 1 1 77 77 THR CA C 77 58.847 58.847 59.682 -0.835 17355
4517 1 10 . 1 1 77 77 THR CB C 77 73.369 73.369 72.401 0.968 17355
4518 1 10 . 1 1 77 77 THR H H 77 7.495 7.495 8.106 -0.611 17355
4519 1 10 . 1 1 78 78 VAL N N 78 120.107 120.107 116.550 3.557 17355
4520 1 10 . 1 1 78 78 VAL HA H 78 3.418 3.418 4.047 -0.629 17355
4521 1 10 . 1 1 78 78 VAL CA C 78 67.446 67.446 66.314 1.132 17355
4522 1 10 . 1 1 78 78 VAL CB C 78 31.949 31.949 31.342 0.607 17355
4523 1 10 . 1 1 78 78 VAL H H 78 7.373 7.373 7.711 -0.338 17355
4524 1 10 . 1 1 79 79 ARG N N 79 117.131 117.131 118.891 -1.760 17355
4525 1 10 . 1 1 79 79 ARG HA H 79 3.877 3.877 4.179 -0.302 17355
4526 1 10 . 1 1 79 79 ARG CA C 79 59.566 59.566 58.160 1.406 17355
4527 1 10 . 1 1 79 79 ARG CB C 79 30.174 30.174 29.690 0.484 17355
4528 1 10 . 1 1 79 79 ARG H H 79 8.518 8.518 8.285 0.233 17355
4529 1 10 . 1 1 80 80 GLU N N 80 118.542 118.542 120.761 -2.219 17355
4530 1 10 . 1 1 80 80 GLU HA H 80 4.033 4.033 4.153 -0.120 17355
4531 1 10 . 1 1 80 80 GLU CA C 80 59.427 59.427 59.363 0.064 17355
4532 1 10 . 1 1 80 80 GLU CB C 80 30.206 30.206 29.768 0.438 17355
4533 1 10 . 1 1 80 80 GLU H H 80 7.847 7.847 8.153 -0.306 17355
4534 1 10 . 1 1 81 81 MET N N 81 119.630 119.630 119.276 0.354 17355
4535 1 10 . 1 1 81 81 MET HA H 81 4.158 4.158 4.146 0.012 17355
4536 1 10 . 1 1 81 81 MET CA C 81 59.025 59.025 59.078 -0.053 17355
4537 1 10 . 1 1 81 81 MET CB C 81 32.916 32.916 32.712 0.204 17355
4538 1 10 . 1 1 81 81 MET H H 81 8.211 8.211 8.309 -0.098 17355
4539 1 10 . 1 1 82 82 ALA N N 82 120.463 120.463 121.225 -0.762 17355
4540 1 10 . 1 1 82 82 ALA HA H 82 3.911 3.911 4.169 -0.258 17355
4541 1 10 . 1 1 82 82 ALA CA C 82 56.004 56.004 54.537 1.467 17355
4542 1 10 . 1 1 82 82 ALA CB C 82 18.430 18.430 18.318 0.112 17355
4543 1 10 . 1 1 82 82 ALA H H 82 7.978 7.978 7.579 0.399 17355
4544 1 10 . 1 1 83 83 GLU N N 83 116.663 116.663 120.047 -3.384 17355
4545 1 10 . 1 1 83 83 GLU HA H 83 4.034 4.034 3.859 0.175 17355
4546 1 10 . 1 1 83 83 GLU CA C 83 59.476 59.476 59.889 -0.413 17355
4547 1 10 . 1 1 83 83 GLU CB C 83 29.470 29.470 29.579 -0.110 17355
4548 1 10 . 1 1 83 83 GLU H H 83 8.608 8.608 7.804 0.804 17355
4549 1 10 . 1 1 84 84 ALA N N 84 122.742 122.742 120.824 1.918 17355
4550 1 10 . 1 1 84 84 ALA HA H 84 4.241 4.241 4.020 0.221 17355
4551 1 10 . 1 1 84 84 ALA CA C 84 54.970 54.970 55.098 -0.128 17355
4552 1 10 . 1 1 84 84 ALA CB C 84 18.150 18.150 18.145 0.005 17355
4553 1 10 . 1 1 84 84 ALA H H 84 7.918 7.918 7.807 0.111 17355
4554 1 10 . 1 1 85 85 LEU N N 85 119.158 119.158 118.930 0.228 17355
4555 1 10 . 1 1 85 85 LEU HA H 85 3.945 3.945 3.905 0.040 17355
4556 1 10 . 1 1 85 85 LEU CA C 85 57.849 57.849 57.350 0.499 17355
4557 1 10 . 1 1 85 85 LEU CB C 85 41.884 41.884 41.674 0.210 17355
4558 1 10 . 1 1 85 85 LEU H H 85 7.692 7.692 7.776 -0.084 17355
4559 1 10 . 1 1 86 86 GLU N N 86 118.441 118.441 118.840 -0.399 17355
4560 1 10 . 1 1 86 86 GLU HA H 86 4.053 4.053 4.028 0.025 17355
4561 1 10 . 1 1 86 86 GLU CA C 86 59.131 59.131 58.953 0.178 17355
4562 1 10 . 1 1 86 86 GLU CB C 86 29.868 29.868 29.330 0.538 17355
4563 1 10 . 1 1 86 86 GLU H H 86 8.152 8.152 8.497 -0.345 17355
4564 1 10 . 1 1 87 87 ALA N N 87 120.690 120.690 119.389 1.301 17355
4565 1 10 . 1 1 87 87 ALA HA H 87 4.139 4.139 4.531 -0.392 17355
4566 1 10 . 1 1 87 87 ALA CA C 87 54.506 54.506 52.319 2.187 17355
4567 1 10 . 1 1 87 87 ALA CB C 87 18.435 18.435 19.544 -1.109 17355
4568 1 10 . 1 1 87 87 ALA H H 87 7.899 7.899 7.741 0.158 17355
4569 1 10 . 1 1 88 88 ARG N N 88 117.642 117.642 119.083 -1.441 17355
4570 1 10 . 1 1 88 88 ARG HA H 88 4.204 4.204 4.179 0.025 17355
4571 1 10 . 1 1 88 88 ARG CA C 88 57.435 57.435 58.126 -0.691 17355
4572 1 10 . 1 1 88 88 ARG CB C 88 30.106 30.106 30.593 -0.487 17355
4573 1 10 . 1 1 88 88 ARG H H 88 7.593 7.593 7.549 0.044 17355
4574 1 10 . 1 1 89 89 GLU N N 89 121.080 121.080 117.719 3.361 17355
4575 1 10 . 1 1 89 89 GLU HA H 89 4.047 4.047 4.435 -0.388 17355
4576 1 10 . 1 1 89 89 GLU CA C 89 58.858 58.858 56.435 2.423 17355
4577 1 10 . 1 1 89 89 GLU CB C 89 29.912 29.912 27.514 2.398 17355
4578 1 10 . 1 1 89 89 GLU H H 89 8.222 8.222 7.855 0.367 17355
4579 1 10 . 1 1 90 90 ARG N N 90 117.834 117.834 119.715 -1.881 17355
4580 1 10 . 1 1 90 90 ARG HA H 90 4.212 4.212 4.411 -0.199 17355
4581 1 10 . 1 1 90 90 ARG CA C 90 57.409 57.409 56.623 0.786 17355
4582 1 10 . 1 1 90 90 ARG CB C 90 30.906 30.906 32.450 -1.544 17355
4583 1 10 . 1 1 90 90 ARG H H 90 7.924 7.924 7.502 0.422 17355
4584 1 10 . 1 1 91 91 GLU N N 91 118.786 118.786 118.856 -0.070 17355
4585 1 10 . 1 1 91 91 GLU HA H 91 4.254 4.254 4.398 -0.144 17355
4586 1 10 . 1 1 91 91 GLU CA C 91 56.693 56.693 56.791 -0.098 17355
4587 1 10 . 1 1 91 91 GLU CB C 91 30.416 30.416 30.726 -0.310 17355
4588 1 10 . 1 1 91 91 GLU H H 91 7.749 7.749 8.098 -0.349 17355
4589 1 10 . 1 1 92 92 ALA N N 92 125.247 125.247 128.023 -2.776 17355
4590 1 10 . 1 1 92 92 ALA HA H 92 4.551 4.551 4.539 0.012 17355
4591 1 10 . 1 1 92 92 ALA CA C 92 51.073 51.073 52.213 -1.140 17355
4592 1 10 . 1 1 92 92 ALA CB C 92 18.443 18.443 18.194 0.249 17355
4593 1 10 . 1 1 92 92 ALA H H 92 7.888 7.888 8.178 -0.290 17355
4594 1 10 . 1 1 93 93 PRO HA H 93 4.383 4.383 4.575 -0.192 17355
4595 1 10 . 1 1 93 93 PRO CA C 93 63.744 63.744 62.726 1.018 17355
4596 1 10 . 1 1 93 93 PRO CB C 93 32.122 32.122 32.450 -0.328 17355
4597 1 10 . 1 1 94 94 HIS N N 94 118.597 118.597 118.394 0.203 17355
4598 1 10 . 1 1 94 94 HIS HA H 94 4.639 4.639 4.624 0.015 17355
4599 1 10 . 1 1 94 94 HIS CA C 94 56.044 56.044 56.123 -0.079 17355
4600 1 10 . 1 1 94 94 HIS CB C 94 29.789 29.789 31.347 -1.558 17355
4601 1 10 . 1 1 94 94 HIS H H 94 8.392 8.392 8.346 0.046 17355
4602 1 10 . 1 1 95 95 LEU N N 95 123.443 123.443 126.307 -2.864 17355
4603 1 10 . 1 1 95 95 LEU HA H 95 4.287 4.287 4.138 0.149 17355
4604 1 10 . 1 1 95 95 LEU CA C 95 55.233 55.233 55.225 0.008 17355
4605 1 10 . 1 1 95 95 LEU CB C 95 42.710 42.710 42.017 0.693 17355
4606 1 10 . 1 1 95 95 LEU H H 95 8.061 8.061 8.456 -0.395 17355
4607 1 10 . 1 1 96 96 GLU N N 96 121.295 121.295 121.865 -0.570 17355
4608 1 10 . 1 1 96 96 GLU HA H 96 4.176 4.176 4.244 -0.068 17355
4609 1 10 . 1 1 96 96 GLU CA C 96 56.706 56.706 55.302 1.404 17355
4610 1 10 . 1 1 96 96 GLU CB C 96 30.319 30.319 30.723 -0.404 17355
4611 1 10 . 1 1 96 96 GLU H H 96 8.346 8.346 8.096 0.250 17355
4612 1 10 . 1 1 97 97 HIS N N 97 119.932 119.932 118.271 1.661 17355
4613 1 10 . 1 1 97 97 HIS HA H 97 4.555 4.555 4.788 -0.233 17355
4614 1 10 . 1 1 97 97 HIS CA C 97 56.042 56.042 56.059 -0.017 17355
4615 1 10 . 1 1 97 97 HIS H H 97 8.251 8.251 8.641 -0.390 17355
4616 1 10 . 1 1 98 98 HIS N N 98 125.446 125.446 117.934 7.512 17355
4617 1 10 . 1 1 98 98 HIS HA H 98 4.363 4.363 4.793 -0.430 17355
4618 1 10 . 1 1 98 98 HIS CA C 98 57.303 57.303 57.709 -0.406 17355
4619 1 10 . 1 1 98 98 HIS CB C 98 30.319 30.319 31.408 -1.089 17355
4620 1 10 . 1 1 98 98 HIS H H 98 8.054 8.054 8.857 -0.803 17355
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 91 2.952 -0.110 2.966 17355
2 1 1 "Average Difference" HA 99 0.293 0.079 0.283 17355
3 1 1 "Average Difference" C 0 0.000 0.000 0.000 17355
4 1 1 "Average Difference" CA 96 1.393 -0.344 1.357 17355
5 1 1 "Average Difference" CB 91 1.170 -0.098 1.173 17355
6 1 1 "Average Difference" HN 91 0.558 -0.055 0.558 17355
7 1 2 "Average Difference" N 91 3.188 -0.279 3.194 17355
8 1 2 "Average Difference" HA 99 0.293 0.075 0.285 17355
9 1 2 "Average Difference" C 0 0.000 0.000 0.000 17355
10 1 2 "Average Difference" CA 96 1.336 -0.481 1.253 17355
11 1 2 "Average Difference" CB 91 1.002 -0.111 1.001 17355
12 1 2 "Average Difference" HN 91 0.540 -0.089 0.536 17355
13 1 3 "Average Difference" N 91 2.914 -0.127 2.928 17355
14 1 3 "Average Difference" HA 99 0.313 0.038 0.312 17355
15 1 3 "Average Difference" C 0 0.000 0.000 0.000 17355
16 1 3 "Average Difference" CA 96 1.366 -0.393 1.315 17355
17 1 3 "Average Difference" CB 91 1.204 -0.193 1.195 17355
18 1 3 "Average Difference" HN 91 0.527 -0.087 0.523 17355
19 1 4 "Average Difference" N 91 3.138 -0.249 3.145 17355
20 1 4 "Average Difference" HA 99 0.304 0.064 0.298 17355
21 1 4 "Average Difference" C 0 0.000 0.000 0.000 17355
22 1 4 "Average Difference" CA 96 1.464 -0.311 1.439 17355
23 1 4 "Average Difference" CB 91 1.264 -0.079 1.268 17355
24 1 4 "Average Difference" HN 91 0.537 -0.066 0.536 17355
25 1 5 "Average Difference" N 91 2.988 -0.385 2.979 17355
26 1 5 "Average Difference" HA 99 0.288 0.067 0.281 17355
27 1 5 "Average Difference" C 0 0.000 0.000 0.000 17355
28 1 5 "Average Difference" CA 96 1.370 -0.338 1.334 17355
29 1 5 "Average Difference" CB 91 1.209 -0.160 1.205 17355
30 1 5 "Average Difference" HN 91 0.529 -0.072 0.527 17355
31 1 6 "Average Difference" N 91 3.238 -0.371 3.234 17355
32 1 6 "Average Difference" HA 99 0.290 0.062 0.285 17355
33 1 6 "Average Difference" C 0 0.000 0.000 0.000 17355
34 1 6 "Average Difference" CA 96 1.295 -0.358 1.251 17355
35 1 6 "Average Difference" CB 91 1.033 -0.068 1.037 17355
36 1 6 "Average Difference" HN 91 0.546 -0.091 0.541 17355
37 1 7 "Average Difference" N 91 3.021 -0.152 3.034 17355
38 1 7 "Average Difference" HA 99 0.274 0.049 0.271 17355
39 1 7 "Average Difference" C 0 0.000 0.000 0.000 17355
40 1 7 "Average Difference" CA 96 1.350 -0.309 1.321 17355
41 1 7 "Average Difference" CB 91 1.027 -0.062 1.031 17355
42 1 7 "Average Difference" HN 91 0.548 -0.088 0.544 17355
43 1 8 "Average Difference" N 91 3.298 -0.086 3.316 17355
44 1 8 "Average Difference" HA 99 0.287 0.085 0.275 17355
45 1 8 "Average Difference" C 0 0.000 0.000 0.000 17355
46 1 8 "Average Difference" CA 96 1.354 -0.423 1.293 17355
47 1 8 "Average Difference" CB 91 1.080 -0.101 1.081 17355
48 1 8 "Average Difference" HN 91 0.570 -0.114 0.562 17355
49 1 9 "Average Difference" N 91 3.330 -0.060 3.348 17355
50 1 9 "Average Difference" HA 99 0.306 0.092 0.293 17355
51 1 9 "Average Difference" C 0 0.000 0.000 0.000 17355
52 1 9 "Average Difference" CA 96 1.435 -0.336 1.402 17355
53 1 9 "Average Difference" CB 91 1.260 -0.103 1.263 17355
54 1 9 "Average Difference" HN 91 0.540 -0.039 0.541 17355
55 1 10 "Average Difference" N 91 3.071 -0.038 3.087 17355
56 1 10 "Average Difference" HA 99 0.291 0.066 0.285 17355
57 1 10 "Average Difference" C 0 0.000 0.000 0.000 17355
58 1 10 "Average Difference" CA 96 1.306 -0.443 1.235 17355
59 1 10 "Average Difference" CB 91 1.116 -0.081 1.120 17355
60 1 10 "Average Difference" HN 91 0.547 -0.107 0.539 17355
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 17355
_Entity_delta_chem_shifts.ID 2
_Entity_delta_chem_shifts.Details
;
This saveframe contains the averaged SPARTA chemical shift over all the models used.
;
loop_
_Delta_CS.Atom_chem_shift_ID
_Delta_CS.Entity_delta_chem_shifts_ID
_Delta_CS.Assembly_atom_ID
_Delta_CS.Entity_assembly_ID
_Delta_CS.Entity_ID
_Delta_CS.Comp_index_ID
_Delta_CS.Seq_ID
_Delta_CS.Comp_ID
_Delta_CS.Atom_ID
_Delta_CS.Atom_type
_Delta_CS.Auth_seq_ID
_Delta_CS.Original_CS_value
_Delta_CS.Corrected_CS_value
_Delta_CS.Sparta_CS_value
_Delta_CS.Delta_CS_value
_Delta_CS.Entry_ID
1 1 . 1 1 3 3 ARG HA H 3 4.321 4.321 4.335 -0.014 17355
2 1 . 1 1 3 3 ARG CA C 3 56.560 56.560 56.379 0.181 17355
3 1 . 1 1 4 4 ALA N N 4 125.797 125.797 123.825 1.972 17355
4 1 . 1 1 4 4 ALA HA H 4 4.283 4.283 4.391 -0.108 17355
5 1 . 1 1 4 4 ALA CA C 4 52.900 52.900 52.239 0.661 17355
6 1 . 1 1 4 4 ALA CB C 4 19.411 19.411 19.470 -0.059 17355
7 1 . 1 1 4 4 ALA H H 4 8.563 8.563 8.341 0.222 17355
8 1 . 1 1 5 5 ASP N N 5 118.416 118.416 119.679 -1.263 17355
9 1 . 1 1 5 5 ASP HA H 5 4.584 4.584 4.632 -0.048 17355
10 1 . 1 1 5 5 ASP CA C 5 54.337 54.337 54.147 0.190 17355
11 1 . 1 1 5 5 ASP CB C 5 41.186 41.186 41.200 -0.014 17355
12 1 . 1 1 5 5 ASP H H 5 8.208 8.208 8.255 -0.047 17355
13 1 . 1 1 6 6 ASP N N 6 120.632 120.632 120.427 0.205 17355
14 1 . 1 1 6 6 ASP HA H 6 4.578 4.578 4.533 0.045 17355
15 1 . 1 1 6 6 ASP CA C 6 54.589 54.589 54.124 0.465 17355
16 1 . 1 1 6 6 ASP CB C 6 41.239 41.239 41.613 -0.374 17355
17 1 . 1 1 6 6 ASP H H 6 8.140 8.140 8.286 -0.146 17355
18 1 . 1 1 7 7 THR N N 7 113.693 113.693 111.738 1.955 17355
19 1 . 1 1 7 7 THR HA H 7 4.245 4.245 4.375 -0.130 17355
20 1 . 1 1 7 7 THR CA C 7 62.392 62.392 62.574 -0.182 17355
21 1 . 1 1 7 7 THR CB C 7 69.721 69.721 68.713 1.008 17355
22 1 . 1 1 7 7 THR H H 7 8.045 8.045 8.214 -0.169 17355
23 1 . 1 1 8 8 ALA N N 8 126.414 126.414 126.505 -0.091 17355
24 1 . 1 1 8 8 ALA HA H 8 4.314 4.314 4.297 0.016 17355
25 1 . 1 1 8 8 ALA CA C 8 52.253 52.253 52.992 -0.738 17355
26 1 . 1 1 8 8 ALA CB C 8 19.464 19.464 19.498 -0.034 17355
27 1 . 1 1 8 8 ALA H H 8 8.139 8.139 8.144 -0.005 17355
28 1 . 1 1 9 9 LEU N N 9 122.921 122.921 119.469 3.452 17355
29 1 . 1 1 9 9 LEU HA H 9 4.559 4.559 4.628 -0.069 17355
30 1 . 1 1 9 9 LEU CA C 9 53.088 53.088 54.345 -1.257 17355
31 1 . 1 1 9 9 LEU CB C 9 41.929 41.929 42.114 -0.185 17355
32 1 . 1 1 9 9 LEU H H 9 8.113 8.113 8.059 0.054 17355
33 1 . 1 1 10 10 PRO HA H 10 4.367 4.367 4.448 -0.081 17355
34 1 . 1 1 10 10 PRO CA C 10 63.373 63.373 63.647 -0.274 17355
35 1 . 1 1 10 10 PRO CB C 10 31.975 31.975 32.238 -0.263 17355
36 1 . 1 1 11 11 ALA N N 11 124.349 124.349 120.695 3.654 17355
37 1 . 1 1 11 11 ALA HA H 11 4.262 4.262 4.353 -0.091 17355
38 1 . 1 1 11 11 ALA CA C 11 52.496 52.496 51.902 0.594 17355
39 1 . 1 1 11 11 ALA CB C 11 19.424 19.424 19.766 -0.342 17355
40 1 . 1 1 11 11 ALA H H 11 8.317 8.317 7.751 0.566 17355
41 1 . 1 1 12 12 ALA N N 12 123.291 123.291 122.546 0.745 17355
42 1 . 1 1 12 12 ALA HA H 12 4.380 4.380 4.499 -0.119 17355
43 1 . 1 1 12 12 ALA CA C 12 52.461 52.461 52.373 0.088 17355
44 1 . 1 1 12 12 ALA CB C 12 19.557 19.557 19.363 0.194 17355
45 1 . 1 1 12 12 ALA H H 12 8.287 8.287 8.147 0.141 17355
46 1 . 1 1 13 13 THR N N 13 112.758 112.758 114.071 -1.313 17355
47 1 . 1 1 13 13 THR HA H 13 4.350 4.350 4.297 0.053 17355
48 1 . 1 1 13 13 THR CA C 13 62.074 62.074 62.768 -0.694 17355
49 1 . 1 1 13 13 THR CB C 13 70.070 70.070 69.412 0.658 17355
50 1 . 1 1 13 13 THR H H 13 8.074 8.074 8.423 -0.349 17355
51 1 . 1 1 14 14 GLY N N 14 110.774 110.774 109.731 1.043 17355
52 1 . 1 1 14 14 GLY CA C 14 45.692 45.692 45.262 0.430 17355
53 1 . 1 1 14 14 GLY H H 14 8.405 8.405 7.867 0.537 17355
54 1 . 1 1 15 15 ALA N N 15 124.127 124.127 125.694 -1.567 17355
55 1 . 1 1 15 15 ALA HA H 15 4.137 4.137 4.097 0.040 17355
56 1 . 1 1 15 15 ALA CA C 15 55.368 55.368 54.319 1.050 17355
57 1 . 1 1 15 15 ALA CB C 15 20.100 20.100 18.677 1.423 17355
58 1 . 1 1 15 15 ALA H H 15 8.866 8.866 8.400 0.466 17355
59 1 . 1 1 16 16 LEU N N 16 118.013 118.013 119.893 -1.880 17355
60 1 . 1 1 16 16 LEU HA H 16 3.870 3.870 4.028 -0.158 17355
61 1 . 1 1 16 16 LEU CA C 16 58.820 58.820 57.881 0.939 17355
62 1 . 1 1 16 16 LEU CB C 16 41.332 41.332 41.299 0.033 17355
63 1 . 1 1 16 16 LEU H H 16 8.414 8.414 8.435 -0.021 17355
64 1 . 1 1 17 17 GLU N N 17 117.730 117.730 116.661 1.069 17355
65 1 . 1 1 17 17 GLU HA H 17 3.978 3.978 4.172 -0.193 17355
66 1 . 1 1 17 17 GLU CA C 17 59.909 59.909 58.006 1.903 17355
67 1 . 1 1 17 17 GLU CB C 17 29.212 29.212 28.828 0.384 17355
68 1 . 1 1 17 17 GLU H H 17 8.088 8.088 8.105 -0.017 17355
69 1 . 1 1 18 18 LEU N N 18 121.355 121.355 120.920 0.435 17355
70 1 . 1 1 18 18 LEU HA H 18 4.165 4.165 4.084 0.081 17355
71 1 . 1 1 18 18 LEU CA C 18 58.469 58.469 57.928 0.541 17355
72 1 . 1 1 18 18 LEU CB C 18 42.459 42.459 42.234 0.225 17355
73 1 . 1 1 18 18 LEU H H 18 7.767 7.767 7.428 0.339 17355
74 1 . 1 1 19 19 VAL N N 19 118.522 118.522 116.724 1.798 17355
75 1 . 1 1 19 19 VAL HA H 19 3.424 3.424 3.767 -0.343 17355
76 1 . 1 1 19 19 VAL CA C 19 67.958 67.958 66.035 1.923 17355
77 1 . 1 1 19 19 VAL CB C 19 31.922 31.922 31.925 -0.002 17355
78 1 . 1 1 19 19 VAL H H 19 8.661 8.661 7.634 1.027 17355
79 1 . 1 1 20 20 ARG N N 20 117.959 117.959 118.011 -0.052 17355
80 1 . 1 1 20 20 ARG HA H 20 3.576 3.576 4.267 -0.691 17355
81 1 . 1 1 20 20 ARG CA C 20 60.994 60.994 56.924 4.070 17355
82 1 . 1 1 20 20 ARG CB C 20 30.703 30.703 28.149 2.554 17355
83 1 . 1 1 20 20 ARG H H 20 8.705 8.705 8.250 0.455 17355
84 1 . 1 1 21 21 HIS N N 21 115.245 115.245 116.656 -1.411 17355
85 1 . 1 1 21 21 HIS HA H 21 4.144 4.144 4.572 -0.428 17355
86 1 . 1 1 21 21 HIS CA C 21 60.536 60.536 57.053 3.483 17355
87 1 . 1 1 21 21 HIS CB C 21 29.099 29.099 32.628 -3.528 17355
88 1 . 1 1 21 21 HIS H H 21 7.811 7.811 8.333 -0.522 17355
89 1 . 1 1 22 22 LEU N N 22 119.884 119.884 120.441 -0.557 17355
90 1 . 1 1 22 22 LEU HA H 22 4.078 4.078 4.135 -0.057 17355
91 1 . 1 1 22 22 LEU CA C 22 58.164 58.164 57.951 0.214 17355
92 1 . 1 1 22 22 LEU CB C 22 42.889 42.889 41.910 0.979 17355
93 1 . 1 1 22 22 LEU H H 22 8.301 8.301 7.709 0.592 17355
94 1 . 1 1 23 23 VAL N N 23 119.391 119.391 118.663 0.728 17355
95 1 . 1 1 23 23 VAL HA H 23 3.429 3.429 3.691 -0.262 17355
96 1 . 1 1 23 23 VAL CA C 23 67.179 67.179 66.552 0.627 17355
97 1 . 1 1 23 23 VAL CB C 23 31.366 31.366 31.398 -0.032 17355
98 1 . 1 1 23 23 VAL H H 23 8.897 8.897 7.472 1.425 17355
99 1 . 1 1 24 24 ALA N N 24 121.610 121.610 121.785 -0.175 17355
100 1 . 1 1 24 24 ALA HA H 24 3.851 3.851 3.997 -0.146 17355
101 1 . 1 1 24 24 ALA CA C 24 55.944 55.944 55.226 0.718 17355
102 1 . 1 1 24 24 ALA CB C 24 18.042 18.042 18.322 -0.280 17355
103 1 . 1 1 24 24 ALA H H 24 8.276 8.276 8.041 0.235 17355
104 1 . 1 1 25 25 GLU N N 25 114.822 114.822 116.486 -1.664 17355
105 1 . 1 1 25 25 GLU HA H 25 4.042 4.042 4.275 -0.233 17355
106 1 . 1 1 25 25 GLU CA C 25 59.255 59.255 58.504 0.752 17355
107 1 . 1 1 25 25 GLU CB C 25 29.951 29.951 29.139 0.812 17355
108 1 . 1 1 25 25 GLU H H 25 7.693 7.693 8.013 -0.320 17355
109 1 . 1 1 26 26 ARG N N 26 118.510 118.510 117.188 1.322 17355
110 1 . 1 1 26 26 ARG HA H 26 4.252 4.252 4.324 -0.072 17355
111 1 . 1 1 26 26 ARG CA C 26 57.090 57.090 56.476 0.614 17355
112 1 . 1 1 26 26 ARG CB C 26 30.080 30.080 30.522 -0.442 17355
113 1 . 1 1 26 26 ARG H H 26 7.783 7.783 7.724 0.059 17355
114 1 . 1 1 27 27 ALA N N 27 120.375 120.375 120.162 0.213 17355
115 1 . 1 1 27 27 ALA HA H 27 4.342 4.342 4.516 -0.174 17355
116 1 . 1 1 27 27 ALA CA C 27 52.134 52.134 51.818 0.316 17355
117 1 . 1 1 27 27 ALA CB C 27 19.283 19.283 20.618 -1.335 17355
118 1 . 1 1 27 27 ALA H H 27 8.638 8.638 7.828 0.810 17355
119 1 . 1 1 28 28 GLU N N 28 115.494 115.494 116.773 -1.279 17355
120 1 . 1 1 28 28 GLU HA H 28 3.873 3.873 4.218 -0.345 17355
121 1 . 1 1 28 28 GLU CA C 28 56.940 56.940 57.133 -0.193 17355
122 1 . 1 1 28 28 GLU CB C 28 27.058 27.058 29.507 -2.449 17355
123 1 . 1 1 28 28 GLU H H 28 7.734 7.734 8.262 -0.528 17355
124 1 . 1 1 29 29 LEU N N 29 119.978 119.978 120.867 -0.889 17355
125 1 . 1 1 29 29 LEU HA H 29 4.898 4.898 4.854 0.044 17355
126 1 . 1 1 29 29 LEU CA C 29 51.498 51.498 51.900 -0.402 17355
127 1 . 1 1 29 29 LEU CB C 29 45.348 45.348 45.065 0.283 17355
128 1 . 1 1 29 29 LEU H H 29 8.075 8.075 7.884 0.191 17355
129 1 . 1 1 30 30 PRO HA H 30 4.461 4.461 4.452 0.009 17355
130 1 . 1 1 30 30 PRO CA C 30 62.524 62.524 62.879 -0.355 17355
131 1 . 1 1 30 30 PRO CB C 30 32.015 32.015 30.328 1.687 17355
132 1 . 1 1 31 31 VAL N N 31 123.773 123.773 120.088 3.685 17355
133 1 . 1 1 31 31 VAL HA H 31 3.540 3.540 3.827 -0.287 17355
134 1 . 1 1 31 31 VAL CA C 31 65.493 65.493 64.133 1.360 17355
135 1 . 1 1 31 31 VAL CB C 31 31.865 31.865 31.567 0.298 17355
136 1 . 1 1 31 31 VAL H H 31 8.432 8.432 8.070 0.362 17355
137 1 . 1 1 32 32 GLU N N 32 117.215 117.215 120.976 -3.761 17355
138 1 . 1 1 32 32 GLU HA H 32 4.053 4.053 4.665 -0.612 17355
139 1 . 1 1 32 32 GLU CA C 32 59.131 59.131 56.836 2.295 17355
140 1 . 1 1 32 32 GLU CB C 32 28.781 28.781 30.371 -1.590 17355
141 1 . 1 1 32 32 GLU H H 32 8.971 8.971 8.269 0.702 17355
142 1 . 1 1 33 33 VAL N N 33 113.611 113.611 119.744 -6.133 17355
143 1 . 1 1 33 33 VAL HA H 33 4.214 4.214 4.181 0.033 17355
144 1 . 1 1 33 33 VAL CA C 33 61.795 61.795 61.895 -0.100 17355
145 1 . 1 1 33 33 VAL CB C 33 32.094 32.094 31.344 0.750 17355
146 1 . 1 1 33 33 VAL H H 33 7.470 7.470 7.840 -0.370 17355
147 1 . 1 1 34 34 LEU N N 34 123.533 123.533 122.716 0.817 17355
148 1 . 1 1 34 34 LEU HA H 34 4.114 4.114 4.352 -0.238 17355
149 1 . 1 1 34 34 LEU CA C 34 54.877 54.877 54.739 0.138 17355
150 1 . 1 1 34 34 LEU CB C 34 42.590 42.590 42.242 0.348 17355
151 1 . 1 1 34 34 LEU H H 34 7.300 7.300 7.732 -0.432 17355
152 1 . 1 1 35 35 ARG N N 35 125.820 125.820 125.679 0.141 17355
153 1 . 1 1 35 35 ARG HA H 35 4.578 4.578 4.170 0.408 17355
154 1 . 1 1 35 35 ARG CA C 35 54.619 54.619 56.712 -2.094 17355
155 1 . 1 1 35 35 ARG CB C 35 31.909 31.909 30.928 0.981 17355
156 1 . 1 1 35 35 ARG H H 35 8.415 8.415 8.380 0.035 17355
157 1 . 1 1 36 36 ASP N N 36 123.211 123.211 116.417 6.794 17355
158 1 . 1 1 36 36 ASP HA H 36 4.156 4.156 4.617 -0.461 17355
159 1 . 1 1 36 36 ASP CA C 36 57.258 57.258 55.579 1.680 17355
160 1 . 1 1 36 36 ASP CB C 36 40.400 40.400 41.636 -1.236 17355
161 1 . 1 1 36 36 ASP H H 36 8.880 8.880 8.558 0.322 17355
162 1 . 1 1 37 37 ASP N N 37 112.390 112.390 118.735 -6.345 17355
163 1 . 1 1 37 37 ASP HA H 37 4.614 4.614 4.706 -0.092 17355
164 1 . 1 1 37 37 ASP CA C 37 52.651 52.651 53.607 -0.956 17355
165 1 . 1 1 37 37 ASP CB C 37 40.100 40.100 40.827 -0.727 17355
166 1 . 1 1 37 37 ASP H H 37 7.800 7.800 8.200 -0.400 17355
167 1 . 1 1 38 38 SER N N 38 116.534 116.534 116.335 0.199 17355
168 1 . 1 1 38 38 SER HA H 38 4.147 4.147 4.325 -0.178 17355
169 1 . 1 1 38 38 SER CA C 38 61.186 61.186 58.318 2.868 17355
170 1 . 1 1 38 38 SER CB C 38 63.946 63.946 62.967 0.979 17355
171 1 . 1 1 38 38 SER H H 38 7.376 7.376 7.908 -0.532 17355
172 1 . 1 1 39 39 ARG N N 39 124.337 124.337 124.887 -0.550 17355
173 1 . 1 1 39 39 ARG HA H 39 4.521 4.521 4.402 0.119 17355
174 1 . 1 1 39 39 ARG CA C 39 55.049 55.049 55.394 -0.345 17355
175 1 . 1 1 39 39 ARG CB C 39 30.723 30.723 31.332 -0.609 17355
176 1 . 1 1 39 39 ARG H H 39 10.095 10.095 8.077 2.018 17355
177 1 . 1 1 40 40 PHE N N 40 122.834 122.834 119.016 3.818 17355
178 1 . 1 1 40 40 PHE HA H 40 3.916 3.916 4.695 -0.779 17355
179 1 . 1 1 40 40 PHE CA C 40 62.869 62.869 58.758 4.111 17355
180 1 . 1 1 40 40 PHE CB C 40 39.662 39.662 37.920 1.742 17355
181 1 . 1 1 40 40 PHE H H 40 7.498 7.498 8.258 -0.760 17355
182 1 . 1 1 41 41 LEU N N 41 117.682 117.682 117.723 -0.041 17355
183 1 . 1 1 41 41 LEU HA H 41 4.519 4.519 4.332 0.187 17355
184 1 . 1 1 41 41 LEU CA C 41 58.111 58.111 55.992 2.119 17355
185 1 . 1 1 41 41 LEU CB C 41 41.087 41.087 42.870 -1.783 17355
186 1 . 1 1 41 41 LEU H H 41 8.619 8.619 7.619 1.000 17355
187 1 . 1 1 42 42 ASP N N 42 114.800 114.800 120.055 -5.255 17355
188 1 . 1 1 42 42 ASP HA H 42 4.185 4.185 4.410 -0.225 17355
189 1 . 1 1 42 42 ASP CA C 42 57.713 57.713 56.107 1.607 17355
190 1 . 1 1 42 42 ASP CB C 42 41.206 41.206 40.989 0.217 17355
191 1 . 1 1 42 42 ASP H H 42 8.239 8.239 8.249 -0.010 17355
192 1 . 1 1 43 43 ASP N N 43 111.125 111.125 119.578 -8.453 17355
193 1 . 1 1 43 43 ASP HA H 43 4.915 4.915 4.539 0.376 17355
194 1 . 1 1 43 43 ASP CA C 43 56.105 56.105 55.962 0.143 17355
195 1 . 1 1 43 43 ASP CB C 43 41.703 41.703 40.896 0.807 17355
196 1 . 1 1 43 43 ASP H H 43 7.355 7.355 8.205 -0.850 17355
197 1 . 1 1 44 44 LEU N N 44 114.924 114.924 117.651 -2.727 17355
198 1 . 1 1 44 44 LEU HA H 44 4.273 4.273 4.114 0.159 17355
199 1 . 1 1 44 44 LEU CA C 44 54.480 54.480 56.426 -1.946 17355
200 1 . 1 1 44 44 LEU CB C 44 41.671 41.671 42.597 -0.926 17355
201 1 . 1 1 44 44 LEU H H 44 7.172 7.172 7.682 -0.510 17355
202 1 . 1 1 45 45 HIS N N 45 114.429 114.429 115.472 -1.044 17355
203 1 . 1 1 45 45 HIS HA H 45 4.581 4.581 4.322 0.259 17355
204 1 . 1 1 45 45 HIS CA C 45 56.189 56.189 56.400 -0.211 17355
205 1 . 1 1 45 45 HIS CB C 45 26.073 26.073 28.385 -2.313 17355
206 1 . 1 1 45 45 HIS H H 45 7.308 7.308 7.891 -0.583 17355
207 1 . 1 1 46 46 MET N N 46 118.597 118.597 121.559 -2.962 17355
208 1 . 1 1 46 46 MET HA H 46 4.614 4.614 4.804 -0.190 17355
209 1 . 1 1 46 46 MET CA C 46 55.646 55.646 54.514 1.131 17355
210 1 . 1 1 46 46 MET CB C 46 35.501 35.501 36.547 -1.046 17355
211 1 . 1 1 46 46 MET H H 46 8.618 8.618 8.164 0.454 17355
212 1 . 1 1 47 47 SER N N 47 116.110 116.110 115.814 0.295 17355
213 1 . 1 1 47 47 SER HA H 47 4.559 4.559 4.809 -0.250 17355
214 1 . 1 1 47 47 SER CA C 47 56.696 56.696 57.379 -0.683 17355
215 1 . 1 1 47 47 SER CB C 47 65.888 65.888 65.385 0.503 17355
216 1 . 1 1 47 47 SER H H 47 8.446 8.446 8.594 -0.148 17355
217 1 . 1 1 48 48 SER N N 48 116.756 116.756 117.924 -1.168 17355
218 1 . 1 1 48 48 SER HA H 48 3.701 3.701 4.181 -0.480 17355
219 1 . 1 1 48 48 SER CA C 48 62.260 62.260 62.011 0.249 17355
220 1 . 1 1 48 48 SER CB C 48 62.289 62.289 62.972 -0.683 17355
221 1 . 1 1 48 48 SER H H 48 8.948 8.948 8.813 0.136 17355
222 1 . 1 1 49 49 ILE N N 49 122.227 122.227 121.007 1.220 17355
223 1 . 1 1 49 49 ILE HA H 49 3.806 3.806 3.801 0.005 17355
224 1 . 1 1 49 49 ILE CA C 49 64.215 64.215 64.674 -0.459 17355
225 1 . 1 1 49 49 ILE CB C 49 38.059 38.059 36.516 1.542 17355
226 1 . 1 1 49 49 ILE H H 49 7.595 7.595 8.071 -0.476 17355
227 1 . 1 1 50 50 THR N N 50 120.233 120.233 116.001 4.232 17355
228 1 . 1 1 50 50 THR HA H 50 3.878 3.878 3.990 -0.113 17355
229 1 . 1 1 50 50 THR CA C 50 66.427 66.427 66.182 0.245 17355
230 1 . 1 1 50 50 THR CB C 50 68.223 68.223 68.191 0.032 17355
231 1 . 1 1 50 50 THR H H 50 7.539 7.539 7.823 -0.284 17355
232 1 . 1 1 51 51 VAL N N 51 121.320 121.320 120.858 0.462 17355
233 1 . 1 1 51 51 VAL HA H 51 3.090 3.090 3.602 -0.512 17355
234 1 . 1 1 51 51 VAL CA C 51 67.440 67.440 66.488 0.953 17355
235 1 . 1 1 51 51 VAL CB C 51 31.087 31.087 31.074 0.013 17355
236 1 . 1 1 51 51 VAL H H 51 8.178 8.178 8.554 -0.376 17355
237 1 . 1 1 52 52 GLY N N 52 105.968 105.968 105.758 0.210 17355
238 1 . 1 1 52 52 GLY CA C 52 47.339 47.339 46.552 0.787 17355
239 1 . 1 1 52 52 GLY H H 52 8.004 8.004 7.752 0.252 17355
240 1 . 1 1 53 53 GLN N N 53 120.486 120.486 118.770 1.716 17355
241 1 . 1 1 53 53 GLN HA H 53 4.086 4.086 4.220 -0.134 17355
242 1 . 1 1 53 53 GLN CA C 53 58.919 58.919 57.409 1.510 17355
243 1 . 1 1 53 53 GLN CB C 53 27.867 27.867 29.088 -1.221 17355
244 1 . 1 1 53 53 GLN H H 53 7.675 7.675 7.752 -0.077 17355
245 1 . 1 1 54 54 LEU N N 54 121.901 121.901 116.514 5.387 17355
246 1 . 1 1 54 54 LEU HA H 54 4.049 4.049 4.511 -0.462 17355
247 1 . 1 1 54 54 LEU CA C 54 58.661 58.661 56.954 1.707 17355
248 1 . 1 1 54 54 LEU CB C 54 42.426 42.426 42.117 0.308 17355
249 1 . 1 1 54 54 LEU H H 54 8.038 8.038 7.347 0.691 17355
250 1 . 1 1 55 55 VAL N N 55 119.226 119.226 120.668 -1.442 17355
251 1 . 1 1 55 55 VAL HA H 55 3.543 3.543 3.693 -0.150 17355
252 1 . 1 1 55 55 VAL CA C 55 66.871 66.871 64.780 2.091 17355
253 1 . 1 1 55 55 VAL CB C 55 31.392 31.392 30.935 0.457 17355
254 1 . 1 1 55 55 VAL H H 55 8.375 8.375 8.373 0.002 17355
255 1 . 1 1 56 56 ASN N N 56 117.987 117.987 117.268 0.719 17355
256 1 . 1 1 56 56 ASN HA H 56 4.473 4.473 4.489 -0.016 17355
257 1 . 1 1 56 56 ASN CA C 56 56.557 56.557 55.690 0.867 17355
258 1 . 1 1 56 56 ASN CB C 56 38.509 38.509 38.412 0.097 17355
259 1 . 1 1 56 56 ASN H H 56 7.521 7.521 8.310 -0.789 17355
260 1 . 1 1 57 57 GLU N N 57 121.765 121.765 119.819 1.946 17355
261 1 . 1 1 57 57 GLU HA H 57 4.070 4.070 4.222 -0.152 17355
262 1 . 1 1 57 57 GLU CA C 57 59.496 59.496 58.497 0.999 17355
263 1 . 1 1 57 57 GLU CB C 57 29.395 29.395 29.740 -0.346 17355
264 1 . 1 1 57 57 GLU H H 57 8.225 8.225 7.603 0.622 17355
265 1 . 1 1 58 58 ALA N N 58 123.779 123.779 122.025 1.754 17355
266 1 . 1 1 58 58 ALA HA H 58 3.874 3.874 4.267 -0.393 17355
267 1 . 1 1 58 58 ALA CA C 58 55.227 55.227 54.876 0.351 17355
268 1 . 1 1 58 58 ALA CB C 58 18.388 18.388 18.281 0.107 17355
269 1 . 1 1 58 58 ALA H H 58 8.659 8.659 7.472 1.187 17355
270 1 . 1 1 59 59 ALA N N 59 118.656 118.656 121.627 -2.972 17355
271 1 . 1 1 59 59 ALA HA H 59 3.819 3.819 3.947 -0.128 17355
272 1 . 1 1 59 59 ALA CA C 59 55.871 55.871 55.090 0.780 17355
273 1 . 1 1 59 59 ALA CB C 59 18.152 18.152 18.402 -0.250 17355
274 1 . 1 1 59 59 ALA H H 59 8.537 8.537 7.663 0.873 17355
275 1 . 1 1 60 60 ARG N N 60 117.701 117.701 118.583 -0.882 17355
276 1 . 1 1 60 60 ARG HA H 60 4.096 4.096 3.947 0.149 17355
277 1 . 1 1 60 60 ARG CA C 60 59.609 59.609 59.059 0.550 17355
278 1 . 1 1 60 60 ARG CB C 60 29.974 29.974 29.692 0.282 17355
279 1 . 1 1 60 60 ARG H H 60 7.923 7.923 7.726 0.197 17355
280 1 . 1 1 61 61 ALA N N 61 123.271 123.271 121.410 1.861 17355
281 1 . 1 1 61 61 ALA HA H 61 4.137 4.137 4.149 -0.012 17355
282 1 . 1 1 61 61 ALA CA C 61 54.912 54.912 54.229 0.684 17355
283 1 . 1 1 61 61 ALA CB C 61 18.304 18.304 18.447 -0.143 17355
284 1 . 1 1 61 61 ALA H H 61 8.044 8.044 7.485 0.559 17355
285 1 . 1 1 62 62 MET N N 62 114.725 114.725 116.149 -1.424 17355
286 1 . 1 1 62 62 MET HA H 62 4.297 4.297 4.231 0.066 17355
287 1 . 1 1 62 62 MET CA C 62 56.392 56.392 56.833 -0.441 17355
288 1 . 1 1 62 62 MET CB C 62 34.827 34.827 33.090 1.737 17355
289 1 . 1 1 62 62 MET H H 62 7.710 7.710 8.018 -0.308 17355
290 1 . 1 1 63 63 GLY N N 63 108.268 108.268 106.998 1.270 17355
291 1 . 1 1 63 63 GLY CA C 63 46.079 46.079 45.215 0.864 17355
292 1 . 1 1 63 63 GLY H H 63 7.846 7.846 7.683 0.163 17355
293 1 . 1 1 64 64 LEU N N 64 119.547 119.547 119.693 -0.146 17355
294 1 . 1 1 64 64 LEU HA H 64 4.526 4.526 4.584 -0.058 17355
295 1 . 1 1 64 64 LEU CA C 64 53.605 53.605 54.394 -0.789 17355
296 1 . 1 1 64 64 LEU CB C 64 43.784 43.784 42.687 1.097 17355
297 1 . 1 1 64 64 LEU H H 64 8.183 8.183 8.014 0.169 17355
298 1 . 1 1 65 65 SER N N 65 115.418 115.418 113.495 1.923 17355
299 1 . 1 1 65 65 SER HA H 65 4.328 4.328 4.420 -0.092 17355
300 1 . 1 1 65 65 SER CA C 65 58.319 58.319 58.783 -0.464 17355
301 1 . 1 1 65 65 SER CB C 65 64.181 64.181 63.427 0.754 17355
302 1 . 1 1 65 65 SER H H 65 8.302 8.302 8.283 0.019 17355
303 1 . 1 1 66 66 ALA N N 66 124.266 124.266 124.270 -0.004 17355
304 1 . 1 1 66 66 ALA HA H 66 4.212 4.212 4.586 -0.374 17355
305 1 . 1 1 66 66 ALA CA C 66 52.624 52.624 52.708 -0.084 17355
306 1 . 1 1 66 66 ALA CB C 66 19.309 19.309 19.136 0.173 17355
307 1 . 1 1 66 66 ALA H H 66 8.262 8.262 8.141 0.121 17355
308 1 . 1 1 67 67 VAL N N 67 118.373 118.373 117.781 0.592 17355
309 1 . 1 1 67 67 VAL HA H 67 4.049 4.049 4.075 -0.026 17355
310 1 . 1 1 67 67 VAL CA C 67 62.010 62.010 62.747 -0.737 17355
311 1 . 1 1 67 67 VAL CB C 67 33.495 33.495 32.258 1.237 17355
312 1 . 1 1 67 67 VAL H H 67 7.949 7.949 7.449 0.501 17355
313 1 . 1 1 68 68 ALA N N 68 127.696 127.696 120.351 7.345 17355
314 1 . 1 1 68 68 ALA HA H 68 4.308 4.308 4.050 0.258 17355
315 1 . 1 1 68 68 ALA CA C 68 52.070 52.070 53.933 -1.863 17355
316 1 . 1 1 68 68 ALA CB C 68 19.220 19.220 17.654 1.566 17355
317 1 . 1 1 68 68 ALA H H 68 8.319 8.319 8.179 0.140 17355
318 1 . 1 1 69 69 MET N N 69 120.285 120.285 114.008 6.277 17355
319 1 . 1 1 69 69 MET HA H 69 4.664 4.664 4.794 -0.130 17355
320 1 . 1 1 69 69 MET CA C 69 53.004 53.004 53.922 -0.918 17355
321 1 . 1 1 69 69 MET CB C 69 32.678 32.678 33.073 -0.395 17355
322 1 . 1 1 69 69 MET H H 69 8.224 8.224 7.879 0.345 17355
323 1 . 1 1 70 70 PRO HA H 70 4.446 4.446 4.437 0.009 17355
324 1 . 1 1 70 70 PRO CA C 70 63.452 63.452 64.694 -1.242 17355
325 1 . 1 1 70 70 PRO CB C 70 32.012 32.012 32.248 -0.236 17355
326 1 . 1 1 71 71 THR N N 71 112.663 112.663 109.627 3.036 17355
327 1 . 1 1 71 71 THR HA H 71 4.074 4.074 3.768 0.306 17355
328 1 . 1 1 71 71 THR CA C 71 62.869 62.869 61.347 1.522 17355
329 1 . 1 1 71 71 THR CB C 71 69.516 69.516 69.716 -0.200 17355
330 1 . 1 1 71 71 THR H H 71 7.957 7.957 7.512 0.445 17355
331 1 . 1 1 72 72 ASN N N 72 120.054 120.054 119.182 0.872 17355
332 1 . 1 1 72 72 ASN HA H 72 4.695 4.695 3.947 0.747 17355
333 1 . 1 1 72 72 ASN CA C 72 52.856 52.856 55.979 -3.123 17355
334 1 . 1 1 72 72 ASN CB C 72 38.165 38.165 37.630 0.535 17355
335 1 . 1 1 72 72 ASN H H 72 8.227 8.227 8.216 0.011 17355
336 1 . 1 1 73 73 PHE N N 73 121.570 121.570 115.280 6.290 17355
337 1 . 1 1 73 73 PHE HA H 73 4.342 4.342 3.738 0.604 17355
338 1 . 1 1 73 73 PHE CA C 73 59.609 59.609 60.436 -0.827 17355
339 1 . 1 1 73 73 PHE CB C 73 39.000 39.000 36.757 2.244 17355
340 1 . 1 1 73 73 PHE H H 73 8.331 8.331 8.240 0.091 17355
341 1 . 1 1 74 74 ALA N N 74 121.047 121.047 122.066 -1.019 17355
342 1 . 1 1 74 74 ALA HA H 74 4.074 4.074 4.162 -0.088 17355
343 1 . 1 1 74 74 ALA CA C 74 54.705 54.705 54.937 -0.231 17355
344 1 . 1 1 74 74 ALA CB C 74 19.159 19.159 19.008 0.151 17355
345 1 . 1 1 74 74 ALA H H 74 8.163 8.163 8.060 0.103 17355
346 1 . 1 1 75 75 THR N N 75 104.824 104.824 113.738 -8.914 17355
347 1 . 1 1 75 75 THR HA H 75 4.475 4.475 4.358 0.117 17355
348 1 . 1 1 75 75 THR CA C 75 60.669 60.669 61.648 -0.979 17355
349 1 . 1 1 75 75 THR CB C 75 69.543 69.543 66.671 2.872 17355
350 1 . 1 1 75 75 THR H H 75 7.581 7.581 8.236 -0.655 17355
351 1 . 1 1 76 76 ALA N N 76 124.548 124.548 126.720 -2.172 17355
352 1 . 1 1 76 76 ALA HA H 76 4.714 4.714 4.854 -0.140 17355
353 1 . 1 1 76 76 ALA CA C 76 52.929 52.929 50.739 2.190 17355
354 1 . 1 1 76 76 ALA CB C 76 20.661 20.661 22.128 -1.467 17355
355 1 . 1 1 76 76 ALA H H 76 7.689 7.689 7.978 -0.289 17355
356 1 . 1 1 77 77 THR N N 77 108.654 108.654 110.947 -2.293 17355
357 1 . 1 1 77 77 THR HA H 77 5.017 5.017 4.612 0.406 17355
358 1 . 1 1 77 77 THR CA C 77 58.847 58.847 59.805 -0.958 17355
359 1 . 1 1 77 77 THR CB C 77 73.369 73.369 71.922 1.448 17355
360 1 . 1 1 77 77 THR H H 77 7.495 7.495 8.182 -0.687 17355
361 1 . 1 1 78 78 VAL N N 78 120.107 120.107 117.532 2.575 17355
362 1 . 1 1 78 78 VAL HA H 78 3.418 3.418 4.021 -0.603 17355
363 1 . 1 1 78 78 VAL CA C 78 67.446 67.446 66.522 0.924 17355
364 1 . 1 1 78 78 VAL CB C 78 31.949 31.949 31.486 0.463 17355
365 1 . 1 1 78 78 VAL H H 78 7.373 7.373 7.988 -0.615 17355
366 1 . 1 1 79 79 ARG N N 79 117.131 117.131 118.815 -1.684 17355
367 1 . 1 1 79 79 ARG HA H 79 3.877 3.877 4.150 -0.273 17355
368 1 . 1 1 79 79 ARG CA C 79 59.566 59.566 58.263 1.303 17355
369 1 . 1 1 79 79 ARG CB C 79 30.174 30.174 29.618 0.556 17355
370 1 . 1 1 79 79 ARG H H 79 8.518 8.518 7.915 0.603 17355
371 1 . 1 1 80 80 GLU N N 80 118.542 118.542 120.697 -2.155 17355
372 1 . 1 1 80 80 GLU HA H 80 4.033 4.033 4.111 -0.078 17355
373 1 . 1 1 80 80 GLU CA C 80 59.427 59.427 59.526 -0.099 17355
374 1 . 1 1 80 80 GLU CB C 80 30.206 30.206 29.643 0.563 17355
375 1 . 1 1 80 80 GLU H H 80 7.847 7.847 8.056 -0.209 17355
376 1 . 1 1 81 81 MET N N 81 119.630 119.630 119.125 0.505 17355
377 1 . 1 1 81 81 MET HA H 81 4.158 4.158 4.142 0.016 17355
378 1 . 1 1 81 81 MET CA C 81 59.025 59.025 59.053 -0.028 17355
379 1 . 1 1 81 81 MET CB C 81 32.916 32.916 32.663 0.253 17355
380 1 . 1 1 81 81 MET H H 81 8.211 8.211 8.305 -0.095 17355
381 1 . 1 1 82 82 ALA N N 82 120.463 120.463 121.566 -1.103 17355
382 1 . 1 1 82 82 ALA HA H 82 3.911 3.911 4.170 -0.259 17355
383 1 . 1 1 82 82 ALA CA C 82 56.004 56.004 54.509 1.495 17355
384 1 . 1 1 82 82 ALA CB C 82 18.430 18.430 18.338 0.092 17355
385 1 . 1 1 82 82 ALA H H 82 7.978 7.978 7.555 0.423 17355
386 1 . 1 1 83 83 GLU N N 83 116.663 116.663 119.936 -3.273 17355
387 1 . 1 1 83 83 GLU HA H 83 4.034 4.034 3.885 0.149 17355
388 1 . 1 1 83 83 GLU CA C 83 59.476 59.476 59.758 -0.282 17355
389 1 . 1 1 83 83 GLU CB C 83 29.470 29.470 29.607 -0.137 17355
390 1 . 1 1 83 83 GLU H H 83 8.608 8.608 7.983 0.625 17355
391 1 . 1 1 84 84 ALA N N 84 122.742 122.742 121.210 1.532 17355
392 1 . 1 1 84 84 ALA HA H 84 4.241 4.241 3.994 0.247 17355
393 1 . 1 1 84 84 ALA CA C 84 54.970 54.970 55.258 -0.288 17355
394 1 . 1 1 84 84 ALA CB C 84 18.150 18.150 18.152 -0.002 17355
395 1 . 1 1 84 84 ALA H H 84 7.918 7.918 7.938 -0.020 17355
396 1 . 1 1 85 85 LEU N N 85 119.158 119.158 118.592 0.566 17355
397 1 . 1 1 85 85 LEU HA H 85 3.945 3.945 3.906 0.039 17355
398 1 . 1 1 85 85 LEU CA C 85 57.849 57.849 57.443 0.406 17355
399 1 . 1 1 85 85 LEU CB C 85 41.884 41.884 41.702 0.182 17355
400 1 . 1 1 85 85 LEU H H 85 7.692 7.692 7.728 -0.036 17355
401 1 . 1 1 86 86 GLU N N 86 118.441 118.441 119.973 -1.532 17355
402 1 . 1 1 86 86 GLU HA H 86 4.053 4.053 4.172 -0.119 17355
403 1 . 1 1 86 86 GLU CA C 86 59.131 59.131 58.876 0.255 17355
404 1 . 1 1 86 86 GLU CB C 86 29.868 29.868 29.319 0.548 17355
405 1 . 1 1 86 86 GLU H H 86 8.152 8.152 8.470 -0.318 17355
406 1 . 1 1 87 87 ALA N N 87 120.690 120.690 120.968 -0.278 17355
407 1 . 1 1 87 87 ALA HA H 87 4.139 4.139 4.395 -0.256 17355
408 1 . 1 1 87 87 ALA CA C 87 54.506 54.506 53.388 1.118 17355
409 1 . 1 1 87 87 ALA CB C 87 18.435 18.435 19.279 -0.844 17355
410 1 . 1 1 87 87 ALA H H 87 7.899 7.899 7.947 -0.048 17355
411 1 . 1 1 88 88 ARG N N 88 117.642 117.642 119.541 -1.899 17355
412 1 . 1 1 88 88 ARG HA H 88 4.204 4.204 4.015 0.189 17355
413 1 . 1 1 88 88 ARG CA C 88 57.435 57.435 59.072 -1.637 17355
414 1 . 1 1 88 88 ARG CB C 88 30.106 30.106 29.909 0.197 17355
415 1 . 1 1 88 88 ARG H H 88 7.593 7.593 8.258 -0.665 17355
416 1 . 1 1 89 89 GLU N N 89 121.080 121.080 117.545 3.535 17355
417 1 . 1 1 89 89 GLU HA H 89 4.047 4.047 4.086 -0.039 17355
418 1 . 1 1 89 89 GLU CA C 89 58.858 58.858 58.518 0.340 17355
419 1 . 1 1 89 89 GLU CB C 89 29.912 29.912 29.013 0.899 17355
420 1 . 1 1 89 89 GLU H H 89 8.222 8.222 7.795 0.427 17355
421 1 . 1 1 90 90 ARG N N 90 117.834 117.834 118.847 -1.013 17355
422 1 . 1 1 90 90 ARG HA H 90 4.212 4.212 4.187 0.025 17355
423 1 . 1 1 90 90 ARG CA C 90 57.409 57.409 57.942 -0.533 17355
424 1 . 1 1 90 90 ARG CB C 90 30.906 30.906 30.808 0.098 17355
425 1 . 1 1 90 90 ARG H H 90 7.924 7.924 7.655 0.269 17355
426 1 . 1 1 91 91 GLU N N 91 118.786 118.786 118.256 0.530 17355
427 1 . 1 1 91 91 GLU HA H 91 4.254 4.254 4.375 -0.121 17355
428 1 . 1 1 91 91 GLU CA C 91 56.693 56.693 56.305 0.388 17355
429 1 . 1 1 91 91 GLU CB C 91 30.416 30.416 30.665 -0.249 17355
430 1 . 1 1 91 91 GLU H H 91 7.749 7.749 7.817 -0.068 17355
431 1 . 1 1 92 92 ALA N N 92 125.247 125.247 125.706 -0.459 17355
432 1 . 1 1 92 92 ALA HA H 92 4.551 4.551 4.444 0.107 17355
433 1 . 1 1 92 92 ALA CA C 92 51.073 51.073 52.038 -0.964 17355
434 1 . 1 1 92 92 ALA CB C 92 18.443 18.443 17.991 0.452 17355
435 1 . 1 1 92 92 ALA H H 92 7.888 7.888 7.980 -0.092 17355
436 1 . 1 1 93 93 PRO HA H 93 4.383 4.383 4.401 -0.017 17355
437 1 . 1 1 93 93 PRO CA C 93 63.744 63.744 63.132 0.612 17355
438 1 . 1 1 93 93 PRO CB C 93 32.122 32.122 32.193 -0.070 17355
439 1 . 1 1 94 94 HIS N N 94 118.597 118.597 116.967 1.630 17355
440 1 . 1 1 94 94 HIS HA H 94 4.639 4.639 4.648 -0.010 17355
441 1 . 1 1 94 94 HIS CA C 94 56.044 56.044 56.060 -0.016 17355
442 1 . 1 1 94 94 HIS CB C 94 29.789 29.789 30.381 -0.592 17355
443 1 . 1 1 94 94 HIS H H 94 8.392 8.392 8.311 0.081 17355
444 1 . 1 1 95 95 LEU N N 95 123.443 123.443 121.663 1.780 17355
445 1 . 1 1 95 95 LEU HA H 95 4.287 4.287 4.548 -0.261 17355
446 1 . 1 1 95 95 LEU CA C 95 55.233 55.233 54.602 0.631 17355
447 1 . 1 1 95 95 LEU CB C 95 42.710 42.710 43.468 -0.758 17355
448 1 . 1 1 95 95 LEU H H 95 8.061 8.061 8.107 -0.046 17355
449 1 . 1 1 96 96 GLU N N 96 121.295 121.295 120.401 0.894 17355
450 1 . 1 1 96 96 GLU HA H 96 4.176 4.176 4.587 -0.411 17355
451 1 . 1 1 96 96 GLU CA C 96 56.706 56.706 55.922 0.784 17355
452 1 . 1 1 96 96 GLU CB C 96 30.319 30.319 31.114 -0.795 17355
453 1 . 1 1 96 96 GLU H H 96 8.346 8.346 8.413 -0.067 17355
454 1 . 1 1 97 97 HIS N N 97 119.932 119.932 119.576 0.356 17355
455 1 . 1 1 97 97 HIS HA H 97 4.555 4.555 4.771 -0.216 17355
456 1 . 1 1 97 97 HIS CA C 97 56.042 56.042 55.909 0.133 17355
457 1 . 1 1 97 97 HIS H H 97 8.251 8.251 8.691 -0.440 17355
458 1 . 1 1 98 98 HIS N N 98 125.446 125.446 118.646 6.800 17355
459 1 . 1 1 98 98 HIS HA H 98 4.363 4.363 4.697 -0.334 17355
460 1 . 1 1 98 98 HIS CA C 98 57.303 57.303 56.008 1.295 17355
461 1 . 1 1 98 98 HIS CB C 98 30.319 30.319 30.571 -0.252 17355
462 1 . 1 1 98 98 HIS H H 98 8.054 8.054 8.388 -0.334 17355
stop_
save_