data_19439
save_entry_information
_Entry.Sf_category entry_information
_Entry.NMR_STAR_version 3.0.9.13
_Entry.Entry_ID 19439
_Entry.PDB_ID 2MCH
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 19439
_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 59 59 ALA N N 59 123.310 123.310 123.544 -0.234 19439
2 1 1 . 1 1 59 59 ALA HA H 59 4.232 4.232 4.404 -0.172 19439
3 1 1 . 1 1 59 59 ALA CA C 59 52.274 52.274 53.309 -1.035 19439
4 1 1 . 1 1 59 59 ALA CB C 59 19.623 19.623 18.906 0.717 19439
5 1 1 . 1 1 59 59 ALA H H 59 7.894 7.894 7.941 -0.047 19439
6 1 1 . 1 1 60 60 LEU N N 60 120.936 120.936 114.830 6.106 19439
7 1 1 . 1 1 60 60 LEU HA H 60 4.364 4.364 4.376 -0.012 19439
8 1 1 . 1 1 60 60 LEU CA C 60 54.130 54.130 54.677 -0.547 19439
9 1 1 . 1 1 60 60 LEU CB C 60 43.209 43.209 40.967 2.242 19439
10 1 1 . 1 1 60 60 LEU H H 60 8.046 8.046 7.687 0.359 19439
11 1 1 . 1 1 61 61 ALA N N 61 125.460 125.460 122.405 3.055 19439
12 1 1 . 1 1 61 61 ALA HA H 61 4.364 4.364 4.312 0.052 19439
13 1 1 . 1 1 61 61 ALA CA C 61 51.176 51.176 51.844 -0.668 19439
14 1 1 . 1 1 61 61 ALA CB C 61 20.172 20.172 19.715 0.457 19439
15 1 1 . 1 1 61 61 ALA H H 61 8.338 8.338 7.525 0.813 19439
16 1 1 . 1 1 62 62 ALA N N 62 127.765 127.765 127.119 0.646 19439
17 1 1 . 1 1 62 62 ALA HA H 62 4.394 4.394 4.671 -0.277 19439
18 1 1 . 1 1 62 62 ALA CA C 62 51.888 51.888 50.781 1.107 19439
19 1 1 . 1 1 62 62 ALA CB C 62 18.806 18.806 21.149 -2.343 19439
20 1 1 . 1 1 62 62 ALA H H 62 8.487 8.487 9.035 -0.548 19439
21 1 1 . 1 1 63 63 LEU N N 63 120.199 120.199 120.570 -0.371 19439
22 1 1 . 1 1 63 63 LEU HA H 63 4.828 4.828 4.948 -0.120 19439
23 1 1 . 1 1 63 63 LEU CA C 63 51.852 51.852 53.023 -1.171 19439
24 1 1 . 1 1 63 63 LEU CB C 63 44.081 44.081 45.587 -1.506 19439
25 1 1 . 1 1 63 63 LEU H H 63 7.927 7.927 8.271 -0.344 19439
26 1 1 . 1 1 64 64 HIS N N 64 122.277 122.277 119.187 3.090 19439
27 1 1 . 1 1 64 64 HIS HA H 64 4.114 4.114 4.575 -0.461 19439
28 1 1 . 1 1 64 64 HIS CA C 64 58.038 58.038 56.982 1.056 19439
29 1 1 . 1 1 64 64 HIS CB C 64 31.228 31.228 31.493 -0.265 19439
30 1 1 . 1 1 64 64 HIS H H 64 8.477 8.477 8.823 -0.346 19439
31 1 1 . 1 1 65 65 ALA HA H 65 4.339 4.339 4.447 -0.108 19439
32 1 1 . 1 1 65 65 ALA CA C 65 53.281 53.281 52.328 0.953 19439
33 1 1 . 1 1 65 65 ALA CB C 65 20.276 20.276 19.825 0.451 19439
34 1 1 . 1 1 66 66 GLU N N 66 113.868 113.868 117.347 -3.479 19439
35 1 1 . 1 1 66 66 GLU HA H 66 4.619 4.619 4.494 0.125 19439
36 1 1 . 1 1 66 66 GLU CA C 66 54.727 54.727 54.867 -0.140 19439
37 1 1 . 1 1 66 66 GLU CB C 66 32.894 32.894 31.938 0.956 19439
38 1 1 . 1 1 66 66 GLU H H 66 7.759 7.759 7.975 -0.216 19439
39 1 1 . 1 1 68 68 PRO HA H 68 4.219 4.219 4.276 -0.057 19439
40 1 1 . 1 1 68 68 PRO CA C 68 64.664 64.664 65.026 -0.362 19439
41 1 1 . 1 1 68 68 PRO CB C 68 32.066 32.066 31.682 0.384 19439
42 1 1 . 1 1 69 69 LEU N N 69 117.262 117.262 118.195 -0.933 19439
43 1 1 . 1 1 69 69 LEU HA H 69 4.182 4.182 4.168 0.014 19439
44 1 1 . 1 1 69 69 LEU CA C 69 52.430 52.430 53.608 -1.178 19439
45 1 1 . 1 1 69 69 LEU CB C 69 40.907 40.907 41.218 -0.311 19439
46 1 1 . 1 1 69 69 LEU H H 69 8.439 8.439 7.925 0.514 19439
47 1 1 . 1 1 70 70 ALA N N 70 120.426 120.426 120.960 -0.534 19439
48 1 1 . 1 1 70 70 ALA HA H 70 3.411 3.411 4.205 -0.794 19439
49 1 1 . 1 1 70 70 ALA CA C 70 53.685 53.685 53.488 0.197 19439
50 1 1 . 1 1 70 70 ALA CB C 70 17.914 17.914 18.633 -0.719 19439
51 1 1 . 1 1 70 70 ALA H H 70 7.113 7.113 7.418 -0.305 19439
52 1 1 . 1 1 71 71 GLY N N 71 108.911 108.911 112.676 -3.765 19439
53 1 1 . 1 1 71 71 GLY CA C 71 45.215 45.215 45.033 0.182 19439
54 1 1 . 1 1 71 71 GLY H H 71 8.856 8.856 8.754 0.102 19439
55 1 1 . 1 1 72 72 LEU N N 72 120.000 120.000 121.581 -1.581 19439
56 1 1 . 1 1 72 72 LEU HA H 72 4.769 4.769 4.913 -0.144 19439
57 1 1 . 1 1 72 72 LEU CA C 72 51.972 51.972 51.535 0.437 19439
58 1 1 . 1 1 72 72 LEU CB C 72 41.255 41.255 42.821 -1.566 19439
59 1 1 . 1 1 72 72 LEU H H 72 8.136 8.136 8.024 0.112 19439
60 1 1 . 1 1 73 73 PRO HA H 73 4.739 4.739 4.640 0.099 19439
61 1 1 . 1 1 73 73 PRO CA C 73 61.456 61.456 62.816 -1.360 19439
62 1 1 . 1 1 73 73 PRO CB C 73 31.245 31.245 31.939 -0.694 19439
63 1 1 . 1 1 74 74 VAL N N 74 121.723 121.723 120.027 1.696 19439
64 1 1 . 1 1 74 74 VAL HA H 74 3.446 3.446 3.746 -0.300 19439
65 1 1 . 1 1 74 74 VAL CA C 74 65.744 65.744 63.801 1.943 19439
66 1 1 . 1 1 74 74 VAL CB C 74 31.236 31.236 31.939 -0.703 19439
67 1 1 . 1 1 74 74 VAL H H 74 7.710 7.710 8.106 -0.396 19439
68 1 1 . 1 1 75 75 THR N N 75 108.893 108.893 108.575 0.318 19439
69 1 1 . 1 1 75 75 THR HA H 75 4.937 4.937 4.622 0.315 19439
70 1 1 . 1 1 75 75 THR CA C 75 59.892 59.892 59.479 0.413 19439
71 1 1 . 1 1 75 75 THR CB C 75 12.018 12.018 71.862 -59.844 19439
72 1 1 . 1 1 75 75 THR H H 75 8.710 8.710 7.931 0.779 19439
73 1 1 . 1 1 76 76 ARG HA H 76 3.873 3.873 3.941 -0.068 19439
74 1 1 . 1 1 76 76 ARG H H 76 8.447 8.447 8.887 -0.440 19439
75 1 1 . 1 1 77 77 SER N N 77 114.482 114.482 114.967 -0.485 19439
76 1 1 . 1 1 77 77 SER HA H 77 4.061 4.061 4.202 -0.141 19439
77 1 1 . 1 1 77 77 SER CA C 77 60.467 60.467 61.447 -0.980 19439
78 1 1 . 1 1 77 77 SER CB C 77 62.449 62.449 62.646 -0.197 19439
79 1 1 . 1 1 77 77 SER H H 77 8.105 8.105 8.004 0.101 19439
80 1 1 . 1 1 78 78 ASP N N 78 120.538 120.538 122.653 -2.115 19439
81 1 1 . 1 1 78 78 ASP HA H 78 4.333 4.333 4.332 0.001 19439
82 1 1 . 1 1 78 78 ASP CA C 78 58.020 58.020 57.272 0.749 19439
83 1 1 . 1 1 78 78 ASP CB C 78 43.252 43.252 40.350 2.902 19439
84 1 1 . 1 1 78 78 ASP H H 78 7.300 7.300 8.073 -0.773 19439
85 1 1 . 1 1 79 79 ALA N N 79 120.614 120.614 122.811 -2.197 19439
86 1 1 . 1 1 79 79 ALA HA H 79 3.672 3.672 3.866 -0.194 19439
87 1 1 . 1 1 79 79 ALA CA C 79 54.886 54.886 55.170 -0.284 19439
88 1 1 . 1 1 79 79 ALA CB C 79 19.628 19.628 18.285 1.343 19439
89 1 1 . 1 1 79 79 ALA H H 79 7.767 7.767 8.227 -0.460 19439
90 1 1 . 1 1 80 80 ARG N N 80 116.203 116.203 119.182 -2.979 19439
91 1 1 . 1 1 80 80 ARG HA H 80 3.732 3.732 4.006 -0.274 19439
92 1 1 . 1 1 80 80 ARG CA C 80 61.441 61.441 59.525 1.916 19439
93 1 1 . 1 1 80 80 ARG CB C 80 30.266 30.266 30.415 -0.149 19439
94 1 1 . 1 1 80 80 ARG H H 80 7.981 7.981 8.077 -0.096 19439
95 1 1 . 1 1 81 81 VAL N N 81 119.192 119.192 119.560 -0.368 19439
96 1 1 . 1 1 81 81 VAL HA H 81 3.582 3.582 3.947 -0.365 19439
97 1 1 . 1 1 81 81 VAL CA C 81 66.909 66.909 66.444 0.465 19439
98 1 1 . 1 1 81 81 VAL CB C 81 31.668 31.668 31.759 -0.091 19439
99 1 1 . 1 1 81 81 VAL H H 81 7.338 7.338 8.128 -0.790 19439
100 1 1 . 1 1 82 82 LEU N N 82 118.722 118.722 122.060 -3.338 19439
101 1 1 . 1 1 82 82 LEU HA H 82 4.044 4.044 3.966 0.078 19439
102 1 1 . 1 1 82 82 LEU CA C 82 58.356 58.356 58.668 -0.312 19439
103 1 1 . 1 1 82 82 LEU CB C 82 41.627 41.627 41.675 -0.048 19439
104 1 1 . 1 1 82 82 LEU H H 82 7.599 7.599 8.403 -0.804 19439
105 1 1 . 1 1 83 83 ILE N N 83 120.893 120.893 119.896 0.997 19439
106 1 1 . 1 1 83 83 ILE HA H 83 3.642 3.642 3.731 -0.089 19439
107 1 1 . 1 1 83 83 ILE CA C 83 65.669 65.669 65.557 0.112 19439
108 1 1 . 1 1 83 83 ILE CB C 83 38.579 38.579 37.973 0.606 19439
109 1 1 . 1 1 83 83 ILE H H 83 8.546 8.546 8.343 0.203 19439
110 1 1 . 1 1 84 84 PHE N N 84 123.343 123.343 120.589 2.754 19439
111 1 1 . 1 1 84 84 PHE HA H 84 4.084 4.084 4.051 0.033 19439
112 1 1 . 1 1 84 84 PHE CA C 84 62.593 62.593 60.708 1.885 19439
113 1 1 . 1 1 84 84 PHE CB C 84 39.211 39.211 38.715 0.496 19439
114 1 1 . 1 1 84 84 PHE H H 84 8.622 8.622 8.485 0.137 19439
115 1 1 . 1 1 85 85 ASN N N 85 118.037 118.037 118.562 -0.525 19439
116 1 1 . 1 1 85 85 ASN HA H 85 4.426 4.426 4.000 0.426 19439
117 1 1 . 1 1 85 85 ASN CA C 85 56.045 56.045 56.294 -0.249 19439
118 1 1 . 1 1 85 85 ASN CB C 85 37.785 37.785 38.060 -0.275 19439
119 1 1 . 1 1 85 85 ASN H H 85 8.834 8.834 8.560 0.274 19439
120 1 1 . 1 1 86 86 GLU N N 86 121.098 121.098 121.749 -0.651 19439
121 1 1 . 1 1 86 86 GLU HA H 86 4.052 4.052 3.979 0.073 19439
122 1 1 . 1 1 86 86 GLU CA C 86 59.328 59.328 59.575 -0.247 19439
123 1 1 . 1 1 86 86 GLU CB C 86 30.253 30.253 29.624 0.629 19439
124 1 1 . 1 1 86 86 GLU H H 86 8.105 8.105 8.254 -0.149 19439
125 1 1 . 1 1 87 87 TRP N N 87 122.584 122.584 121.897 0.687 19439
126 1 1 . 1 1 87 87 TRP HA H 87 4.006 4.006 4.146 -0.140 19439
127 1 1 . 1 1 87 87 TRP CA C 87 61.545 61.545 61.677 -0.132 19439
128 1 1 . 1 1 87 87 TRP CB C 87 27.943 27.943 29.412 -1.469 19439
129 1 1 . 1 1 87 87 TRP H H 87 8.099 8.099 8.704 -0.605 19439
130 1 1 . 1 1 88 88 GLU N N 88 117.357 117.357 119.527 -2.170 19439
131 1 1 . 1 1 88 88 GLU HA H 88 2.919 2.919 3.148 -0.229 19439
132 1 1 . 1 1 88 88 GLU CA C 88 59.804 59.804 59.221 0.583 19439
133 1 1 . 1 1 88 88 GLU CB C 88 29.546 29.546 28.956 0.590 19439
134 1 1 . 1 1 88 88 GLU H H 88 8.440 8.440 8.456 -0.016 19439
135 1 1 . 1 1 89 89 GLU N N 89 116.109 116.109 119.894 -3.785 19439
136 1 1 . 1 1 89 89 GLU HA H 89 3.995 3.995 3.860 0.135 19439
137 1 1 . 1 1 89 89 GLU CA C 89 58.329 58.329 59.468 -1.139 19439
138 1 1 . 1 1 89 89 GLU CB C 89 29.649 29.649 29.511 0.138 19439
139 1 1 . 1 1 89 89 GLU H H 89 7.244 7.244 7.942 -0.698 19439
140 1 1 . 1 1 90 90 ARG N N 90 120.512 120.512 118.351 2.161 19439
141 1 1 . 1 1 90 90 ARG HA H 90 3.920 3.920 3.885 0.035 19439
142 1 1 . 1 1 90 90 ARG CA C 90 58.683 58.683 58.844 -0.162 19439
143 1 1 . 1 1 90 90 ARG CB C 90 30.659 30.659 29.620 1.039 19439
144 1 1 . 1 1 90 90 ARG H H 90 8.368 8.368 8.311 0.057 19439
145 1 1 . 1 1 91 91 LYS N N 91 120.024 120.024 119.714 0.310 19439
146 1 1 . 1 1 91 91 LYS HA H 91 3.964 3.964 4.006 -0.042 19439
147 1 1 . 1 1 91 91 LYS CA C 91 57.278 57.278 58.797 -1.519 19439
148 1 1 . 1 1 91 91 LYS CB C 91 30.582 30.582 31.335 -0.753 19439
149 1 1 . 1 1 91 91 LYS H H 91 8.491 8.491 7.944 0.547 19439
150 1 1 . 1 1 92 92 LYS N N 92 118.192 118.192 118.787 -0.595 19439
151 1 1 . 1 1 92 92 LYS HA H 92 3.796 3.796 4.089 -0.293 19439
152 1 1 . 1 1 92 92 LYS CA C 92 58.976 58.976 58.713 0.263 19439
153 1 1 . 1 1 92 92 LYS CB C 92 32.188 32.188 32.320 -0.132 19439
154 1 1 . 1 1 92 92 LYS H H 92 6.933 6.933 7.785 -0.852 19439
155 1 1 . 1 1 93 93 SER N N 93 110.447 110.447 113.810 -3.363 19439
156 1 1 . 1 1 93 93 SER HA H 93 4.484 4.484 4.325 0.159 19439
157 1 1 . 1 1 93 93 SER CA C 93 58.386 58.386 60.765 -2.379 19439
158 1 1 . 1 1 93 93 SER CB C 93 64.173 64.173 64.174 -0.002 19439
159 1 1 . 1 1 93 93 SER H H 93 7.282 7.282 7.724 -0.442 19439
160 1 1 . 1 1 94 94 ASP N N 94 120.163 120.163 119.817 0.346 19439
161 1 1 . 1 1 94 94 ASP HA H 94 4.872 4.872 5.175 -0.303 19439
162 1 1 . 1 1 94 94 ASP CA C 94 51.157 51.157 52.602 -1.445 19439
163 1 1 . 1 1 94 94 ASP CB C 94 41.256 41.256 43.789 -2.533 19439
164 1 1 . 1 1 94 94 ASP H H 94 7.303 7.303 8.280 -0.977 19439
165 1 1 . 1 1 95 95 PRO CA C 95 63.871 63.871 63.718 0.153 19439
166 1 1 . 1 1 95 95 PRO CB C 95 31.497 31.497 32.482 -0.985 19439
167 1 1 . 1 1 96 96 TRP N N 96 117.486 117.486 117.327 0.159 19439
168 1 1 . 1 1 96 96 TRP HA H 96 4.637 4.637 3.873 0.764 19439
169 1 1 . 1 1 96 96 TRP CA C 96 56.061 56.061 55.873 0.188 19439
170 1 1 . 1 1 96 96 TRP CB C 96 28.605 28.605 27.767 0.838 19439
171 1 1 . 1 1 96 96 TRP H H 96 7.484 7.484 7.876 -0.392 19439
172 1 1 . 1 1 97 97 LEU N N 97 123.510 123.510 121.566 1.944 19439
173 1 1 . 1 1 97 97 LEU HA H 97 4.098 4.098 3.219 0.879 19439
174 1 1 . 1 1 97 97 LEU CA C 97 56.024 56.024 54.744 1.280 19439
175 1 1 . 1 1 97 97 LEU CB C 97 42.893 42.893 42.944 -0.051 19439
176 1 1 . 1 1 97 97 LEU H H 97 7.137 7.137 6.806 0.331 19439
177 1 1 . 1 1 98 98 ARG N N 98 129.724 129.724 125.509 4.215 19439
178 1 1 . 1 1 98 98 ARG HA H 98 4.486 4.486 4.492 -0.006 19439
179 1 1 . 1 1 98 98 ARG CA C 98 55.622 55.622 54.956 0.666 19439
180 1 1 . 1 1 98 98 ARG CB C 98 31.229 31.229 31.522 -0.293 19439
181 1 1 . 1 1 98 98 ARG H H 98 8.825 8.825 8.332 0.493 19439
182 1 1 . 1 1 99 99 LEU N N 99 127.814 127.814 125.089 2.725 19439
183 1 1 . 1 1 99 99 LEU HA H 99 3.586 3.586 4.155 -0.569 19439
184 1 1 . 1 1 99 99 LEU CA C 99 54.352 54.352 54.497 -0.145 19439
185 1 1 . 1 1 99 99 LEU CB C 99 40.485 40.485 41.514 -1.029 19439
186 1 1 . 1 1 99 99 LEU H H 99 8.236 8.236 8.121 0.115 19439
187 1 1 . 1 1 100 100 ASP N N 100 126.633 126.633 128.797 -2.164 19439
188 1 1 . 1 1 100 100 ASP HA H 100 4.646 4.646 4.811 -0.165 19439
189 1 1 . 1 1 100 100 ASP CA C 100 52.894 52.894 54.042 -1.148 19439
190 1 1 . 1 1 100 100 ASP CB C 100 41.224 41.224 42.619 -1.395 19439
191 1 1 . 1 1 100 100 ASP H H 100 8.018 8.018 8.663 -0.645 19439
192 1 1 . 1 1 101 101 MET N N 101 122.473 122.473 120.131 2.342 19439
193 1 1 . 1 1 101 101 MET HA H 101 4.481 4.481 4.572 -0.091 19439
194 1 1 . 1 1 101 101 MET CA C 101 53.398 53.398 54.092 -0.694 19439
195 1 1 . 1 1 101 101 MET CB C 101 33.296 33.296 32.781 0.515 19439
196 1 1 . 1 1 101 101 MET H H 101 8.639 8.639 7.879 0.760 19439
197 1 1 . 1 1 102 102 SER N N 102 116.243 116.243 116.353 -0.110 19439
198 1 1 . 1 1 102 102 SER HA H 102 4.114 4.114 4.358 -0.244 19439
199 1 1 . 1 1 102 102 SER CA C 102 58.709 58.709 57.734 0.975 19439
200 1 1 . 1 1 102 102 SER CB C 102 64.701 64.701 64.991 -0.290 19439
201 1 1 . 1 1 102 102 SER H H 102 8.096 8.096 7.916 0.180 19439
202 1 1 . 1 1 103 103 ASP N N 103 121.639 121.639 123.417 -1.778 19439
203 1 1 . 1 1 103 103 ASP HA H 103 3.724 3.724 3.938 -0.214 19439
204 1 1 . 1 1 103 103 ASP CA C 103 57.296 57.296 57.608 -0.312 19439
205 1 1 . 1 1 103 103 ASP CB C 103 38.720 38.720 40.416 -1.696 19439
206 1 1 . 1 1 103 103 ASP H H 103 8.669 8.669 8.806 -0.137 19439
207 1 1 . 1 1 104 104 LYS N N 104 116.276 116.276 119.020 -2.744 19439
208 1 1 . 1 1 104 104 LYS HA H 104 3.678 3.678 4.008 -0.330 19439
209 1 1 . 1 1 104 104 LYS CA C 104 59.833 59.833 58.779 1.054 19439
210 1 1 . 1 1 104 104 LYS CB C 104 32.090 32.090 32.199 -0.109 19439
211 1 1 . 1 1 104 104 LYS H H 104 7.775 7.775 8.142 -0.367 19439
212 1 1 . 1 1 105 105 ALA N N 105 122.257 122.257 122.543 -0.286 19439
213 1 1 . 1 1 105 105 ALA HA H 105 3.873 3.873 4.017 -0.144 19439
214 1 1 . 1 1 105 105 ALA CA C 105 55.008 55.008 54.829 0.179 19439
215 1 1 . 1 1 105 105 ALA CB C 105 17.741 17.741 18.110 -0.369 19439
216 1 1 . 1 1 105 105 ALA H H 105 7.266 7.266 7.441 -0.175 19439
217 1 1 . 1 1 106 106 ILE N N 106 119.452 119.452 119.526 -0.074 19439
218 1 1 . 1 1 106 106 ILE HA H 106 3.419 3.419 3.771 -0.352 19439
219 1 1 . 1 1 106 106 ILE CA C 106 65.971 65.971 64.526 1.445 19439
220 1 1 . 1 1 106 106 ILE CB C 106 37.430 37.430 37.597 -0.167 19439
221 1 1 . 1 1 106 106 ILE H H 106 7.974 7.974 7.804 0.170 19439
222 1 1 . 1 1 107 107 PHE N N 107 117.814 117.814 118.746 -0.932 19439
223 1 1 . 1 1 107 107 PHE HA H 107 4.368 4.368 4.782 -0.414 19439
224 1 1 . 1 1 107 107 PHE CA C 107 56.844 56.844 58.253 -1.409 19439
225 1 1 . 1 1 107 107 PHE CB C 107 37.150 37.150 37.556 -0.406 19439
226 1 1 . 1 1 107 107 PHE H H 107 8.434 8.434 7.713 0.721 19439
227 1 1 . 1 1 108 108 ARG N N 108 117.368 117.368 119.223 -1.855 19439
228 1 1 . 1 1 108 108 ARG HA H 108 3.994 3.994 4.181 -0.187 19439
229 1 1 . 1 1 108 108 ARG CA C 108 58.682 58.682 58.235 0.447 19439
230 1 1 . 1 1 108 108 ARG CB C 108 30.287 30.287 29.743 0.544 19439
231 1 1 . 1 1 108 108 ARG H H 108 7.474 7.474 8.356 -0.882 19439
232 1 1 . 1 1 109 109 ARG N N 109 117.440 117.440 117.049 0.391 19439
233 1 1 . 1 1 109 109 ARG HA H 109 3.900 3.900 3.973 -0.073 19439
234 1 1 . 1 1 109 109 ARG CA C 109 57.312 57.312 58.133 -0.821 19439
235 1 1 . 1 1 109 109 ARG CB C 109 31.626 31.626 30.786 0.840 19439
236 1 1 . 1 1 109 109 ARG H H 109 7.118 7.118 7.655 -0.537 19439
237 1 1 . 1 1 110 110 TYR N N 110 116.060 116.060 116.334 -0.274 19439
238 1 1 . 1 1 110 110 TYR HA H 110 5.265 5.265 5.176 0.089 19439
239 1 1 . 1 1 110 110 TYR CA C 110 54.188 54.188 54.621 -0.433 19439
240 1 1 . 1 1 110 110 TYR CB C 110 38.484 38.484 38.227 0.257 19439
241 1 1 . 1 1 110 110 TYR H H 110 8.707 8.707 8.087 0.620 19439
242 1 1 . 1 1 111 111 PRO HA H 111 4.388 4.388 4.696 -0.308 19439
243 1 1 . 1 1 111 111 PRO CA C 111 64.847 64.847 64.354 0.493 19439
244 1 1 . 1 1 111 111 PRO CB C 111 31.381 31.381 32.023 -0.642 19439
245 1 1 . 1 1 112 112 HIS N N 112 115.542 115.542 114.316 1.226 19439
246 1 1 . 1 1 112 112 HIS HA H 112 4.482 4.482 4.542 -0.060 19439
247 1 1 . 1 1 112 112 HIS CA C 112 58.498 58.498 56.980 1.518 19439
248 1 1 . 1 1 112 112 HIS CB C 112 29.654 29.654 28.615 1.039 19439
249 1 1 . 1 1 112 112 HIS H H 112 8.196 8.196 8.353 -0.157 19439
250 1 1 . 1 1 113 113 LEU N N 113 120.583 120.583 120.539 0.044 19439
251 1 1 . 1 1 113 113 LEU HA H 113 4.165 4.165 4.155 0.010 19439
252 1 1 . 1 1 113 113 LEU CA C 113 54.013 54.013 55.548 -1.535 19439
253 1 1 . 1 1 113 113 LEU CB C 113 41.669 41.669 41.781 -0.112 19439
254 1 1 . 1 1 113 113 LEU H H 113 7.527 7.527 7.545 -0.018 19439
255 1 2 . 1 1 59 59 ALA N N 59 123.310 123.310 123.020 0.290 19439
256 1 2 . 1 1 59 59 ALA HA H 59 4.232 4.232 4.473 -0.241 19439
257 1 2 . 1 1 59 59 ALA CA C 59 52.274 52.274 52.240 0.033 19439
258 1 2 . 1 1 59 59 ALA CB C 59 19.623 19.623 19.518 0.105 19439
259 1 2 . 1 1 59 59 ALA H H 59 7.894 7.894 8.040 -0.146 19439
260 1 2 . 1 1 60 60 LEU N N 60 120.936 120.936 121.623 -0.687 19439
261 1 2 . 1 1 60 60 LEU HA H 60 4.364 4.364 4.396 -0.032 19439
262 1 2 . 1 1 60 60 LEU CA C 60 54.130 54.130 54.495 -0.365 19439
263 1 2 . 1 1 60 60 LEU CB C 60 43.209 43.209 42.639 0.570 19439
264 1 2 . 1 1 60 60 LEU H H 60 8.046 8.046 8.234 -0.188 19439
265 1 2 . 1 1 61 61 ALA N N 61 125.460 125.460 122.867 2.593 19439
266 1 2 . 1 1 61 61 ALA HA H 61 4.364 4.364 4.274 0.090 19439
267 1 2 . 1 1 61 61 ALA CA C 61 51.176 51.176 52.458 -1.282 19439
268 1 2 . 1 1 61 61 ALA CB C 61 20.172 20.172 19.329 0.843 19439
269 1 2 . 1 1 61 61 ALA H H 61 8.338 8.338 8.313 0.025 19439
270 1 2 . 1 1 62 62 ALA N N 62 127.765 127.765 126.214 1.551 19439
271 1 2 . 1 1 62 62 ALA HA H 62 4.394 4.394 4.753 -0.359 19439
272 1 2 . 1 1 62 62 ALA CA C 62 51.888 51.888 50.467 1.421 19439
273 1 2 . 1 1 62 62 ALA CB C 62 18.806 18.806 21.010 -2.204 19439
274 1 2 . 1 1 62 62 ALA H H 62 8.487 8.487 8.831 -0.344 19439
275 1 2 . 1 1 63 63 LEU N N 63 120.199 120.199 120.542 -0.343 19439
276 1 2 . 1 1 63 63 LEU HA H 63 4.828 4.828 4.953 -0.125 19439
277 1 2 . 1 1 63 63 LEU CA C 63 51.852 51.852 52.971 -1.119 19439
278 1 2 . 1 1 63 63 LEU CB C 63 44.081 44.081 45.255 -1.174 19439
279 1 2 . 1 1 63 63 LEU H H 63 7.927 7.927 8.301 -0.374 19439
280 1 2 . 1 1 64 64 HIS N N 64 122.277 122.277 119.166 3.111 19439
281 1 2 . 1 1 64 64 HIS HA H 64 4.114 4.114 4.549 -0.435 19439
282 1 2 . 1 1 64 64 HIS CA C 64 58.038 58.038 57.094 0.944 19439
283 1 2 . 1 1 64 64 HIS CB C 64 31.228 31.228 31.395 -0.167 19439
284 1 2 . 1 1 64 64 HIS H H 64 8.477 8.477 8.777 -0.300 19439
285 1 2 . 1 1 65 65 ALA HA H 65 4.339 4.339 4.452 -0.113 19439
286 1 2 . 1 1 65 65 ALA CA C 65 53.281 53.281 52.505 0.775 19439
287 1 2 . 1 1 65 65 ALA CB C 65 20.276 20.276 19.925 0.351 19439
288 1 2 . 1 1 66 66 GLU N N 66 113.868 113.868 117.302 -3.434 19439
289 1 2 . 1 1 66 66 GLU HA H 66 4.619 4.619 4.512 0.107 19439
290 1 2 . 1 1 66 66 GLU CA C 66 54.727 54.727 55.047 -0.320 19439
291 1 2 . 1 1 66 66 GLU CB C 66 32.894 32.894 32.799 0.095 19439
292 1 2 . 1 1 66 66 GLU H H 66 7.759 7.759 8.007 -0.248 19439
293 1 2 . 1 1 68 68 PRO HA H 68 4.219 4.219 4.292 -0.073 19439
294 1 2 . 1 1 68 68 PRO CA C 68 64.664 64.664 65.024 -0.360 19439
295 1 2 . 1 1 68 68 PRO CB C 68 32.066 32.066 31.690 0.376 19439
296 1 2 . 1 1 69 69 LEU N N 69 117.262 117.262 118.508 -1.246 19439
297 1 2 . 1 1 69 69 LEU HA H 69 4.182 4.182 4.222 -0.040 19439
298 1 2 . 1 1 69 69 LEU CA C 69 52.430 52.430 53.709 -1.280 19439
299 1 2 . 1 1 69 69 LEU CB C 69 40.907 40.907 41.515 -0.608 19439
300 1 2 . 1 1 69 69 LEU H H 69 8.439 8.439 7.961 0.478 19439
301 1 2 . 1 1 70 70 ALA N N 70 120.426 120.426 121.069 -0.643 19439
302 1 2 . 1 1 70 70 ALA HA H 70 3.411 3.411 4.222 -0.811 19439
303 1 2 . 1 1 70 70 ALA CA C 70 53.685 53.685 53.486 0.199 19439
304 1 2 . 1 1 70 70 ALA CB C 70 17.914 17.914 18.639 -0.725 19439
305 1 2 . 1 1 70 70 ALA H H 70 7.113 7.113 7.427 -0.314 19439
306 1 2 . 1 1 71 71 GLY N N 71 108.911 108.911 112.692 -3.781 19439
307 1 2 . 1 1 71 71 GLY CA C 71 45.215 45.215 45.034 0.181 19439
308 1 2 . 1 1 71 71 GLY H H 71 8.856 8.856 8.791 0.065 19439
309 1 2 . 1 1 72 72 LEU N N 72 120.000 120.000 121.616 -1.616 19439
310 1 2 . 1 1 72 72 LEU HA H 72 4.769 4.769 4.924 -0.155 19439
311 1 2 . 1 1 72 72 LEU CA C 72 51.972 51.972 51.543 0.429 19439
312 1 2 . 1 1 72 72 LEU CB C 72 41.255 41.255 42.880 -1.625 19439
313 1 2 . 1 1 72 72 LEU H H 72 8.136 8.136 8.031 0.105 19439
314 1 2 . 1 1 73 73 PRO HA H 73 4.739 4.739 4.675 0.064 19439
315 1 2 . 1 1 73 73 PRO CA C 73 61.456 61.456 62.740 -1.284 19439
316 1 2 . 1 1 73 73 PRO CB C 73 31.245 31.245 32.013 -0.768 19439
317 1 2 . 1 1 74 74 VAL N N 74 121.723 121.723 120.683 1.040 19439
318 1 2 . 1 1 74 74 VAL HA H 74 3.446 3.446 3.806 -0.360 19439
319 1 2 . 1 1 74 74 VAL CA C 74 65.744 65.744 64.071 1.673 19439
320 1 2 . 1 1 74 74 VAL CB C 74 31.236 31.236 31.956 -0.720 19439
321 1 2 . 1 1 74 74 VAL H H 74 7.710 7.710 8.134 -0.424 19439
322 1 2 . 1 1 75 75 THR N N 75 108.893 108.893 112.662 -3.769 19439
323 1 2 . 1 1 75 75 THR HA H 75 4.937 4.937 4.557 0.380 19439
324 1 2 . 1 1 75 75 THR CA C 75 59.892 59.892 59.390 0.502 19439
325 1 2 . 1 1 75 75 THR CB C 75 12.018 12.018 70.809 -58.791 19439
326 1 2 . 1 1 75 75 THR H H 75 8.710 8.710 8.213 0.497 19439
327 1 2 . 1 1 76 76 ARG HA H 76 3.873 3.873 4.034 -0.161 19439
328 1 2 . 1 1 76 76 ARG H H 76 8.447 8.447 8.854 -0.407 19439
329 1 2 . 1 1 77 77 SER N N 77 114.482 114.482 114.758 -0.276 19439
330 1 2 . 1 1 77 77 SER HA H 77 4.061 4.061 4.136 -0.075 19439
331 1 2 . 1 1 77 77 SER CA C 77 60.467 60.467 61.452 -0.985 19439
332 1 2 . 1 1 77 77 SER CB C 77 62.449 62.449 62.733 -0.284 19439
333 1 2 . 1 1 77 77 SER H H 77 8.105 8.105 8.169 -0.064 19439
334 1 2 . 1 1 78 78 ASP N N 78 120.538 120.538 122.408 -1.870 19439
335 1 2 . 1 1 78 78 ASP HA H 78 4.333 4.333 4.437 -0.104 19439
336 1 2 . 1 1 78 78 ASP CA C 78 58.020 58.020 56.910 1.110 19439
337 1 2 . 1 1 78 78 ASP CB C 78 43.252 43.252 40.361 2.891 19439
338 1 2 . 1 1 78 78 ASP H H 78 7.300 7.300 7.689 -0.389 19439
339 1 2 . 1 1 79 79 ALA N N 79 120.614 120.614 123.109 -2.495 19439
340 1 2 . 1 1 79 79 ALA HA H 79 3.672 3.672 3.863 -0.191 19439
341 1 2 . 1 1 79 79 ALA CA C 79 54.886 54.886 55.198 -0.312 19439
342 1 2 . 1 1 79 79 ALA CB C 79 19.628 19.628 18.327 1.301 19439
343 1 2 . 1 1 79 79 ALA H H 79 7.767 7.767 8.146 -0.379 19439
344 1 2 . 1 1 80 80 ARG N N 80 116.203 116.203 119.383 -3.180 19439
345 1 2 . 1 1 80 80 ARG HA H 80 3.732 3.732 4.081 -0.349 19439
346 1 2 . 1 1 80 80 ARG CA C 80 61.441 61.441 59.433 2.008 19439
347 1 2 . 1 1 80 80 ARG CB C 80 30.266 30.266 30.442 -0.176 19439
348 1 2 . 1 1 80 80 ARG H H 80 7.981 7.981 8.332 -0.351 19439
349 1 2 . 1 1 81 81 VAL N N 81 119.192 119.192 120.049 -0.857 19439
350 1 2 . 1 1 81 81 VAL HA H 81 3.582 3.582 3.926 -0.344 19439
351 1 2 . 1 1 81 81 VAL CA C 81 66.909 66.909 67.006 -0.097 19439
352 1 2 . 1 1 81 81 VAL CB C 81 31.668 31.668 31.741 -0.073 19439
353 1 2 . 1 1 81 81 VAL H H 81 7.338 7.338 8.091 -0.753 19439
354 1 2 . 1 1 82 82 LEU N N 82 118.722 118.722 121.283 -2.561 19439
355 1 2 . 1 1 82 82 LEU HA H 82 4.044 4.044 3.970 0.074 19439
356 1 2 . 1 1 82 82 LEU CA C 82 58.356 58.356 58.706 -0.350 19439
357 1 2 . 1 1 82 82 LEU CB C 82 41.627 41.627 41.701 -0.074 19439
358 1 2 . 1 1 82 82 LEU H H 82 7.599 7.599 8.429 -0.830 19439
359 1 2 . 1 1 83 83 ILE N N 83 120.893 120.893 119.531 1.362 19439
360 1 2 . 1 1 83 83 ILE HA H 83 3.642 3.642 3.722 -0.080 19439
361 1 2 . 1 1 83 83 ILE CA C 83 65.669 65.669 65.599 0.070 19439
362 1 2 . 1 1 83 83 ILE CB C 83 38.579 38.579 37.972 0.607 19439
363 1 2 . 1 1 83 83 ILE H H 83 8.546 8.546 8.359 0.187 19439
364 1 2 . 1 1 84 84 PHE N N 84 123.343 123.343 121.115 2.228 19439
365 1 2 . 1 1 84 84 PHE HA H 84 4.084 4.084 4.172 -0.088 19439
366 1 2 . 1 1 84 84 PHE CA C 84 62.593 62.593 60.988 1.605 19439
367 1 2 . 1 1 84 84 PHE CB C 84 39.211 39.211 39.086 0.125 19439
368 1 2 . 1 1 84 84 PHE H H 84 8.622 8.622 8.755 -0.133 19439
369 1 2 . 1 1 85 85 ASN N N 85 118.037 118.037 117.746 0.291 19439
370 1 2 . 1 1 85 85 ASN HA H 85 4.426 4.426 4.121 0.305 19439
371 1 2 . 1 1 85 85 ASN CA C 85 56.045 56.045 56.728 -0.683 19439
372 1 2 . 1 1 85 85 ASN CB C 85 37.785 37.785 38.417 -0.632 19439
373 1 2 . 1 1 85 85 ASN H H 85 8.834 8.834 8.593 0.241 19439
374 1 2 . 1 1 86 86 GLU N N 86 121.098 121.098 122.274 -1.176 19439
375 1 2 . 1 1 86 86 GLU HA H 86 4.052 4.052 4.001 0.051 19439
376 1 2 . 1 1 86 86 GLU CA C 86 59.328 59.328 59.666 -0.338 19439
377 1 2 . 1 1 86 86 GLU CB C 86 30.253 30.253 29.631 0.622 19439
378 1 2 . 1 1 86 86 GLU H H 86 8.105 8.105 8.342 -0.237 19439
379 1 2 . 1 1 87 87 TRP N N 87 122.584 122.584 122.013 0.571 19439
380 1 2 . 1 1 87 87 TRP HA H 87 4.006 4.006 4.186 -0.180 19439
381 1 2 . 1 1 87 87 TRP CA C 87 61.545 61.545 61.700 -0.155 19439
382 1 2 . 1 1 87 87 TRP CB C 87 27.943 27.943 29.466 -1.523 19439
383 1 2 . 1 1 87 87 TRP H H 87 8.099 8.099 8.626 -0.527 19439
384 1 2 . 1 1 88 88 GLU N N 88 117.357 117.357 119.074 -1.717 19439
385 1 2 . 1 1 88 88 GLU HA H 88 2.919 2.919 2.962 -0.043 19439
386 1 2 . 1 1 88 88 GLU CA C 88 59.804 59.804 59.714 0.090 19439
387 1 2 . 1 1 88 88 GLU CB C 88 29.546 29.546 29.089 0.457 19439
388 1 2 . 1 1 88 88 GLU H H 88 8.440 8.440 8.576 -0.136 19439
389 1 2 . 1 1 89 89 GLU N N 89 116.109 116.109 119.702 -3.593 19439
390 1 2 . 1 1 89 89 GLU HA H 89 3.995 3.995 3.811 0.184 19439
391 1 2 . 1 1 89 89 GLU CA C 89 58.329 58.329 59.451 -1.122 19439
392 1 2 . 1 1 89 89 GLU CB C 89 29.649 29.649 29.466 0.183 19439
393 1 2 . 1 1 89 89 GLU H H 89 7.244 7.244 8.047 -0.803 19439
394 1 2 . 1 1 90 90 ARG N N 90 120.512 120.512 118.477 2.035 19439
395 1 2 . 1 1 90 90 ARG HA H 90 3.920 3.920 3.893 0.027 19439
396 1 2 . 1 1 90 90 ARG CA C 90 58.683 58.683 58.736 -0.053 19439
397 1 2 . 1 1 90 90 ARG CB C 90 30.659 30.659 29.643 1.016 19439
398 1 2 . 1 1 90 90 ARG H H 90 8.368 8.368 8.014 0.354 19439
399 1 2 . 1 1 91 91 LYS N N 91 120.024 120.024 119.732 0.292 19439
400 1 2 . 1 1 91 91 LYS HA H 91 3.964 3.964 3.995 -0.031 19439
401 1 2 . 1 1 91 91 LYS CA C 91 57.278 57.278 58.887 -1.609 19439
402 1 2 . 1 1 91 91 LYS CB C 91 30.582 30.582 31.344 -0.762 19439
403 1 2 . 1 1 91 91 LYS H H 91 8.491 8.491 7.935 0.556 19439
404 1 2 . 1 1 92 92 LYS N N 92 118.192 118.192 118.200 -0.008 19439
405 1 2 . 1 1 92 92 LYS HA H 92 3.796 3.796 4.003 -0.207 19439
406 1 2 . 1 1 92 92 LYS CA C 92 58.976 58.976 58.548 0.428 19439
407 1 2 . 1 1 92 92 LYS CB C 92 32.188 32.188 32.307 -0.119 19439
408 1 2 . 1 1 92 92 LYS H H 92 6.933 6.933 7.771 -0.838 19439
409 1 2 . 1 1 93 93 SER N N 93 110.447 110.447 113.641 -3.194 19439
410 1 2 . 1 1 93 93 SER HA H 93 4.484 4.484 4.348 0.136 19439
411 1 2 . 1 1 93 93 SER CA C 93 58.386 58.386 60.451 -2.065 19439
412 1 2 . 1 1 93 93 SER CB C 93 64.173 64.173 64.222 -0.049 19439
413 1 2 . 1 1 93 93 SER H H 93 7.282 7.282 7.711 -0.429 19439
414 1 2 . 1 1 94 94 ASP N N 94 120.163 120.163 119.883 0.280 19439
415 1 2 . 1 1 94 94 ASP HA H 94 4.872 4.872 5.065 -0.193 19439
416 1 2 . 1 1 94 94 ASP CA C 94 51.157 51.157 52.554 -1.397 19439
417 1 2 . 1 1 94 94 ASP CB C 94 41.256 41.256 43.163 -1.907 19439
418 1 2 . 1 1 94 94 ASP H H 94 7.303 7.303 8.168 -0.865 19439
419 1 2 . 1 1 95 95 PRO CA C 95 63.871 63.871 63.934 -0.064 19439
420 1 2 . 1 1 95 95 PRO CB C 95 31.497 31.497 32.272 -0.775 19439
421 1 2 . 1 1 96 96 TRP N N 96 117.486 117.486 117.460 0.026 19439
422 1 2 . 1 1 96 96 TRP HA H 96 4.637 4.637 4.725 -0.088 19439
423 1 2 . 1 1 96 96 TRP CA C 96 56.061 56.061 55.696 0.365 19439
424 1 2 . 1 1 96 96 TRP CB C 96 28.605 28.605 28.476 0.129 19439
425 1 2 . 1 1 96 96 TRP H H 96 7.484 7.484 7.863 -0.379 19439
426 1 2 . 1 1 97 97 LEU N N 97 123.510 123.510 121.015 2.495 19439
427 1 2 . 1 1 97 97 LEU HA H 97 4.098 4.098 3.016 1.082 19439
428 1 2 . 1 1 97 97 LEU CA C 97 56.024 56.024 54.506 1.518 19439
429 1 2 . 1 1 97 97 LEU CB C 97 42.893 42.893 42.667 0.226 19439
430 1 2 . 1 1 97 97 LEU H H 97 7.137 7.137 6.589 0.548 19439
431 1 2 . 1 1 98 98 ARG N N 98 129.724 129.724 125.268 4.456 19439
432 1 2 . 1 1 98 98 ARG HA H 98 4.486 4.486 4.821 -0.335 19439
433 1 2 . 1 1 98 98 ARG CA C 98 55.622 55.622 55.309 0.313 19439
434 1 2 . 1 1 98 98 ARG CB C 98 31.229 31.229 31.240 -0.011 19439
435 1 2 . 1 1 98 98 ARG H H 98 8.825 8.825 8.249 0.576 19439
436 1 2 . 1 1 99 99 LEU N N 99 127.814 127.814 124.815 2.999 19439
437 1 2 . 1 1 99 99 LEU HA H 99 3.586 3.586 4.287 -0.701 19439
438 1 2 . 1 1 99 99 LEU CA C 99 54.352 54.352 54.542 -0.190 19439
439 1 2 . 1 1 99 99 LEU CB C 99 40.485 40.485 42.060 -1.575 19439
440 1 2 . 1 1 99 99 LEU H H 99 8.236 8.236 8.438 -0.202 19439
441 1 2 . 1 1 100 100 ASP N N 100 126.633 126.633 127.775 -1.142 19439
442 1 2 . 1 1 100 100 ASP HA H 100 4.646 4.646 4.939 -0.293 19439
443 1 2 . 1 1 100 100 ASP CA C 100 52.894 52.894 53.820 -0.926 19439
444 1 2 . 1 1 100 100 ASP CB C 100 41.224 41.224 42.348 -1.124 19439
445 1 2 . 1 1 100 100 ASP H H 100 8.018 8.018 8.506 -0.488 19439
446 1 2 . 1 1 101 101 MET N N 101 122.473 122.473 120.012 2.461 19439
447 1 2 . 1 1 101 101 MET HA H 101 4.481 4.481 4.752 -0.271 19439
448 1 2 . 1 1 101 101 MET CA C 101 53.398 53.398 54.903 -1.505 19439
449 1 2 . 1 1 101 101 MET CB C 101 33.296 33.296 35.402 -2.106 19439
450 1 2 . 1 1 101 101 MET H H 101 8.639 8.639 8.107 0.532 19439
451 1 2 . 1 1 102 102 SER N N 102 116.243 116.243 115.858 0.385 19439
452 1 2 . 1 1 102 102 SER HA H 102 4.114 4.114 4.612 -0.498 19439
453 1 2 . 1 1 102 102 SER CA C 102 58.709 58.709 56.679 2.030 19439
454 1 2 . 1 1 102 102 SER CB C 102 64.701 64.701 65.366 -0.665 19439
455 1 2 . 1 1 102 102 SER H H 102 8.096 8.096 8.298 -0.202 19439
456 1 2 . 1 1 103 103 ASP N N 103 121.639 121.639 122.245 -0.606 19439
457 1 2 . 1 1 103 103 ASP HA H 103 3.724 3.724 3.786 -0.062 19439
458 1 2 . 1 1 103 103 ASP CA C 103 57.296 57.296 57.388 -0.092 19439
459 1 2 . 1 1 103 103 ASP CB C 103 38.720 38.720 40.339 -1.619 19439
460 1 2 . 1 1 103 103 ASP H H 103 8.669 8.669 8.748 -0.080 19439
461 1 2 . 1 1 104 104 LYS N N 104 116.276 116.276 119.046 -2.770 19439
462 1 2 . 1 1 104 104 LYS HA H 104 3.678 3.678 4.072 -0.394 19439
463 1 2 . 1 1 104 104 LYS CA C 104 59.833 59.833 58.805 1.028 19439
464 1 2 . 1 1 104 104 LYS CB C 104 32.090 32.090 31.815 0.275 19439
465 1 2 . 1 1 104 104 LYS H H 104 7.775 7.775 7.918 -0.143 19439
466 1 2 . 1 1 105 105 ALA N N 105 122.257 122.257 122.299 -0.042 19439
467 1 2 . 1 1 105 105 ALA HA H 105 3.873 3.873 4.076 -0.203 19439
468 1 2 . 1 1 105 105 ALA CA C 105 55.008 55.008 54.785 0.223 19439
469 1 2 . 1 1 105 105 ALA CB C 105 17.741 17.741 18.061 -0.320 19439
470 1 2 . 1 1 105 105 ALA H H 105 7.266 7.266 7.491 -0.225 19439
471 1 2 . 1 1 106 106 ILE N N 106 119.452 119.452 119.774 -0.322 19439
472 1 2 . 1 1 106 106 ILE HA H 106 3.419 3.419 3.847 -0.428 19439
473 1 2 . 1 1 106 106 ILE CA C 106 65.971 65.971 64.598 1.373 19439
474 1 2 . 1 1 106 106 ILE CB C 106 37.430 37.430 37.712 -0.282 19439
475 1 2 . 1 1 106 106 ILE H H 106 7.974 7.974 7.926 0.048 19439
476 1 2 . 1 1 107 107 PHE N N 107 117.814 117.814 118.572 -0.758 19439
477 1 2 . 1 1 107 107 PHE HA H 107 4.368 4.368 4.763 -0.395 19439
478 1 2 . 1 1 107 107 PHE CA C 107 56.844 56.844 57.861 -1.016 19439
479 1 2 . 1 1 107 107 PHE CB C 107 37.150 37.150 37.588 -0.438 19439
480 1 2 . 1 1 107 107 PHE H H 107 8.434 8.434 8.379 0.055 19439
481 1 2 . 1 1 108 108 ARG N N 108 117.368 117.368 120.959 -3.591 19439
482 1 2 . 1 1 108 108 ARG HA H 108 3.994 3.994 4.235 -0.241 19439
483 1 2 . 1 1 108 108 ARG CA C 108 58.682 58.682 58.503 0.179 19439
484 1 2 . 1 1 108 108 ARG CB C 108 30.287 30.287 30.390 -0.103 19439
485 1 2 . 1 1 108 108 ARG H H 108 7.474 7.474 8.225 -0.751 19439
486 1 2 . 1 1 109 109 ARG N N 109 117.440 117.440 117.439 0.001 19439
487 1 2 . 1 1 109 109 ARG HA H 109 3.900 3.900 3.893 0.007 19439
488 1 2 . 1 1 109 109 ARG CA C 109 57.312 57.312 58.330 -1.018 19439
489 1 2 . 1 1 109 109 ARG CB C 109 31.626 31.626 30.547 1.079 19439
490 1 2 . 1 1 109 109 ARG H H 109 7.118 7.118 7.834 -0.716 19439
491 1 2 . 1 1 110 110 TYR N N 110 116.060 116.060 116.399 -0.339 19439
492 1 2 . 1 1 110 110 TYR HA H 110 5.265 5.265 5.172 0.093 19439
493 1 2 . 1 1 110 110 TYR CA C 110 54.188 54.188 54.529 -0.341 19439
494 1 2 . 1 1 110 110 TYR CB C 110 38.484 38.484 38.159 0.325 19439
495 1 2 . 1 1 110 110 TYR H H 110 8.707 8.707 8.112 0.595 19439
496 1 2 . 1 1 111 111 PRO HA H 111 4.388 4.388 4.676 -0.288 19439
497 1 2 . 1 1 111 111 PRO CA C 111 64.847 64.847 64.173 0.674 19439
498 1 2 . 1 1 111 111 PRO CB C 111 31.381 31.381 32.173 -0.792 19439
499 1 2 . 1 1 112 112 HIS N N 112 115.542 115.542 112.921 2.621 19439
500 1 2 . 1 1 112 112 HIS HA H 112 4.482 4.482 4.543 -0.061 19439
501 1 2 . 1 1 112 112 HIS CA C 112 58.498 58.498 56.498 2.001 19439
502 1 2 . 1 1 112 112 HIS CB C 112 29.654 29.654 29.093 0.561 19439
503 1 2 . 1 1 112 112 HIS H H 112 8.196 8.196 8.165 0.031 19439
504 1 2 . 1 1 113 113 LEU N N 113 120.583 120.583 120.698 -0.115 19439
505 1 2 . 1 1 113 113 LEU HA H 113 4.165 4.165 4.279 -0.114 19439
506 1 2 . 1 1 113 113 LEU CA C 113 54.013 54.013 55.660 -1.647 19439
507 1 2 . 1 1 113 113 LEU CB C 113 41.669 41.669 42.099 -0.430 19439
508 1 2 . 1 1 113 113 LEU H H 113 7.527 7.527 7.469 0.058 19439
509 1 3 . 1 1 59 59 ALA N N 59 123.310 123.310 123.739 -0.429 19439
510 1 3 . 1 1 59 59 ALA HA H 59 4.232 4.232 4.537 -0.305 19439
511 1 3 . 1 1 59 59 ALA CA C 59 52.274 52.274 52.773 -0.499 19439
512 1 3 . 1 1 59 59 ALA CB C 59 19.623 19.623 19.074 0.549 19439
513 1 3 . 1 1 59 59 ALA H H 59 7.894 7.894 8.044 -0.150 19439
514 1 3 . 1 1 60 60 LEU N N 60 120.936 120.936 120.763 0.173 19439
515 1 3 . 1 1 60 60 LEU HA H 60 4.364 4.364 4.667 -0.303 19439
516 1 3 . 1 1 60 60 LEU CA C 60 54.130 54.130 54.665 -0.535 19439
517 1 3 . 1 1 60 60 LEU CB C 60 43.209 43.209 44.562 -1.353 19439
518 1 3 . 1 1 60 60 LEU H H 60 8.046 8.046 8.088 -0.042 19439
519 1 3 . 1 1 61 61 ALA N N 61 125.460 125.460 122.662 2.798 19439
520 1 3 . 1 1 61 61 ALA HA H 61 4.364 4.364 4.881 -0.517 19439
521 1 3 . 1 1 61 61 ALA CA C 61 51.176 51.176 51.812 -0.636 19439
522 1 3 . 1 1 61 61 ALA CB C 61 20.172 20.172 21.881 -1.709 19439
523 1 3 . 1 1 61 61 ALA H H 61 8.338 8.338 8.247 0.091 19439
524 1 3 . 1 1 62 62 ALA N N 62 127.765 127.765 122.930 4.835 19439
525 1 3 . 1 1 62 62 ALA HA H 62 4.394 4.394 4.840 -0.446 19439
526 1 3 . 1 1 62 62 ALA CA C 62 51.888 51.888 50.442 1.446 19439
527 1 3 . 1 1 62 62 ALA CB C 62 18.806 18.806 20.953 -2.147 19439
528 1 3 . 1 1 62 62 ALA H H 62 8.487 8.487 8.998 -0.511 19439
529 1 3 . 1 1 63 63 LEU N N 63 120.199 120.199 120.998 -0.799 19439
530 1 3 . 1 1 63 63 LEU HA H 63 4.828 4.828 4.981 -0.153 19439
531 1 3 . 1 1 63 63 LEU CA C 63 51.852 51.852 53.035 -1.183 19439
532 1 3 . 1 1 63 63 LEU CB C 63 44.081 44.081 45.393 -1.312 19439
533 1 3 . 1 1 63 63 LEU H H 63 7.927 7.927 8.342 -0.415 19439
534 1 3 . 1 1 64 64 HIS N N 64 122.277 122.277 119.154 3.123 19439
535 1 3 . 1 1 64 64 HIS HA H 64 4.114 4.114 4.578 -0.464 19439
536 1 3 . 1 1 64 64 HIS CA C 64 58.038 58.038 56.959 1.079 19439
537 1 3 . 1 1 64 64 HIS CB C 64 31.228 31.228 31.489 -0.261 19439
538 1 3 . 1 1 64 64 HIS H H 64 8.477 8.477 8.851 -0.374 19439
539 1 3 . 1 1 65 65 ALA HA H 65 4.339 4.339 4.457 -0.118 19439
540 1 3 . 1 1 65 65 ALA CA C 65 53.281 53.281 52.488 0.793 19439
541 1 3 . 1 1 65 65 ALA CB C 65 20.276 20.276 19.952 0.324 19439
542 1 3 . 1 1 66 66 GLU N N 66 113.868 113.868 117.327 -3.459 19439
543 1 3 . 1 1 66 66 GLU HA H 66 4.619 4.619 4.514 0.105 19439
544 1 3 . 1 1 66 66 GLU CA C 66 54.727 54.727 55.023 -0.296 19439
545 1 3 . 1 1 66 66 GLU CB C 66 32.894 32.894 32.818 0.076 19439
546 1 3 . 1 1 66 66 GLU H H 66 7.759 7.759 7.999 -0.240 19439
547 1 3 . 1 1 68 68 PRO HA H 68 4.219 4.219 4.289 -0.070 19439
548 1 3 . 1 1 68 68 PRO CA C 68 64.664 64.664 65.029 -0.365 19439
549 1 3 . 1 1 68 68 PRO CB C 68 32.066 32.066 31.686 0.380 19439
550 1 3 . 1 1 69 69 LEU N N 69 117.262 117.262 118.494 -1.232 19439
551 1 3 . 1 1 69 69 LEU HA H 69 4.182 4.182 4.220 -0.038 19439
552 1 3 . 1 1 69 69 LEU CA C 69 52.430 52.430 53.674 -1.244 19439
553 1 3 . 1 1 69 69 LEU CB C 69 40.907 40.907 41.527 -0.620 19439
554 1 3 . 1 1 69 69 LEU H H 69 8.439 8.439 7.962 0.477 19439
555 1 3 . 1 1 70 70 ALA N N 70 120.426 120.426 121.108 -0.682 19439
556 1 3 . 1 1 70 70 ALA HA H 70 3.411 3.411 4.211 -0.800 19439
557 1 3 . 1 1 70 70 ALA CA C 70 53.685 53.685 53.493 0.192 19439
558 1 3 . 1 1 70 70 ALA CB C 70 17.914 17.914 18.644 -0.730 19439
559 1 3 . 1 1 70 70 ALA H H 70 7.113 7.113 7.430 -0.317 19439
560 1 3 . 1 1 71 71 GLY N N 71 108.911 108.911 113.883 -4.972 19439
561 1 3 . 1 1 71 71 GLY CA C 71 45.215 45.215 45.149 0.066 19439
562 1 3 . 1 1 71 71 GLY H H 71 8.856 8.856 8.898 -0.042 19439
563 1 3 . 1 1 72 72 LEU N N 72 120.000 120.000 120.681 -0.681 19439
564 1 3 . 1 1 72 72 LEU HA H 72 4.769 4.769 4.976 -0.207 19439
565 1 3 . 1 1 72 72 LEU CA C 72 51.972 51.972 51.541 0.431 19439
566 1 3 . 1 1 72 72 LEU CB C 72 41.255 41.255 42.938 -1.683 19439
567 1 3 . 1 1 72 72 LEU H H 72 8.136 8.136 7.937 0.199 19439
568 1 3 . 1 1 73 73 PRO HA H 73 4.739 4.739 4.666 0.073 19439
569 1 3 . 1 1 73 73 PRO CA C 73 61.456 61.456 62.757 -1.301 19439
570 1 3 . 1 1 73 73 PRO CB C 73 31.245 31.245 31.960 -0.715 19439
571 1 3 . 1 1 74 74 VAL N N 74 121.723 121.723 119.855 1.868 19439
572 1 3 . 1 1 74 74 VAL HA H 74 3.446 3.446 3.721 -0.275 19439
573 1 3 . 1 1 74 74 VAL CA C 74 65.744 65.744 63.767 1.977 19439
574 1 3 . 1 1 74 74 VAL CB C 74 31.236 31.236 31.873 -0.637 19439
575 1 3 . 1 1 74 74 VAL H H 74 7.710 7.710 8.123 -0.413 19439
576 1 3 . 1 1 75 75 THR N N 75 108.893 108.893 108.936 -0.043 19439
577 1 3 . 1 1 75 75 THR HA H 75 4.937 4.937 4.560 0.377 19439
578 1 3 . 1 1 75 75 THR CA C 75 59.892 59.892 59.739 0.153 19439
579 1 3 . 1 1 75 75 THR CB C 75 12.018 12.018 71.814 -59.796 19439
580 1 3 . 1 1 75 75 THR H H 75 8.710 8.710 7.529 1.181 19439
581 1 3 . 1 1 76 76 ARG HA H 76 3.873 3.873 4.000 -0.127 19439
582 1 3 . 1 1 76 76 ARG H H 76 8.447 8.447 8.830 -0.383 19439
583 1 3 . 1 1 77 77 SER N N 77 114.482 114.482 114.775 -0.293 19439
584 1 3 . 1 1 77 77 SER HA H 77 4.061 4.061 4.201 -0.140 19439
585 1 3 . 1 1 77 77 SER CA C 77 60.467 60.467 61.139 -0.672 19439
586 1 3 . 1 1 77 77 SER CB C 77 62.449 62.449 62.668 -0.219 19439
587 1 3 . 1 1 77 77 SER H H 77 8.105 8.105 7.854 0.251 19439
588 1 3 . 1 1 78 78 ASP N N 78 120.538 120.538 122.361 -1.823 19439
589 1 3 . 1 1 78 78 ASP HA H 78 4.333 4.333 4.350 -0.017 19439
590 1 3 . 1 1 78 78 ASP CA C 78 58.020 58.020 57.387 0.633 19439
591 1 3 . 1 1 78 78 ASP CB C 78 43.252 43.252 40.398 2.854 19439
592 1 3 . 1 1 78 78 ASP H H 78 7.300 7.300 8.107 -0.807 19439
593 1 3 . 1 1 79 79 ALA N N 79 120.614 120.614 122.815 -2.201 19439
594 1 3 . 1 1 79 79 ALA HA H 79 3.672 3.672 3.919 -0.247 19439
595 1 3 . 1 1 79 79 ALA CA C 79 54.886 54.886 55.247 -0.361 19439
596 1 3 . 1 1 79 79 ALA CB C 79 19.628 19.628 18.330 1.298 19439
597 1 3 . 1 1 79 79 ALA H H 79 7.767 7.767 8.286 -0.519 19439
598 1 3 . 1 1 80 80 ARG N N 80 116.203 116.203 119.222 -3.019 19439
599 1 3 . 1 1 80 80 ARG HA H 80 3.732 3.732 4.040 -0.308 19439
600 1 3 . 1 1 80 80 ARG CA C 80 61.441 61.441 59.533 1.907 19439
601 1 3 . 1 1 80 80 ARG CB C 80 30.266 30.266 30.407 -0.141 19439
602 1 3 . 1 1 80 80 ARG H H 80 7.981 7.981 8.227 -0.246 19439
603 1 3 . 1 1 81 81 VAL N N 81 119.192 119.192 119.574 -0.382 19439
604 1 3 . 1 1 81 81 VAL HA H 81 3.582 3.582 3.993 -0.411 19439
605 1 3 . 1 1 81 81 VAL CA C 81 66.909 66.909 66.229 0.680 19439
606 1 3 . 1 1 81 81 VAL CB C 81 31.668 31.668 31.630 0.038 19439
607 1 3 . 1 1 81 81 VAL H H 81 7.338 7.338 8.149 -0.811 19439
608 1 3 . 1 1 82 82 LEU N N 82 118.722 118.722 121.689 -2.967 19439
609 1 3 . 1 1 82 82 LEU HA H 82 4.044 4.044 3.952 0.092 19439
610 1 3 . 1 1 82 82 LEU CA C 82 58.356 58.356 58.767 -0.412 19439
611 1 3 . 1 1 82 82 LEU CB C 82 41.627 41.627 41.642 -0.015 19439
612 1 3 . 1 1 82 82 LEU H H 82 7.599 7.599 8.397 -0.798 19439
613 1 3 . 1 1 83 83 ILE N N 83 120.893 120.893 119.457 1.436 19439
614 1 3 . 1 1 83 83 ILE HA H 83 3.642 3.642 3.690 -0.048 19439
615 1 3 . 1 1 83 83 ILE CA C 83 65.669 65.669 65.621 0.048 19439
616 1 3 . 1 1 83 83 ILE CB C 83 38.579 38.579 37.938 0.641 19439
617 1 3 . 1 1 83 83 ILE H H 83 8.546 8.546 8.391 0.155 19439
618 1 3 . 1 1 84 84 PHE N N 84 123.343 123.343 120.688 2.655 19439
619 1 3 . 1 1 84 84 PHE HA H 84 4.084 4.084 4.089 -0.005 19439
620 1 3 . 1 1 84 84 PHE CA C 84 62.593 62.593 60.636 1.957 19439
621 1 3 . 1 1 84 84 PHE CB C 84 39.211 39.211 38.715 0.496 19439
622 1 3 . 1 1 84 84 PHE H H 84 8.622 8.622 8.539 0.083 19439
623 1 3 . 1 1 85 85 ASN N N 85 118.037 118.037 117.936 0.101 19439
624 1 3 . 1 1 85 85 ASN HA H 85 4.426 4.426 4.034 0.392 19439
625 1 3 . 1 1 85 85 ASN CA C 85 56.045 56.045 56.652 -0.607 19439
626 1 3 . 1 1 85 85 ASN CB C 85 37.785 37.785 38.429 -0.644 19439
627 1 3 . 1 1 85 85 ASN H H 85 8.834 8.834 8.566 0.268 19439
628 1 3 . 1 1 86 86 GLU N N 86 121.098 121.098 121.796 -0.698 19439
629 1 3 . 1 1 86 86 GLU HA H 86 4.052 4.052 3.974 0.078 19439
630 1 3 . 1 1 86 86 GLU CA C 86 59.328 59.328 59.622 -0.294 19439
631 1 3 . 1 1 86 86 GLU CB C 86 30.253 30.253 29.747 0.506 19439
632 1 3 . 1 1 86 86 GLU H H 86 8.105 8.105 8.277 -0.172 19439
633 1 3 . 1 1 87 87 TRP N N 87 122.584 122.584 122.073 0.511 19439
634 1 3 . 1 1 87 87 TRP HA H 87 4.006 4.006 4.162 -0.156 19439
635 1 3 . 1 1 87 87 TRP CA C 87 61.545 61.545 61.821 -0.276 19439
636 1 3 . 1 1 87 87 TRP CB C 87 27.943 27.943 29.523 -1.580 19439
637 1 3 . 1 1 87 87 TRP H H 87 8.099 8.099 8.675 -0.576 19439
638 1 3 . 1 1 88 88 GLU N N 88 117.357 117.357 118.819 -1.462 19439
639 1 3 . 1 1 88 88 GLU HA H 88 2.919 2.919 3.340 -0.421 19439
640 1 3 . 1 1 88 88 GLU CA C 88 59.804 59.804 59.997 -0.193 19439
641 1 3 . 1 1 88 88 GLU CB C 88 29.546 29.546 29.101 0.445 19439
642 1 3 . 1 1 88 88 GLU H H 88 8.440 8.440 8.525 -0.085 19439
643 1 3 . 1 1 89 89 GLU N N 89 116.109 116.109 119.682 -3.573 19439
644 1 3 . 1 1 89 89 GLU HA H 89 3.995 3.995 3.857 0.138 19439
645 1 3 . 1 1 89 89 GLU CA C 89 58.329 58.329 59.501 -1.171 19439
646 1 3 . 1 1 89 89 GLU CB C 89 29.649 29.649 29.508 0.141 19439
647 1 3 . 1 1 89 89 GLU H H 89 7.244 7.244 7.977 -0.733 19439
648 1 3 . 1 1 90 90 ARG N N 90 120.512 120.512 118.229 2.283 19439
649 1 3 . 1 1 90 90 ARG HA H 90 3.920 3.920 3.936 -0.016 19439
650 1 3 . 1 1 90 90 ARG CA C 90 58.683 58.683 58.705 -0.022 19439
651 1 3 . 1 1 90 90 ARG CB C 90 30.659 30.659 29.764 0.895 19439
652 1 3 . 1 1 90 90 ARG H H 90 8.368 8.368 8.045 0.323 19439
653 1 3 . 1 1 91 91 LYS N N 91 120.024 120.024 120.200 -0.176 19439
654 1 3 . 1 1 91 91 LYS HA H 91 3.964 3.964 3.905 0.059 19439
655 1 3 . 1 1 91 91 LYS CA C 91 57.278 57.278 58.572 -1.294 19439
656 1 3 . 1 1 91 91 LYS CB C 91 30.582 30.582 31.117 -0.535 19439
657 1 3 . 1 1 91 91 LYS H H 91 8.491 8.491 8.017 0.474 19439
658 1 3 . 1 1 92 92 LYS N N 92 118.192 118.192 117.369 0.823 19439
659 1 3 . 1 1 92 92 LYS HA H 92 3.796 3.796 4.102 -0.306 19439
660 1 3 . 1 1 92 92 LYS CA C 92 58.976 58.976 58.659 0.317 19439
661 1 3 . 1 1 92 92 LYS CB C 92 32.188 32.188 32.410 -0.222 19439
662 1 3 . 1 1 92 92 LYS H H 92 6.933 6.933 7.736 -0.803 19439
663 1 3 . 1 1 93 93 SER N N 93 110.447 110.447 113.775 -3.328 19439
664 1 3 . 1 1 93 93 SER HA H 93 4.484 4.484 4.387 0.097 19439
665 1 3 . 1 1 93 93 SER CA C 93 58.386 58.386 60.354 -1.968 19439
666 1 3 . 1 1 93 93 SER CB C 93 64.173 64.173 64.263 -0.090 19439
667 1 3 . 1 1 93 93 SER H H 93 7.282 7.282 7.721 -0.439 19439
668 1 3 . 1 1 94 94 ASP N N 94 120.163 120.163 119.888 0.275 19439
669 1 3 . 1 1 94 94 ASP HA H 94 4.872 4.872 5.049 -0.177 19439
670 1 3 . 1 1 94 94 ASP CA C 94 51.157 51.157 52.577 -1.420 19439
671 1 3 . 1 1 94 94 ASP CB C 94 41.256 41.256 43.011 -1.755 19439
672 1 3 . 1 1 94 94 ASP H H 94 7.303 7.303 8.184 -0.881 19439
673 1 3 . 1 1 95 95 PRO CA C 95 63.871 63.871 64.126 -0.255 19439
674 1 3 . 1 1 95 95 PRO CB C 95 31.497 31.497 32.388 -0.891 19439
675 1 3 . 1 1 96 96 TRP N N 96 117.486 117.486 118.330 -0.844 19439
676 1 3 . 1 1 96 96 TRP HA H 96 4.637 4.637 4.554 0.083 19439
677 1 3 . 1 1 96 96 TRP CA C 96 56.061 56.061 55.617 0.444 19439
678 1 3 . 1 1 96 96 TRP CB C 96 28.605 28.605 28.213 0.392 19439
679 1 3 . 1 1 96 96 TRP H H 96 7.484 7.484 8.031 -0.547 19439
680 1 3 . 1 1 97 97 LEU N N 97 123.510 123.510 121.874 1.636 19439
681 1 3 . 1 1 97 97 LEU HA H 97 4.098 4.098 3.382 0.716 19439
682 1 3 . 1 1 97 97 LEU CA C 97 56.024 56.024 54.349 1.675 19439
683 1 3 . 1 1 97 97 LEU CB C 97 42.893 42.893 42.775 0.118 19439
684 1 3 . 1 1 97 97 LEU H H 97 7.137 7.137 6.852 0.285 19439
685 1 3 . 1 1 98 98 ARG N N 98 129.724 129.724 124.285 5.439 19439
686 1 3 . 1 1 98 98 ARG HA H 98 4.486 4.486 4.625 -0.139 19439
687 1 3 . 1 1 98 98 ARG CA C 98 55.622 55.622 54.836 0.786 19439
688 1 3 . 1 1 98 98 ARG CB C 98 31.229 31.229 32.206 -0.977 19439
689 1 3 . 1 1 98 98 ARG H H 98 8.825 8.825 8.284 0.541 19439
690 1 3 . 1 1 99 99 LEU N N 99 127.814 127.814 125.133 2.681 19439
691 1 3 . 1 1 99 99 LEU HA H 99 3.586 3.586 4.174 -0.588 19439
692 1 3 . 1 1 99 99 LEU CA C 99 54.352 54.352 54.398 -0.046 19439
693 1 3 . 1 1 99 99 LEU CB C 99 40.485 40.485 41.532 -1.047 19439
694 1 3 . 1 1 99 99 LEU H H 99 8.236 8.236 8.132 0.104 19439
695 1 3 . 1 1 100 100 ASP N N 100 126.633 126.633 127.404 -0.771 19439
696 1 3 . 1 1 100 100 ASP HA H 100 4.646 4.646 4.839 -0.193 19439
697 1 3 . 1 1 100 100 ASP CA C 100 52.894 52.894 54.004 -1.110 19439
698 1 3 . 1 1 100 100 ASP CB C 100 41.224 41.224 42.848 -1.624 19439
699 1 3 . 1 1 100 100 ASP H H 100 8.018 8.018 8.644 -0.626 19439
700 1 3 . 1 1 101 101 MET N N 101 122.473 122.473 119.876 2.597 19439
701 1 3 . 1 1 101 101 MET HA H 101 4.481 4.481 4.581 -0.100 19439
702 1 3 . 1 1 101 101 MET CA C 101 53.398 53.398 54.275 -0.877 19439
703 1 3 . 1 1 101 101 MET CB C 101 33.296 33.296 33.229 0.067 19439
704 1 3 . 1 1 101 101 MET H H 101 8.639 8.639 7.963 0.676 19439
705 1 3 . 1 1 102 102 SER N N 102 116.243 116.243 118.593 -2.350 19439
706 1 3 . 1 1 102 102 SER HA H 102 4.114 4.114 4.421 -0.307 19439
707 1 3 . 1 1 102 102 SER CA C 102 58.709 58.709 57.654 1.055 19439
708 1 3 . 1 1 102 102 SER CB C 102 64.701 64.701 64.221 0.480 19439
709 1 3 . 1 1 102 102 SER H H 102 8.096 8.096 7.974 0.122 19439
710 1 3 . 1 1 103 103 ASP N N 103 121.639 121.639 122.947 -1.308 19439
711 1 3 . 1 1 103 103 ASP HA H 103 3.724 3.724 3.849 -0.125 19439
712 1 3 . 1 1 103 103 ASP CA C 103 57.296 57.296 57.196 0.100 19439
713 1 3 . 1 1 103 103 ASP CB C 103 38.720 38.720 40.034 -1.314 19439
714 1 3 . 1 1 103 103 ASP H H 103 8.669 8.669 8.740 -0.071 19439
715 1 3 . 1 1 104 104 LYS N N 104 116.276 116.276 119.037 -2.761 19439
716 1 3 . 1 1 104 104 LYS HA H 104 3.678 3.678 4.080 -0.402 19439
717 1 3 . 1 1 104 104 LYS CA C 104 59.833 59.833 58.953 0.881 19439
718 1 3 . 1 1 104 104 LYS CB C 104 32.090 32.090 32.090 0.000 19439
719 1 3 . 1 1 104 104 LYS H H 104 7.775 7.775 8.299 -0.524 19439
720 1 3 . 1 1 105 105 ALA N N 105 122.257 122.257 122.575 -0.318 19439
721 1 3 . 1 1 105 105 ALA HA H 105 3.873 3.873 4.085 -0.212 19439
722 1 3 . 1 1 105 105 ALA CA C 105 55.008 55.008 54.780 0.228 19439
723 1 3 . 1 1 105 105 ALA CB C 105 17.741 17.741 18.118 -0.377 19439
724 1 3 . 1 1 105 105 ALA H H 105 7.266 7.266 7.567 -0.301 19439
725 1 3 . 1 1 106 106 ILE N N 106 119.452 119.452 119.796 -0.344 19439
726 1 3 . 1 1 106 106 ILE HA H 106 3.419 3.419 3.810 -0.391 19439
727 1 3 . 1 1 106 106 ILE CA C 106 65.971 65.971 64.344 1.627 19439
728 1 3 . 1 1 106 106 ILE CB C 106 37.430 37.430 37.570 -0.140 19439
729 1 3 . 1 1 106 106 ILE H H 106 7.974 7.974 7.846 0.128 19439
730 1 3 . 1 1 107 107 PHE N N 107 117.814 117.814 119.047 -1.233 19439
731 1 3 . 1 1 107 107 PHE HA H 107 4.368 4.368 4.772 -0.404 19439
732 1 3 . 1 1 107 107 PHE CA C 107 56.844 56.844 58.475 -1.631 19439
733 1 3 . 1 1 107 107 PHE CB C 107 37.150 37.150 37.619 -0.469 19439
734 1 3 . 1 1 107 107 PHE H H 107 8.434 8.434 8.147 0.287 19439
735 1 3 . 1 1 108 108 ARG N N 108 117.368 117.368 118.971 -1.603 19439
736 1 3 . 1 1 108 108 ARG HA H 108 3.994 3.994 4.217 -0.223 19439
737 1 3 . 1 1 108 108 ARG CA C 108 58.682 58.682 58.247 0.435 19439
738 1 3 . 1 1 108 108 ARG CB C 108 30.287 30.287 29.893 0.394 19439
739 1 3 . 1 1 108 108 ARG H H 108 7.474 7.474 8.267 -0.793 19439
740 1 3 . 1 1 109 109 ARG N N 109 117.440 117.440 118.538 -1.098 19439
741 1 3 . 1 1 109 109 ARG HA H 109 3.900 3.900 4.038 -0.138 19439
742 1 3 . 1 1 109 109 ARG CA C 109 57.312 57.312 58.299 -0.987 19439
743 1 3 . 1 1 109 109 ARG CB C 109 31.626 31.626 31.160 0.466 19439
744 1 3 . 1 1 109 109 ARG H H 109 7.118 7.118 7.748 -0.630 19439
745 1 3 . 1 1 110 110 TYR N N 110 116.060 116.060 117.831 -1.771 19439
746 1 3 . 1 1 110 110 TYR HA H 110 5.265 5.265 5.150 0.115 19439
747 1 3 . 1 1 110 110 TYR CA C 110 54.188 54.188 54.303 -0.115 19439
748 1 3 . 1 1 110 110 TYR CB C 110 38.484 38.484 38.513 -0.029 19439
749 1 3 . 1 1 110 110 TYR H H 110 8.707 8.707 8.246 0.461 19439
750 1 3 . 1 1 111 111 PRO HA H 111 4.388 4.388 4.723 -0.335 19439
751 1 3 . 1 1 111 111 PRO CA C 111 64.847 64.847 64.290 0.557 19439
752 1 3 . 1 1 111 111 PRO CB C 111 31.381 31.381 32.178 -0.798 19439
753 1 3 . 1 1 112 112 HIS N N 112 115.542 115.542 114.497 1.045 19439
754 1 3 . 1 1 112 112 HIS HA H 112 4.482 4.482 4.557 -0.075 19439
755 1 3 . 1 1 112 112 HIS CA C 112 58.498 58.498 56.992 1.506 19439
756 1 3 . 1 1 112 112 HIS CB C 112 29.654 29.654 28.505 1.149 19439
757 1 3 . 1 1 112 112 HIS H H 112 8.196 8.196 8.425 -0.229 19439
758 1 3 . 1 1 113 113 LEU N N 113 120.583 120.583 120.280 0.303 19439
759 1 3 . 1 1 113 113 LEU HA H 113 4.165 4.165 4.359 -0.194 19439
760 1 3 . 1 1 113 113 LEU CA C 113 54.013 54.013 54.954 -0.941 19439
761 1 3 . 1 1 113 113 LEU CB C 113 41.669 41.669 41.699 -0.030 19439
762 1 3 . 1 1 113 113 LEU H H 113 7.527 7.527 7.293 0.234 19439
763 1 4 . 1 1 59 59 ALA N N 59 123.310 123.310 122.411 0.899 19439
764 1 4 . 1 1 59 59 ALA HA H 59 4.232 4.232 4.703 -0.471 19439
765 1 4 . 1 1 59 59 ALA CA C 59 52.274 52.274 52.614 -0.340 19439
766 1 4 . 1 1 59 59 ALA CB C 59 19.623 19.623 19.042 0.581 19439
767 1 4 . 1 1 59 59 ALA H H 59 7.894 7.894 8.087 -0.193 19439
768 1 4 . 1 1 60 60 LEU N N 60 120.936 120.936 119.040 1.896 19439
769 1 4 . 1 1 60 60 LEU HA H 60 4.364 4.364 4.195 0.169 19439
770 1 4 . 1 1 60 60 LEU CA C 60 54.130 54.130 55.603 -1.473 19439
771 1 4 . 1 1 60 60 LEU CB C 60 43.209 43.209 42.049 1.160 19439
772 1 4 . 1 1 60 60 LEU H H 60 8.046 8.046 8.088 -0.042 19439
773 1 4 . 1 1 61 61 ALA N N 61 125.460 125.460 120.606 4.854 19439
774 1 4 . 1 1 61 61 ALA HA H 61 4.364 4.364 4.384 -0.020 19439
775 1 4 . 1 1 61 61 ALA CA C 61 51.176 51.176 51.410 -0.234 19439
776 1 4 . 1 1 61 61 ALA CB C 61 20.172 20.172 19.658 0.514 19439
777 1 4 . 1 1 61 61 ALA H H 61 8.338 8.338 7.422 0.916 19439
778 1 4 . 1 1 62 62 ALA N N 62 127.765 127.765 126.039 1.726 19439
779 1 4 . 1 1 62 62 ALA HA H 62 4.394 4.394 4.672 -0.278 19439
780 1 4 . 1 1 62 62 ALA CA C 62 51.888 51.888 50.860 1.028 19439
781 1 4 . 1 1 62 62 ALA CB C 62 18.806 18.806 20.937 -2.131 19439
782 1 4 . 1 1 62 62 ALA H H 62 8.487 8.487 8.985 -0.498 19439
783 1 4 . 1 1 63 63 LEU N N 63 120.199 120.199 120.660 -0.461 19439
784 1 4 . 1 1 63 63 LEU HA H 63 4.828 4.828 4.941 -0.113 19439
785 1 4 . 1 1 63 63 LEU CA C 63 51.852 51.852 52.922 -1.070 19439
786 1 4 . 1 1 63 63 LEU CB C 63 44.081 44.081 45.624 -1.543 19439
787 1 4 . 1 1 63 63 LEU H H 63 7.927 7.927 8.257 -0.330 19439
788 1 4 . 1 1 64 64 HIS N N 64 122.277 122.277 119.433 2.844 19439
789 1 4 . 1 1 64 64 HIS HA H 64 4.114 4.114 4.564 -0.450 19439
790 1 4 . 1 1 64 64 HIS CA C 64 58.038 58.038 57.034 1.004 19439
791 1 4 . 1 1 64 64 HIS CB C 64 31.228 31.228 31.223 0.006 19439
792 1 4 . 1 1 64 64 HIS H H 64 8.477 8.477 8.816 -0.339 19439
793 1 4 . 1 1 65 65 ALA HA H 65 4.339 4.339 4.404 -0.065 19439
794 1 4 . 1 1 65 65 ALA CA C 65 53.281 53.281 52.874 0.407 19439
795 1 4 . 1 1 65 65 ALA CB C 65 20.276 20.276 19.828 0.448 19439
796 1 4 . 1 1 66 66 GLU N N 66 113.868 113.868 116.521 -2.653 19439
797 1 4 . 1 1 66 66 GLU HA H 66 4.619 4.619 4.514 0.105 19439
798 1 4 . 1 1 66 66 GLU CA C 66 54.727 54.727 55.079 -0.352 19439
799 1 4 . 1 1 66 66 GLU CB C 66 32.894 32.894 32.865 0.029 19439
800 1 4 . 1 1 66 66 GLU H H 66 7.759 7.759 8.059 -0.300 19439
801 1 4 . 1 1 68 68 PRO HA H 68 4.219 4.219 4.245 -0.026 19439
802 1 4 . 1 1 68 68 PRO CA C 68 64.664 64.664 65.056 -0.392 19439
803 1 4 . 1 1 68 68 PRO CB C 68 32.066 32.066 31.738 0.328 19439
804 1 4 . 1 1 69 69 LEU N N 69 117.262 117.262 117.427 -0.165 19439
805 1 4 . 1 1 69 69 LEU HA H 69 4.182 4.182 4.386 -0.204 19439
806 1 4 . 1 1 69 69 LEU CA C 69 52.430 52.430 53.396 -0.966 19439
807 1 4 . 1 1 69 69 LEU CB C 69 40.907 40.907 41.234 -0.327 19439
808 1 4 . 1 1 69 69 LEU H H 69 8.439 8.439 7.878 0.561 19439
809 1 4 . 1 1 70 70 ALA N N 70 120.426 120.426 121.589 -1.163 19439
810 1 4 . 1 1 70 70 ALA HA H 70 3.411 3.411 4.114 -0.703 19439
811 1 4 . 1 1 70 70 ALA CA C 70 53.685 53.685 53.464 0.221 19439
812 1 4 . 1 1 70 70 ALA CB C 70 17.914 17.914 18.699 -0.785 19439
813 1 4 . 1 1 70 70 ALA H H 70 7.113 7.113 7.583 -0.470 19439
814 1 4 . 1 1 71 71 GLY N N 71 108.911 108.911 113.252 -4.341 19439
815 1 4 . 1 1 71 71 GLY CA C 71 45.215 45.215 45.022 0.193 19439
816 1 4 . 1 1 71 71 GLY H H 71 8.856 8.856 8.987 -0.131 19439
817 1 4 . 1 1 72 72 LEU N N 72 120.000 120.000 120.760 -0.760 19439
818 1 4 . 1 1 72 72 LEU HA H 72 4.769 4.769 4.998 -0.229 19439
819 1 4 . 1 1 72 72 LEU CA C 72 51.972 51.972 51.576 0.396 19439
820 1 4 . 1 1 72 72 LEU CB C 72 41.255 41.255 42.951 -1.696 19439
821 1 4 . 1 1 72 72 LEU H H 72 8.136 8.136 7.937 0.199 19439
822 1 4 . 1 1 73 73 PRO HA H 73 4.739 4.739 4.677 0.062 19439
823 1 4 . 1 1 73 73 PRO CA C 73 61.456 61.456 62.804 -1.348 19439
824 1 4 . 1 1 73 73 PRO CB C 73 31.245 31.245 32.010 -0.765 19439
825 1 4 . 1 1 74 74 VAL N N 74 121.723 121.723 119.562 2.161 19439
826 1 4 . 1 1 74 74 VAL HA H 74 3.446 3.446 3.909 -0.463 19439
827 1 4 . 1 1 74 74 VAL CA C 74 65.744 65.744 63.607 2.137 19439
828 1 4 . 1 1 74 74 VAL CB C 74 31.236 31.236 31.954 -0.718 19439
829 1 4 . 1 1 74 74 VAL H H 74 7.710 7.710 8.114 -0.404 19439
830 1 4 . 1 1 75 75 THR N N 75 108.893 108.893 109.012 -0.119 19439
831 1 4 . 1 1 75 75 THR HA H 75 4.937 4.937 4.540 0.397 19439
832 1 4 . 1 1 75 75 THR CA C 75 59.892 59.892 59.674 0.218 19439
833 1 4 . 1 1 75 75 THR CB C 75 12.018 12.018 71.837 -59.819 19439
834 1 4 . 1 1 75 75 THR H H 75 8.710 8.710 7.501 1.209 19439
835 1 4 . 1 1 76 76 ARG HA H 76 3.873 3.873 3.960 -0.087 19439
836 1 4 . 1 1 76 76 ARG H H 76 8.447 8.447 8.839 -0.392 19439
837 1 4 . 1 1 77 77 SER N N 77 114.482 114.482 114.045 0.437 19439
838 1 4 . 1 1 77 77 SER HA H 77 4.061 4.061 4.178 -0.117 19439
839 1 4 . 1 1 77 77 SER CA C 77 60.467 60.467 61.353 -0.886 19439
840 1 4 . 1 1 77 77 SER CB C 77 62.449 62.449 62.554 -0.105 19439
841 1 4 . 1 1 77 77 SER H H 77 8.105 8.105 7.963 0.142 19439
842 1 4 . 1 1 78 78 ASP N N 78 120.538 120.538 121.927 -1.389 19439
843 1 4 . 1 1 78 78 ASP HA H 78 4.333 4.333 4.308 0.025 19439
844 1 4 . 1 1 78 78 ASP CA C 78 58.020 58.020 57.252 0.768 19439
845 1 4 . 1 1 78 78 ASP CB C 78 43.252 43.252 40.394 2.858 19439
846 1 4 . 1 1 78 78 ASP H H 78 7.300 7.300 8.153 -0.853 19439
847 1 4 . 1 1 79 79 ALA N N 79 120.614 120.614 122.793 -2.179 19439
848 1 4 . 1 1 79 79 ALA HA H 79 3.672 3.672 3.848 -0.176 19439
849 1 4 . 1 1 79 79 ALA CA C 79 54.886 54.886 55.217 -0.331 19439
850 1 4 . 1 1 79 79 ALA CB C 79 19.628 19.628 18.317 1.311 19439
851 1 4 . 1 1 79 79 ALA H H 79 7.767 7.767 8.287 -0.520 19439
852 1 4 . 1 1 80 80 ARG N N 80 116.203 116.203 119.168 -2.965 19439
853 1 4 . 1 1 80 80 ARG HA H 80 3.732 3.732 4.056 -0.324 19439
854 1 4 . 1 1 80 80 ARG CA C 80 61.441 61.441 59.417 2.023 19439
855 1 4 . 1 1 80 80 ARG CB C 80 30.266 30.266 30.390 -0.124 19439
856 1 4 . 1 1 80 80 ARG H H 80 7.981 7.981 8.156 -0.175 19439
857 1 4 . 1 1 81 81 VAL N N 81 119.192 119.192 120.136 -0.944 19439
858 1 4 . 1 1 81 81 VAL HA H 81 3.582 3.582 3.938 -0.356 19439
859 1 4 . 1 1 81 81 VAL CA C 81 66.909 66.909 66.681 0.228 19439
860 1 4 . 1 1 81 81 VAL CB C 81 31.668 31.668 31.719 -0.051 19439
861 1 4 . 1 1 81 81 VAL H H 81 7.338 7.338 8.297 -0.959 19439
862 1 4 . 1 1 82 82 LEU N N 82 118.722 118.722 121.387 -2.665 19439
863 1 4 . 1 1 82 82 LEU HA H 82 4.044 4.044 3.918 0.126 19439
864 1 4 . 1 1 82 82 LEU CA C 82 58.356 58.356 58.676 -0.320 19439
865 1 4 . 1 1 82 82 LEU CB C 82 41.627 41.627 41.647 -0.020 19439
866 1 4 . 1 1 82 82 LEU H H 82 7.599 7.599 8.338 -0.739 19439
867 1 4 . 1 1 83 83 ILE N N 83 120.893 120.893 119.753 1.140 19439
868 1 4 . 1 1 83 83 ILE HA H 83 3.642 3.642 3.752 -0.110 19439
869 1 4 . 1 1 83 83 ILE CA C 83 65.669 65.669 65.542 0.127 19439
870 1 4 . 1 1 83 83 ILE CB C 83 38.579 38.579 37.998 0.580 19439
871 1 4 . 1 1 83 83 ILE H H 83 8.546 8.546 8.345 0.201 19439
872 1 4 . 1 1 84 84 PHE N N 84 123.343 123.343 120.373 2.970 19439
873 1 4 . 1 1 84 84 PHE HA H 84 4.084 4.084 4.069 0.015 19439
874 1 4 . 1 1 84 84 PHE CA C 84 62.593 62.593 60.195 2.398 19439
875 1 4 . 1 1 84 84 PHE CB C 84 39.211 39.211 38.662 0.549 19439
876 1 4 . 1 1 84 84 PHE H H 84 8.622 8.622 8.461 0.161 19439
877 1 4 . 1 1 85 85 ASN N N 85 118.037 118.037 118.080 -0.043 19439
878 1 4 . 1 1 85 85 ASN HA H 85 4.426 4.426 4.113 0.313 19439
879 1 4 . 1 1 85 85 ASN CA C 85 56.045 56.045 56.850 -0.805 19439
880 1 4 . 1 1 85 85 ASN CB C 85 37.785 37.785 38.556 -0.771 19439
881 1 4 . 1 1 85 85 ASN H H 85 8.834 8.834 8.604 0.230 19439
882 1 4 . 1 1 86 86 GLU N N 86 121.098 121.098 121.926 -0.828 19439
883 1 4 . 1 1 86 86 GLU HA H 86 4.052 4.052 4.000 0.052 19439
884 1 4 . 1 1 86 86 GLU CA C 86 59.328 59.328 59.822 -0.494 19439
885 1 4 . 1 1 86 86 GLU CB C 86 30.253 30.253 29.612 0.641 19439
886 1 4 . 1 1 86 86 GLU H H 86 8.105 8.105 8.296 -0.191 19439
887 1 4 . 1 1 87 87 TRP N N 87 122.584 122.584 122.035 0.549 19439
888 1 4 . 1 1 87 87 TRP HA H 87 4.006 4.006 4.184 -0.178 19439
889 1 4 . 1 1 87 87 TRP CA C 87 61.545 61.545 61.826 -0.281 19439
890 1 4 . 1 1 87 87 TRP CB C 87 27.943 27.943 29.515 -1.572 19439
891 1 4 . 1 1 87 87 TRP H H 87 8.099 8.099 8.668 -0.569 19439
892 1 4 . 1 1 88 88 GLU N N 88 117.357 117.357 119.020 -1.663 19439
893 1 4 . 1 1 88 88 GLU HA H 88 2.919 2.919 3.466 -0.547 19439
894 1 4 . 1 1 88 88 GLU CA C 88 59.804 59.804 59.785 0.019 19439
895 1 4 . 1 1 88 88 GLU CB C 88 29.546 29.546 29.133 0.413 19439
896 1 4 . 1 1 88 88 GLU H H 88 8.440 8.440 8.665 -0.225 19439
897 1 4 . 1 1 89 89 GLU N N 89 116.109 116.109 118.967 -2.858 19439
898 1 4 . 1 1 89 89 GLU HA H 89 3.995 3.995 3.966 0.029 19439
899 1 4 . 1 1 89 89 GLU CA C 89 58.329 58.329 59.382 -1.053 19439
900 1 4 . 1 1 89 89 GLU CB C 89 29.649 29.649 29.331 0.318 19439
901 1 4 . 1 1 89 89 GLU H H 89 7.244 7.244 8.047 -0.803 19439
902 1 4 . 1 1 90 90 ARG N N 90 120.512 120.512 118.590 1.922 19439
903 1 4 . 1 1 90 90 ARG HA H 90 3.920 3.920 3.961 -0.041 19439
904 1 4 . 1 1 90 90 ARG CA C 90 58.683 58.683 58.721 -0.038 19439
905 1 4 . 1 1 90 90 ARG CB C 90 30.659 30.659 29.756 0.903 19439
906 1 4 . 1 1 90 90 ARG H H 90 8.368 8.368 8.405 -0.037 19439
907 1 4 . 1 1 91 91 LYS N N 91 120.024 120.024 120.030 -0.006 19439
908 1 4 . 1 1 91 91 LYS HA H 91 3.964 3.964 3.887 0.077 19439
909 1 4 . 1 1 91 91 LYS CA C 91 57.278 57.278 58.414 -1.136 19439
910 1 4 . 1 1 91 91 LYS CB C 91 30.582 30.582 31.217 -0.635 19439
911 1 4 . 1 1 91 91 LYS H H 91 8.491 8.491 8.021 0.470 19439
912 1 4 . 1 1 92 92 LYS N N 92 118.192 118.192 117.852 0.340 19439
913 1 4 . 1 1 92 92 LYS HA H 92 3.796 3.796 4.040 -0.244 19439
914 1 4 . 1 1 92 92 LYS CA C 92 58.976 58.976 59.184 -0.208 19439
915 1 4 . 1 1 92 92 LYS CB C 92 32.188 32.188 32.458 -0.270 19439
916 1 4 . 1 1 92 92 LYS H H 92 6.933 6.933 7.752 -0.819 19439
917 1 4 . 1 1 93 93 SER N N 93 110.447 110.447 113.079 -2.632 19439
918 1 4 . 1 1 93 93 SER HA H 93 4.484 4.484 4.330 0.154 19439
919 1 4 . 1 1 93 93 SER CA C 93 58.386 58.386 60.260 -1.874 19439
920 1 4 . 1 1 93 93 SER CB C 93 64.173 64.173 64.052 0.121 19439
921 1 4 . 1 1 93 93 SER H H 93 7.282 7.282 7.815 -0.533 19439
922 1 4 . 1 1 94 94 ASP N N 94 120.163 120.163 119.519 0.644 19439
923 1 4 . 1 1 94 94 ASP HA H 94 4.872 4.872 4.987 -0.115 19439
924 1 4 . 1 1 94 94 ASP CA C 94 51.157 51.157 52.442 -1.285 19439
925 1 4 . 1 1 94 94 ASP CB C 94 41.256 41.256 43.067 -1.811 19439
926 1 4 . 1 1 94 94 ASP H H 94 7.303 7.303 8.033 -0.730 19439
927 1 4 . 1 1 95 95 PRO CA C 95 63.871 63.871 64.014 -0.144 19439
928 1 4 . 1 1 95 95 PRO CB C 95 31.497 31.497 32.221 -0.724 19439
929 1 4 . 1 1 96 96 TRP N N 96 117.486 117.486 117.485 0.001 19439
930 1 4 . 1 1 96 96 TRP HA H 96 4.637 4.637 4.636 0.001 19439
931 1 4 . 1 1 96 96 TRP CA C 96 56.061 56.061 55.995 0.066 19439
932 1 4 . 1 1 96 96 TRP CB C 96 28.605 28.605 28.219 0.386 19439
933 1 4 . 1 1 96 96 TRP H H 96 7.484 7.484 7.971 -0.487 19439
934 1 4 . 1 1 97 97 LEU N N 97 123.510 123.510 121.827 1.683 19439
935 1 4 . 1 1 97 97 LEU HA H 97 4.098 4.098 3.181 0.917 19439
936 1 4 . 1 1 97 97 LEU CA C 97 56.024 56.024 54.662 1.362 19439
937 1 4 . 1 1 97 97 LEU CB C 97 42.893 42.893 42.498 0.395 19439
938 1 4 . 1 1 97 97 LEU H H 97 7.137 7.137 6.726 0.411 19439
939 1 4 . 1 1 98 98 ARG N N 98 129.724 129.724 124.173 5.551 19439
940 1 4 . 1 1 98 98 ARG HA H 98 4.486 4.486 4.690 -0.204 19439
941 1 4 . 1 1 98 98 ARG CA C 98 55.622 55.622 54.579 1.043 19439
942 1 4 . 1 1 98 98 ARG CB C 98 31.229 31.229 32.317 -1.088 19439
943 1 4 . 1 1 98 98 ARG H H 98 8.825 8.825 8.306 0.519 19439
944 1 4 . 1 1 99 99 LEU N N 99 127.814 127.814 124.352 3.462 19439
945 1 4 . 1 1 99 99 LEU HA H 99 3.586 3.586 4.194 -0.608 19439
946 1 4 . 1 1 99 99 LEU CA C 99 54.352 54.352 54.367 -0.015 19439
947 1 4 . 1 1 99 99 LEU CB C 99 40.485 40.485 41.696 -1.210 19439
948 1 4 . 1 1 99 99 LEU H H 99 8.236 8.236 8.126 0.110 19439
949 1 4 . 1 1 100 100 ASP N N 100 126.633 126.633 127.592 -0.959 19439
950 1 4 . 1 1 100 100 ASP HA H 100 4.646 4.646 4.856 -0.210 19439
951 1 4 . 1 1 100 100 ASP CA C 100 52.894 52.894 53.853 -0.959 19439
952 1 4 . 1 1 100 100 ASP CB C 100 41.224 41.224 43.101 -1.877 19439
953 1 4 . 1 1 100 100 ASP H H 100 8.018 8.018 8.588 -0.570 19439
954 1 4 . 1 1 101 101 MET N N 101 122.473 122.473 119.577 2.896 19439
955 1 4 . 1 1 101 101 MET HA H 101 4.481 4.481 4.635 -0.154 19439
956 1 4 . 1 1 101 101 MET CA C 101 53.398 53.398 54.535 -1.137 19439
957 1 4 . 1 1 101 101 MET CB C 101 33.296 33.296 33.076 0.220 19439
958 1 4 . 1 1 101 101 MET H H 101 8.639 8.639 8.006 0.633 19439
959 1 4 . 1 1 102 102 SER N N 102 116.243 116.243 117.484 -1.241 19439
960 1 4 . 1 1 102 102 SER HA H 102 4.114 4.114 4.274 -0.160 19439
961 1 4 . 1 1 102 102 SER CA C 102 58.709 58.709 57.394 1.315 19439
962 1 4 . 1 1 102 102 SER CB C 102 64.701 64.701 64.793 -0.092 19439
963 1 4 . 1 1 102 102 SER H H 102 8.096 8.096 8.076 0.020 19439
964 1 4 . 1 1 103 103 ASP N N 103 121.639 121.639 123.834 -2.195 19439
965 1 4 . 1 1 103 103 ASP HA H 103 3.724 3.724 3.918 -0.194 19439
966 1 4 . 1 1 103 103 ASP CA C 103 57.296 57.296 56.462 0.834 19439
967 1 4 . 1 1 103 103 ASP CB C 103 38.720 38.720 40.178 -1.458 19439
968 1 4 . 1 1 103 103 ASP H H 103 8.669 8.669 8.784 -0.115 19439
969 1 4 . 1 1 104 104 LYS N N 104 116.276 116.276 119.620 -3.344 19439
970 1 4 . 1 1 104 104 LYS HA H 104 3.678 3.678 4.006 -0.328 19439
971 1 4 . 1 1 104 104 LYS CA C 104 59.833 59.833 59.072 0.761 19439
972 1 4 . 1 1 104 104 LYS CB C 104 32.090 32.090 32.224 -0.134 19439
973 1 4 . 1 1 104 104 LYS H H 104 7.775 7.775 7.474 0.301 19439
974 1 4 . 1 1 105 105 ALA N N 105 122.257 122.257 122.542 -0.285 19439
975 1 4 . 1 1 105 105 ALA HA H 105 3.873 3.873 4.092 -0.219 19439
976 1 4 . 1 1 105 105 ALA CA C 105 55.008 55.008 54.764 0.244 19439
977 1 4 . 1 1 105 105 ALA CB C 105 17.741 17.741 18.130 -0.389 19439
978 1 4 . 1 1 105 105 ALA H H 105 7.266 7.266 7.602 -0.336 19439
979 1 4 . 1 1 106 106 ILE N N 106 119.452 119.452 119.870 -0.418 19439
980 1 4 . 1 1 106 106 ILE HA H 106 3.419 3.419 3.826 -0.407 19439
981 1 4 . 1 1 106 106 ILE CA C 106 65.971 65.971 64.488 1.483 19439
982 1 4 . 1 1 106 106 ILE CB C 106 37.430 37.430 37.583 -0.153 19439
983 1 4 . 1 1 106 106 ILE H H 106 7.974 7.974 7.770 0.204 19439
984 1 4 . 1 1 107 107 PHE N N 107 117.814 117.814 118.867 -1.053 19439
985 1 4 . 1 1 107 107 PHE HA H 107 4.368 4.368 4.683 -0.315 19439
986 1 4 . 1 1 107 107 PHE CA C 107 56.844 56.844 58.576 -1.732 19439
987 1 4 . 1 1 107 107 PHE CB C 107 37.150 37.150 37.707 -0.557 19439
988 1 4 . 1 1 107 107 PHE H H 107 8.434 8.434 8.183 0.251 19439
989 1 4 . 1 1 108 108 ARG N N 108 117.368 117.368 120.181 -2.813 19439
990 1 4 . 1 1 108 108 ARG HA H 108 3.994 3.994 4.120 -0.126 19439
991 1 4 . 1 1 108 108 ARG CA C 108 58.682 58.682 58.895 -0.213 19439
992 1 4 . 1 1 108 108 ARG CB C 108 30.287 30.287 30.291 -0.004 19439
993 1 4 . 1 1 108 108 ARG H H 108 7.474 7.474 8.200 -0.726 19439
994 1 4 . 1 1 109 109 ARG N N 109 117.440 117.440 116.937 0.503 19439
995 1 4 . 1 1 109 109 ARG HA H 109 3.900 3.900 3.938 -0.038 19439
996 1 4 . 1 1 109 109 ARG CA C 109 57.312 57.312 58.209 -0.897 19439
997 1 4 . 1 1 109 109 ARG CB C 109 31.626 31.626 30.917 0.709 19439
998 1 4 . 1 1 109 109 ARG H H 109 7.118 7.118 7.669 -0.551 19439
999 1 4 . 1 1 110 110 TYR N N 110 116.060 116.060 116.368 -0.308 19439
1000 1 4 . 1 1 110 110 TYR HA H 110 5.265 5.265 5.154 0.111 19439
1001 1 4 . 1 1 110 110 TYR CA C 110 54.188 54.188 54.701 -0.513 19439
1002 1 4 . 1 1 110 110 TYR CB C 110 38.484 38.484 38.434 0.050 19439
1003 1 4 . 1 1 110 110 TYR H H 110 8.707 8.707 8.090 0.617 19439
1004 1 4 . 1 1 111 111 PRO HA H 111 4.388 4.388 4.680 -0.292 19439
1005 1 4 . 1 1 111 111 PRO CA C 111 64.847 64.847 64.335 0.512 19439
1006 1 4 . 1 1 111 111 PRO CB C 111 31.381 31.381 32.076 -0.695 19439
1007 1 4 . 1 1 112 112 HIS N N 112 115.542 115.542 114.649 0.893 19439
1008 1 4 . 1 1 112 112 HIS HA H 112 4.482 4.482 4.527 -0.045 19439
1009 1 4 . 1 1 112 112 HIS CA C 112 58.498 58.498 57.243 1.255 19439
1010 1 4 . 1 1 112 112 HIS CB C 112 29.654 29.654 28.536 1.118 19439
1011 1 4 . 1 1 112 112 HIS H H 112 8.196 8.196 8.413 -0.217 19439
1012 1 4 . 1 1 113 113 LEU N N 113 120.583 120.583 119.983 0.600 19439
1013 1 4 . 1 1 113 113 LEU HA H 113 4.165 4.165 4.357 -0.192 19439
1014 1 4 . 1 1 113 113 LEU CA C 113 54.013 54.013 55.046 -1.033 19439
1015 1 4 . 1 1 113 113 LEU CB C 113 41.669 41.669 41.553 0.116 19439
1016 1 4 . 1 1 113 113 LEU H H 113 7.527 7.527 7.434 0.093 19439
1017 1 5 . 1 1 59 59 ALA N N 59 123.310 123.310 122.012 1.298 19439
1018 1 5 . 1 1 59 59 ALA HA H 59 4.232 4.232 4.651 -0.419 19439
1019 1 5 . 1 1 59 59 ALA CA C 59 52.274 52.274 51.978 0.296 19439
1020 1 5 . 1 1 59 59 ALA CB C 59 19.623 19.623 19.327 0.296 19439
1021 1 5 . 1 1 59 59 ALA H H 59 7.894 7.894 8.205 -0.311 19439
1022 1 5 . 1 1 60 60 LEU N N 60 120.936 120.936 114.842 6.094 19439
1023 1 5 . 1 1 60 60 LEU HA H 60 4.364 4.364 4.331 0.033 19439
1024 1 5 . 1 1 60 60 LEU CA C 60 54.130 54.130 54.908 -0.778 19439
1025 1 5 . 1 1 60 60 LEU CB C 60 43.209 43.209 41.027 2.182 19439
1026 1 5 . 1 1 60 60 LEU H H 60 8.046 8.046 7.657 0.389 19439
1027 1 5 . 1 1 61 61 ALA N N 61 125.460 125.460 121.821 3.639 19439
1028 1 5 . 1 1 61 61 ALA HA H 61 4.364 4.364 4.258 0.106 19439
1029 1 5 . 1 1 61 61 ALA CA C 61 51.176 51.176 51.862 -0.686 19439
1030 1 5 . 1 1 61 61 ALA CB C 61 20.172 20.172 19.558 0.614 19439
1031 1 5 . 1 1 61 61 ALA H H 61 8.338 8.338 7.564 0.774 19439
1032 1 5 . 1 1 62 62 ALA N N 62 127.765 127.765 126.767 0.998 19439
1033 1 5 . 1 1 62 62 ALA HA H 62 4.394 4.394 4.662 -0.268 19439
1034 1 5 . 1 1 62 62 ALA CA C 62 51.888 51.888 50.842 1.046 19439
1035 1 5 . 1 1 62 62 ALA CB C 62 18.806 18.806 20.982 -2.176 19439
1036 1 5 . 1 1 62 62 ALA H H 62 8.487 8.487 8.915 -0.428 19439
1037 1 5 . 1 1 63 63 LEU N N 63 120.199 120.199 120.922 -0.723 19439
1038 1 5 . 1 1 63 63 LEU HA H 63 4.828 4.828 4.973 -0.145 19439
1039 1 5 . 1 1 63 63 LEU CA C 63 51.852 51.852 53.005 -1.153 19439
1040 1 5 . 1 1 63 63 LEU CB C 63 44.081 44.081 45.392 -1.311 19439
1041 1 5 . 1 1 63 63 LEU H H 63 7.927 7.927 8.286 -0.359 19439
1042 1 5 . 1 1 64 64 HIS N N 64 122.277 122.277 119.249 3.028 19439
1043 1 5 . 1 1 64 64 HIS HA H 64 4.114 4.114 4.570 -0.456 19439
1044 1 5 . 1 1 64 64 HIS CA C 64 58.038 58.038 56.986 1.052 19439
1045 1 5 . 1 1 64 64 HIS CB C 64 31.228 31.228 31.486 -0.258 19439
1046 1 5 . 1 1 64 64 HIS H H 64 8.477 8.477 8.840 -0.363 19439
1047 1 5 . 1 1 65 65 ALA HA H 65 4.339 4.339 4.442 -0.103 19439
1048 1 5 . 1 1 65 65 ALA CA C 65 53.281 53.281 52.311 0.970 19439
1049 1 5 . 1 1 65 65 ALA CB C 65 20.276 20.276 20.067 0.209 19439
1050 1 5 . 1 1 66 66 GLU N N 66 113.868 113.868 117.527 -3.659 19439
1051 1 5 . 1 1 66 66 GLU HA H 66 4.619 4.619 4.569 0.050 19439
1052 1 5 . 1 1 66 66 GLU CA C 66 54.727 54.727 55.441 -0.714 19439
1053 1 5 . 1 1 66 66 GLU CB C 66 32.894 32.894 32.389 0.505 19439
1054 1 5 . 1 1 66 66 GLU H H 66 7.759 7.759 7.922 -0.163 19439
1055 1 5 . 1 1 68 68 PRO HA H 68 4.219 4.219 4.283 -0.064 19439
1056 1 5 . 1 1 68 68 PRO CA C 68 64.664 64.664 65.037 -0.373 19439
1057 1 5 . 1 1 68 68 PRO CB C 68 32.066 32.066 31.683 0.383 19439
1058 1 5 . 1 1 69 69 LEU N N 69 117.262 117.262 118.272 -1.010 19439
1059 1 5 . 1 1 69 69 LEU HA H 69 4.182 4.182 4.197 -0.015 19439
1060 1 5 . 1 1 69 69 LEU CA C 69 52.430 52.430 53.526 -1.096 19439
1061 1 5 . 1 1 69 69 LEU CB C 69 40.907 40.907 41.248 -0.341 19439
1062 1 5 . 1 1 69 69 LEU H H 69 8.439 8.439 7.925 0.514 19439
1063 1 5 . 1 1 70 70 ALA N N 70 120.426 120.426 121.060 -0.634 19439
1064 1 5 . 1 1 70 70 ALA HA H 70 3.411 3.411 4.211 -0.800 19439
1065 1 5 . 1 1 70 70 ALA CA C 70 53.685 53.685 53.482 0.203 19439
1066 1 5 . 1 1 70 70 ALA CB C 70 17.914 17.914 18.621 -0.707 19439
1067 1 5 . 1 1 70 70 ALA H H 70 7.113 7.113 7.426 -0.313 19439
1068 1 5 . 1 1 71 71 GLY N N 71 108.911 108.911 112.696 -3.785 19439
1069 1 5 . 1 1 71 71 GLY CA C 71 45.215 45.215 45.050 0.166 19439
1070 1 5 . 1 1 71 71 GLY H H 71 8.856 8.856 8.792 0.064 19439
1071 1 5 . 1 1 72 72 LEU N N 72 120.000 120.000 121.639 -1.639 19439
1072 1 5 . 1 1 72 72 LEU HA H 72 4.769 4.769 4.937 -0.168 19439
1073 1 5 . 1 1 72 72 LEU CA C 72 51.972 51.972 51.575 0.397 19439
1074 1 5 . 1 1 72 72 LEU CB C 72 41.255 41.255 42.857 -1.602 19439
1075 1 5 . 1 1 72 72 LEU H H 72 8.136 8.136 8.049 0.087 19439
1076 1 5 . 1 1 73 73 PRO HA H 73 4.739 4.739 4.659 0.080 19439
1077 1 5 . 1 1 73 73 PRO CA C 73 61.456 61.456 62.814 -1.358 19439
1078 1 5 . 1 1 73 73 PRO CB C 73 31.245 31.245 31.988 -0.742 19439
1079 1 5 . 1 1 74 74 VAL N N 74 121.723 121.723 121.019 0.704 19439
1080 1 5 . 1 1 74 74 VAL HA H 74 3.446 3.446 3.724 -0.278 19439
1081 1 5 . 1 1 74 74 VAL CA C 74 65.744 65.744 64.251 1.493 19439
1082 1 5 . 1 1 74 74 VAL CB C 74 31.236 31.236 31.939 -0.702 19439
1083 1 5 . 1 1 74 74 VAL H H 74 7.710 7.710 8.148 -0.438 19439
1084 1 5 . 1 1 75 75 THR N N 75 108.893 108.893 112.746 -3.853 19439
1085 1 5 . 1 1 75 75 THR HA H 75 4.937 4.937 4.618 0.319 19439
1086 1 5 . 1 1 75 75 THR CA C 75 59.892 59.892 59.271 0.621 19439
1087 1 5 . 1 1 75 75 THR CB C 75 12.018 12.018 70.789 -58.771 19439
1088 1 5 . 1 1 75 75 THR H H 75 8.710 8.710 8.203 0.507 19439
1089 1 5 . 1 1 76 76 ARG HA H 76 3.873 3.873 4.061 -0.188 19439
1090 1 5 . 1 1 76 76 ARG H H 76 8.447 8.447 8.861 -0.414 19439
1091 1 5 . 1 1 77 77 SER N N 77 114.482 114.482 116.074 -1.592 19439
1092 1 5 . 1 1 77 77 SER HA H 77 4.061 4.061 4.177 -0.116 19439
1093 1 5 . 1 1 77 77 SER CA C 77 60.467 60.467 61.320 -0.853 19439
1094 1 5 . 1 1 77 77 SER CB C 77 62.449 62.449 62.847 -0.398 19439
1095 1 5 . 1 1 77 77 SER H H 77 8.105 8.105 7.926 0.179 19439
1096 1 5 . 1 1 78 78 ASP N N 78 120.538 120.538 122.717 -2.179 19439
1097 1 5 . 1 1 78 78 ASP HA H 78 4.333 4.333 4.387 -0.054 19439
1098 1 5 . 1 1 78 78 ASP CA C 78 58.020 58.020 57.064 0.956 19439
1099 1 5 . 1 1 78 78 ASP CB C 78 43.252 43.252 40.388 2.864 19439
1100 1 5 . 1 1 78 78 ASP H H 78 7.300 7.300 7.750 -0.450 19439
1101 1 5 . 1 1 79 79 ALA N N 79 120.614 120.614 122.976 -2.362 19439
1102 1 5 . 1 1 79 79 ALA HA H 79 3.672 3.672 3.852 -0.180 19439
1103 1 5 . 1 1 79 79 ALA CA C 79 54.886 54.886 55.181 -0.295 19439
1104 1 5 . 1 1 79 79 ALA CB C 79 19.628 19.628 18.251 1.377 19439
1105 1 5 . 1 1 79 79 ALA H H 79 7.767 7.767 8.104 -0.337 19439
1106 1 5 . 1 1 80 80 ARG N N 80 116.203 116.203 119.115 -2.912 19439
1107 1 5 . 1 1 80 80 ARG HA H 80 3.732 3.732 4.019 -0.287 19439
1108 1 5 . 1 1 80 80 ARG CA C 80 61.441 61.441 59.591 1.850 19439
1109 1 5 . 1 1 80 80 ARG CB C 80 30.266 30.266 30.414 -0.148 19439
1110 1 5 . 1 1 80 80 ARG H H 80 7.981 7.981 8.226 -0.245 19439
1111 1 5 . 1 1 81 81 VAL N N 81 119.192 119.192 119.692 -0.500 19439
1112 1 5 . 1 1 81 81 VAL HA H 81 3.582 3.582 3.989 -0.407 19439
1113 1 5 . 1 1 81 81 VAL CA C 81 66.909 66.909 66.588 0.321 19439
1114 1 5 . 1 1 81 81 VAL CB C 81 31.668 31.668 31.751 -0.083 19439
1115 1 5 . 1 1 81 81 VAL H H 81 7.338 7.338 8.031 -0.693 19439
1116 1 5 . 1 1 82 82 LEU N N 82 118.722 118.722 121.836 -3.114 19439
1117 1 5 . 1 1 82 82 LEU HA H 82 4.044 4.044 3.900 0.144 19439
1118 1 5 . 1 1 82 82 LEU CA C 82 58.356 58.356 58.755 -0.399 19439
1119 1 5 . 1 1 82 82 LEU CB C 82 41.627 41.627 41.605 0.022 19439
1120 1 5 . 1 1 82 82 LEU H H 82 7.599 7.599 8.427 -0.828 19439
1121 1 5 . 1 1 83 83 ILE N N 83 120.893 120.893 119.541 1.352 19439
1122 1 5 . 1 1 83 83 ILE HA H 83 3.642 3.642 3.727 -0.085 19439
1123 1 5 . 1 1 83 83 ILE CA C 83 65.669 65.669 65.583 0.086 19439
1124 1 5 . 1 1 83 83 ILE CB C 83 38.579 38.579 37.932 0.647 19439
1125 1 5 . 1 1 83 83 ILE H H 83 8.546 8.546 8.315 0.231 19439
1126 1 5 . 1 1 84 84 PHE N N 84 123.343 123.343 120.359 2.984 19439
1127 1 5 . 1 1 84 84 PHE HA H 84 4.084 4.084 4.111 -0.027 19439
1128 1 5 . 1 1 84 84 PHE CA C 84 62.593 62.593 60.205 2.388 19439
1129 1 5 . 1 1 84 84 PHE CB C 84 39.211 39.211 38.710 0.501 19439
1130 1 5 . 1 1 84 84 PHE H H 84 8.622 8.622 8.659 -0.037 19439
1131 1 5 . 1 1 85 85 ASN N N 85 118.037 118.037 118.976 -0.939 19439
1132 1 5 . 1 1 85 85 ASN HA H 85 4.426 4.426 4.098 0.328 19439
1133 1 5 . 1 1 85 85 ASN CA C 85 56.045 56.045 56.515 -0.470 19439
1134 1 5 . 1 1 85 85 ASN CB C 85 37.785 37.785 38.559 -0.774 19439
1135 1 5 . 1 1 85 85 ASN H H 85 8.834 8.834 8.604 0.230 19439
1136 1 5 . 1 1 86 86 GLU N N 86 121.098 121.098 121.941 -0.843 19439
1137 1 5 . 1 1 86 86 GLU HA H 86 4.052 4.052 3.997 0.055 19439
1138 1 5 . 1 1 86 86 GLU CA C 86 59.328 59.328 59.673 -0.345 19439
1139 1 5 . 1 1 86 86 GLU CB C 86 30.253 30.253 29.603 0.650 19439
1140 1 5 . 1 1 86 86 GLU H H 86 8.105 8.105 8.184 -0.079 19439
1141 1 5 . 1 1 87 87 TRP N N 87 122.584 122.584 122.172 0.412 19439
1142 1 5 . 1 1 87 87 TRP HA H 87 4.006 4.006 4.200 -0.194 19439
1143 1 5 . 1 1 87 87 TRP CA C 87 61.545 61.545 61.712 -0.167 19439
1144 1 5 . 1 1 87 87 TRP CB C 87 27.943 27.943 29.530 -1.587 19439
1145 1 5 . 1 1 87 87 TRP H H 87 8.099 8.099 8.824 -0.725 19439
1146 1 5 . 1 1 88 88 GLU N N 88 117.357 117.357 119.560 -2.203 19439
1147 1 5 . 1 1 88 88 GLU HA H 88 2.919 2.919 3.269 -0.350 19439
1148 1 5 . 1 1 88 88 GLU CA C 88 59.804 59.804 59.590 0.214 19439
1149 1 5 . 1 1 88 88 GLU CB C 88 29.546 29.546 29.118 0.428 19439
1150 1 5 . 1 1 88 88 GLU H H 88 8.440 8.440 8.726 -0.286 19439
1151 1 5 . 1 1 89 89 GLU N N 89 116.109 116.109 119.821 -3.712 19439
1152 1 5 . 1 1 89 89 GLU HA H 89 3.995 3.995 3.888 0.107 19439
1153 1 5 . 1 1 89 89 GLU CA C 89 58.329 58.329 59.472 -1.143 19439
1154 1 5 . 1 1 89 89 GLU CB C 89 29.649 29.649 29.532 0.117 19439
1155 1 5 . 1 1 89 89 GLU H H 89 7.244 7.244 7.996 -0.752 19439
1156 1 5 . 1 1 90 90 ARG N N 90 120.512 120.512 118.279 2.233 19439
1157 1 5 . 1 1 90 90 ARG HA H 90 3.920 3.920 3.966 -0.046 19439
1158 1 5 . 1 1 90 90 ARG CA C 90 58.683 58.683 58.415 0.268 19439
1159 1 5 . 1 1 90 90 ARG CB C 90 30.659 30.659 29.664 0.995 19439
1160 1 5 . 1 1 90 90 ARG H H 90 8.368 8.368 8.056 0.312 19439
1161 1 5 . 1 1 91 91 LYS N N 91 120.024 120.024 120.256 -0.232 19439
1162 1 5 . 1 1 91 91 LYS HA H 91 3.964 3.964 3.960 0.004 19439
1163 1 5 . 1 1 91 91 LYS CA C 91 57.278 57.278 58.704 -1.426 19439
1164 1 5 . 1 1 91 91 LYS CB C 91 30.582 30.582 31.252 -0.670 19439
1165 1 5 . 1 1 91 91 LYS H H 91 8.491 8.491 8.124 0.367 19439
1166 1 5 . 1 1 92 92 LYS N N 92 118.192 118.192 118.534 -0.342 19439
1167 1 5 . 1 1 92 92 LYS HA H 92 3.796 3.796 4.051 -0.255 19439
1168 1 5 . 1 1 92 92 LYS CA C 92 58.976 58.976 58.638 0.338 19439
1169 1 5 . 1 1 92 92 LYS CB C 92 32.188 32.188 32.122 0.066 19439
1170 1 5 . 1 1 92 92 LYS H H 92 6.933 6.933 7.623 -0.690 19439
1171 1 5 . 1 1 93 93 SER N N 93 110.447 110.447 112.982 -2.535 19439
1172 1 5 . 1 1 93 93 SER HA H 93 4.484 4.484 4.336 0.148 19439
1173 1 5 . 1 1 93 93 SER CA C 93 58.386 58.386 60.049 -1.663 19439
1174 1 5 . 1 1 93 93 SER CB C 93 64.173 64.173 64.387 -0.214 19439
1175 1 5 . 1 1 93 93 SER H H 93 7.282 7.282 7.678 -0.396 19439
1176 1 5 . 1 1 94 94 ASP N N 94 120.163 120.163 119.591 0.572 19439
1177 1 5 . 1 1 94 94 ASP HA H 94 4.872 4.872 5.048 -0.176 19439
1178 1 5 . 1 1 94 94 ASP CA C 94 51.157 51.157 52.816 -1.659 19439
1179 1 5 . 1 1 94 94 ASP CB C 94 41.256 41.256 43.290 -2.034 19439
1180 1 5 . 1 1 94 94 ASP H H 94 7.303 7.303 8.218 -0.915 19439
1181 1 5 . 1 1 95 95 PRO CA C 95 63.871 63.871 64.176 -0.305 19439
1182 1 5 . 1 1 95 95 PRO CB C 95 31.497 31.497 32.565 -1.068 19439
1183 1 5 . 1 1 96 96 TRP N N 96 117.486 117.486 118.239 -0.753 19439
1184 1 5 . 1 1 96 96 TRP HA H 96 4.637 4.637 4.578 0.059 19439
1185 1 5 . 1 1 96 96 TRP CA C 96 56.061 56.061 55.773 0.288 19439
1186 1 5 . 1 1 96 96 TRP CB C 96 28.605 28.605 28.171 0.434 19439
1187 1 5 . 1 1 96 96 TRP H H 96 7.484 7.484 8.036 -0.552 19439
1188 1 5 . 1 1 97 97 LEU N N 97 123.510 123.510 120.830 2.680 19439
1189 1 5 . 1 1 97 97 LEU HA H 97 4.098 4.098 3.329 0.769 19439
1190 1 5 . 1 1 97 97 LEU CA C 97 56.024 56.024 54.105 1.919 19439
1191 1 5 . 1 1 97 97 LEU CB C 97 42.893 42.893 42.640 0.253 19439
1192 1 5 . 1 1 97 97 LEU H H 97 7.137 7.137 6.840 0.297 19439
1193 1 5 . 1 1 98 98 ARG N N 98 129.724 129.724 123.812 5.912 19439
1194 1 5 . 1 1 98 98 ARG HA H 98 4.486 4.486 4.708 -0.222 19439
1195 1 5 . 1 1 98 98 ARG CA C 98 55.622 55.622 54.490 1.132 19439
1196 1 5 . 1 1 98 98 ARG CB C 98 31.229 31.229 31.763 -0.534 19439
1197 1 5 . 1 1 98 98 ARG H H 98 8.825 8.825 8.256 0.569 19439
1198 1 5 . 1 1 99 99 LEU N N 99 127.814 127.814 123.259 4.555 19439
1199 1 5 . 1 1 99 99 LEU HA H 99 3.586 3.586 4.163 -0.577 19439
1200 1 5 . 1 1 99 99 LEU CA C 99 54.352 54.352 54.168 0.184 19439
1201 1 5 . 1 1 99 99 LEU CB C 99 40.485 40.485 41.536 -1.051 19439
1202 1 5 . 1 1 99 99 LEU H H 99 8.236 8.236 8.102 0.134 19439
1203 1 5 . 1 1 100 100 ASP N N 100 126.633 126.633 128.027 -1.394 19439
1204 1 5 . 1 1 100 100 ASP HA H 100 4.646 4.646 4.861 -0.215 19439
1205 1 5 . 1 1 100 100 ASP CA C 100 52.894 52.894 53.907 -1.014 19439
1206 1 5 . 1 1 100 100 ASP CB C 100 41.224 41.224 42.871 -1.647 19439
1207 1 5 . 1 1 100 100 ASP H H 100 8.018 8.018 8.603 -0.585 19439
1208 1 5 . 1 1 101 101 MET N N 101 122.473 122.473 120.163 2.310 19439
1209 1 5 . 1 1 101 101 MET HA H 101 4.481 4.481 4.610 -0.129 19439
1210 1 5 . 1 1 101 101 MET CA C 101 53.398 53.398 54.170 -0.772 19439
1211 1 5 . 1 1 101 101 MET CB C 101 33.296 33.296 32.675 0.621 19439
1212 1 5 . 1 1 101 101 MET H H 101 8.639 8.639 7.999 0.640 19439
1213 1 5 . 1 1 102 102 SER N N 102 116.243 116.243 116.487 -0.244 19439
1214 1 5 . 1 1 102 102 SER HA H 102 4.114 4.114 4.287 -0.173 19439
1215 1 5 . 1 1 102 102 SER CA C 102 58.709 58.709 57.530 1.179 19439
1216 1 5 . 1 1 102 102 SER CB C 102 64.701 64.701 64.212 0.489 19439
1217 1 5 . 1 1 102 102 SER H H 102 8.096 8.096 7.718 0.378 19439
1218 1 5 . 1 1 103 103 ASP N N 103 121.639 121.639 125.941 -4.302 19439
1219 1 5 . 1 1 103 103 ASP HA H 103 3.724 3.724 3.902 -0.178 19439
1220 1 5 . 1 1 103 103 ASP CA C 103 57.296 57.296 57.424 -0.128 19439
1221 1 5 . 1 1 103 103 ASP CB C 103 38.720 38.720 40.459 -1.739 19439
1222 1 5 . 1 1 103 103 ASP H H 103 8.669 8.669 8.623 0.046 19439
1223 1 5 . 1 1 104 104 LYS N N 104 116.276 116.276 118.987 -2.711 19439
1224 1 5 . 1 1 104 104 LYS HA H 104 3.678 3.678 4.067 -0.389 19439
1225 1 5 . 1 1 104 104 LYS CA C 104 59.833 59.833 58.798 1.035 19439
1226 1 5 . 1 1 104 104 LYS CB C 104 32.090 32.090 31.823 0.267 19439
1227 1 5 . 1 1 104 104 LYS H H 104 7.775 7.775 7.448 0.327 19439
1228 1 5 . 1 1 105 105 ALA N N 105 122.257 122.257 122.359 -0.102 19439
1229 1 5 . 1 1 105 105 ALA HA H 105 3.873 3.873 4.088 -0.215 19439
1230 1 5 . 1 1 105 105 ALA CA C 105 55.008 55.008 54.806 0.202 19439
1231 1 5 . 1 1 105 105 ALA CB C 105 17.741 17.741 18.062 -0.321 19439
1232 1 5 . 1 1 105 105 ALA H H 105 7.266 7.266 7.565 -0.299 19439
1233 1 5 . 1 1 106 106 ILE N N 106 119.452 119.452 119.785 -0.333 19439
1234 1 5 . 1 1 106 106 ILE HA H 106 3.419 3.419 3.853 -0.434 19439
1235 1 5 . 1 1 106 106 ILE CA C 106 65.971 65.971 64.417 1.554 19439
1236 1 5 . 1 1 106 106 ILE CB C 106 37.430 37.430 37.585 -0.155 19439
1237 1 5 . 1 1 106 106 ILE H H 106 7.974 7.974 7.780 0.194 19439
1238 1 5 . 1 1 107 107 PHE N N 107 117.814 117.814 119.154 -1.340 19439
1239 1 5 . 1 1 107 107 PHE HA H 107 4.368 4.368 4.684 -0.316 19439
1240 1 5 . 1 1 107 107 PHE CA C 107 56.844 56.844 58.482 -1.638 19439
1241 1 5 . 1 1 107 107 PHE CB C 107 37.150 37.150 37.570 -0.420 19439
1242 1 5 . 1 1 107 107 PHE H H 107 8.434 8.434 8.260 0.174 19439
1243 1 5 . 1 1 108 108 ARG N N 108 117.368 117.368 118.942 -1.574 19439
1244 1 5 . 1 1 108 108 ARG HA H 108 3.994 3.994 4.204 -0.210 19439
1245 1 5 . 1 1 108 108 ARG CA C 108 58.682 58.682 58.223 0.459 19439
1246 1 5 . 1 1 108 108 ARG CB C 108 30.287 30.287 29.837 0.450 19439
1247 1 5 . 1 1 108 108 ARG H H 108 7.474 7.474 8.226 -0.752 19439
1248 1 5 . 1 1 109 109 ARG N N 109 117.440 117.440 117.033 0.407 19439
1249 1 5 . 1 1 109 109 ARG HA H 109 3.900 3.900 3.982 -0.082 19439
1250 1 5 . 1 1 109 109 ARG CA C 109 57.312 57.312 58.154 -0.842 19439
1251 1 5 . 1 1 109 109 ARG CB C 109 31.626 31.626 30.875 0.751 19439
1252 1 5 . 1 1 109 109 ARG H H 109 7.118 7.118 7.733 -0.615 19439
1253 1 5 . 1 1 110 110 TYR N N 110 116.060 116.060 116.678 -0.618 19439
1254 1 5 . 1 1 110 110 TYR HA H 110 5.265 5.265 5.137 0.128 19439
1255 1 5 . 1 1 110 110 TYR CA C 110 54.188 54.188 54.766 -0.578 19439
1256 1 5 . 1 1 110 110 TYR CB C 110 38.484 38.484 38.650 -0.166 19439
1257 1 5 . 1 1 110 110 TYR H H 110 8.707 8.707 8.186 0.521 19439
1258 1 5 . 1 1 111 111 PRO HA H 111 4.388 4.388 4.701 -0.313 19439
1259 1 5 . 1 1 111 111 PRO CA C 111 64.847 64.847 64.275 0.572 19439
1260 1 5 . 1 1 111 111 PRO CB C 111 31.381 31.381 32.133 -0.752 19439
1261 1 5 . 1 1 112 112 HIS N N 112 115.542 115.542 112.349 3.193 19439
1262 1 5 . 1 1 112 112 HIS HA H 112 4.482 4.482 4.546 -0.064 19439
1263 1 5 . 1 1 112 112 HIS CA C 112 58.498 58.498 56.743 1.755 19439
1264 1 5 . 1 1 112 112 HIS CB C 112 29.654 29.654 28.743 0.911 19439
1265 1 5 . 1 1 112 112 HIS H H 112 8.196 8.196 8.331 -0.135 19439
1266 1 5 . 1 1 113 113 LEU N N 113 120.583 120.583 119.970 0.613 19439
1267 1 5 . 1 1 113 113 LEU HA H 113 4.165 4.165 4.286 -0.121 19439
1268 1 5 . 1 1 113 113 LEU CA C 113 54.013 54.013 55.302 -1.289 19439
1269 1 5 . 1 1 113 113 LEU CB C 113 41.669 41.669 41.976 -0.307 19439
1270 1 5 . 1 1 113 113 LEU H H 113 7.527 7.527 7.500 0.027 19439
1271 1 6 . 1 1 59 59 ALA N N 59 123.310 123.310 123.114 0.196 19439
1272 1 6 . 1 1 59 59 ALA HA H 59 4.232 4.232 4.325 -0.093 19439
1273 1 6 . 1 1 59 59 ALA CA C 59 52.274 52.274 52.204 0.070 19439
1274 1 6 . 1 1 59 59 ALA CB C 59 19.623 19.623 17.287 2.336 19439
1275 1 6 . 1 1 59 59 ALA H H 59 7.894 7.894 8.285 -0.391 19439
1276 1 6 . 1 1 60 60 LEU N N 60 120.936 120.936 120.206 0.730 19439
1277 1 6 . 1 1 60 60 LEU HA H 60 4.364 4.364 4.259 0.105 19439
1278 1 6 . 1 1 60 60 LEU CA C 60 54.130 54.130 55.691 -1.561 19439
1279 1 6 . 1 1 60 60 LEU CB C 60 43.209 43.209 42.388 0.821 19439
1280 1 6 . 1 1 60 60 LEU H H 60 8.046 8.046 7.712 0.334 19439
1281 1 6 . 1 1 61 61 ALA N N 61 125.460 125.460 120.886 4.574 19439
1282 1 6 . 1 1 61 61 ALA HA H 61 4.364 4.364 4.333 0.031 19439
1283 1 6 . 1 1 61 61 ALA CA C 61 51.176 51.176 51.703 -0.527 19439
1284 1 6 . 1 1 61 61 ALA CB C 61 20.172 20.172 19.683 0.489 19439
1285 1 6 . 1 1 61 61 ALA H H 61 8.338 8.338 7.726 0.612 19439
1286 1 6 . 1 1 62 62 ALA N N 62 127.765 127.765 126.299 1.466 19439
1287 1 6 . 1 1 62 62 ALA HA H 62 4.394 4.394 4.683 -0.289 19439
1288 1 6 . 1 1 62 62 ALA CA C 62 51.888 51.888 50.789 1.099 19439
1289 1 6 . 1 1 62 62 ALA CB C 62 18.806 18.806 21.074 -2.268 19439
1290 1 6 . 1 1 62 62 ALA H H 62 8.487 8.487 8.982 -0.495 19439
1291 1 6 . 1 1 63 63 LEU N N 63 120.199 120.199 120.692 -0.493 19439
1292 1 6 . 1 1 63 63 LEU HA H 63 4.828 4.828 4.955 -0.127 19439
1293 1 6 . 1 1 63 63 LEU CA C 63 51.852 51.852 52.895 -1.043 19439
1294 1 6 . 1 1 63 63 LEU CB C 63 44.081 44.081 45.534 -1.453 19439
1295 1 6 . 1 1 63 63 LEU H H 63 7.927 7.927 8.279 -0.352 19439
1296 1 6 . 1 1 64 64 HIS N N 64 122.277 122.277 119.419 2.858 19439
1297 1 6 . 1 1 64 64 HIS HA H 64 4.114 4.114 4.545 -0.431 19439
1298 1 6 . 1 1 64 64 HIS CA C 64 58.038 58.038 57.117 0.921 19439
1299 1 6 . 1 1 64 64 HIS CB C 64 31.228 31.228 31.203 0.025 19439
1300 1 6 . 1 1 64 64 HIS H H 64 8.477 8.477 8.762 -0.285 19439
1301 1 6 . 1 1 65 65 ALA HA H 65 4.339 4.339 4.376 -0.037 19439
1302 1 6 . 1 1 65 65 ALA CA C 65 53.281 53.281 52.823 0.458 19439
1303 1 6 . 1 1 65 65 ALA CB C 65 20.276 20.276 19.736 0.540 19439
1304 1 6 . 1 1 66 66 GLU N N 66 113.868 113.868 116.642 -2.774 19439
1305 1 6 . 1 1 66 66 GLU HA H 66 4.619 4.619 4.459 0.160 19439
1306 1 6 . 1 1 66 66 GLU CA C 66 54.727 54.727 55.052 -0.325 19439
1307 1 6 . 1 1 66 66 GLU CB C 66 32.894 32.894 31.861 1.033 19439
1308 1 6 . 1 1 66 66 GLU H H 66 7.759 7.759 8.009 -0.250 19439
1309 1 6 . 1 1 68 68 PRO HA H 68 4.219 4.219 4.246 -0.027 19439
1310 1 6 . 1 1 68 68 PRO CA C 68 64.664 64.664 65.044 -0.380 19439
1311 1 6 . 1 1 68 68 PRO CB C 68 32.066 32.066 31.741 0.325 19439
1312 1 6 . 1 1 69 69 LEU N N 69 117.262 117.262 117.474 -0.212 19439
1313 1 6 . 1 1 69 69 LEU HA H 69 4.182 4.182 4.394 -0.212 19439
1314 1 6 . 1 1 69 69 LEU CA C 69 52.430 52.430 53.360 -0.930 19439
1315 1 6 . 1 1 69 69 LEU CB C 69 40.907 40.907 41.186 -0.279 19439
1316 1 6 . 1 1 69 69 LEU H H 69 8.439 8.439 7.839 0.600 19439
1317 1 6 . 1 1 70 70 ALA N N 70 120.426 120.426 121.589 -1.163 19439
1318 1 6 . 1 1 70 70 ALA HA H 70 3.411 3.411 4.117 -0.706 19439
1319 1 6 . 1 1 70 70 ALA CA C 70 53.685 53.685 53.476 0.209 19439
1320 1 6 . 1 1 70 70 ALA CB C 70 17.914 17.914 18.749 -0.835 19439
1321 1 6 . 1 1 70 70 ALA H H 70 7.113 7.113 7.578 -0.465 19439
1322 1 6 . 1 1 71 71 GLY N N 71 108.911 108.911 111.952 -3.041 19439
1323 1 6 . 1 1 71 71 GLY CA C 71 45.215 45.215 45.078 0.137 19439
1324 1 6 . 1 1 71 71 GLY H H 71 8.856 8.856 8.873 -0.017 19439
1325 1 6 . 1 1 72 72 LEU N N 72 120.000 120.000 121.649 -1.649 19439
1326 1 6 . 1 1 72 72 LEU HA H 72 4.769 4.769 4.947 -0.178 19439
1327 1 6 . 1 1 72 72 LEU CA C 72 51.972 51.972 51.554 0.417 19439
1328 1 6 . 1 1 72 72 LEU CB C 72 41.255 41.255 42.783 -1.528 19439
1329 1 6 . 1 1 72 72 LEU H H 72 8.136 8.136 8.024 0.112 19439
1330 1 6 . 1 1 73 73 PRO HA H 73 4.739 4.739 4.685 0.054 19439
1331 1 6 . 1 1 73 73 PRO CA C 73 61.456 61.456 62.803 -1.347 19439
1332 1 6 . 1 1 73 73 PRO CB C 73 31.245 31.245 31.947 -0.702 19439
1333 1 6 . 1 1 74 74 VAL N N 74 121.723 121.723 120.191 1.532 19439
1334 1 6 . 1 1 74 74 VAL HA H 74 3.446 3.446 3.858 -0.412 19439
1335 1 6 . 1 1 74 74 VAL CA C 74 65.744 65.744 63.841 1.903 19439
1336 1 6 . 1 1 74 74 VAL CB C 74 31.236 31.236 31.934 -0.698 19439
1337 1 6 . 1 1 74 74 VAL H H 74 7.710 7.710 8.177 -0.467 19439
1338 1 6 . 1 1 75 75 THR N N 75 108.893 108.893 109.416 -0.523 19439
1339 1 6 . 1 1 75 75 THR HA H 75 4.937 4.937 4.595 0.342 19439
1340 1 6 . 1 1 75 75 THR CA C 75 59.892 59.892 59.621 0.271 19439
1341 1 6 . 1 1 75 75 THR CB C 75 12.018 12.018 71.989 -59.971 19439
1342 1 6 . 1 1 75 75 THR H H 75 8.710 8.710 7.900 0.810 19439
1343 1 6 . 1 1 76 76 ARG HA H 76 3.873 3.873 4.038 -0.165 19439
1344 1 6 . 1 1 76 76 ARG H H 76 8.447 8.447 8.795 -0.348 19439
1345 1 6 . 1 1 77 77 SER N N 77 114.482 114.482 115.310 -0.828 19439
1346 1 6 . 1 1 77 77 SER HA H 77 4.061 4.061 4.142 -0.081 19439
1347 1 6 . 1 1 77 77 SER CA C 77 60.467 60.467 61.869 -1.402 19439
1348 1 6 . 1 1 77 77 SER CB C 77 62.449 62.449 62.626 -0.177 19439
1349 1 6 . 1 1 77 77 SER H H 77 8.105 8.105 8.104 0.001 19439
1350 1 6 . 1 1 78 78 ASP N N 78 120.538 120.538 122.464 -1.926 19439
1351 1 6 . 1 1 78 78 ASP HA H 78 4.333 4.333 4.351 -0.018 19439
1352 1 6 . 1 1 78 78 ASP CA C 78 58.020 58.020 57.236 0.784 19439
1353 1 6 . 1 1 78 78 ASP CB C 78 43.252 43.252 40.335 2.917 19439
1354 1 6 . 1 1 78 78 ASP H H 78 7.300 7.300 8.084 -0.784 19439
1355 1 6 . 1 1 79 79 ALA N N 79 120.614 120.614 122.762 -2.148 19439
1356 1 6 . 1 1 79 79 ALA HA H 79 3.672 3.672 3.852 -0.180 19439
1357 1 6 . 1 1 79 79 ALA CA C 79 54.886 54.886 55.130 -0.244 19439
1358 1 6 . 1 1 79 79 ALA CB C 79 19.628 19.628 18.324 1.304 19439
1359 1 6 . 1 1 79 79 ALA H H 79 7.767 7.767 8.211 -0.444 19439
1360 1 6 . 1 1 80 80 ARG N N 80 116.203 116.203 118.664 -2.461 19439
1361 1 6 . 1 1 80 80 ARG HA H 80 3.732 3.732 4.046 -0.314 19439
1362 1 6 . 1 1 80 80 ARG CA C 80 61.441 61.441 59.196 2.245 19439
1363 1 6 . 1 1 80 80 ARG CB C 80 30.266 30.266 30.037 0.230 19439
1364 1 6 . 1 1 80 80 ARG H H 80 7.981 7.981 8.234 -0.253 19439
1365 1 6 . 1 1 81 81 VAL N N 81 119.192 119.192 120.212 -1.020 19439
1366 1 6 . 1 1 81 81 VAL HA H 81 3.582 3.582 4.022 -0.440 19439
1367 1 6 . 1 1 81 81 VAL CA C 81 66.909 66.909 66.700 0.209 19439
1368 1 6 . 1 1 81 81 VAL CB C 81 31.668 31.668 31.590 0.078 19439
1369 1 6 . 1 1 81 81 VAL H H 81 7.338 7.338 8.201 -0.863 19439
1370 1 6 . 1 1 82 82 LEU N N 82 118.722 118.722 121.440 -2.718 19439
1371 1 6 . 1 1 82 82 LEU HA H 82 4.044 4.044 3.944 0.100 19439
1372 1 6 . 1 1 82 82 LEU CA C 82 58.356 58.356 58.722 -0.366 19439
1373 1 6 . 1 1 82 82 LEU CB C 82 41.627 41.627 41.635 -0.007 19439
1374 1 6 . 1 1 82 82 LEU H H 82 7.599 7.599 8.433 -0.834 19439
1375 1 6 . 1 1 83 83 ILE N N 83 120.893 120.893 119.440 1.453 19439
1376 1 6 . 1 1 83 83 ILE HA H 83 3.642 3.642 3.722 -0.080 19439
1377 1 6 . 1 1 83 83 ILE CA C 83 65.669 65.669 65.600 0.069 19439
1378 1 6 . 1 1 83 83 ILE CB C 83 38.579 38.579 37.917 0.662 19439
1379 1 6 . 1 1 83 83 ILE H H 83 8.546 8.546 8.334 0.212 19439
1380 1 6 . 1 1 84 84 PHE N N 84 123.343 123.343 120.838 2.505 19439
1381 1 6 . 1 1 84 84 PHE HA H 84 4.084 4.084 4.159 -0.075 19439
1382 1 6 . 1 1 84 84 PHE CA C 84 62.593 62.593 60.171 2.422 19439
1383 1 6 . 1 1 84 84 PHE CB C 84 39.211 39.211 38.645 0.566 19439
1384 1 6 . 1 1 84 84 PHE H H 84 8.622 8.622 8.597 0.025 19439
1385 1 6 . 1 1 85 85 ASN N N 85 118.037 118.037 118.345 -0.308 19439
1386 1 6 . 1 1 85 85 ASN HA H 85 4.426 4.426 4.158 0.268 19439
1387 1 6 . 1 1 85 85 ASN CA C 85 56.045 56.045 55.962 0.083 19439
1388 1 6 . 1 1 85 85 ASN CB C 85 37.785 37.785 38.160 -0.375 19439
1389 1 6 . 1 1 85 85 ASN H H 85 8.834 8.834 8.655 0.179 19439
1390 1 6 . 1 1 86 86 GLU N N 86 121.098 121.098 122.403 -1.305 19439
1391 1 6 . 1 1 86 86 GLU HA H 86 4.052 4.052 4.011 0.041 19439
1392 1 6 . 1 1 86 86 GLU CA C 86 59.328 59.328 59.583 -0.255 19439
1393 1 6 . 1 1 86 86 GLU CB C 86 30.253 30.253 29.720 0.533 19439
1394 1 6 . 1 1 86 86 GLU H H 86 8.105 8.105 8.417 -0.312 19439
1395 1 6 . 1 1 87 87 TRP N N 87 122.584 122.584 122.080 0.504 19439
1396 1 6 . 1 1 87 87 TRP HA H 87 4.006 4.006 4.228 -0.222 19439
1397 1 6 . 1 1 87 87 TRP CA C 87 61.545 61.545 61.699 -0.154 19439
1398 1 6 . 1 1 87 87 TRP CB C 87 27.943 27.943 29.489 -1.546 19439
1399 1 6 . 1 1 87 87 TRP H H 87 8.099 8.099 8.779 -0.680 19439
1400 1 6 . 1 1 88 88 GLU N N 88 117.357 117.357 119.064 -1.707 19439
1401 1 6 . 1 1 88 88 GLU HA H 88 2.919 2.919 3.217 -0.298 19439
1402 1 6 . 1 1 88 88 GLU CA C 88 59.804 59.804 59.277 0.527 19439
1403 1 6 . 1 1 88 88 GLU CB C 88 29.546 29.546 29.311 0.234 19439
1404 1 6 . 1 1 88 88 GLU H H 88 8.440 8.440 8.540 -0.100 19439
1405 1 6 . 1 1 89 89 GLU N N 89 116.109 116.109 119.607 -3.498 19439
1406 1 6 . 1 1 89 89 GLU HA H 89 3.995 3.995 3.900 0.095 19439
1407 1 6 . 1 1 89 89 GLU CA C 89 58.329 58.329 59.402 -1.073 19439
1408 1 6 . 1 1 89 89 GLU CB C 89 29.649 29.649 29.461 0.188 19439
1409 1 6 . 1 1 89 89 GLU H H 89 7.244 7.244 8.108 -0.864 19439
1410 1 6 . 1 1 90 90 ARG N N 90 120.512 120.512 118.520 1.992 19439
1411 1 6 . 1 1 90 90 ARG HA H 90 3.920 3.920 3.940 -0.020 19439
1412 1 6 . 1 1 90 90 ARG CA C 90 58.683 58.683 58.636 0.047 19439
1413 1 6 . 1 1 90 90 ARG CB C 90 30.659 30.659 29.617 1.042 19439
1414 1 6 . 1 1 90 90 ARG H H 90 8.368 8.368 8.180 0.188 19439
1415 1 6 . 1 1 91 91 LYS N N 91 120.024 120.024 119.803 0.221 19439
1416 1 6 . 1 1 91 91 LYS HA H 91 3.964 3.964 3.967 -0.003 19439
1417 1 6 . 1 1 91 91 LYS CA C 91 57.278 57.278 58.943 -1.665 19439
1418 1 6 . 1 1 91 91 LYS CB C 91 30.582 30.582 31.343 -0.761 19439
1419 1 6 . 1 1 91 91 LYS H H 91 8.491 8.491 8.044 0.447 19439
1420 1 6 . 1 1 92 92 LYS N N 92 118.192 118.192 118.941 -0.749 19439
1421 1 6 . 1 1 92 92 LYS HA H 92 3.796 3.796 4.133 -0.337 19439
1422 1 6 . 1 1 92 92 LYS CA C 92 58.976 58.976 58.622 0.354 19439
1423 1 6 . 1 1 92 92 LYS CB C 92 32.188 32.188 31.904 0.284 19439
1424 1 6 . 1 1 92 92 LYS H H 92 6.933 6.933 7.737 -0.804 19439
1425 1 6 . 1 1 93 93 SER N N 93 110.447 110.447 113.288 -2.841 19439
1426 1 6 . 1 1 93 93 SER HA H 93 4.484 4.484 4.338 0.146 19439
1427 1 6 . 1 1 93 93 SER CA C 93 58.386 58.386 60.163 -1.777 19439
1428 1 6 . 1 1 93 93 SER CB C 93 64.173 64.173 64.433 -0.260 19439
1429 1 6 . 1 1 93 93 SER H H 93 7.282 7.282 7.693 -0.411 19439
1430 1 6 . 1 1 94 94 ASP N N 94 120.163 120.163 119.528 0.635 19439
1431 1 6 . 1 1 94 94 ASP HA H 94 4.872 4.872 5.056 -0.184 19439
1432 1 6 . 1 1 94 94 ASP CA C 94 51.157 51.157 52.908 -1.751 19439
1433 1 6 . 1 1 94 94 ASP CB C 94 41.256 41.256 43.200 -1.944 19439
1434 1 6 . 1 1 94 94 ASP H H 94 7.303 7.303 8.275 -0.972 19439
1435 1 6 . 1 1 95 95 PRO CA C 95 63.871 63.871 63.608 0.263 19439
1436 1 6 . 1 1 95 95 PRO CB C 95 31.497 31.497 32.367 -0.870 19439
1437 1 6 . 1 1 96 96 TRP N N 96 117.486 117.486 117.498 -0.012 19439
1438 1 6 . 1 1 96 96 TRP HA H 96 4.637 4.637 4.599 0.038 19439
1439 1 6 . 1 1 96 96 TRP CA C 96 56.061 56.061 55.076 0.985 19439
1440 1 6 . 1 1 96 96 TRP CB C 96 28.605 28.605 28.571 0.034 19439
1441 1 6 . 1 1 96 96 TRP H H 96 7.484 7.484 7.957 -0.473 19439
1442 1 6 . 1 1 97 97 LEU N N 97 123.510 123.510 121.917 1.593 19439
1443 1 6 . 1 1 97 97 LEU HA H 97 4.098 4.098 3.209 0.889 19439
1444 1 6 . 1 1 97 97 LEU CA C 97 56.024 56.024 54.284 1.740 19439
1445 1 6 . 1 1 97 97 LEU CB C 97 42.893 42.893 42.362 0.531 19439
1446 1 6 . 1 1 97 97 LEU H H 97 7.137 7.137 6.938 0.199 19439
1447 1 6 . 1 1 98 98 ARG N N 98 129.724 129.724 124.826 4.898 19439
1448 1 6 . 1 1 98 98 ARG HA H 98 4.486 4.486 4.455 0.031 19439
1449 1 6 . 1 1 98 98 ARG CA C 98 55.622 55.622 55.225 0.397 19439
1450 1 6 . 1 1 98 98 ARG CB C 98 31.229 31.229 30.988 0.240 19439
1451 1 6 . 1 1 98 98 ARG H H 98 8.825 8.825 8.276 0.549 19439
1452 1 6 . 1 1 99 99 LEU N N 99 127.814 127.814 123.797 4.017 19439
1453 1 6 . 1 1 99 99 LEU HA H 99 3.586 3.586 4.221 -0.635 19439
1454 1 6 . 1 1 99 99 LEU CA C 99 54.352 54.352 54.135 0.217 19439
1455 1 6 . 1 1 99 99 LEU CB C 99 40.485 40.485 41.324 -0.839 19439
1456 1 6 . 1 1 99 99 LEU H H 99 8.236 8.236 8.076 0.160 19439
1457 1 6 . 1 1 100 100 ASP N N 100 126.633 126.633 127.731 -1.098 19439
1458 1 6 . 1 1 100 100 ASP HA H 100 4.646 4.646 4.841 -0.195 19439
1459 1 6 . 1 1 100 100 ASP CA C 100 52.894 52.894 53.732 -0.838 19439
1460 1 6 . 1 1 100 100 ASP CB C 100 41.224 41.224 42.954 -1.730 19439
1461 1 6 . 1 1 100 100 ASP H H 100 8.018 8.018 8.472 -0.454 19439
1462 1 6 . 1 1 101 101 MET N N 101 122.473 122.473 118.655 3.818 19439
1463 1 6 . 1 1 101 101 MET HA H 101 4.481 4.481 4.676 -0.195 19439
1464 1 6 . 1 1 101 101 MET CA C 101 53.398 53.398 54.512 -1.114 19439
1465 1 6 . 1 1 101 101 MET CB C 101 33.296 33.296 33.300 -0.004 19439
1466 1 6 . 1 1 101 101 MET H H 101 8.639 8.639 7.941 0.698 19439
1467 1 6 . 1 1 102 102 SER N N 102 116.243 116.243 117.364 -1.121 19439
1468 1 6 . 1 1 102 102 SER HA H 102 4.114 4.114 4.392 -0.278 19439
1469 1 6 . 1 1 102 102 SER CA C 102 58.709 58.709 57.879 0.830 19439
1470 1 6 . 1 1 102 102 SER CB C 102 64.701 64.701 65.322 -0.621 19439
1471 1 6 . 1 1 102 102 SER H H 102 8.096 8.096 8.265 -0.169 19439
1472 1 6 . 1 1 103 103 ASP N N 103 121.639 121.639 122.939 -1.300 19439
1473 1 6 . 1 1 103 103 ASP HA H 103 3.724 3.724 3.935 -0.211 19439
1474 1 6 . 1 1 103 103 ASP CA C 103 57.296 57.296 57.571 -0.275 19439
1475 1 6 . 1 1 103 103 ASP CB C 103 38.720 38.720 40.254 -1.534 19439
1476 1 6 . 1 1 103 103 ASP H H 103 8.669 8.669 8.784 -0.115 19439
1477 1 6 . 1 1 104 104 LYS N N 104 116.276 116.276 119.032 -2.756 19439
1478 1 6 . 1 1 104 104 LYS HA H 104 3.678 3.678 3.995 -0.317 19439
1479 1 6 . 1 1 104 104 LYS CA C 104 59.833 59.833 58.797 1.036 19439
1480 1 6 . 1 1 104 104 LYS CB C 104 32.090 32.090 32.197 -0.107 19439
1481 1 6 . 1 1 104 104 LYS H H 104 7.775 7.775 8.109 -0.334 19439
1482 1 6 . 1 1 105 105 ALA N N 105 122.257 122.257 122.613 -0.356 19439
1483 1 6 . 1 1 105 105 ALA HA H 105 3.873 3.873 4.037 -0.164 19439
1484 1 6 . 1 1 105 105 ALA CA C 105 55.008 55.008 54.869 0.139 19439
1485 1 6 . 1 1 105 105 ALA CB C 105 17.741 17.741 18.143 -0.402 19439
1486 1 6 . 1 1 105 105 ALA H H 105 7.266 7.266 7.424 -0.158 19439
1487 1 6 . 1 1 106 106 ILE N N 106 119.452 119.452 119.583 -0.131 19439
1488 1 6 . 1 1 106 106 ILE HA H 106 3.419 3.419 3.803 -0.384 19439
1489 1 6 . 1 1 106 106 ILE CA C 106 65.971 65.971 64.741 1.230 19439
1490 1 6 . 1 1 106 106 ILE CB C 106 37.430 37.430 37.660 -0.230 19439
1491 1 6 . 1 1 106 106 ILE H H 106 7.974 7.974 7.873 0.101 19439
1492 1 6 . 1 1 107 107 PHE N N 107 117.814 117.814 118.931 -1.117 19439
1493 1 6 . 1 1 107 107 PHE HA H 107 4.368 4.368 4.739 -0.371 19439
1494 1 6 . 1 1 107 107 PHE CA C 107 56.844 56.844 58.267 -1.423 19439
1495 1 6 . 1 1 107 107 PHE CB C 107 37.150 37.150 37.532 -0.383 19439
1496 1 6 . 1 1 107 107 PHE H H 107 8.434 8.434 7.972 0.462 19439
1497 1 6 . 1 1 108 108 ARG N N 108 117.368 117.368 119.270 -1.902 19439
1498 1 6 . 1 1 108 108 ARG HA H 108 3.994 3.994 4.120 -0.126 19439
1499 1 6 . 1 1 108 108 ARG CA C 108 58.682 58.682 58.951 -0.269 19439
1500 1 6 . 1 1 108 108 ARG CB C 108 30.287 30.287 30.104 0.183 19439
1501 1 6 . 1 1 108 108 ARG H H 108 7.474 7.474 8.327 -0.853 19439
1502 1 6 . 1 1 109 109 ARG N N 109 117.440 117.440 117.374 0.066 19439
1503 1 6 . 1 1 109 109 ARG HA H 109 3.900 3.900 3.948 -0.048 19439
1504 1 6 . 1 1 109 109 ARG CA C 109 57.312 57.312 58.254 -0.942 19439
1505 1 6 . 1 1 109 109 ARG CB C 109 31.626 31.626 30.744 0.882 19439
1506 1 6 . 1 1 109 109 ARG H H 109 7.118 7.118 7.621 -0.503 19439
1507 1 6 . 1 1 110 110 TYR N N 110 116.060 116.060 116.918 -0.858 19439
1508 1 6 . 1 1 110 110 TYR HA H 110 5.265 5.265 5.117 0.148 19439
1509 1 6 . 1 1 110 110 TYR CA C 110 54.188 54.188 54.307 -0.119 19439
1510 1 6 . 1 1 110 110 TYR CB C 110 38.484 38.484 37.958 0.526 19439
1511 1 6 . 1 1 110 110 TYR H H 110 8.707 8.707 8.146 0.561 19439
1512 1 6 . 1 1 111 111 PRO HA H 111 4.388 4.388 4.657 -0.269 19439
1513 1 6 . 1 1 111 111 PRO CA C 111 64.847 64.847 64.394 0.453 19439
1514 1 6 . 1 1 111 111 PRO CB C 111 31.381 31.381 32.079 -0.698 19439
1515 1 6 . 1 1 112 112 HIS N N 112 115.542 115.542 115.242 0.300 19439
1516 1 6 . 1 1 112 112 HIS HA H 112 4.482 4.482 4.509 -0.027 19439
1517 1 6 . 1 1 112 112 HIS CA C 112 58.498 58.498 57.419 1.079 19439
1518 1 6 . 1 1 112 112 HIS CB C 112 29.654 29.654 28.394 1.260 19439
1519 1 6 . 1 1 112 112 HIS H H 112 8.196 8.196 8.438 -0.242 19439
1520 1 6 . 1 1 113 113 LEU N N 113 120.583 120.583 119.277 1.306 19439
1521 1 6 . 1 1 113 113 LEU HA H 113 4.165 4.165 4.400 -0.235 19439
1522 1 6 . 1 1 113 113 LEU CA C 113 54.013 54.013 54.934 -0.921 19439
1523 1 6 . 1 1 113 113 LEU CB C 113 41.669 41.669 41.351 0.318 19439
1524 1 6 . 1 1 113 113 LEU H H 113 7.527 7.527 7.771 -0.244 19439
1525 1 7 . 1 1 59 59 ALA N N 59 123.310 123.310 122.601 0.709 19439
1526 1 7 . 1 1 59 59 ALA HA H 59 4.232 4.232 4.708 -0.476 19439
1527 1 7 . 1 1 59 59 ALA CA C 59 52.274 52.274 51.637 0.637 19439
1528 1 7 . 1 1 59 59 ALA CB C 59 19.623 19.623 21.517 -1.894 19439
1529 1 7 . 1 1 59 59 ALA H H 59 7.894 7.894 8.055 -0.161 19439
1530 1 7 . 1 1 60 60 LEU N N 60 120.936 120.936 118.128 2.808 19439
1531 1 7 . 1 1 60 60 LEU HA H 60 4.364 4.364 4.891 -0.527 19439
1532 1 7 . 1 1 60 60 LEU CA C 60 54.130 54.130 54.995 -0.865 19439
1533 1 7 . 1 1 60 60 LEU CB C 60 43.209 43.209 44.225 -1.016 19439
1534 1 7 . 1 1 60 60 LEU H H 60 8.046 8.046 8.410 -0.364 19439
1535 1 7 . 1 1 61 61 ALA N N 61 125.460 125.460 123.196 2.264 19439
1536 1 7 . 1 1 61 61 ALA HA H 61 4.364 4.364 4.769 -0.405 19439
1537 1 7 . 1 1 61 61 ALA CA C 61 51.176 51.176 51.470 -0.294 19439
1538 1 7 . 1 1 61 61 ALA CB C 61 20.172 20.172 21.733 -1.561 19439
1539 1 7 . 1 1 61 61 ALA H H 61 8.338 8.338 8.187 0.151 19439
1540 1 7 . 1 1 62 62 ALA N N 62 127.765 127.765 123.191 4.574 19439
1541 1 7 . 1 1 62 62 ALA HA H 62 4.394 4.394 4.827 -0.433 19439
1542 1 7 . 1 1 62 62 ALA CA C 62 51.888 51.888 50.418 1.470 19439
1543 1 7 . 1 1 62 62 ALA CB C 62 18.806 18.806 21.052 -2.245 19439
1544 1 7 . 1 1 62 62 ALA H H 62 8.487 8.487 8.975 -0.488 19439
1545 1 7 . 1 1 63 63 LEU N N 63 120.199 120.199 120.612 -0.413 19439
1546 1 7 . 1 1 63 63 LEU HA H 63 4.828 4.828 4.958 -0.130 19439
1547 1 7 . 1 1 63 63 LEU CA C 63 51.852 51.852 53.075 -1.223 19439
1548 1 7 . 1 1 63 63 LEU CB C 63 44.081 44.081 45.591 -1.510 19439
1549 1 7 . 1 1 63 63 LEU H H 63 7.927 7.927 8.315 -0.388 19439
1550 1 7 . 1 1 64 64 HIS N N 64 122.277 122.277 119.194 3.083 19439
1551 1 7 . 1 1 64 64 HIS HA H 64 4.114 4.114 4.583 -0.469 19439
1552 1 7 . 1 1 64 64 HIS CA C 64 58.038 58.038 56.940 1.098 19439
1553 1 7 . 1 1 64 64 HIS CB C 64 31.228 31.228 31.512 -0.284 19439
1554 1 7 . 1 1 64 64 HIS H H 64 8.477 8.477 8.851 -0.374 19439
1555 1 7 . 1 1 65 65 ALA HA H 65 4.339 4.339 4.472 -0.133 19439
1556 1 7 . 1 1 65 65 ALA CA C 65 53.281 53.281 52.386 0.895 19439
1557 1 7 . 1 1 65 65 ALA CB C 65 20.276 20.276 20.003 0.273 19439
1558 1 7 . 1 1 66 66 GLU N N 66 113.868 113.868 117.588 -3.720 19439
1559 1 7 . 1 1 66 66 GLU HA H 66 4.619 4.619 4.514 0.105 19439
1560 1 7 . 1 1 66 66 GLU CA C 66 54.727 54.727 55.028 -0.301 19439
1561 1 7 . 1 1 66 66 GLU CB C 66 32.894 32.894 32.792 0.102 19439
1562 1 7 . 1 1 66 66 GLU H H 66 7.759 7.759 7.996 -0.237 19439
1563 1 7 . 1 1 68 68 PRO HA H 68 4.219 4.219 4.282 -0.063 19439
1564 1 7 . 1 1 68 68 PRO CA C 68 64.664 64.664 65.028 -0.364 19439
1565 1 7 . 1 1 68 68 PRO CB C 68 32.066 32.066 31.684 0.382 19439
1566 1 7 . 1 1 69 69 LEU N N 69 117.262 117.262 118.257 -0.995 19439
1567 1 7 . 1 1 69 69 LEU HA H 69 4.182 4.182 4.188 -0.006 19439
1568 1 7 . 1 1 69 69 LEU CA C 69 52.430 52.430 53.557 -1.127 19439
1569 1 7 . 1 1 69 69 LEU CB C 69 40.907 40.907 41.228 -0.321 19439
1570 1 7 . 1 1 69 69 LEU H H 69 8.439 8.439 7.931 0.508 19439
1571 1 7 . 1 1 70 70 ALA N N 70 120.426 120.426 121.013 -0.587 19439
1572 1 7 . 1 1 70 70 ALA HA H 70 3.411 3.411 4.204 -0.793 19439
1573 1 7 . 1 1 70 70 ALA CA C 70 53.685 53.685 53.486 0.199 19439
1574 1 7 . 1 1 70 70 ALA CB C 70 17.914 17.914 18.627 -0.713 19439
1575 1 7 . 1 1 70 70 ALA H H 70 7.113 7.113 7.424 -0.311 19439
1576 1 7 . 1 1 71 71 GLY N N 71 108.911 108.911 113.873 -4.962 19439
1577 1 7 . 1 1 71 71 GLY CA C 71 45.215 45.215 45.121 0.094 19439
1578 1 7 . 1 1 71 71 GLY H H 71 8.856 8.856 8.884 -0.028 19439
1579 1 7 . 1 1 72 72 LEU N N 72 120.000 120.000 120.745 -0.745 19439
1580 1 7 . 1 1 72 72 LEU HA H 72 4.769 4.769 4.982 -0.213 19439
1581 1 7 . 1 1 72 72 LEU CA C 72 51.972 51.972 51.572 0.400 19439
1582 1 7 . 1 1 72 72 LEU CB C 72 41.255 41.255 42.962 -1.706 19439
1583 1 7 . 1 1 72 72 LEU H H 72 8.136 8.136 7.942 0.194 19439
1584 1 7 . 1 1 73 73 PRO HA H 73 4.739 4.739 4.652 0.087 19439
1585 1 7 . 1 1 73 73 PRO CA C 73 61.456 61.456 62.793 -1.337 19439
1586 1 7 . 1 1 73 73 PRO CB C 73 31.245 31.245 31.962 -0.716 19439
1587 1 7 . 1 1 74 74 VAL N N 74 121.723 121.723 120.166 1.557 19439
1588 1 7 . 1 1 74 74 VAL HA H 74 3.446 3.446 3.732 -0.286 19439
1589 1 7 . 1 1 74 74 VAL CA C 74 65.744 65.744 63.971 1.773 19439
1590 1 7 . 1 1 74 74 VAL CB C 74 31.236 31.236 31.921 -0.685 19439
1591 1 7 . 1 1 74 74 VAL H H 74 7.710 7.710 8.122 -0.412 19439
1592 1 7 . 1 1 75 75 THR N N 75 108.893 108.893 109.407 -0.514 19439
1593 1 7 . 1 1 75 75 THR HA H 75 4.937 4.937 4.644 0.293 19439
1594 1 7 . 1 1 75 75 THR CA C 75 59.892 59.892 59.643 0.249 19439
1595 1 7 . 1 1 75 75 THR CB C 75 12.018 12.018 71.836 -59.818 19439
1596 1 7 . 1 1 75 75 THR H H 75 8.710 8.710 7.993 0.717 19439
1597 1 7 . 1 1 76 76 ARG HA H 76 3.873 3.873 4.042 -0.169 19439
1598 1 7 . 1 1 76 76 ARG H H 76 8.447 8.447 8.817 -0.370 19439
1599 1 7 . 1 1 77 77 SER N N 77 114.482 114.482 116.860 -2.378 19439
1600 1 7 . 1 1 77 77 SER HA H 77 4.061 4.061 4.199 -0.138 19439
1601 1 7 . 1 1 77 77 SER CA C 77 60.467 60.467 61.354 -0.887 19439
1602 1 7 . 1 1 77 77 SER CB C 77 62.449 62.449 62.734 -0.285 19439
1603 1 7 . 1 1 77 77 SER H H 77 8.105 8.105 7.830 0.275 19439
1604 1 7 . 1 1 78 78 ASP N N 78 120.538 120.538 122.891 -2.353 19439
1605 1 7 . 1 1 78 78 ASP HA H 78 4.333 4.333 4.350 -0.017 19439
1606 1 7 . 1 1 78 78 ASP CA C 78 58.020 58.020 57.285 0.735 19439
1607 1 7 . 1 1 78 78 ASP CB C 78 43.252 43.252 40.331 2.921 19439
1608 1 7 . 1 1 78 78 ASP H H 78 7.300 7.300 8.078 -0.778 19439
1609 1 7 . 1 1 79 79 ALA N N 79 120.614 120.614 122.817 -2.203 19439
1610 1 7 . 1 1 79 79 ALA HA H 79 3.672 3.672 3.839 -0.167 19439
1611 1 7 . 1 1 79 79 ALA CA C 79 54.886 54.886 55.209 -0.323 19439
1612 1 7 . 1 1 79 79 ALA CB C 79 19.628 19.628 18.306 1.322 19439
1613 1 7 . 1 1 79 79 ALA H H 79 7.767 7.767 8.291 -0.524 19439
1614 1 7 . 1 1 80 80 ARG N N 80 116.203 116.203 119.181 -2.978 19439
1615 1 7 . 1 1 80 80 ARG HA H 80 3.732 3.732 4.033 -0.301 19439
1616 1 7 . 1 1 80 80 ARG CA C 80 61.441 61.441 59.513 1.928 19439
1617 1 7 . 1 1 80 80 ARG CB C 80 30.266 30.266 30.378 -0.112 19439
1618 1 7 . 1 1 80 80 ARG H H 80 7.981 7.981 8.174 -0.193 19439
1619 1 7 . 1 1 81 81 VAL N N 81 119.192 119.192 119.773 -0.581 19439
1620 1 7 . 1 1 81 81 VAL HA H 81 3.582 3.582 3.960 -0.378 19439
1621 1 7 . 1 1 81 81 VAL CA C 81 66.909 66.909 66.447 0.462 19439
1622 1 7 . 1 1 81 81 VAL CB C 81 31.668 31.668 31.671 -0.003 19439
1623 1 7 . 1 1 81 81 VAL H H 81 7.338 7.338 8.092 -0.754 19439
1624 1 7 . 1 1 82 82 LEU N N 82 118.722 118.722 121.424 -2.702 19439
1625 1 7 . 1 1 82 82 LEU HA H 82 4.044 4.044 3.932 0.112 19439
1626 1 7 . 1 1 82 82 LEU CA C 82 58.356 58.356 58.689 -0.333 19439
1627 1 7 . 1 1 82 82 LEU CB C 82 41.627 41.627 41.637 -0.010 19439
1628 1 7 . 1 1 82 82 LEU H H 82 7.599 7.599 8.386 -0.787 19439
1629 1 7 . 1 1 83 83 ILE N N 83 120.893 120.893 119.588 1.305 19439
1630 1 7 . 1 1 83 83 ILE HA H 83 3.642 3.642 3.703 -0.061 19439
1631 1 7 . 1 1 83 83 ILE CA C 83 65.669 65.669 65.680 -0.011 19439
1632 1 7 . 1 1 83 83 ILE CB C 83 38.579 38.579 37.934 0.645 19439
1633 1 7 . 1 1 83 83 ILE H H 83 8.546 8.546 8.468 0.078 19439
1634 1 7 . 1 1 84 84 PHE N N 84 123.343 123.343 120.633 2.710 19439
1635 1 7 . 1 1 84 84 PHE HA H 84 4.084 4.084 4.094 -0.010 19439
1636 1 7 . 1 1 84 84 PHE CA C 84 62.593 62.593 60.211 2.382 19439
1637 1 7 . 1 1 84 84 PHE CB C 84 39.211 39.211 38.655 0.556 19439
1638 1 7 . 1 1 84 84 PHE H H 84 8.622 8.622 8.517 0.105 19439
1639 1 7 . 1 1 85 85 ASN N N 85 118.037 118.037 118.040 -0.003 19439
1640 1 7 . 1 1 85 85 ASN HA H 85 4.426 4.426 4.061 0.365 19439
1641 1 7 . 1 1 85 85 ASN CA C 85 56.045 56.045 56.511 -0.466 19439
1642 1 7 . 1 1 85 85 ASN CB C 85 37.785 37.785 38.437 -0.652 19439
1643 1 7 . 1 1 85 85 ASN H H 85 8.834 8.834 8.636 0.198 19439
1644 1 7 . 1 1 86 86 GLU N N 86 121.098 121.098 121.660 -0.562 19439
1645 1 7 . 1 1 86 86 GLU HA H 86 4.052 4.052 3.926 0.126 19439
1646 1 7 . 1 1 86 86 GLU CA C 86 59.328 59.328 59.721 -0.393 19439
1647 1 7 . 1 1 86 86 GLU CB C 86 30.253 30.253 29.689 0.565 19439
1648 1 7 . 1 1 86 86 GLU H H 86 8.105 8.105 8.261 -0.156 19439
1649 1 7 . 1 1 87 87 TRP N N 87 122.584 122.584 121.992 0.592 19439
1650 1 7 . 1 1 87 87 TRP HA H 87 4.006 4.006 4.192 -0.186 19439
1651 1 7 . 1 1 87 87 TRP CA C 87 61.545 61.545 61.864 -0.319 19439
1652 1 7 . 1 1 87 87 TRP CB C 87 27.943 27.943 29.515 -1.573 19439
1653 1 7 . 1 1 87 87 TRP H H 87 8.099 8.099 8.599 -0.500 19439
1654 1 7 . 1 1 88 88 GLU N N 88 117.357 117.357 118.849 -1.492 19439
1655 1 7 . 1 1 88 88 GLU HA H 88 2.919 2.919 3.272 -0.353 19439
1656 1 7 . 1 1 88 88 GLU CA C 88 59.804 59.804 59.634 0.170 19439
1657 1 7 . 1 1 88 88 GLU CB C 88 29.546 29.546 29.301 0.245 19439
1658 1 7 . 1 1 88 88 GLU H H 88 8.440 8.440 8.630 -0.190 19439
1659 1 7 . 1 1 89 89 GLU N N 89 116.109 116.109 119.833 -3.724 19439
1660 1 7 . 1 1 89 89 GLU HA H 89 3.995 3.995 3.894 0.101 19439
1661 1 7 . 1 1 89 89 GLU CA C 89 58.329 58.329 59.239 -0.909 19439
1662 1 7 . 1 1 89 89 GLU CB C 89 29.649 29.649 29.297 0.352 19439
1663 1 7 . 1 1 89 89 GLU H H 89 7.244 7.244 8.046 -0.802 19439
1664 1 7 . 1 1 90 90 ARG N N 90 120.512 120.512 118.758 1.754 19439
1665 1 7 . 1 1 90 90 ARG HA H 90 3.920 3.920 3.868 0.052 19439
1666 1 7 . 1 1 90 90 ARG CA C 90 58.683 58.683 58.894 -0.211 19439
1667 1 7 . 1 1 90 90 ARG CB C 90 30.659 30.659 29.561 1.098 19439
1668 1 7 . 1 1 90 90 ARG H H 90 8.368 8.368 8.075 0.293 19439
1669 1 7 . 1 1 91 91 LYS N N 91 120.024 120.024 119.782 0.242 19439
1670 1 7 . 1 1 91 91 LYS HA H 91 3.964 3.964 3.958 0.006 19439
1671 1 7 . 1 1 91 91 LYS CA C 91 57.278 57.278 58.716 -1.438 19439
1672 1 7 . 1 1 91 91 LYS CB C 91 30.582 30.582 31.226 -0.644 19439
1673 1 7 . 1 1 91 91 LYS H H 91 8.491 8.491 7.979 0.512 19439
1674 1 7 . 1 1 92 92 LYS N N 92 118.192 118.192 118.230 -0.038 19439
1675 1 7 . 1 1 92 92 LYS HA H 92 3.796 3.796 3.967 -0.171 19439
1676 1 7 . 1 1 92 92 LYS CA C 92 58.976 58.976 58.693 0.283 19439
1677 1 7 . 1 1 92 92 LYS CB C 92 32.188 32.188 32.258 -0.070 19439
1678 1 7 . 1 1 92 92 LYS H H 92 6.933 6.933 7.948 -1.015 19439
1679 1 7 . 1 1 93 93 SER N N 93 110.447 110.447 113.963 -3.516 19439
1680 1 7 . 1 1 93 93 SER HA H 93 4.484 4.484 4.243 0.241 19439
1681 1 7 . 1 1 93 93 SER CA C 93 58.386 58.386 61.090 -2.704 19439
1682 1 7 . 1 1 93 93 SER CB C 93 64.173 64.173 64.360 -0.187 19439
1683 1 7 . 1 1 93 93 SER H H 93 7.282 7.282 7.751 -0.469 19439
1684 1 7 . 1 1 94 94 ASP N N 94 120.163 120.163 118.036 2.127 19439
1685 1 7 . 1 1 94 94 ASP HA H 94 4.872 4.872 5.135 -0.263 19439
1686 1 7 . 1 1 94 94 ASP CA C 94 51.157 51.157 52.892 -1.735 19439
1687 1 7 . 1 1 94 94 ASP CB C 94 41.256 41.256 43.602 -2.346 19439
1688 1 7 . 1 1 94 94 ASP H H 94 7.303 7.303 8.077 -0.774 19439
1689 1 7 . 1 1 95 95 PRO CA C 95 63.871 63.871 63.672 0.199 19439
1690 1 7 . 1 1 95 95 PRO CB C 95 31.497 31.497 32.324 -0.827 19439
1691 1 7 . 1 1 96 96 TRP N N 96 117.486 117.486 117.590 -0.104 19439
1692 1 7 . 1 1 96 96 TRP HA H 96 4.637 4.637 4.564 0.073 19439
1693 1 7 . 1 1 96 96 TRP CA C 96 56.061 56.061 55.321 0.740 19439
1694 1 7 . 1 1 96 96 TRP CB C 96 28.605 28.605 27.906 0.699 19439
1695 1 7 . 1 1 96 96 TRP H H 96 7.484 7.484 7.839 -0.355 19439
1696 1 7 . 1 1 97 97 LEU N N 97 123.510 123.510 120.609 2.901 19439
1697 1 7 . 1 1 97 97 LEU HA H 97 4.098 4.098 3.195 0.903 19439
1698 1 7 . 1 1 97 97 LEU CA C 97 56.024 56.024 54.437 1.587 19439
1699 1 7 . 1 1 97 97 LEU CB C 97 42.893 42.893 43.143 -0.250 19439
1700 1 7 . 1 1 97 97 LEU H H 97 7.137 7.137 6.866 0.271 19439
1701 1 7 . 1 1 98 98 ARG N N 98 129.724 129.724 125.011 4.713 19439
1702 1 7 . 1 1 98 98 ARG HA H 98 4.486 4.486 4.579 -0.093 19439
1703 1 7 . 1 1 98 98 ARG CA C 98 55.622 55.622 54.968 0.655 19439
1704 1 7 . 1 1 98 98 ARG CB C 98 31.229 31.229 31.374 -0.145 19439
1705 1 7 . 1 1 98 98 ARG H H 98 8.825 8.825 8.262 0.563 19439
1706 1 7 . 1 1 99 99 LEU N N 99 127.814 127.814 122.698 5.116 19439
1707 1 7 . 1 1 99 99 LEU HA H 99 3.586 3.586 4.325 -0.739 19439
1708 1 7 . 1 1 99 99 LEU CA C 99 54.352 54.352 54.156 0.196 19439
1709 1 7 . 1 1 99 99 LEU CB C 99 40.485 40.485 41.817 -1.332 19439
1710 1 7 . 1 1 99 99 LEU H H 99 8.236 8.236 8.134 0.102 19439
1711 1 7 . 1 1 100 100 ASP N N 100 126.633 126.633 127.769 -1.136 19439
1712 1 7 . 1 1 100 100 ASP HA H 100 4.646 4.646 4.874 -0.228 19439
1713 1 7 . 1 1 100 100 ASP CA C 100 52.894 52.894 53.892 -0.998 19439
1714 1 7 . 1 1 100 100 ASP CB C 100 41.224 41.224 43.023 -1.799 19439
1715 1 7 . 1 1 100 100 ASP H H 100 8.018 8.018 8.597 -0.579 19439
1716 1 7 . 1 1 101 101 MET N N 101 122.473 122.473 119.774 2.699 19439
1717 1 7 . 1 1 101 101 MET HA H 101 4.481 4.481 4.641 -0.160 19439
1718 1 7 . 1 1 101 101 MET CA C 101 53.398 53.398 54.320 -0.922 19439
1719 1 7 . 1 1 101 101 MET CB C 101 33.296 33.296 32.866 0.430 19439
1720 1 7 . 1 1 101 101 MET H H 101 8.639 8.639 7.953 0.686 19439
1721 1 7 . 1 1 102 102 SER N N 102 116.243 116.243 116.955 -0.712 19439
1722 1 7 . 1 1 102 102 SER HA H 102 4.114 4.114 4.397 -0.283 19439
1723 1 7 . 1 1 102 102 SER CA C 102 58.709 58.709 57.133 1.576 19439
1724 1 7 . 1 1 102 102 SER CB C 102 64.701 64.701 65.235 -0.534 19439
1725 1 7 . 1 1 102 102 SER H H 102 8.096 8.096 8.039 0.057 19439
1726 1 7 . 1 1 103 103 ASP N N 103 121.639 121.639 124.246 -2.607 19439
1727 1 7 . 1 1 103 103 ASP HA H 103 3.724 3.724 3.950 -0.226 19439
1728 1 7 . 1 1 103 103 ASP CA C 103 57.296 57.296 56.935 0.361 19439
1729 1 7 . 1 1 103 103 ASP CB C 103 38.720 38.720 40.289 -1.569 19439
1730 1 7 . 1 1 103 103 ASP H H 103 8.669 8.669 8.775 -0.106 19439
1731 1 7 . 1 1 104 104 LYS N N 104 116.276 116.276 119.085 -2.809 19439
1732 1 7 . 1 1 104 104 LYS HA H 104 3.678 3.678 4.047 -0.369 19439
1733 1 7 . 1 1 104 104 LYS CA C 104 59.833 59.833 58.805 1.028 19439
1734 1 7 . 1 1 104 104 LYS CB C 104 32.090 32.090 31.806 0.284 19439
1735 1 7 . 1 1 104 104 LYS H H 104 7.775 7.775 7.427 0.348 19439
1736 1 7 . 1 1 105 105 ALA N N 105 122.257 122.257 122.351 -0.094 19439
1737 1 7 . 1 1 105 105 ALA HA H 105 3.873 3.873 4.088 -0.215 19439
1738 1 7 . 1 1 105 105 ALA CA C 105 55.008 55.008 54.798 0.210 19439
1739 1 7 . 1 1 105 105 ALA CB C 105 17.741 17.741 18.077 -0.336 19439
1740 1 7 . 1 1 105 105 ALA H H 105 7.266 7.266 7.599 -0.333 19439
1741 1 7 . 1 1 106 106 ILE N N 106 119.452 119.452 119.875 -0.423 19439
1742 1 7 . 1 1 106 106 ILE HA H 106 3.419 3.419 3.835 -0.416 19439
1743 1 7 . 1 1 106 106 ILE CA C 106 65.971 65.971 64.623 1.348 19439
1744 1 7 . 1 1 106 106 ILE CB C 106 37.430 37.430 37.640 -0.210 19439
1745 1 7 . 1 1 106 106 ILE H H 106 7.974 7.974 7.775 0.199 19439
1746 1 7 . 1 1 107 107 PHE N N 107 117.814 117.814 118.905 -1.091 19439
1747 1 7 . 1 1 107 107 PHE HA H 107 4.368 4.368 4.691 -0.323 19439
1748 1 7 . 1 1 107 107 PHE CA C 107 56.844 56.844 58.275 -1.431 19439
1749 1 7 . 1 1 107 107 PHE CB C 107 37.150 37.150 37.694 -0.544 19439
1750 1 7 . 1 1 107 107 PHE H H 107 8.434 8.434 8.289 0.145 19439
1751 1 7 . 1 1 108 108 ARG N N 108 117.368 117.368 120.082 -2.714 19439
1752 1 7 . 1 1 108 108 ARG HA H 108 3.994 3.994 4.124 -0.130 19439
1753 1 7 . 1 1 108 108 ARG CA C 108 58.682 58.682 58.839 -0.157 19439
1754 1 7 . 1 1 108 108 ARG CB C 108 30.287 30.287 30.294 -0.007 19439
1755 1 7 . 1 1 108 108 ARG H H 108 7.474 7.474 8.195 -0.721 19439
1756 1 7 . 1 1 109 109 ARG N N 109 117.440 117.440 117.120 0.320 19439
1757 1 7 . 1 1 109 109 ARG HA H 109 3.900 3.900 3.918 -0.018 19439
1758 1 7 . 1 1 109 109 ARG CA C 109 57.312 57.312 58.239 -0.927 19439
1759 1 7 . 1 1 109 109 ARG CB C 109 31.626 31.626 30.814 0.812 19439
1760 1 7 . 1 1 109 109 ARG H H 109 7.118 7.118 7.652 -0.534 19439
1761 1 7 . 1 1 110 110 TYR N N 110 116.060 116.060 116.354 -0.294 19439
1762 1 7 . 1 1 110 110 TYR HA H 110 5.265 5.265 5.169 0.096 19439
1763 1 7 . 1 1 110 110 TYR CA C 110 54.188 54.188 54.631 -0.443 19439
1764 1 7 . 1 1 110 110 TYR CB C 110 38.484 38.484 38.219 0.265 19439
1765 1 7 . 1 1 110 110 TYR H H 110 8.707 8.707 8.052 0.655 19439
1766 1 7 . 1 1 111 111 PRO HA H 111 4.388 4.388 4.651 -0.263 19439
1767 1 7 . 1 1 111 111 PRO CA C 111 64.847 64.847 64.384 0.463 19439
1768 1 7 . 1 1 111 111 PRO CB C 111 31.381 31.381 32.051 -0.670 19439
1769 1 7 . 1 1 112 112 HIS N N 112 115.542 115.542 113.314 2.228 19439
1770 1 7 . 1 1 112 112 HIS HA H 112 4.482 4.482 4.517 -0.035 19439
1771 1 7 . 1 1 112 112 HIS CA C 112 58.498 58.498 57.032 1.466 19439
1772 1 7 . 1 1 112 112 HIS CB C 112 29.654 29.654 28.575 1.079 19439
1773 1 7 . 1 1 112 112 HIS H H 112 8.196 8.196 8.383 -0.187 19439
1774 1 7 . 1 1 113 113 LEU N N 113 120.583 120.583 120.038 0.545 19439
1775 1 7 . 1 1 113 113 LEU HA H 113 4.165 4.165 4.299 -0.134 19439
1776 1 7 . 1 1 113 113 LEU CA C 113 54.013 54.013 55.068 -1.055 19439
1777 1 7 . 1 1 113 113 LEU CB C 113 41.669 41.669 41.620 0.049 19439
1778 1 7 . 1 1 113 113 LEU H H 113 7.527 7.527 7.437 0.090 19439
1779 1 8 . 1 1 59 59 ALA N N 59 123.310 123.310 124.440 -1.130 19439
1780 1 8 . 1 1 59 59 ALA HA H 59 4.232 4.232 4.522 -0.290 19439
1781 1 8 . 1 1 59 59 ALA CA C 59 52.274 52.274 51.852 0.422 19439
1782 1 8 . 1 1 59 59 ALA CB C 59 19.623 19.623 19.091 0.532 19439
1783 1 8 . 1 1 59 59 ALA H H 59 7.894 7.894 7.954 -0.060 19439
1784 1 8 . 1 1 60 60 LEU N N 60 120.936 120.936 119.689 1.247 19439
1785 1 8 . 1 1 60 60 LEU HA H 60 4.364 4.364 4.433 -0.069 19439
1786 1 8 . 1 1 60 60 LEU CA C 60 54.130 54.130 55.798 -1.668 19439
1787 1 8 . 1 1 60 60 LEU CB C 60 43.209 43.209 41.871 1.338 19439
1788 1 8 . 1 1 60 60 LEU H H 60 8.046 8.046 8.126 -0.080 19439
1789 1 8 . 1 1 61 61 ALA N N 61 125.460 125.460 121.588 3.872 19439
1790 1 8 . 1 1 61 61 ALA HA H 61 4.364 4.364 4.356 0.008 19439
1791 1 8 . 1 1 61 61 ALA CA C 61 51.176 51.176 51.550 -0.374 19439
1792 1 8 . 1 1 61 61 ALA CB C 61 20.172 20.172 19.702 0.470 19439
1793 1 8 . 1 1 61 61 ALA H H 61 8.338 8.338 7.511 0.827 19439
1794 1 8 . 1 1 62 62 ALA N N 62 127.765 127.765 125.078 2.687 19439
1795 1 8 . 1 1 62 62 ALA HA H 62 4.394 4.394 4.647 -0.253 19439
1796 1 8 . 1 1 62 62 ALA CA C 62 51.888 51.888 50.985 0.903 19439
1797 1 8 . 1 1 62 62 ALA CB C 62 18.806 18.806 20.369 -1.563 19439
1798 1 8 . 1 1 62 62 ALA H H 62 8.487 8.487 8.912 -0.425 19439
1799 1 8 . 1 1 63 63 LEU N N 63 120.199 120.199 118.333 1.866 19439
1800 1 8 . 1 1 63 63 LEU HA H 63 4.828 4.828 5.036 -0.208 19439
1801 1 8 . 1 1 63 63 LEU CA C 63 51.852 51.852 53.206 -1.354 19439
1802 1 8 . 1 1 63 63 LEU CB C 63 44.081 44.081 45.643 -1.562 19439
1803 1 8 . 1 1 63 63 LEU H H 63 7.927 7.927 8.182 -0.255 19439
1804 1 8 . 1 1 64 64 HIS N N 64 122.277 122.277 118.484 3.793 19439
1805 1 8 . 1 1 64 64 HIS HA H 64 4.114 4.114 4.591 -0.477 19439
1806 1 8 . 1 1 64 64 HIS CA C 64 58.038 58.038 57.212 0.826 19439
1807 1 8 . 1 1 64 64 HIS CB C 64 31.228 31.228 31.601 -0.373 19439
1808 1 8 . 1 1 64 64 HIS H H 64 8.477 8.477 8.832 -0.355 19439
1809 1 8 . 1 1 65 65 ALA HA H 65 4.339 4.339 4.470 -0.131 19439
1810 1 8 . 1 1 65 65 ALA CA C 65 53.281 53.281 52.349 0.932 19439
1811 1 8 . 1 1 65 65 ALA CB C 65 20.276 20.276 19.945 0.331 19439
1812 1 8 . 1 1 66 66 GLU N N 66 113.868 113.868 117.578 -3.710 19439
1813 1 8 . 1 1 66 66 GLU HA H 66 4.619 4.619 4.516 0.103 19439
1814 1 8 . 1 1 66 66 GLU CA C 66 54.727 54.727 55.051 -0.324 19439
1815 1 8 . 1 1 66 66 GLU CB C 66 32.894 32.894 32.806 0.089 19439
1816 1 8 . 1 1 66 66 GLU H H 66 7.759 7.759 8.005 -0.246 19439
1817 1 8 . 1 1 68 68 PRO HA H 68 4.219 4.219 4.294 -0.075 19439
1818 1 8 . 1 1 68 68 PRO CA C 68 64.664 64.664 65.025 -0.361 19439
1819 1 8 . 1 1 68 68 PRO CB C 68 32.066 32.066 31.691 0.375 19439
1820 1 8 . 1 1 69 69 LEU N N 69 117.262 117.262 118.536 -1.274 19439
1821 1 8 . 1 1 69 69 LEU HA H 69 4.182 4.182 4.230 -0.048 19439
1822 1 8 . 1 1 69 69 LEU CA C 69 52.430 52.430 53.674 -1.244 19439
1823 1 8 . 1 1 69 69 LEU CB C 69 40.907 40.907 41.514 -0.606 19439
1824 1 8 . 1 1 69 69 LEU H H 69 8.439 8.439 7.958 0.481 19439
1825 1 8 . 1 1 70 70 ALA N N 70 120.426 120.426 121.020 -0.594 19439
1826 1 8 . 1 1 70 70 ALA HA H 70 3.411 3.411 4.185 -0.774 19439
1827 1 8 . 1 1 70 70 ALA CA C 70 53.685 53.685 53.543 0.142 19439
1828 1 8 . 1 1 70 70 ALA CB C 70 17.914 17.914 18.686 -0.772 19439
1829 1 8 . 1 1 70 70 ALA H H 70 7.113 7.113 7.435 -0.322 19439
1830 1 8 . 1 1 71 71 GLY N N 71 108.911 108.911 113.773 -4.862 19439
1831 1 8 . 1 1 71 71 GLY CA C 71 45.215 45.215 45.128 0.087 19439
1832 1 8 . 1 1 71 71 GLY H H 71 8.856 8.856 8.938 -0.082 19439
1833 1 8 . 1 1 72 72 LEU N N 72 120.000 120.000 121.031 -1.031 19439
1834 1 8 . 1 1 72 72 LEU HA H 72 4.769 4.769 4.978 -0.209 19439
1835 1 8 . 1 1 72 72 LEU CA C 72 51.972 51.972 51.605 0.367 19439
1836 1 8 . 1 1 72 72 LEU CB C 72 41.255 41.255 42.851 -1.596 19439
1837 1 8 . 1 1 72 72 LEU H H 72 8.136 8.136 7.960 0.176 19439
1838 1 8 . 1 1 73 73 PRO HA H 73 4.739 4.739 4.586 0.153 19439
1839 1 8 . 1 1 73 73 PRO CA C 73 61.456 61.456 62.742 -1.286 19439
1840 1 8 . 1 1 73 73 PRO CB C 73 31.245 31.245 32.023 -0.778 19439
1841 1 8 . 1 1 74 74 VAL N N 74 121.723 121.723 119.423 2.300 19439
1842 1 8 . 1 1 74 74 VAL HA H 74 3.446 3.446 3.833 -0.387 19439
1843 1 8 . 1 1 74 74 VAL CA C 74 65.744 65.744 64.001 1.742 19439
1844 1 8 . 1 1 74 74 VAL CB C 74 31.236 31.236 32.017 -0.781 19439
1845 1 8 . 1 1 74 74 VAL H H 74 7.710 7.710 8.342 -0.632 19439
1846 1 8 . 1 1 75 75 THR N N 75 108.893 108.893 108.819 0.074 19439
1847 1 8 . 1 1 75 75 THR HA H 75 4.937 4.937 4.554 0.383 19439
1848 1 8 . 1 1 75 75 THR CA C 75 59.892 59.892 59.814 0.078 19439
1849 1 8 . 1 1 75 75 THR CB C 75 12.018 12.018 71.799 -59.782 19439
1850 1 8 . 1 1 75 75 THR H H 75 8.710 8.710 7.446 1.264 19439
1851 1 8 . 1 1 76 76 ARG HA H 76 3.873 3.873 4.084 -0.211 19439
1852 1 8 . 1 1 76 76 ARG H H 76 8.447 8.447 8.796 -0.349 19439
1853 1 8 . 1 1 77 77 SER N N 77 114.482 114.482 115.036 -0.554 19439
1854 1 8 . 1 1 77 77 SER HA H 77 4.061 4.061 4.199 -0.138 19439
1855 1 8 . 1 1 77 77 SER CA C 77 60.467 60.467 61.121 -0.654 19439
1856 1 8 . 1 1 77 77 SER CB C 77 62.449 62.449 62.678 -0.229 19439
1857 1 8 . 1 1 77 77 SER H H 77 8.105 8.105 7.956 0.149 19439
1858 1 8 . 1 1 78 78 ASP N N 78 120.538 120.538 122.001 -1.463 19439
1859 1 8 . 1 1 78 78 ASP HA H 78 4.333 4.333 4.374 -0.041 19439
1860 1 8 . 1 1 78 78 ASP CA C 78 58.020 58.020 57.288 0.732 19439
1861 1 8 . 1 1 78 78 ASP CB C 78 43.252 43.252 40.525 2.728 19439
1862 1 8 . 1 1 78 78 ASP H H 78 7.300 7.300 8.145 -0.845 19439
1863 1 8 . 1 1 79 79 ALA N N 79 120.614 120.614 123.118 -2.504 19439
1864 1 8 . 1 1 79 79 ALA HA H 79 3.672 3.672 3.907 -0.235 19439
1865 1 8 . 1 1 79 79 ALA CA C 79 54.886 54.886 55.312 -0.426 19439
1866 1 8 . 1 1 79 79 ALA CB C 79 19.628 19.628 18.232 1.396 19439
1867 1 8 . 1 1 79 79 ALA H H 79 7.767 7.767 8.383 -0.616 19439
1868 1 8 . 1 1 80 80 ARG N N 80 116.203 116.203 119.330 -3.127 19439
1869 1 8 . 1 1 80 80 ARG HA H 80 3.732 3.732 4.088 -0.356 19439
1870 1 8 . 1 1 80 80 ARG CA C 80 61.441 61.441 59.145 2.296 19439
1871 1 8 . 1 1 80 80 ARG CB C 80 30.266 30.266 30.061 0.206 19439
1872 1 8 . 1 1 80 80 ARG H H 80 7.981 7.981 8.062 -0.081 19439
1873 1 8 . 1 1 81 81 VAL N N 81 119.192 119.192 120.010 -0.818 19439
1874 1 8 . 1 1 81 81 VAL HA H 81 3.582 3.582 3.946 -0.364 19439
1875 1 8 . 1 1 81 81 VAL CA C 81 66.909 66.909 66.673 0.236 19439
1876 1 8 . 1 1 81 81 VAL CB C 81 31.668 31.668 31.699 -0.031 19439
1877 1 8 . 1 1 81 81 VAL H H 81 7.338 7.338 8.149 -0.811 19439
1878 1 8 . 1 1 82 82 LEU N N 82 118.722 118.722 121.299 -2.577 19439
1879 1 8 . 1 1 82 82 LEU HA H 82 4.044 4.044 3.970 0.074 19439
1880 1 8 . 1 1 82 82 LEU CA C 82 58.356 58.356 58.622 -0.266 19439
1881 1 8 . 1 1 82 82 LEU CB C 82 41.627 41.627 41.677 -0.050 19439
1882 1 8 . 1 1 82 82 LEU H H 82 7.599 7.599 8.350 -0.751 19439
1883 1 8 . 1 1 83 83 ILE N N 83 120.893 120.893 119.767 1.126 19439
1884 1 8 . 1 1 83 83 ILE HA H 83 3.642 3.642 3.770 -0.128 19439
1885 1 8 . 1 1 83 83 ILE CA C 83 65.669 65.669 65.574 0.095 19439
1886 1 8 . 1 1 83 83 ILE CB C 83 38.579 38.579 38.021 0.558 19439
1887 1 8 . 1 1 83 83 ILE H H 83 8.546 8.546 8.454 0.092 19439
1888 1 8 . 1 1 84 84 PHE N N 84 123.343 123.343 120.468 2.875 19439
1889 1 8 . 1 1 84 84 PHE HA H 84 4.084 4.084 4.134 -0.050 19439
1890 1 8 . 1 1 84 84 PHE CA C 84 62.593 62.593 60.807 1.786 19439
1891 1 8 . 1 1 84 84 PHE CB C 84 39.211 39.211 38.928 0.283 19439
1892 1 8 . 1 1 84 84 PHE H H 84 8.622 8.622 8.622 -0.000 19439
1893 1 8 . 1 1 85 85 ASN N N 85 118.037 118.037 117.844 0.193 19439
1894 1 8 . 1 1 85 85 ASN HA H 85 4.426 4.426 4.105 0.321 19439
1895 1 8 . 1 1 85 85 ASN CA C 85 56.045 56.045 56.768 -0.723 19439
1896 1 8 . 1 1 85 85 ASN CB C 85 37.785 37.785 38.459 -0.674 19439
1897 1 8 . 1 1 85 85 ASN H H 85 8.834 8.834 8.673 0.161 19439
1898 1 8 . 1 1 86 86 GLU N N 86 121.098 121.098 122.369 -1.271 19439
1899 1 8 . 1 1 86 86 GLU HA H 86 4.052 4.052 4.012 0.040 19439
1900 1 8 . 1 1 86 86 GLU CA C 86 59.328 59.328 59.715 -0.387 19439
1901 1 8 . 1 1 86 86 GLU CB C 86 30.253 30.253 29.553 0.700 19439
1902 1 8 . 1 1 86 86 GLU H H 86 8.105 8.105 8.273 -0.168 19439
1903 1 8 . 1 1 87 87 TRP N N 87 122.584 122.584 121.914 0.670 19439
1904 1 8 . 1 1 87 87 TRP HA H 87 4.006 4.006 4.167 -0.161 19439
1905 1 8 . 1 1 87 87 TRP CA C 87 61.545 61.545 61.796 -0.251 19439
1906 1 8 . 1 1 87 87 TRP CB C 87 27.943 27.943 29.478 -1.535 19439
1907 1 8 . 1 1 87 87 TRP H H 87 8.099 8.099 8.662 -0.562 19439
1908 1 8 . 1 1 88 88 GLU N N 88 117.357 117.357 117.585 -0.228 19439
1909 1 8 . 1 1 88 88 GLU HA H 88 2.919 2.919 3.344 -0.425 19439
1910 1 8 . 1 1 88 88 GLU CA C 88 59.804 59.804 59.804 0.000 19439
1911 1 8 . 1 1 88 88 GLU CB C 88 29.546 29.546 28.675 0.871 19439
1912 1 8 . 1 1 88 88 GLU H H 88 8.440 8.440 8.409 0.031 19439
1913 1 8 . 1 1 89 89 GLU N N 89 116.109 116.109 119.807 -3.698 19439
1914 1 8 . 1 1 89 89 GLU HA H 89 3.995 3.995 3.777 0.218 19439
1915 1 8 . 1 1 89 89 GLU CA C 89 58.329 58.329 59.301 -0.972 19439
1916 1 8 . 1 1 89 89 GLU CB C 89 29.649 29.649 29.499 0.150 19439
1917 1 8 . 1 1 89 89 GLU H H 89 7.244 7.244 7.976 -0.732 19439
1918 1 8 . 1 1 90 90 ARG N N 90 120.512 120.512 118.067 2.445 19439
1919 1 8 . 1 1 90 90 ARG HA H 90 3.920 3.920 3.924 -0.004 19439
1920 1 8 . 1 1 90 90 ARG CA C 90 58.683 58.683 58.709 -0.026 19439
1921 1 8 . 1 1 90 90 ARG CB C 90 30.659 30.659 29.676 0.983 19439
1922 1 8 . 1 1 90 90 ARG H H 90 8.368 8.368 8.284 0.084 19439
1923 1 8 . 1 1 91 91 LYS N N 91 120.024 120.024 119.712 0.312 19439
1924 1 8 . 1 1 91 91 LYS HA H 91 3.964 3.964 3.992 -0.028 19439
1925 1 8 . 1 1 91 91 LYS CA C 91 57.278 57.278 58.608 -1.330 19439
1926 1 8 . 1 1 91 91 LYS CB C 91 30.582 30.582 31.323 -0.741 19439
1927 1 8 . 1 1 91 91 LYS H H 91 8.491 8.491 7.933 0.558 19439
1928 1 8 . 1 1 92 92 LYS N N 92 118.192 118.192 118.075 0.117 19439
1929 1 8 . 1 1 92 92 LYS HA H 92 3.796 3.796 3.973 -0.177 19439
1930 1 8 . 1 1 92 92 LYS CA C 92 58.976 58.976 58.674 0.302 19439
1931 1 8 . 1 1 92 92 LYS CB C 92 32.188 32.188 32.172 0.015 19439
1932 1 8 . 1 1 92 92 LYS H H 92 6.933 6.933 7.711 -0.778 19439
1933 1 8 . 1 1 93 93 SER N N 93 110.447 110.447 112.831 -2.384 19439
1934 1 8 . 1 1 93 93 SER HA H 93 4.484 4.484 4.415 0.069 19439
1935 1 8 . 1 1 93 93 SER CA C 93 58.386 58.386 60.686 -2.300 19439
1936 1 8 . 1 1 93 93 SER CB C 93 64.173 64.173 64.232 -0.059 19439
1937 1 8 . 1 1 93 93 SER H H 93 7.282 7.282 7.701 -0.419 19439
1938 1 8 . 1 1 94 94 ASP N N 94 120.163 120.163 119.265 0.898 19439
1939 1 8 . 1 1 94 94 ASP HA H 94 4.872 4.872 5.036 -0.164 19439
1940 1 8 . 1 1 94 94 ASP CA C 94 51.157 51.157 52.723 -1.566 19439
1941 1 8 . 1 1 94 94 ASP CB C 94 41.256 41.256 43.075 -1.819 19439
1942 1 8 . 1 1 94 94 ASP H H 94 7.303 7.303 8.180 -0.877 19439
1943 1 8 . 1 1 95 95 PRO CA C 95 63.871 63.871 63.607 0.264 19439
1944 1 8 . 1 1 95 95 PRO CB C 95 31.497 31.497 32.222 -0.725 19439
1945 1 8 . 1 1 96 96 TRP N N 96 117.486 117.486 117.147 0.339 19439
1946 1 8 . 1 1 96 96 TRP HA H 96 4.637 4.637 4.586 0.051 19439
1947 1 8 . 1 1 96 96 TRP CA C 96 56.061 56.061 54.950 1.111 19439
1948 1 8 . 1 1 96 96 TRP CB C 96 28.605 28.605 28.619 -0.014 19439
1949 1 8 . 1 1 96 96 TRP H H 96 7.484 7.484 7.908 -0.424 19439
1950 1 8 . 1 1 97 97 LEU N N 97 123.510 123.510 121.812 1.698 19439
1951 1 8 . 1 1 97 97 LEU HA H 97 4.098 4.098 3.119 0.979 19439
1952 1 8 . 1 1 97 97 LEU CA C 97 56.024 56.024 54.539 1.485 19439
1953 1 8 . 1 1 97 97 LEU CB C 97 42.893 42.893 42.159 0.734 19439
1954 1 8 . 1 1 97 97 LEU H H 97 7.137 7.137 6.828 0.309 19439
1955 1 8 . 1 1 98 98 ARG N N 98 129.724 129.724 125.178 4.546 19439
1956 1 8 . 1 1 98 98 ARG HA H 98 4.486 4.486 4.555 -0.069 19439
1957 1 8 . 1 1 98 98 ARG CA C 98 55.622 55.622 54.901 0.721 19439
1958 1 8 . 1 1 98 98 ARG CB C 98 31.229 31.229 31.158 0.071 19439
1959 1 8 . 1 1 98 98 ARG H H 98 8.825 8.825 8.327 0.498 19439
1960 1 8 . 1 1 99 99 LEU N N 99 127.814 127.814 123.132 4.682 19439
1961 1 8 . 1 1 99 99 LEU HA H 99 3.586 3.586 4.268 -0.682 19439
1962 1 8 . 1 1 99 99 LEU CA C 99 54.352 54.352 54.356 -0.004 19439
1963 1 8 . 1 1 99 99 LEU CB C 99 40.485 40.485 41.746 -1.261 19439
1964 1 8 . 1 1 99 99 LEU H H 99 8.236 8.236 8.172 0.064 19439
1965 1 8 . 1 1 100 100 ASP N N 100 126.633 126.633 128.856 -2.223 19439
1966 1 8 . 1 1 100 100 ASP HA H 100 4.646 4.646 4.856 -0.210 19439
1967 1 8 . 1 1 100 100 ASP CA C 100 52.894 52.894 54.209 -1.315 19439
1968 1 8 . 1 1 100 100 ASP CB C 100 41.224 41.224 42.462 -1.238 19439
1969 1 8 . 1 1 100 100 ASP H H 100 8.018 8.018 8.739 -0.721 19439
1970 1 8 . 1 1 101 101 MET N N 101 122.473 122.473 120.965 1.508 19439
1971 1 8 . 1 1 101 101 MET HA H 101 4.481 4.481 4.578 -0.097 19439
1972 1 8 . 1 1 101 101 MET CA C 101 53.398 53.398 54.434 -1.036 19439
1973 1 8 . 1 1 101 101 MET CB C 101 33.296 33.296 32.938 0.358 19439
1974 1 8 . 1 1 101 101 MET H H 101 8.639 8.639 8.007 0.632 19439
1975 1 8 . 1 1 102 102 SER N N 102 116.243 116.243 117.168 -0.925 19439
1976 1 8 . 1 1 102 102 SER HA H 102 4.114 4.114 4.406 -0.292 19439
1977 1 8 . 1 1 102 102 SER CA C 102 58.709 58.709 57.343 1.366 19439
1978 1 8 . 1 1 102 102 SER CB C 102 64.701 64.701 65.101 -0.400 19439
1979 1 8 . 1 1 102 102 SER H H 102 8.096 8.096 7.976 0.120 19439
1980 1 8 . 1 1 103 103 ASP N N 103 121.639 121.639 124.109 -2.470 19439
1981 1 8 . 1 1 103 103 ASP HA H 103 3.724 3.724 3.901 -0.177 19439
1982 1 8 . 1 1 103 103 ASP CA C 103 57.296 57.296 57.164 0.132 19439
1983 1 8 . 1 1 103 103 ASP CB C 103 38.720 38.720 40.467 -1.746 19439
1984 1 8 . 1 1 103 103 ASP H H 103 8.669 8.669 8.746 -0.077 19439
1985 1 8 . 1 1 104 104 LYS N N 104 116.276 116.276 118.982 -2.706 19439
1986 1 8 . 1 1 104 104 LYS HA H 104 3.678 3.678 4.001 -0.323 19439
1987 1 8 . 1 1 104 104 LYS CA C 104 59.833 59.833 58.830 1.003 19439
1988 1 8 . 1 1 104 104 LYS CB C 104 32.090 32.090 32.200 -0.110 19439
1989 1 8 . 1 1 104 104 LYS H H 104 7.775 7.775 7.627 0.148 19439
1990 1 8 . 1 1 105 105 ALA N N 105 122.257 122.257 122.707 -0.450 19439
1991 1 8 . 1 1 105 105 ALA HA H 105 3.873 3.873 4.073 -0.200 19439
1992 1 8 . 1 1 105 105 ALA CA C 105 55.008 55.008 54.766 0.242 19439
1993 1 8 . 1 1 105 105 ALA CB C 105 17.741 17.741 18.126 -0.385 19439
1994 1 8 . 1 1 105 105 ALA H H 105 7.266 7.266 7.602 -0.336 19439
1995 1 8 . 1 1 106 106 ILE N N 106 119.452 119.452 119.858 -0.406 19439
1996 1 8 . 1 1 106 106 ILE HA H 106 3.419 3.419 3.808 -0.389 19439
1997 1 8 . 1 1 106 106 ILE CA C 106 65.971 65.971 64.431 1.540 19439
1998 1 8 . 1 1 106 106 ILE CB C 106 37.430 37.430 37.597 -0.167 19439
1999 1 8 . 1 1 106 106 ILE H H 106 7.974 7.974 7.725 0.249 19439
2000 1 8 . 1 1 107 107 PHE N N 107 117.814 117.814 118.657 -0.843 19439
2001 1 8 . 1 1 107 107 PHE HA H 107 4.368 4.368 4.821 -0.453 19439
2002 1 8 . 1 1 107 107 PHE CA C 107 56.844 56.844 58.111 -1.267 19439
2003 1 8 . 1 1 107 107 PHE CB C 107 37.150 37.150 37.612 -0.462 19439
2004 1 8 . 1 1 107 107 PHE H H 107 8.434 8.434 8.090 0.344 19439
2005 1 8 . 1 1 108 108 ARG N N 108 117.368 117.368 120.240 -2.872 19439
2006 1 8 . 1 1 108 108 ARG HA H 108 3.994 3.994 4.246 -0.252 19439
2007 1 8 . 1 1 108 108 ARG CA C 108 58.682 58.682 58.103 0.579 19439
2008 1 8 . 1 1 108 108 ARG CB C 108 30.287 30.287 30.116 0.171 19439
2009 1 8 . 1 1 108 108 ARG H H 108 7.474 7.474 8.137 -0.663 19439
2010 1 8 . 1 1 109 109 ARG N N 109 117.440 117.440 117.950 -0.510 19439
2011 1 8 . 1 1 109 109 ARG HA H 109 3.900 3.900 4.052 -0.152 19439
2012 1 8 . 1 1 109 109 ARG CA C 109 57.312 57.312 57.920 -0.608 19439
2013 1 8 . 1 1 109 109 ARG CB C 109 31.626 31.626 31.238 0.388 19439
2014 1 8 . 1 1 109 109 ARG H H 109 7.118 7.118 7.728 -0.610 19439
2015 1 8 . 1 1 110 110 TYR N N 110 116.060 116.060 118.054 -1.994 19439
2016 1 8 . 1 1 110 110 TYR HA H 110 5.265 5.265 5.153 0.112 19439
2017 1 8 . 1 1 110 110 TYR CA C 110 54.188 54.188 54.240 -0.052 19439
2018 1 8 . 1 1 110 110 TYR CB C 110 38.484 38.484 38.427 0.057 19439
2019 1 8 . 1 1 110 110 TYR H H 110 8.707 8.707 8.241 0.466 19439
2020 1 8 . 1 1 111 111 PRO HA H 111 4.388 4.388 4.749 -0.361 19439
2021 1 8 . 1 1 111 111 PRO CA C 111 64.847 64.847 64.238 0.609 19439
2022 1 8 . 1 1 111 111 PRO CB C 111 31.381 31.381 32.180 -0.799 19439
2023 1 8 . 1 1 112 112 HIS N N 112 115.542 115.542 114.701 0.841 19439
2024 1 8 . 1 1 112 112 HIS HA H 112 4.482 4.482 4.559 -0.077 19439
2025 1 8 . 1 1 112 112 HIS CA C 112 58.498 58.498 56.961 1.537 19439
2026 1 8 . 1 1 112 112 HIS CB C 112 29.654 29.654 28.432 1.222 19439
2027 1 8 . 1 1 112 112 HIS H H 112 8.196 8.196 8.419 -0.223 19439
2028 1 8 . 1 1 113 113 LEU N N 113 120.583 120.583 119.113 1.470 19439
2029 1 8 . 1 1 113 113 LEU HA H 113 4.165 4.165 4.345 -0.180 19439
2030 1 8 . 1 1 113 113 LEU CA C 113 54.013 54.013 55.344 -1.331 19439
2031 1 8 . 1 1 113 113 LEU CB C 113 41.669 41.669 41.907 -0.238 19439
2032 1 8 . 1 1 113 113 LEU H H 113 7.527 7.527 7.550 -0.023 19439
2033 1 9 . 1 1 59 59 ALA N N 59 123.310 123.310 122.530 0.780 19439
2034 1 9 . 1 1 59 59 ALA HA H 59 4.232 4.232 3.963 0.269 19439
2035 1 9 . 1 1 59 59 ALA CA C 59 52.274 52.274 52.233 0.041 19439
2036 1 9 . 1 1 59 59 ALA CB C 59 19.623 19.623 18.508 1.115 19439
2037 1 9 . 1 1 59 59 ALA H H 59 7.894 7.894 8.304 -0.410 19439
2038 1 9 . 1 1 60 60 LEU N N 60 120.936 120.936 119.509 1.427 19439
2039 1 9 . 1 1 60 60 LEU HA H 60 4.364 4.364 4.066 0.298 19439
2040 1 9 . 1 1 60 60 LEU CA C 60 54.130 54.130 56.679 -2.549 19439
2041 1 9 . 1 1 60 60 LEU CB C 60 43.209 43.209 42.091 1.118 19439
2042 1 9 . 1 1 60 60 LEU H H 60 8.046 8.046 8.094 -0.048 19439
2043 1 9 . 1 1 61 61 ALA N N 61 125.460 125.460 116.275 9.185 19439
2044 1 9 . 1 1 61 61 ALA HA H 61 4.364 4.364 4.770 -0.406 19439
2045 1 9 . 1 1 61 61 ALA CA C 61 51.176 51.176 50.887 0.289 19439
2046 1 9 . 1 1 61 61 ALA CB C 61 20.172 20.172 21.325 -1.153 19439
2047 1 9 . 1 1 61 61 ALA H H 61 8.338 8.338 7.436 0.902 19439
2048 1 9 . 1 1 62 62 ALA N N 62 127.765 127.765 123.647 4.118 19439
2049 1 9 . 1 1 62 62 ALA HA H 62 4.394 4.394 4.830 -0.436 19439
2050 1 9 . 1 1 62 62 ALA CA C 62 51.888 51.888 50.333 1.555 19439
2051 1 9 . 1 1 62 62 ALA CB C 62 18.806 18.806 21.130 -2.324 19439
2052 1 9 . 1 1 62 62 ALA H H 62 8.487 8.487 9.043 -0.556 19439
2053 1 9 . 1 1 63 63 LEU N N 63 120.199 120.199 120.671 -0.472 19439
2054 1 9 . 1 1 63 63 LEU HA H 63 4.828 4.828 4.961 -0.133 19439
2055 1 9 . 1 1 63 63 LEU CA C 63 51.852 51.852 53.031 -1.179 19439
2056 1 9 . 1 1 63 63 LEU CB C 63 44.081 44.081 45.482 -1.401 19439
2057 1 9 . 1 1 63 63 LEU H H 63 7.927 7.927 8.317 -0.390 19439
2058 1 9 . 1 1 64 64 HIS N N 64 122.277 122.277 119.237 3.040 19439
2059 1 9 . 1 1 64 64 HIS HA H 64 4.114 4.114 4.568 -0.454 19439
2060 1 9 . 1 1 64 64 HIS CA C 64 58.038 58.038 57.016 1.022 19439
2061 1 9 . 1 1 64 64 HIS CB C 64 31.228 31.228 31.458 -0.230 19439
2062 1 9 . 1 1 64 64 HIS H H 64 8.477 8.477 8.826 -0.349 19439
2063 1 9 . 1 1 65 65 ALA HA H 65 4.339 4.339 4.458 -0.119 19439
2064 1 9 . 1 1 65 65 ALA CA C 65 53.281 53.281 52.489 0.792 19439
2065 1 9 . 1 1 65 65 ALA CB C 65 20.276 20.276 19.949 0.327 19439
2066 1 9 . 1 1 66 66 GLU N N 66 113.868 113.868 117.334 -3.466 19439
2067 1 9 . 1 1 66 66 GLU HA H 66 4.619 4.619 4.514 0.105 19439
2068 1 9 . 1 1 66 66 GLU CA C 66 54.727 54.727 55.042 -0.315 19439
2069 1 9 . 1 1 66 66 GLU CB C 66 32.894 32.894 32.805 0.089 19439
2070 1 9 . 1 1 66 66 GLU H H 66 7.759 7.759 8.007 -0.248 19439
2071 1 9 . 1 1 68 68 PRO HA H 68 4.219 4.219 4.292 -0.073 19439
2072 1 9 . 1 1 68 68 PRO CA C 68 64.664 64.664 65.029 -0.366 19439
2073 1 9 . 1 1 68 68 PRO CB C 68 32.066 32.066 31.689 0.377 19439
2074 1 9 . 1 1 69 69 LEU N N 69 117.262 117.262 118.504 -1.242 19439
2075 1 9 . 1 1 69 69 LEU HA H 69 4.182 4.182 4.230 -0.048 19439
2076 1 9 . 1 1 69 69 LEU CA C 69 52.430 52.430 53.683 -1.253 19439
2077 1 9 . 1 1 69 69 LEU CB C 69 40.907 40.907 41.514 -0.607 19439
2078 1 9 . 1 1 69 69 LEU H H 69 8.439 8.439 7.962 0.477 19439
2079 1 9 . 1 1 70 70 ALA N N 70 120.426 120.426 121.102 -0.676 19439
2080 1 9 . 1 1 70 70 ALA HA H 70 3.411 3.411 4.218 -0.807 19439
2081 1 9 . 1 1 70 70 ALA CA C 70 53.685 53.685 53.492 0.193 19439
2082 1 9 . 1 1 70 70 ALA CB C 70 17.914 17.914 18.648 -0.734 19439
2083 1 9 . 1 1 70 70 ALA H H 70 7.113 7.113 7.432 -0.319 19439
2084 1 9 . 1 1 71 71 GLY N N 71 108.911 108.911 112.698 -3.787 19439
2085 1 9 . 1 1 71 71 GLY CA C 71 45.215 45.215 45.045 0.170 19439
2086 1 9 . 1 1 71 71 GLY H H 71 8.856 8.856 8.792 0.064 19439
2087 1 9 . 1 1 72 72 LEU N N 72 120.000 120.000 121.645 -1.645 19439
2088 1 9 . 1 1 72 72 LEU HA H 72 4.769 4.769 4.933 -0.164 19439
2089 1 9 . 1 1 72 72 LEU CA C 72 51.972 51.972 51.563 0.409 19439
2090 1 9 . 1 1 72 72 LEU CB C 72 41.255 41.255 42.849 -1.594 19439
2091 1 9 . 1 1 72 72 LEU H H 72 8.136 8.136 8.037 0.099 19439
2092 1 9 . 1 1 73 73 PRO HA H 73 4.739 4.739 4.642 0.097 19439
2093 1 9 . 1 1 73 73 PRO CA C 73 61.456 61.456 62.822 -1.366 19439
2094 1 9 . 1 1 73 73 PRO CB C 73 31.245 31.245 31.936 -0.691 19439
2095 1 9 . 1 1 74 74 VAL N N 74 121.723 121.723 120.445 1.278 19439
2096 1 9 . 1 1 74 74 VAL HA H 74 3.446 3.446 3.712 -0.266 19439
2097 1 9 . 1 1 74 74 VAL CA C 74 65.744 65.744 64.032 1.712 19439
2098 1 9 . 1 1 74 74 VAL CB C 74 31.236 31.236 31.893 -0.657 19439
2099 1 9 . 1 1 74 74 VAL H H 74 7.710 7.710 8.128 -0.418 19439
2100 1 9 . 1 1 75 75 THR N N 75 108.893 108.893 109.379 -0.486 19439
2101 1 9 . 1 1 75 75 THR HA H 75 4.937 4.937 4.519 0.418 19439
2102 1 9 . 1 1 75 75 THR CA C 75 59.892 59.892 59.573 0.319 19439
2103 1 9 . 1 1 75 75 THR CB C 75 12.018 12.018 71.914 -59.896 19439
2104 1 9 . 1 1 75 75 THR H H 75 8.710 8.710 8.012 0.698 19439
2105 1 9 . 1 1 76 76 ARG HA H 76 3.873 3.873 4.046 -0.173 19439
2106 1 9 . 1 1 76 76 ARG H H 76 8.447 8.447 8.862 -0.415 19439
2107 1 9 . 1 1 77 77 SER N N 77 114.482 114.482 115.374 -0.892 19439
2108 1 9 . 1 1 77 77 SER HA H 77 4.061 4.061 4.186 -0.124 19439
2109 1 9 . 1 1 77 77 SER CA C 77 60.467 60.467 61.502 -1.035 19439
2110 1 9 . 1 1 77 77 SER CB C 77 62.449 62.449 62.661 -0.212 19439
2111 1 9 . 1 1 77 77 SER H H 77 8.105 8.105 7.882 0.223 19439
2112 1 9 . 1 1 78 78 ASP N N 78 120.538 120.538 122.720 -2.182 19439
2113 1 9 . 1 1 78 78 ASP HA H 78 4.333 4.333 4.358 -0.025 19439
2114 1 9 . 1 1 78 78 ASP CA C 78 58.020 58.020 57.239 0.781 19439
2115 1 9 . 1 1 78 78 ASP CB C 78 43.252 43.252 40.319 2.933 19439
2116 1 9 . 1 1 78 78 ASP H H 78 7.300 7.300 7.959 -0.659 19439
2117 1 9 . 1 1 79 79 ALA N N 79 120.614 120.614 122.886 -2.272 19439
2118 1 9 . 1 1 79 79 ALA HA H 79 3.672 3.672 3.861 -0.189 19439
2119 1 9 . 1 1 79 79 ALA CA C 79 54.886 54.886 55.164 -0.279 19439
2120 1 9 . 1 1 79 79 ALA CB C 79 19.628 19.628 18.278 1.350 19439
2121 1 9 . 1 1 79 79 ALA H H 79 7.767 7.767 8.235 -0.468 19439
2122 1 9 . 1 1 80 80 ARG N N 80 116.203 116.203 119.226 -3.023 19439
2123 1 9 . 1 1 80 80 ARG HA H 80 3.732 3.732 4.002 -0.270 19439
2124 1 9 . 1 1 80 80 ARG CA C 80 61.441 61.441 59.578 1.863 19439
2125 1 9 . 1 1 80 80 ARG CB C 80 30.266 30.266 30.384 -0.118 19439
2126 1 9 . 1 1 80 80 ARG H H 80 7.981 7.981 8.213 -0.232 19439
2127 1 9 . 1 1 81 81 VAL N N 81 119.192 119.192 119.419 -0.227 19439
2128 1 9 . 1 1 81 81 VAL HA H 81 3.582 3.582 4.011 -0.429 19439
2129 1 9 . 1 1 81 81 VAL CA C 81 66.909 66.909 66.361 0.548 19439
2130 1 9 . 1 1 81 81 VAL CB C 81 31.668 31.668 31.701 -0.033 19439
2131 1 9 . 1 1 81 81 VAL H H 81 7.338 7.338 8.060 -0.722 19439
2132 1 9 . 1 1 82 82 LEU N N 82 118.722 118.722 121.612 -2.890 19439
2133 1 9 . 1 1 82 82 LEU HA H 82 4.044 4.044 3.872 0.172 19439
2134 1 9 . 1 1 82 82 LEU CA C 82 58.356 58.356 58.797 -0.441 19439
2135 1 9 . 1 1 82 82 LEU CB C 82 41.627 41.627 41.617 0.010 19439
2136 1 9 . 1 1 82 82 LEU H H 82 7.599 7.599 8.434 -0.835 19439
2137 1 9 . 1 1 83 83 ILE N N 83 120.893 120.893 119.398 1.495 19439
2138 1 9 . 1 1 83 83 ILE HA H 83 3.642 3.642 3.700 -0.058 19439
2139 1 9 . 1 1 83 83 ILE CA C 83 65.669 65.669 65.632 0.037 19439
2140 1 9 . 1 1 83 83 ILE CB C 83 38.579 38.579 37.950 0.629 19439
2141 1 9 . 1 1 83 83 ILE H H 83 8.546 8.546 8.353 0.193 19439
2142 1 9 . 1 1 84 84 PHE N N 84 123.343 123.343 120.638 2.705 19439
2143 1 9 . 1 1 84 84 PHE HA H 84 4.084 4.084 4.138 -0.054 19439
2144 1 9 . 1 1 84 84 PHE CA C 84 62.593 62.593 60.153 2.440 19439
2145 1 9 . 1 1 84 84 PHE CB C 84 39.211 39.211 38.649 0.562 19439
2146 1 9 . 1 1 84 84 PHE H H 84 8.622 8.622 8.599 0.023 19439
2147 1 9 . 1 1 85 85 ASN N N 85 118.037 118.037 117.931 0.106 19439
2148 1 9 . 1 1 85 85 ASN HA H 85 4.426 4.426 4.228 0.198 19439
2149 1 9 . 1 1 85 85 ASN CA C 85 56.045 56.045 56.149 -0.104 19439
2150 1 9 . 1 1 85 85 ASN CB C 85 37.785 37.785 38.361 -0.576 19439
2151 1 9 . 1 1 85 85 ASN H H 85 8.834 8.834 8.641 0.193 19439
2152 1 9 . 1 1 86 86 GLU N N 86 121.098 121.098 122.435 -1.337 19439
2153 1 9 . 1 1 86 86 GLU HA H 86 4.052 4.052 4.101 -0.049 19439
2154 1 9 . 1 1 86 86 GLU CA C 86 59.328 59.328 59.767 -0.439 19439
2155 1 9 . 1 1 86 86 GLU CB C 86 30.253 30.253 29.369 0.884 19439
2156 1 9 . 1 1 86 86 GLU H H 86 8.105 8.105 8.342 -0.237 19439
2157 1 9 . 1 1 87 87 TRP N N 87 122.584 122.584 121.445 1.139 19439
2158 1 9 . 1 1 87 87 TRP HA H 87 4.006 4.006 4.190 -0.184 19439
2159 1 9 . 1 1 87 87 TRP CA C 87 61.545 61.545 61.237 0.308 19439
2160 1 9 . 1 1 87 87 TRP CB C 87 27.943 27.943 29.596 -1.653 19439
2161 1 9 . 1 1 87 87 TRP H H 87 8.099 8.099 8.520 -0.421 19439
2162 1 9 . 1 1 88 88 GLU N N 88 117.357 117.357 119.334 -1.977 19439
2163 1 9 . 1 1 88 88 GLU HA H 88 2.919 2.919 3.257 -0.338 19439
2164 1 9 . 1 1 88 88 GLU CA C 88 59.804 59.804 59.474 0.330 19439
2165 1 9 . 1 1 88 88 GLU CB C 88 29.546 29.546 29.153 0.393 19439
2166 1 9 . 1 1 88 88 GLU H H 88 8.440 8.440 8.678 -0.238 19439
2167 1 9 . 1 1 89 89 GLU N N 89 116.109 116.109 119.888 -3.779 19439
2168 1 9 . 1 1 89 89 GLU HA H 89 3.995 3.995 3.843 0.152 19439
2169 1 9 . 1 1 89 89 GLU CA C 89 58.329 58.329 59.499 -1.170 19439
2170 1 9 . 1 1 89 89 GLU CB C 89 29.649 29.649 29.526 0.123 19439
2171 1 9 . 1 1 89 89 GLU H H 89 7.244 7.244 8.068 -0.824 19439
2172 1 9 . 1 1 90 90 ARG N N 90 120.512 120.512 118.361 2.151 19439
2173 1 9 . 1 1 90 90 ARG HA H 90 3.920 3.920 3.933 -0.013 19439
2174 1 9 . 1 1 90 90 ARG CA C 90 58.683 58.683 58.908 -0.225 19439
2175 1 9 . 1 1 90 90 ARG CB C 90 30.659 30.659 29.768 0.891 19439
2176 1 9 . 1 1 90 90 ARG H H 90 8.368 8.368 8.093 0.275 19439
2177 1 9 . 1 1 91 91 LYS N N 91 120.024 120.024 119.866 0.158 19439
2178 1 9 . 1 1 91 91 LYS HA H 91 3.964 3.964 3.966 -0.002 19439
2179 1 9 . 1 1 91 91 LYS CA C 91 57.278 57.278 58.510 -1.232 19439
2180 1 9 . 1 1 91 91 LYS CB C 91 30.582 30.582 31.294 -0.712 19439
2181 1 9 . 1 1 91 91 LYS H H 91 8.491 8.491 8.081 0.410 19439
2182 1 9 . 1 1 92 92 LYS N N 92 118.192 118.192 118.394 -0.202 19439
2183 1 9 . 1 1 92 92 LYS HA H 92 3.796 3.796 4.043 -0.247 19439
2184 1 9 . 1 1 92 92 LYS CA C 92 58.976 58.976 58.273 0.703 19439
2185 1 9 . 1 1 92 92 LYS CB C 92 32.188 32.188 31.813 0.375 19439
2186 1 9 . 1 1 92 92 LYS H H 92 6.933 6.933 7.738 -0.805 19439
2187 1 9 . 1 1 93 93 SER N N 93 110.447 110.447 113.449 -3.002 19439
2188 1 9 . 1 1 93 93 SER HA H 93 4.484 4.484 4.329 0.155 19439
2189 1 9 . 1 1 93 93 SER CA C 93 58.386 58.386 60.605 -2.219 19439
2190 1 9 . 1 1 93 93 SER CB C 93 64.173 64.173 64.222 -0.049 19439
2191 1 9 . 1 1 93 93 SER H H 93 7.282 7.282 7.732 -0.450 19439
2192 1 9 . 1 1 94 94 ASP N N 94 120.163 120.163 119.304 0.859 19439
2193 1 9 . 1 1 94 94 ASP HA H 94 4.872 4.872 5.030 -0.158 19439
2194 1 9 . 1 1 94 94 ASP CA C 94 51.157 51.157 52.784 -1.627 19439
2195 1 9 . 1 1 94 94 ASP CB C 94 41.256 41.256 43.254 -1.998 19439
2196 1 9 . 1 1 94 94 ASP H H 94 7.303 7.303 8.183 -0.880 19439
2197 1 9 . 1 1 95 95 PRO CA C 95 63.871 63.871 64.159 -0.288 19439
2198 1 9 . 1 1 95 95 PRO CB C 95 31.497 31.497 32.452 -0.955 19439
2199 1 9 . 1 1 96 96 TRP N N 96 117.486 117.486 118.474 -0.988 19439
2200 1 9 . 1 1 96 96 TRP HA H 96 4.637 4.637 4.559 0.078 19439
2201 1 9 . 1 1 96 96 TRP CA C 96 56.061 56.061 56.027 0.034 19439
2202 1 9 . 1 1 96 96 TRP CB C 96 28.605 28.605 28.304 0.301 19439
2203 1 9 . 1 1 96 96 TRP H H 96 7.484 7.484 8.085 -0.601 19439
2204 1 9 . 1 1 97 97 LEU N N 97 123.510 123.510 121.750 1.760 19439
2205 1 9 . 1 1 97 97 LEU HA H 97 4.098 4.098 3.329 0.769 19439
2206 1 9 . 1 1 97 97 LEU CA C 97 56.024 56.024 54.362 1.661 19439
2207 1 9 . 1 1 97 97 LEU CB C 97 42.893 42.893 42.532 0.360 19439
2208 1 9 . 1 1 97 97 LEU H H 97 7.137 7.137 6.826 0.311 19439
2209 1 9 . 1 1 98 98 ARG N N 98 129.724 129.724 123.686 6.038 19439
2210 1 9 . 1 1 98 98 ARG HA H 98 4.486 4.486 4.736 -0.250 19439
2211 1 9 . 1 1 98 98 ARG CA C 98 55.622 55.622 54.428 1.194 19439
2212 1 9 . 1 1 98 98 ARG CB C 98 31.229 31.229 32.146 -0.917 19439
2213 1 9 . 1 1 98 98 ARG H H 98 8.825 8.825 8.280 0.545 19439
2214 1 9 . 1 1 99 99 LEU N N 99 127.814 127.814 123.758 4.056 19439
2215 1 9 . 1 1 99 99 LEU HA H 99 3.586 3.586 4.165 -0.579 19439
2216 1 9 . 1 1 99 99 LEU CA C 99 54.352 54.352 54.412 -0.060 19439
2217 1 9 . 1 1 99 99 LEU CB C 99 40.485 40.485 41.491 -1.006 19439
2218 1 9 . 1 1 99 99 LEU H H 99 8.236 8.236 8.028 0.208 19439
2219 1 9 . 1 1 100 100 ASP N N 100 126.633 126.633 128.609 -1.976 19439
2220 1 9 . 1 1 100 100 ASP HA H 100 4.646 4.646 4.792 -0.146 19439
2221 1 9 . 1 1 100 100 ASP CA C 100 52.894 52.894 54.030 -1.136 19439
2222 1 9 . 1 1 100 100 ASP CB C 100 41.224 41.224 42.789 -1.565 19439
2223 1 9 . 1 1 100 100 ASP H H 100 8.018 8.018 8.672 -0.654 19439
2224 1 9 . 1 1 101 101 MET N N 101 122.473 122.473 119.484 2.989 19439
2225 1 9 . 1 1 101 101 MET HA H 101 4.481 4.481 4.603 -0.122 19439
2226 1 9 . 1 1 101 101 MET CA C 101 53.398 53.398 54.310 -0.912 19439
2227 1 9 . 1 1 101 101 MET CB C 101 33.296 33.296 32.862 0.434 19439
2228 1 9 . 1 1 101 101 MET H H 101 8.639 8.639 7.898 0.741 19439
2229 1 9 . 1 1 102 102 SER N N 102 116.243 116.243 116.476 -0.233 19439
2230 1 9 . 1 1 102 102 SER HA H 102 4.114 4.114 4.338 -0.224 19439
2231 1 9 . 1 1 102 102 SER CA C 102 58.709 58.709 58.074 0.635 19439
2232 1 9 . 1 1 102 102 SER CB C 102 64.701 64.701 64.724 -0.023 19439
2233 1 9 . 1 1 102 102 SER H H 102 8.096 8.096 7.932 0.164 19439
2234 1 9 . 1 1 103 103 ASP N N 103 121.639 121.639 122.754 -1.115 19439
2235 1 9 . 1 1 103 103 ASP HA H 103 3.724 3.724 3.840 -0.116 19439
2236 1 9 . 1 1 103 103 ASP CA C 103 57.296 57.296 57.961 -0.664 19439
2237 1 9 . 1 1 103 103 ASP CB C 103 38.720 38.720 40.409 -1.689 19439
2238 1 9 . 1 1 103 103 ASP H H 103 8.669 8.669 8.712 -0.043 19439
2239 1 9 . 1 1 104 104 LYS N N 104 116.276 116.276 119.025 -2.749 19439
2240 1 9 . 1 1 104 104 LYS HA H 104 3.678 3.678 4.037 -0.359 19439
2241 1 9 . 1 1 104 104 LYS CA C 104 59.833 59.833 58.988 0.845 19439
2242 1 9 . 1 1 104 104 LYS CB C 104 32.090 32.090 32.311 -0.221 19439
2243 1 9 . 1 1 104 104 LYS H H 104 7.775 7.775 8.127 -0.352 19439
2244 1 9 . 1 1 105 105 ALA N N 105 122.257 122.257 121.913 0.344 19439
2245 1 9 . 1 1 105 105 ALA HA H 105 3.873 3.873 4.034 -0.161 19439
2246 1 9 . 1 1 105 105 ALA CA C 105 55.008 55.008 54.931 0.077 19439
2247 1 9 . 1 1 105 105 ALA CB C 105 17.741 17.741 18.167 -0.426 19439
2248 1 9 . 1 1 105 105 ALA H H 105 7.266 7.266 7.541 -0.275 19439
2249 1 9 . 1 1 106 106 ILE N N 106 119.452 119.452 119.573 -0.121 19439
2250 1 9 . 1 1 106 106 ILE HA H 106 3.419 3.419 3.833 -0.414 19439
2251 1 9 . 1 1 106 106 ILE CA C 106 65.971 65.971 64.430 1.541 19439
2252 1 9 . 1 1 106 106 ILE CB C 106 37.430 37.430 37.628 -0.198 19439
2253 1 9 . 1 1 106 106 ILE H H 106 7.974 7.974 7.909 0.065 19439
2254 1 9 . 1 1 107 107 PHE N N 107 117.814 117.814 119.042 -1.228 19439
2255 1 9 . 1 1 107 107 PHE HA H 107 4.368 4.368 4.724 -0.356 19439
2256 1 9 . 1 1 107 107 PHE CA C 107 56.844 56.844 58.601 -1.757 19439
2257 1 9 . 1 1 107 107 PHE CB C 107 37.150 37.150 37.611 -0.461 19439
2258 1 9 . 1 1 107 107 PHE H H 107 8.434 8.434 7.985 0.449 19439
2259 1 9 . 1 1 108 108 ARG N N 108 117.368 117.368 119.140 -1.772 19439
2260 1 9 . 1 1 108 108 ARG HA H 108 3.994 3.994 4.205 -0.211 19439
2261 1 9 . 1 1 108 108 ARG CA C 108 58.682 58.682 58.234 0.448 19439
2262 1 9 . 1 1 108 108 ARG CB C 108 30.287 30.287 29.784 0.503 19439
2263 1 9 . 1 1 108 108 ARG H H 108 7.474 7.474 8.479 -1.005 19439
2264 1 9 . 1 1 109 109 ARG N N 109 117.440 117.440 117.092 0.348 19439
2265 1 9 . 1 1 109 109 ARG HA H 109 3.900 3.900 3.963 -0.063 19439
2266 1 9 . 1 1 109 109 ARG CA C 109 57.312 57.312 58.195 -0.883 19439
2267 1 9 . 1 1 109 109 ARG CB C 109 31.626 31.626 30.809 0.817 19439
2268 1 9 . 1 1 109 109 ARG H H 109 7.118 7.118 7.638 -0.520 19439
2269 1 9 . 1 1 110 110 TYR N N 110 116.060 116.060 116.320 -0.260 19439
2270 1 9 . 1 1 110 110 TYR HA H 110 5.265 5.265 5.164 0.101 19439
2271 1 9 . 1 1 110 110 TYR CA C 110 54.188 54.188 54.687 -0.499 19439
2272 1 9 . 1 1 110 110 TYR CB C 110 38.484 38.484 38.416 0.068 19439
2273 1 9 . 1 1 110 110 TYR H H 110 8.707 8.707 8.125 0.582 19439
2274 1 9 . 1 1 111 111 PRO HA H 111 4.388 4.388 4.702 -0.314 19439
2275 1 9 . 1 1 111 111 PRO CA C 111 64.847 64.847 64.337 0.510 19439
2276 1 9 . 1 1 111 111 PRO CB C 111 31.381 31.381 32.047 -0.666 19439
2277 1 9 . 1 1 112 112 HIS N N 112 115.542 115.542 112.823 2.719 19439
2278 1 9 . 1 1 112 112 HIS HA H 112 4.482 4.482 4.526 -0.044 19439
2279 1 9 . 1 1 112 112 HIS CA C 112 58.498 58.498 56.916 1.582 19439
2280 1 9 . 1 1 112 112 HIS CB C 112 29.654 29.654 28.627 1.028 19439
2281 1 9 . 1 1 112 112 HIS H H 112 8.196 8.196 8.369 -0.173 19439
2282 1 9 . 1 1 113 113 LEU N N 113 120.583 120.583 120.090 0.493 19439
2283 1 9 . 1 1 113 113 LEU HA H 113 4.165 4.165 4.300 -0.135 19439
2284 1 9 . 1 1 113 113 LEU CA C 113 54.013 54.013 55.252 -1.239 19439
2285 1 9 . 1 1 113 113 LEU CB C 113 41.669 41.669 41.807 -0.138 19439
2286 1 9 . 1 1 113 113 LEU H H 113 7.527 7.527 7.487 0.040 19439
2287 1 10 . 1 1 59 59 ALA N N 59 123.310 123.310 123.806 -0.496 19439
2288 1 10 . 1 1 59 59 ALA HA H 59 4.232 4.232 4.401 -0.169 19439
2289 1 10 . 1 1 59 59 ALA CA C 59 52.274 52.274 52.128 0.146 19439
2290 1 10 . 1 1 59 59 ALA CB C 59 19.623 19.623 19.052 0.571 19439
2291 1 10 . 1 1 59 59 ALA H H 59 7.894 7.894 8.355 -0.461 19439
2292 1 10 . 1 1 60 60 LEU N N 60 120.936 120.936 117.873 3.063 19439
2293 1 10 . 1 1 60 60 LEU HA H 60 4.364 4.364 3.912 0.452 19439
2294 1 10 . 1 1 60 60 LEU CA C 60 54.130 54.130 55.586 -1.456 19439
2295 1 10 . 1 1 60 60 LEU CB C 60 43.209 43.209 41.992 1.217 19439
2296 1 10 . 1 1 60 60 LEU H H 60 8.046 8.046 7.462 0.584 19439
2297 1 10 . 1 1 61 61 ALA N N 61 125.460 125.460 123.537 1.923 19439
2298 1 10 . 1 1 61 61 ALA HA H 61 4.364 4.364 4.322 0.042 19439
2299 1 10 . 1 1 61 61 ALA CA C 61 51.176 51.176 52.198 -1.022 19439
2300 1 10 . 1 1 61 61 ALA CB C 61 20.172 20.172 19.445 0.727 19439
2301 1 10 . 1 1 61 61 ALA H H 61 8.338 8.338 8.280 0.058 19439
2302 1 10 . 1 1 62 62 ALA N N 62 127.765 127.765 126.664 1.101 19439
2303 1 10 . 1 1 62 62 ALA HA H 62 4.394 4.394 4.664 -0.270 19439
2304 1 10 . 1 1 62 62 ALA CA C 62 51.888 51.888 50.788 1.100 19439
2305 1 10 . 1 1 62 62 ALA CB C 62 18.806 18.806 21.127 -2.321 19439
2306 1 10 . 1 1 62 62 ALA H H 62 8.487 8.487 8.957 -0.470 19439
2307 1 10 . 1 1 63 63 LEU N N 63 120.199 120.199 120.260 -0.061 19439
2308 1 10 . 1 1 63 63 LEU HA H 63 4.828 4.828 4.936 -0.108 19439
2309 1 10 . 1 1 63 63 LEU CA C 63 51.852 51.852 53.061 -1.209 19439
2310 1 10 . 1 1 63 63 LEU CB C 63 44.081 44.081 45.718 -1.637 19439
2311 1 10 . 1 1 63 63 LEU H H 63 7.927 7.927 8.251 -0.324 19439
2312 1 10 . 1 1 64 64 HIS N N 64 122.277 122.277 119.254 3.023 19439
2313 1 10 . 1 1 64 64 HIS HA H 64 4.114 4.114 4.594 -0.480 19439
2314 1 10 . 1 1 64 64 HIS CA C 64 58.038 58.038 56.906 1.132 19439
2315 1 10 . 1 1 64 64 HIS CB C 64 31.228 31.228 31.541 -0.313 19439
2316 1 10 . 1 1 64 64 HIS H H 64 8.477 8.477 8.876 -0.399 19439
2317 1 10 . 1 1 65 65 ALA HA H 65 4.339 4.339 4.467 -0.128 19439
2318 1 10 . 1 1 65 65 ALA CA C 65 53.281 53.281 52.418 0.863 19439
2319 1 10 . 1 1 65 65 ALA CB C 65 20.276 20.276 19.994 0.282 19439
2320 1 10 . 1 1 66 66 GLU N N 66 113.868 113.868 117.495 -3.627 19439
2321 1 10 . 1 1 66 66 GLU HA H 66 4.619 4.619 4.514 0.105 19439
2322 1 10 . 1 1 66 66 GLU CA C 66 54.727 54.727 55.017 -0.290 19439
2323 1 10 . 1 1 66 66 GLU CB C 66 32.894 32.894 32.810 0.084 19439
2324 1 10 . 1 1 66 66 GLU H H 66 7.759 7.759 7.996 -0.237 19439
2325 1 10 . 1 1 68 68 PRO HA H 68 4.219 4.219 4.282 -0.063 19439
2326 1 10 . 1 1 68 68 PRO CA C 68 64.664 64.664 65.024 -0.360 19439
2327 1 10 . 1 1 68 68 PRO CB C 68 32.066 32.066 31.680 0.386 19439
2328 1 10 . 1 1 69 69 LEU N N 69 117.262 117.262 118.267 -1.005 19439
2329 1 10 . 1 1 69 69 LEU HA H 69 4.182 4.182 4.190 -0.008 19439
2330 1 10 . 1 1 69 69 LEU CA C 69 52.430 52.430 53.515 -1.085 19439
2331 1 10 . 1 1 69 69 LEU CB C 69 40.907 40.907 41.239 -0.332 19439
2332 1 10 . 1 1 69 69 LEU H H 69 8.439 8.439 7.933 0.506 19439
2333 1 10 . 1 1 70 70 ALA N N 70 120.426 120.426 121.069 -0.643 19439
2334 1 10 . 1 1 70 70 ALA HA H 70 3.411 3.411 4.202 -0.791 19439
2335 1 10 . 1 1 70 70 ALA CA C 70 53.685 53.685 53.489 0.196 19439
2336 1 10 . 1 1 70 70 ALA CB C 70 17.914 17.914 18.620 -0.706 19439
2337 1 10 . 1 1 70 70 ALA H H 70 7.113 7.113 7.424 -0.311 19439
2338 1 10 . 1 1 71 71 GLY N N 71 108.911 108.911 113.889 -4.978 19439
2339 1 10 . 1 1 71 71 GLY CA C 71 45.215 45.215 45.113 0.102 19439
2340 1 10 . 1 1 71 71 GLY H H 71 8.856 8.856 8.883 -0.027 19439
2341 1 10 . 1 1 72 72 LEU N N 72 120.000 120.000 120.799 -0.799 19439
2342 1 10 . 1 1 72 72 LEU HA H 72 4.769 4.769 4.997 -0.228 19439
2343 1 10 . 1 1 72 72 LEU CA C 72 51.972 51.972 51.602 0.370 19439
2344 1 10 . 1 1 72 72 LEU CB C 72 41.255 41.255 42.931 -1.675 19439
2345 1 10 . 1 1 72 72 LEU H H 72 8.136 8.136 7.942 0.194 19439
2346 1 10 . 1 1 73 73 PRO HA H 73 4.739 4.739 4.641 0.098 19439
2347 1 10 . 1 1 73 73 PRO CA C 73 61.456 61.456 62.877 -1.421 19439
2348 1 10 . 1 1 73 73 PRO CB C 73 31.245 31.245 31.968 -0.723 19439
2349 1 10 . 1 1 74 74 VAL N N 74 121.723 121.723 119.880 1.843 19439
2350 1 10 . 1 1 74 74 VAL HA H 74 3.446 3.446 3.804 -0.358 19439
2351 1 10 . 1 1 74 74 VAL CA C 74 65.744 65.744 63.740 2.004 19439
2352 1 10 . 1 1 74 74 VAL CB C 74 31.236 31.236 31.988 -0.752 19439
2353 1 10 . 1 1 74 74 VAL H H 74 7.710 7.710 8.121 -0.411 19439
2354 1 10 . 1 1 75 75 THR N N 75 108.893 108.893 109.842 -0.949 19439
2355 1 10 . 1 1 75 75 THR HA H 75 4.937 4.937 4.616 0.321 19439
2356 1 10 . 1 1 75 75 THR CA C 75 59.892 59.892 59.668 0.224 19439
2357 1 10 . 1 1 75 75 THR CB C 75 12.018 12.018 72.039 -60.021 19439
2358 1 10 . 1 1 75 75 THR H H 75 8.710 8.710 8.040 0.670 19439
2359 1 10 . 1 1 76 76 ARG HA H 76 3.873 3.873 4.054 -0.181 19439
2360 1 10 . 1 1 76 76 ARG H H 76 8.447 8.447 8.737 -0.290 19439
2361 1 10 . 1 1 77 77 SER N N 77 114.482 114.482 115.936 -1.454 19439
2362 1 10 . 1 1 77 77 SER HA H 77 4.061 4.061 4.139 -0.078 19439
2363 1 10 . 1 1 77 77 SER CA C 77 60.467 60.467 61.562 -1.095 19439
2364 1 10 . 1 1 77 77 SER CB C 77 62.449 62.449 62.501 -0.052 19439
2365 1 10 . 1 1 77 77 SER H H 77 8.105 8.105 8.040 0.065 19439
2366 1 10 . 1 1 78 78 ASP N N 78 120.538 120.538 122.453 -1.915 19439
2367 1 10 . 1 1 78 78 ASP HA H 78 4.333 4.333 4.340 -0.007 19439
2368 1 10 . 1 1 78 78 ASP CA C 78 58.020 58.020 57.195 0.825 19439
2369 1 10 . 1 1 78 78 ASP CB C 78 43.252 43.252 40.303 2.949 19439
2370 1 10 . 1 1 78 78 ASP H H 78 7.300 7.300 8.070 -0.770 19439
2371 1 10 . 1 1 79 79 ALA N N 79 120.614 120.614 122.740 -2.126 19439
2372 1 10 . 1 1 79 79 ALA HA H 79 3.672 3.672 3.761 -0.089 19439
2373 1 10 . 1 1 79 79 ALA CA C 79 54.886 54.886 55.141 -0.255 19439
2374 1 10 . 1 1 79 79 ALA CB C 79 19.628 19.628 18.263 1.365 19439
2375 1 10 . 1 1 79 79 ALA H H 79 7.767 7.767 8.167 -0.400 19439
2376 1 10 . 1 1 80 80 ARG N N 80 116.203 116.203 119.044 -2.841 19439
2377 1 10 . 1 1 80 80 ARG HA H 80 3.732 3.732 3.997 -0.265 19439
2378 1 10 . 1 1 80 80 ARG CA C 80 61.441 61.441 59.386 2.055 19439
2379 1 10 . 1 1 80 80 ARG CB C 80 30.266 30.266 30.330 -0.064 19439
2380 1 10 . 1 1 80 80 ARG H H 80 7.981 7.981 8.151 -0.170 19439
2381 1 10 . 1 1 81 81 VAL N N 81 119.192 119.192 120.054 -0.862 19439
2382 1 10 . 1 1 81 81 VAL HA H 81 3.582 3.582 3.904 -0.322 19439
2383 1 10 . 1 1 81 81 VAL CA C 81 66.909 66.909 66.907 0.002 19439
2384 1 10 . 1 1 81 81 VAL CB C 81 31.668 31.668 31.819 -0.151 19439
2385 1 10 . 1 1 81 81 VAL H H 81 7.338 7.338 8.188 -0.850 19439
2386 1 10 . 1 1 82 82 LEU N N 82 118.722 118.722 121.301 -2.579 19439
2387 1 10 . 1 1 82 82 LEU HA H 82 4.044 4.044 3.906 0.138 19439
2388 1 10 . 1 1 82 82 LEU CA C 82 58.356 58.356 58.657 -0.301 19439
2389 1 10 . 1 1 82 82 LEU CB C 82 41.627 41.627 41.633 -0.006 19439
2390 1 10 . 1 1 82 82 LEU H H 82 7.599 7.599 8.344 -0.745 19439
2391 1 10 . 1 1 83 83 ILE N N 83 120.893 120.893 119.531 1.362 19439
2392 1 10 . 1 1 83 83 ILE HA H 83 3.642 3.642 3.651 -0.009 19439
2393 1 10 . 1 1 83 83 ILE CA C 83 65.669 65.669 65.553 0.116 19439
2394 1 10 . 1 1 83 83 ILE CB C 83 38.579 38.579 37.893 0.686 19439
2395 1 10 . 1 1 83 83 ILE H H 83 8.546 8.546 8.330 0.216 19439
2396 1 10 . 1 1 84 84 PHE N N 84 123.343 123.343 120.509 2.834 19439
2397 1 10 . 1 1 84 84 PHE HA H 84 4.084 4.084 3.973 0.111 19439
2398 1 10 . 1 1 84 84 PHE CA C 84 62.593 62.593 60.428 2.165 19439
2399 1 10 . 1 1 84 84 PHE CB C 84 39.211 39.211 38.501 0.710 19439
2400 1 10 . 1 1 84 84 PHE H H 84 8.622 8.622 8.403 0.219 19439
2401 1 10 . 1 1 85 85 ASN N N 85 118.037 118.037 118.079 -0.042 19439
2402 1 10 . 1 1 85 85 ASN HA H 85 4.426 4.426 3.929 0.497 19439
2403 1 10 . 1 1 85 85 ASN CA C 85 56.045 56.045 56.371 -0.326 19439
2404 1 10 . 1 1 85 85 ASN CB C 85 37.785 37.785 38.479 -0.694 19439
2405 1 10 . 1 1 85 85 ASN H H 85 8.834 8.834 8.547 0.287 19439
2406 1 10 . 1 1 86 86 GLU N N 86 121.098 121.098 121.258 -0.160 19439
2407 1 10 . 1 1 86 86 GLU HA H 86 4.052 4.052 3.914 0.138 19439
2408 1 10 . 1 1 86 86 GLU CA C 86 59.328 59.328 59.556 -0.228 19439
2409 1 10 . 1 1 86 86 GLU CB C 86 30.253 30.253 29.672 0.581 19439
2410 1 10 . 1 1 86 86 GLU H H 86 8.105 8.105 8.145 -0.040 19439
2411 1 10 . 1 1 87 87 TRP N N 87 122.584 122.584 121.941 0.643 19439
2412 1 10 . 1 1 87 87 TRP HA H 87 4.006 4.006 4.168 -0.162 19439
2413 1 10 . 1 1 87 87 TRP CA C 87 61.545 61.545 61.954 -0.409 19439
2414 1 10 . 1 1 87 87 TRP CB C 87 27.943 27.943 29.471 -1.528 19439
2415 1 10 . 1 1 87 87 TRP H H 87 8.099 8.099 8.640 -0.541 19439
2416 1 10 . 1 1 88 88 GLU N N 88 117.357 117.357 118.704 -1.347 19439
2417 1 10 . 1 1 88 88 GLU HA H 88 2.919 2.919 3.365 -0.446 19439
2418 1 10 . 1 1 88 88 GLU CA C 88 59.804 59.804 59.867 -0.063 19439
2419 1 10 . 1 1 88 88 GLU CB C 88 29.546 29.546 29.277 0.269 19439
2420 1 10 . 1 1 88 88 GLU H H 88 8.440 8.440 8.486 -0.046 19439
2421 1 10 . 1 1 89 89 GLU N N 89 116.109 116.109 118.951 -2.842 19439
2422 1 10 . 1 1 89 89 GLU HA H 89 3.995 3.995 3.861 0.134 19439
2423 1 10 . 1 1 89 89 GLU CA C 89 58.329 58.329 59.455 -1.126 19439
2424 1 10 . 1 1 89 89 GLU CB C 89 29.649 29.649 29.497 0.152 19439
2425 1 10 . 1 1 89 89 GLU H H 89 7.244 7.244 8.028 -0.784 19439
2426 1 10 . 1 1 90 90 ARG N N 90 120.512 120.512 118.659 1.853 19439
2427 1 10 . 1 1 90 90 ARG HA H 90 3.920 3.920 3.968 -0.048 19439
2428 1 10 . 1 1 90 90 ARG CA C 90 58.683 58.683 58.734 -0.051 19439
2429 1 10 . 1 1 90 90 ARG CB C 90 30.659 30.659 29.798 0.861 19439
2430 1 10 . 1 1 90 90 ARG H H 90 8.368 8.368 8.150 0.218 19439
2431 1 10 . 1 1 91 91 LYS N N 91 120.024 120.024 120.075 -0.051 19439
2432 1 10 . 1 1 91 91 LYS HA H 91 3.964 3.964 4.006 -0.042 19439
2433 1 10 . 1 1 91 91 LYS CA C 91 57.278 57.278 58.517 -1.240 19439
2434 1 10 . 1 1 91 91 LYS CB C 91 30.582 30.582 31.210 -0.628 19439
2435 1 10 . 1 1 91 91 LYS H H 91 8.491 8.491 8.033 0.458 19439
2436 1 10 . 1 1 92 92 LYS N N 92 118.192 118.192 118.648 -0.456 19439
2437 1 10 . 1 1 92 92 LYS HA H 92 3.796 3.796 4.003 -0.207 19439
2438 1 10 . 1 1 92 92 LYS CA C 92 58.976 58.976 58.744 0.232 19439
2439 1 10 . 1 1 92 92 LYS CB C 92 32.188 32.188 32.352 -0.164 19439
2440 1 10 . 1 1 92 92 LYS H H 92 6.933 6.933 7.704 -0.771 19439
2441 1 10 . 1 1 93 93 SER N N 93 110.447 110.447 113.229 -2.782 19439
2442 1 10 . 1 1 93 93 SER HA H 93 4.484 4.484 4.352 0.132 19439
2443 1 10 . 1 1 93 93 SER CA C 93 58.386 58.386 60.442 -2.056 19439
2444 1 10 . 1 1 93 93 SER CB C 93 64.173 64.173 64.172 0.001 19439
2445 1 10 . 1 1 93 93 SER H H 93 7.282 7.282 7.713 -0.431 19439
2446 1 10 . 1 1 94 94 ASP N N 94 120.163 120.163 119.703 0.460 19439
2447 1 10 . 1 1 94 94 ASP HA H 94 4.872 4.872 5.055 -0.183 19439
2448 1 10 . 1 1 94 94 ASP CA C 94 51.157 51.157 52.546 -1.389 19439
2449 1 10 . 1 1 94 94 ASP CB C 94 41.256 41.256 43.067 -1.811 19439
2450 1 10 . 1 1 94 94 ASP H H 94 7.303 7.303 8.161 -0.858 19439
2451 1 10 . 1 1 95 95 PRO CA C 95 63.871 63.871 64.193 -0.322 19439
2452 1 10 . 1 1 95 95 PRO CB C 95 31.497 31.497 32.464 -0.967 19439
2453 1 10 . 1 1 96 96 TRP N N 96 117.486 117.486 117.122 0.364 19439
2454 1 10 . 1 1 96 96 TRP HA H 96 4.637 4.637 4.622 0.015 19439
2455 1 10 . 1 1 96 96 TRP CA C 96 56.061 56.061 55.847 0.214 19439
2456 1 10 . 1 1 96 96 TRP CB C 96 28.605 28.605 28.075 0.530 19439
2457 1 10 . 1 1 96 96 TRP H H 96 7.484 7.484 8.059 -0.575 19439
2458 1 10 . 1 1 97 97 LEU N N 97 123.510 123.510 120.382 3.128 19439
2459 1 10 . 1 1 97 97 LEU HA H 97 4.098 4.098 3.548 0.550 19439
2460 1 10 . 1 1 97 97 LEU CA C 97 56.024 56.024 54.569 1.456 19439
2461 1 10 . 1 1 97 97 LEU CB C 97 42.893 42.893 43.157 -0.264 19439
2462 1 10 . 1 1 97 97 LEU H H 97 7.137 7.137 6.949 0.188 19439
2463 1 10 . 1 1 98 98 ARG N N 98 129.724 129.724 123.563 6.161 19439
2464 1 10 . 1 1 98 98 ARG HA H 98 4.486 4.486 4.686 -0.200 19439
2465 1 10 . 1 1 98 98 ARG CA C 98 55.622 55.622 54.412 1.210 19439
2466 1 10 . 1 1 98 98 ARG CB C 98 31.229 31.229 32.744 -1.515 19439
2467 1 10 . 1 1 98 98 ARG H H 98 8.825 8.825 8.220 0.605 19439
2468 1 10 . 1 1 99 99 LEU N N 99 127.814 127.814 123.707 4.107 19439
2469 1 10 . 1 1 99 99 LEU HA H 99 3.586 3.586 4.003 -0.417 19439
2470 1 10 . 1 1 99 99 LEU CA C 99 54.352 54.352 53.995 0.357 19439
2471 1 10 . 1 1 99 99 LEU CB C 99 40.485 40.485 41.278 -0.793 19439
2472 1 10 . 1 1 99 99 LEU H H 99 8.236 8.236 8.010 0.226 19439
2473 1 10 . 1 1 100 100 ASP N N 100 126.633 126.633 126.412 0.221 19439
2474 1 10 . 1 1 100 100 ASP HA H 100 4.646 4.646 4.766 -0.120 19439
2475 1 10 . 1 1 100 100 ASP CA C 100 52.894 52.894 53.721 -0.827 19439
2476 1 10 . 1 1 100 100 ASP CB C 100 41.224 41.224 42.909 -1.685 19439
2477 1 10 . 1 1 100 100 ASP H H 100 8.018 8.018 8.406 -0.388 19439
2478 1 10 . 1 1 101 101 MET N N 101 122.473 122.473 120.049 2.424 19439
2479 1 10 . 1 1 101 101 MET HA H 101 4.481 4.481 4.617 -0.136 19439
2480 1 10 . 1 1 101 101 MET CA C 101 53.398 53.398 54.385 -0.987 19439
2481 1 10 . 1 1 101 101 MET CB C 101 33.296 33.296 32.957 0.339 19439
2482 1 10 . 1 1 101 101 MET H H 101 8.639 8.639 7.945 0.694 19439
2483 1 10 . 1 1 102 102 SER N N 102 116.243 116.243 117.444 -1.201 19439
2484 1 10 . 1 1 102 102 SER HA H 102 4.114 4.114 4.336 -0.222 19439
2485 1 10 . 1 1 102 102 SER CA C 102 58.709 58.709 57.385 1.324 19439
2486 1 10 . 1 1 102 102 SER CB C 102 64.701 64.701 65.081 -0.380 19439
2487 1 10 . 1 1 102 102 SER H H 102 8.096 8.096 8.209 -0.113 19439
2488 1 10 . 1 1 103 103 ASP N N 103 121.639 121.639 124.327 -2.688 19439
2489 1 10 . 1 1 103 103 ASP HA H 103 3.724 3.724 3.908 -0.184 19439
2490 1 10 . 1 1 103 103 ASP CA C 103 57.296 57.296 57.165 0.131 19439
2491 1 10 . 1 1 103 103 ASP CB C 103 38.720 38.720 40.393 -1.673 19439
2492 1 10 . 1 1 103 103 ASP H H 103 8.669 8.669 8.789 -0.120 19439
2493 1 10 . 1 1 104 104 LYS N N 104 116.276 116.276 118.973 -2.697 19439
2494 1 10 . 1 1 104 104 LYS HA H 104 3.678 3.678 4.065 -0.387 19439
2495 1 10 . 1 1 104 104 LYS CA C 104 59.833 59.833 58.669 1.164 19439
2496 1 10 . 1 1 104 104 LYS CB C 104 32.090 32.090 31.847 0.243 19439
2497 1 10 . 1 1 104 104 LYS H H 104 7.775 7.775 7.567 0.208 19439
2498 1 10 . 1 1 105 105 ALA N N 105 122.257 122.257 122.580 -0.323 19439
2499 1 10 . 1 1 105 105 ALA HA H 105 3.873 3.873 4.058 -0.185 19439
2500 1 10 . 1 1 105 105 ALA CA C 105 55.008 55.008 54.796 0.212 19439
2501 1 10 . 1 1 105 105 ALA CB C 105 17.741 17.741 18.049 -0.308 19439
2502 1 10 . 1 1 105 105 ALA H H 105 7.266 7.266 7.573 -0.307 19439
2503 1 10 . 1 1 106 106 ILE N N 106 119.452 119.452 119.769 -0.317 19439
2504 1 10 . 1 1 106 106 ILE HA H 106 3.419 3.419 3.814 -0.395 19439
2505 1 10 . 1 1 106 106 ILE CA C 106 65.971 65.971 64.449 1.522 19439
2506 1 10 . 1 1 106 106 ILE CB C 106 37.430 37.430 37.565 -0.135 19439
2507 1 10 . 1 1 106 106 ILE H H 106 7.974 7.974 7.710 0.264 19439
2508 1 10 . 1 1 107 107 PHE N N 107 117.814 117.814 118.330 -0.516 19439
2509 1 10 . 1 1 107 107 PHE HA H 107 4.368 4.368 4.730 -0.362 19439
2510 1 10 . 1 1 107 107 PHE CA C 107 56.844 56.844 58.102 -1.258 19439
2511 1 10 . 1 1 107 107 PHE CB C 107 37.150 37.150 37.597 -0.447 19439
2512 1 10 . 1 1 107 107 PHE H H 107 8.434 8.434 8.016 0.418 19439
2513 1 10 . 1 1 108 108 ARG N N 108 117.368 117.368 120.691 -3.323 19439
2514 1 10 . 1 1 108 108 ARG HA H 108 3.994 3.994 4.094 -0.100 19439
2515 1 10 . 1 1 108 108 ARG CA C 108 58.682 58.682 58.967 -0.285 19439
2516 1 10 . 1 1 108 108 ARG CB C 108 30.287 30.287 30.341 -0.054 19439
2517 1 10 . 1 1 108 108 ARG H H 108 7.474 7.474 8.125 -0.651 19439
2518 1 10 . 1 1 109 109 ARG N N 109 117.440 117.440 116.487 0.953 19439
2519 1 10 . 1 1 109 109 ARG HA H 109 3.900 3.900 4.032 -0.132 19439
2520 1 10 . 1 1 109 109 ARG CA C 109 57.312 57.312 57.049 0.263 19439
2521 1 10 . 1 1 109 109 ARG CB C 109 31.626 31.626 30.684 0.942 19439
2522 1 10 . 1 1 109 109 ARG H H 109 7.118 7.118 7.728 -0.610 19439
2523 1 10 . 1 1 110 110 TYR N N 110 116.060 116.060 117.242 -1.182 19439
2524 1 10 . 1 1 110 110 TYR HA H 110 5.265 5.265 5.179 0.086 19439
2525 1 10 . 1 1 110 110 TYR CA C 110 54.188 54.188 54.752 -0.564 19439
2526 1 10 . 1 1 110 110 TYR CB C 110 38.484 38.484 38.406 0.078 19439
2527 1 10 . 1 1 110 110 TYR H H 110 8.707 8.707 8.101 0.606 19439
2528 1 10 . 1 1 111 111 PRO HA H 111 4.388 4.388 4.704 -0.316 19439
2529 1 10 . 1 1 111 111 PRO CA C 111 64.847 64.847 64.316 0.531 19439
2530 1 10 . 1 1 111 111 PRO CB C 111 31.381 31.381 32.115 -0.734 19439
2531 1 10 . 1 1 112 112 HIS N N 112 115.542 115.542 114.582 0.960 19439
2532 1 10 . 1 1 112 112 HIS HA H 112 4.482 4.482 4.525 -0.043 19439
2533 1 10 . 1 1 112 112 HIS CA C 112 58.498 58.498 57.218 1.280 19439
2534 1 10 . 1 1 112 112 HIS CB C 112 29.654 29.654 28.501 1.153 19439
2535 1 10 . 1 1 112 112 HIS H H 112 8.196 8.196 8.322 -0.126 19439
2536 1 10 . 1 1 113 113 LEU N N 113 120.583 120.583 119.776 0.807 19439
2537 1 10 . 1 1 113 113 LEU HA H 113 4.165 4.165 4.184 -0.019 19439
2538 1 10 . 1 1 113 113 LEU CA C 113 54.013 54.013 55.860 -1.847 19439
2539 1 10 . 1 1 113 113 LEU CB C 113 41.669 41.669 42.211 -0.542 19439
2540 1 10 . 1 1 113 113 LEU H H 113 7.527 7.527 7.353 0.174 19439
2541 1 11 . 1 1 59 59 ALA N N 59 123.310 123.310 123.198 0.112 19439
2542 1 11 . 1 1 59 59 ALA HA H 59 4.232 4.232 4.586 -0.354 19439
2543 1 11 . 1 1 59 59 ALA CA C 59 52.274 52.274 52.038 0.236 19439
2544 1 11 . 1 1 59 59 ALA CB C 59 19.623 19.623 19.487 0.136 19439
2545 1 11 . 1 1 59 59 ALA H H 59 7.894 7.894 8.049 -0.155 19439
2546 1 11 . 1 1 60 60 LEU N N 60 120.936 120.936 122.464 -1.528 19439
2547 1 11 . 1 1 60 60 LEU HA H 60 4.364 4.364 4.416 -0.052 19439
2548 1 11 . 1 1 60 60 LEU CA C 60 54.130 54.130 54.172 -0.042 19439
2549 1 11 . 1 1 60 60 LEU CB C 60 43.209 43.209 42.727 0.482 19439
2550 1 11 . 1 1 60 60 LEU H H 60 8.046 8.046 8.413 -0.367 19439
2551 1 11 . 1 1 61 61 ALA N N 61 125.460 125.460 123.696 1.764 19439
2552 1 11 . 1 1 61 61 ALA HA H 61 4.364 4.364 4.292 0.072 19439
2553 1 11 . 1 1 61 61 ALA CA C 61 51.176 51.176 52.407 -1.231 19439
2554 1 11 . 1 1 61 61 ALA CB C 61 20.172 20.172 19.148 1.024 19439
2555 1 11 . 1 1 61 61 ALA H H 61 8.338 8.338 8.252 0.086 19439
2556 1 11 . 1 1 62 62 ALA N N 62 127.765 127.765 126.591 1.174 19439
2557 1 11 . 1 1 62 62 ALA HA H 62 4.394 4.394 4.637 -0.243 19439
2558 1 11 . 1 1 62 62 ALA CA C 62 51.888 51.888 50.813 1.075 19439
2559 1 11 . 1 1 62 62 ALA CB C 62 18.806 18.806 20.711 -1.905 19439
2560 1 11 . 1 1 62 62 ALA H H 62 8.487 8.487 9.012 -0.525 19439
2561 1 11 . 1 1 63 63 LEU N N 63 120.199 120.199 119.408 0.791 19439
2562 1 11 . 1 1 63 63 LEU HA H 63 4.828 4.828 4.973 -0.145 19439
2563 1 11 . 1 1 63 63 LEU CA C 63 51.852 51.852 53.283 -1.431 19439
2564 1 11 . 1 1 63 63 LEU CB C 63 44.081 44.081 45.785 -1.704 19439
2565 1 11 . 1 1 63 63 LEU H H 63 7.927 7.927 8.175 -0.248 19439
2566 1 11 . 1 1 64 64 HIS N N 64 122.277 122.277 119.547 2.730 19439
2567 1 11 . 1 1 64 64 HIS HA H 64 4.114 4.114 4.555 -0.441 19439
2568 1 11 . 1 1 64 64 HIS CA C 64 58.038 58.038 57.067 0.971 19439
2569 1 11 . 1 1 64 64 HIS CB C 64 31.228 31.228 31.118 0.110 19439
2570 1 11 . 1 1 64 64 HIS H H 64 8.477 8.477 8.797 -0.320 19439
2571 1 11 . 1 1 65 65 ALA HA H 65 4.339 4.339 4.408 -0.069 19439
2572 1 11 . 1 1 65 65 ALA CA C 65 53.281 53.281 52.847 0.434 19439
2573 1 11 . 1 1 65 65 ALA CB C 65 20.276 20.276 19.837 0.439 19439
2574 1 11 . 1 1 66 66 GLU N N 66 113.868 113.868 116.586 -2.718 19439
2575 1 11 . 1 1 66 66 GLU HA H 66 4.619 4.619 4.513 0.106 19439
2576 1 11 . 1 1 66 66 GLU CA C 66 54.727 54.727 55.103 -0.376 19439
2577 1 11 . 1 1 66 66 GLU CB C 66 32.894 32.894 32.854 0.040 19439
2578 1 11 . 1 1 66 66 GLU H H 66 7.759 7.759 8.066 -0.307 19439
2579 1 11 . 1 1 68 68 PRO HA H 68 4.219 4.219 4.246 -0.027 19439
2580 1 11 . 1 1 68 68 PRO CA C 68 64.664 64.664 65.049 -0.385 19439
2581 1 11 . 1 1 68 68 PRO CB C 68 32.066 32.066 31.738 0.329 19439
2582 1 11 . 1 1 69 69 LEU N N 69 117.262 117.262 117.381 -0.119 19439
2583 1 11 . 1 1 69 69 LEU HA H 69 4.182 4.182 4.412 -0.230 19439
2584 1 11 . 1 1 69 69 LEU CA C 69 52.430 52.430 53.153 -0.723 19439
2585 1 11 . 1 1 69 69 LEU CB C 69 40.907 40.907 40.923 -0.016 19439
2586 1 11 . 1 1 69 69 LEU H H 69 8.439 8.439 7.892 0.547 19439
2587 1 11 . 1 1 70 70 ALA N N 70 120.426 120.426 121.585 -1.159 19439
2588 1 11 . 1 1 70 70 ALA HA H 70 3.411 3.411 4.120 -0.709 19439
2589 1 11 . 1 1 70 70 ALA CA C 70 53.685 53.685 53.466 0.219 19439
2590 1 11 . 1 1 70 70 ALA CB C 70 17.914 17.914 18.702 -0.788 19439
2591 1 11 . 1 1 70 70 ALA H H 70 7.113 7.113 7.579 -0.466 19439
2592 1 11 . 1 1 71 71 GLY N N 71 108.911 108.911 113.239 -4.328 19439
2593 1 11 . 1 1 71 71 GLY CA C 71 45.215 45.215 44.996 0.219 19439
2594 1 11 . 1 1 71 71 GLY H H 71 8.856 8.856 8.986 -0.130 19439
2595 1 11 . 1 1 72 72 LEU N N 72 120.000 120.000 120.808 -0.808 19439
2596 1 11 . 1 1 72 72 LEU HA H 72 4.769 4.769 4.987 -0.218 19439
2597 1 11 . 1 1 72 72 LEU CA C 72 51.972 51.972 51.584 0.388 19439
2598 1 11 . 1 1 72 72 LEU CB C 72 41.255 41.255 42.892 -1.637 19439
2599 1 11 . 1 1 72 72 LEU H H 72 8.136 8.136 7.932 0.204 19439
2600 1 11 . 1 1 73 73 PRO HA H 73 4.739 4.739 4.659 0.080 19439
2601 1 11 . 1 1 73 73 PRO CA C 73 61.456 61.456 62.884 -1.428 19439
2602 1 11 . 1 1 73 73 PRO CB C 73 31.245 31.245 32.035 -0.790 19439
2603 1 11 . 1 1 74 74 VAL N N 74 121.723 121.723 119.541 2.182 19439
2604 1 11 . 1 1 74 74 VAL HA H 74 3.446 3.446 3.954 -0.508 19439
2605 1 11 . 1 1 74 74 VAL CA C 74 65.744 65.744 63.607 2.137 19439
2606 1 11 . 1 1 74 74 VAL CB C 74 31.236 31.236 32.041 -0.805 19439
2607 1 11 . 1 1 74 74 VAL H H 74 7.710 7.710 8.204 -0.494 19439
2608 1 11 . 1 1 75 75 THR N N 75 108.893 108.893 109.692 -0.799 19439
2609 1 11 . 1 1 75 75 THR HA H 75 4.937 4.937 4.587 0.350 19439
2610 1 11 . 1 1 75 75 THR CA C 75 59.892 59.892 59.619 0.273 19439
2611 1 11 . 1 1 75 75 THR CB C 75 12.018 12.018 71.964 -59.946 19439
2612 1 11 . 1 1 75 75 THR H H 75 8.710 8.710 8.059 0.651 19439
2613 1 11 . 1 1 76 76 ARG HA H 76 3.873 3.873 4.020 -0.147 19439
2614 1 11 . 1 1 76 76 ARG H H 76 8.447 8.447 8.777 -0.330 19439
2615 1 11 . 1 1 77 77 SER N N 77 114.482 114.482 114.854 -0.372 19439
2616 1 11 . 1 1 77 77 SER HA H 77 4.061 4.061 4.092 -0.031 19439
2617 1 11 . 1 1 77 77 SER CA C 77 60.467 60.467 61.468 -1.001 19439
2618 1 11 . 1 1 77 77 SER CB C 77 62.449 62.449 62.811 -0.362 19439
2619 1 11 . 1 1 77 77 SER H H 77 8.105 8.105 7.982 0.123 19439
2620 1 11 . 1 1 78 78 ASP N N 78 120.538 120.538 121.986 -1.448 19439
2621 1 11 . 1 1 78 78 ASP HA H 78 4.333 4.333 4.305 0.028 19439
2622 1 11 . 1 1 78 78 ASP CA C 78 58.020 58.020 57.211 0.809 19439
2623 1 11 . 1 1 78 78 ASP CB C 78 43.252 43.252 40.312 2.940 19439
2624 1 11 . 1 1 78 78 ASP H H 78 7.300 7.300 8.119 -0.819 19439
2625 1 11 . 1 1 79 79 ALA N N 79 120.614 120.614 122.752 -2.138 19439
2626 1 11 . 1 1 79 79 ALA HA H 79 3.672 3.672 3.841 -0.169 19439
2627 1 11 . 1 1 79 79 ALA CA C 79 54.886 54.886 55.192 -0.306 19439
2628 1 11 . 1 1 79 79 ALA CB C 79 19.628 19.628 18.338 1.290 19439
2629 1 11 . 1 1 79 79 ALA H H 79 7.767 7.767 8.257 -0.490 19439
2630 1 11 . 1 1 80 80 ARG N N 80 116.203 116.203 119.129 -2.926 19439
2631 1 11 . 1 1 80 80 ARG HA H 80 3.732 3.732 4.050 -0.318 19439
2632 1 11 . 1 1 80 80 ARG CA C 80 61.441 61.441 59.425 2.016 19439
2633 1 11 . 1 1 80 80 ARG CB C 80 30.266 30.266 30.363 -0.097 19439
2634 1 11 . 1 1 80 80 ARG H H 80 7.981 7.981 8.183 -0.202 19439
2635 1 11 . 1 1 81 81 VAL N N 81 119.192 119.192 120.009 -0.817 19439
2636 1 11 . 1 1 81 81 VAL HA H 81 3.582 3.582 3.914 -0.332 19439
2637 1 11 . 1 1 81 81 VAL CA C 81 66.909 66.909 66.998 -0.089 19439
2638 1 11 . 1 1 81 81 VAL CB C 81 31.668 31.668 31.860 -0.192 19439
2639 1 11 . 1 1 81 81 VAL H H 81 7.338 7.338 8.208 -0.870 19439
2640 1 11 . 1 1 82 82 LEU N N 82 118.722 118.722 121.325 -2.603 19439
2641 1 11 . 1 1 82 82 LEU HA H 82 4.044 4.044 3.946 0.098 19439
2642 1 11 . 1 1 82 82 LEU CA C 82 58.356 58.356 58.700 -0.344 19439
2643 1 11 . 1 1 82 82 LEU CB C 82 41.627 41.627 41.699 -0.072 19439
2644 1 11 . 1 1 82 82 LEU H H 82 7.599 7.599 8.374 -0.775 19439
2645 1 11 . 1 1 83 83 ILE N N 83 120.893 120.893 119.575 1.318 19439
2646 1 11 . 1 1 83 83 ILE HA H 83 3.642 3.642 3.704 -0.062 19439
2647 1 11 . 1 1 83 83 ILE CA C 83 65.669 65.669 65.685 -0.016 19439
2648 1 11 . 1 1 83 83 ILE CB C 83 38.579 38.579 37.925 0.654 19439
2649 1 11 . 1 1 83 83 ILE H H 83 8.546 8.546 8.483 0.063 19439
2650 1 11 . 1 1 84 84 PHE N N 84 123.343 123.343 121.425 1.918 19439
2651 1 11 . 1 1 84 84 PHE HA H 84 4.084 4.084 4.138 -0.054 19439
2652 1 11 . 1 1 84 84 PHE CA C 84 62.593 62.593 61.310 1.283 19439
2653 1 11 . 1 1 84 84 PHE CB C 84 39.211 39.211 38.923 0.288 19439
2654 1 11 . 1 1 84 84 PHE H H 84 8.622 8.622 8.495 0.127 19439
2655 1 11 . 1 1 85 85 ASN N N 85 118.037 118.037 117.350 0.687 19439
2656 1 11 . 1 1 85 85 ASN HA H 85 4.426 4.426 4.098 0.328 19439
2657 1 11 . 1 1 85 85 ASN CA C 85 56.045 56.045 56.585 -0.540 19439
2658 1 11 . 1 1 85 85 ASN CB C 85 37.785 37.785 38.412 -0.627 19439
2659 1 11 . 1 1 85 85 ASN H H 85 8.834 8.834 8.648 0.186 19439
2660 1 11 . 1 1 86 86 GLU N N 86 121.098 121.098 121.949 -0.851 19439
2661 1 11 . 1 1 86 86 GLU HA H 86 4.052 4.052 3.962 0.090 19439
2662 1 11 . 1 1 86 86 GLU CA C 86 59.328 59.328 59.589 -0.261 19439
2663 1 11 . 1 1 86 86 GLU CB C 86 30.253 30.253 29.760 0.493 19439
2664 1 11 . 1 1 86 86 GLU H H 86 8.105 8.105 8.362 -0.257 19439
2665 1 11 . 1 1 87 87 TRP N N 87 122.584 122.584 122.127 0.457 19439
2666 1 11 . 1 1 87 87 TRP HA H 87 4.006 4.006 4.155 -0.149 19439
2667 1 11 . 1 1 87 87 TRP CA C 87 61.545 61.545 61.713 -0.168 19439
2668 1 11 . 1 1 87 87 TRP CB C 87 27.943 27.943 29.453 -1.510 19439
2669 1 11 . 1 1 87 87 TRP H H 87 8.099 8.099 8.709 -0.610 19439
2670 1 11 . 1 1 88 88 GLU N N 88 117.357 117.357 118.705 -1.348 19439
2671 1 11 . 1 1 88 88 GLU HA H 88 2.919 2.919 3.142 -0.223 19439
2672 1 11 . 1 1 88 88 GLU CA C 88 59.804 59.804 59.731 0.073 19439
2673 1 11 . 1 1 88 88 GLU CB C 88 29.546 29.546 29.041 0.505 19439
2674 1 11 . 1 1 88 88 GLU H H 88 8.440 8.440 8.395 0.045 19439
2675 1 11 . 1 1 89 89 GLU N N 89 116.109 116.109 119.697 -3.588 19439
2676 1 11 . 1 1 89 89 GLU HA H 89 3.995 3.995 3.922 0.073 19439
2677 1 11 . 1 1 89 89 GLU CA C 89 58.329 58.329 59.330 -1.000 19439
2678 1 11 . 1 1 89 89 GLU CB C 89 29.649 29.649 29.373 0.276 19439
2679 1 11 . 1 1 89 89 GLU H H 89 7.244 7.244 7.900 -0.656 19439
2680 1 11 . 1 1 90 90 ARG N N 90 120.512 120.512 118.541 1.971 19439
2681 1 11 . 1 1 90 90 ARG HA H 90 3.920 3.920 3.937 -0.017 19439
2682 1 11 . 1 1 90 90 ARG CA C 90 58.683 58.683 58.452 0.231 19439
2683 1 11 . 1 1 90 90 ARG CB C 90 30.659 30.659 29.547 1.112 19439
2684 1 11 . 1 1 90 90 ARG H H 90 8.368 8.368 8.041 0.327 19439
2685 1 11 . 1 1 91 91 LYS N N 91 120.024 120.024 120.024 0.000 19439
2686 1 11 . 1 1 91 91 LYS HA H 91 3.964 3.964 3.995 -0.031 19439
2687 1 11 . 1 1 91 91 LYS CA C 91 57.278 57.278 58.866 -1.588 19439
2688 1 11 . 1 1 91 91 LYS CB C 91 30.582 30.582 31.330 -0.748 19439
2689 1 11 . 1 1 91 91 LYS H H 91 8.491 8.491 7.947 0.544 19439
2690 1 11 . 1 1 92 92 LYS N N 92 118.192 118.192 118.594 -0.402 19439
2691 1 11 . 1 1 92 92 LYS HA H 92 3.796 3.796 4.020 -0.224 19439
2692 1 11 . 1 1 92 92 LYS CA C 92 58.976 58.976 58.631 0.345 19439
2693 1 11 . 1 1 92 92 LYS CB C 92 32.188 32.188 32.232 -0.044 19439
2694 1 11 . 1 1 92 92 LYS H H 92 6.933 6.933 7.696 -0.763 19439
2695 1 11 . 1 1 93 93 SER N N 93 110.447 110.447 112.949 -2.502 19439
2696 1 11 . 1 1 93 93 SER HA H 93 4.484 4.484 4.325 0.159 19439
2697 1 11 . 1 1 93 93 SER CA C 93 58.386 58.386 60.146 -1.760 19439
2698 1 11 . 1 1 93 93 SER CB C 93 64.173 64.173 64.287 -0.114 19439
2699 1 11 . 1 1 93 93 SER H H 93 7.282 7.282 7.634 -0.352 19439
2700 1 11 . 1 1 94 94 ASP N N 94 120.163 120.163 119.642 0.521 19439
2701 1 11 . 1 1 94 94 ASP HA H 94 4.872 4.872 5.054 -0.182 19439
2702 1 11 . 1 1 94 94 ASP CA C 94 51.157 51.157 52.663 -1.506 19439
2703 1 11 . 1 1 94 94 ASP CB C 94 41.256 41.256 43.091 -1.835 19439
2704 1 11 . 1 1 94 94 ASP H H 94 7.303 7.303 8.171 -0.868 19439
2705 1 11 . 1 1 95 95 PRO CA C 95 63.871 63.871 63.642 0.229 19439
2706 1 11 . 1 1 95 95 PRO CB C 95 31.497 31.497 32.301 -0.804 19439
2707 1 11 . 1 1 96 96 TRP N N 96 117.486 117.486 116.506 0.980 19439
2708 1 11 . 1 1 96 96 TRP HA H 96 4.637 4.637 4.618 0.019 19439
2709 1 11 . 1 1 96 96 TRP CA C 96 56.061 56.061 55.153 0.908 19439
2710 1 11 . 1 1 96 96 TRP CB C 96 28.605 28.605 28.428 0.177 19439
2711 1 11 . 1 1 96 96 TRP H H 96 7.484 7.484 7.925 -0.441 19439
2712 1 11 . 1 1 97 97 LEU N N 97 123.510 123.510 121.503 2.007 19439
2713 1 11 . 1 1 97 97 LEU HA H 97 4.098 4.098 2.869 1.229 19439
2714 1 11 . 1 1 97 97 LEU CA C 97 56.024 56.024 54.134 1.890 19439
2715 1 11 . 1 1 97 97 LEU CB C 97 42.893 42.893 42.282 0.611 19439
2716 1 11 . 1 1 97 97 LEU H H 97 7.137 7.137 6.760 0.377 19439
2717 1 11 . 1 1 98 98 ARG N N 98 129.724 129.724 125.131 4.593 19439
2718 1 11 . 1 1 98 98 ARG HA H 98 4.486 4.486 4.173 0.313 19439
2719 1 11 . 1 1 98 98 ARG CA C 98 55.622 55.622 54.974 0.648 19439
2720 1 11 . 1 1 98 98 ARG CB C 98 31.229 31.229 30.705 0.524 19439
2721 1 11 . 1 1 98 98 ARG H H 98 8.825 8.825 8.066 0.759 19439
2722 1 11 . 1 1 99 99 LEU N N 99 127.814 127.814 122.655 5.159 19439
2723 1 11 . 1 1 99 99 LEU HA H 99 3.586 3.586 4.381 -0.795 19439
2724 1 11 . 1 1 99 99 LEU CA C 99 54.352 54.352 54.283 0.069 19439
2725 1 11 . 1 1 99 99 LEU CB C 99 40.485 40.485 42.282 -1.797 19439
2726 1 11 . 1 1 99 99 LEU H H 99 8.236 8.236 8.236 0.000 19439
2727 1 11 . 1 1 100 100 ASP N N 100 126.633 126.633 127.239 -0.606 19439
2728 1 11 . 1 1 100 100 ASP HA H 100 4.646 4.646 4.821 -0.175 19439
2729 1 11 . 1 1 100 100 ASP CA C 100 52.894 52.894 53.959 -1.065 19439
2730 1 11 . 1 1 100 100 ASP CB C 100 41.224 41.224 43.003 -1.779 19439
2731 1 11 . 1 1 100 100 ASP H H 100 8.018 8.018 8.600 -0.582 19439
2732 1 11 . 1 1 101 101 MET N N 101 122.473 122.473 118.629 3.844 19439
2733 1 11 . 1 1 101 101 MET HA H 101 4.481 4.481 4.671 -0.190 19439
2734 1 11 . 1 1 101 101 MET CA C 101 53.398 53.398 54.424 -1.026 19439
2735 1 11 . 1 1 101 101 MET CB C 101 33.296 33.296 33.071 0.225 19439
2736 1 11 . 1 1 101 101 MET H H 101 8.639 8.639 7.864 0.775 19439
2737 1 11 . 1 1 102 102 SER N N 102 116.243 116.243 118.789 -2.546 19439
2738 1 11 . 1 1 102 102 SER HA H 102 4.114 4.114 4.308 -0.194 19439
2739 1 11 . 1 1 102 102 SER CA C 102 58.709 58.709 57.804 0.905 19439
2740 1 11 . 1 1 102 102 SER CB C 102 64.701 64.701 64.444 0.257 19439
2741 1 11 . 1 1 102 102 SER H H 102 8.096 8.096 7.858 0.238 19439
2742 1 11 . 1 1 103 103 ASP N N 103 121.639 121.639 124.131 -2.492 19439
2743 1 11 . 1 1 103 103 ASP HA H 103 3.724 3.724 3.849 -0.125 19439
2744 1 11 . 1 1 103 103 ASP CA C 103 57.296 57.296 57.972 -0.676 19439
2745 1 11 . 1 1 103 103 ASP CB C 103 38.720 38.720 40.491 -1.771 19439
2746 1 11 . 1 1 103 103 ASP H H 103 8.669 8.669 8.652 0.017 19439
2747 1 11 . 1 1 104 104 LYS N N 104 116.276 116.276 118.373 -2.097 19439
2748 1 11 . 1 1 104 104 LYS HA H 104 3.678 3.678 4.017 -0.339 19439
2749 1 11 . 1 1 104 104 LYS CA C 104 59.833 59.833 58.887 0.946 19439
2750 1 11 . 1 1 104 104 LYS CB C 104 32.090 32.090 31.853 0.237 19439
2751 1 11 . 1 1 104 104 LYS H H 104 7.775 7.775 8.204 -0.429 19439
2752 1 11 . 1 1 105 105 ALA N N 105 122.257 122.257 122.471 -0.214 19439
2753 1 11 . 1 1 105 105 ALA HA H 105 3.873 3.873 4.066 -0.193 19439
2754 1 11 . 1 1 105 105 ALA CA C 105 55.008 55.008 54.595 0.413 19439
2755 1 11 . 1 1 105 105 ALA CB C 105 17.741 17.741 18.063 -0.322 19439
2756 1 11 . 1 1 105 105 ALA H H 105 7.266 7.266 7.621 -0.355 19439
2757 1 11 . 1 1 106 106 ILE N N 106 119.452 119.452 119.785 -0.333 19439
2758 1 11 . 1 1 106 106 ILE HA H 106 3.419 3.419 3.801 -0.382 19439
2759 1 11 . 1 1 106 106 ILE CA C 106 65.971 65.971 64.538 1.433 19439
2760 1 11 . 1 1 106 106 ILE CB C 106 37.430 37.430 37.581 -0.151 19439
2761 1 11 . 1 1 106 106 ILE H H 106 7.974 7.974 7.667 0.307 19439
2762 1 11 . 1 1 107 107 PHE N N 107 117.814 117.814 118.889 -1.075 19439
2763 1 11 . 1 1 107 107 PHE HA H 107 4.368 4.368 4.724 -0.356 19439
2764 1 11 . 1 1 107 107 PHE CA C 107 56.844 56.844 58.318 -1.474 19439
2765 1 11 . 1 1 107 107 PHE CB C 107 37.150 37.150 37.560 -0.410 19439
2766 1 11 . 1 1 107 107 PHE H H 107 8.434 8.434 8.104 0.330 19439
2767 1 11 . 1 1 108 108 ARG N N 108 117.368 117.368 118.878 -1.510 19439
2768 1 11 . 1 1 108 108 ARG HA H 108 3.994 3.994 4.179 -0.185 19439
2769 1 11 . 1 1 108 108 ARG CA C 108 58.682 58.682 58.112 0.570 19439
2770 1 11 . 1 1 108 108 ARG CB C 108 30.287 30.287 29.744 0.543 19439
2771 1 11 . 1 1 108 108 ARG H H 108 7.474 7.474 8.180 -0.706 19439
2772 1 11 . 1 1 109 109 ARG N N 109 117.440 117.440 117.261 0.179 19439
2773 1 11 . 1 1 109 109 ARG HA H 109 3.900 3.900 3.939 -0.039 19439
2774 1 11 . 1 1 109 109 ARG CA C 109 57.312 57.312 58.202 -0.890 19439
2775 1 11 . 1 1 109 109 ARG CB C 109 31.626 31.626 30.708 0.918 19439
2776 1 11 . 1 1 109 109 ARG H H 109 7.118 7.118 7.652 -0.534 19439
2777 1 11 . 1 1 110 110 TYR N N 110 116.060 116.060 116.389 -0.329 19439
2778 1 11 . 1 1 110 110 TYR HA H 110 5.265 5.265 5.170 0.095 19439
2779 1 11 . 1 1 110 110 TYR CA C 110 54.188 54.188 54.609 -0.421 19439
2780 1 11 . 1 1 110 110 TYR CB C 110 38.484 38.484 38.278 0.206 19439
2781 1 11 . 1 1 110 110 TYR H H 110 8.707 8.707 8.069 0.638 19439
2782 1 11 . 1 1 111 111 PRO HA H 111 4.388 4.388 4.674 -0.286 19439
2783 1 11 . 1 1 111 111 PRO CA C 111 64.847 64.847 64.276 0.571 19439
2784 1 11 . 1 1 111 111 PRO CB C 111 31.381 31.381 32.031 -0.650 19439
2785 1 11 . 1 1 112 112 HIS N N 112 115.542 115.542 114.286 1.256 19439
2786 1 11 . 1 1 112 112 HIS HA H 112 4.482 4.482 4.534 -0.052 19439
2787 1 11 . 1 1 112 112 HIS CA C 112 58.498 58.498 57.082 1.416 19439
2788 1 11 . 1 1 112 112 HIS CB C 112 29.654 29.654 28.634 1.020 19439
2789 1 11 . 1 1 112 112 HIS H H 112 8.196 8.196 8.370 -0.174 19439
2790 1 11 . 1 1 113 113 LEU N N 113 120.583 120.583 119.016 1.567 19439
2791 1 11 . 1 1 113 113 LEU HA H 113 4.165 4.165 4.194 -0.029 19439
2792 1 11 . 1 1 113 113 LEU CA C 113 54.013 54.013 55.503 -1.490 19439
2793 1 11 . 1 1 113 113 LEU CB C 113 41.669 41.669 42.173 -0.504 19439
2794 1 11 . 1 1 113 113 LEU H H 113 7.527 7.527 7.459 0.068 19439
2795 1 12 . 1 1 59 59 ALA N N 59 123.310 123.310 124.377 -1.067 19439
2796 1 12 . 1 1 59 59 ALA HA H 59 4.232 4.232 4.431 -0.199 19439
2797 1 12 . 1 1 59 59 ALA CA C 59 52.274 52.274 52.261 0.013 19439
2798 1 12 . 1 1 59 59 ALA CB C 59 19.623 19.623 17.792 1.831 19439
2799 1 12 . 1 1 59 59 ALA H H 59 7.894 7.894 8.113 -0.219 19439
2800 1 12 . 1 1 60 60 LEU N N 60 120.936 120.936 116.182 4.754 19439
2801 1 12 . 1 1 60 60 LEU HA H 60 4.364 4.364 4.458 -0.094 19439
2802 1 12 . 1 1 60 60 LEU CA C 60 54.130 54.130 55.300 -1.169 19439
2803 1 12 . 1 1 60 60 LEU CB C 60 43.209 43.209 41.518 1.691 19439
2804 1 12 . 1 1 60 60 LEU H H 60 8.046 8.046 7.692 0.354 19439
2805 1 12 . 1 1 61 61 ALA N N 61 125.460 125.460 121.919 3.541 19439
2806 1 12 . 1 1 61 61 ALA HA H 61 4.364 4.364 4.298 0.066 19439
2807 1 12 . 1 1 61 61 ALA CA C 61 51.176 51.176 51.831 -0.655 19439
2808 1 12 . 1 1 61 61 ALA CB C 61 20.172 20.172 19.712 0.460 19439
2809 1 12 . 1 1 61 61 ALA H H 61 8.338 8.338 7.725 0.613 19439
2810 1 12 . 1 1 62 62 ALA N N 62 127.765 127.765 125.901 1.864 19439
2811 1 12 . 1 1 62 62 ALA HA H 62 4.394 4.394 4.689 -0.295 19439
2812 1 12 . 1 1 62 62 ALA CA C 62 51.888 51.888 50.864 1.024 19439
2813 1 12 . 1 1 62 62 ALA CB C 62 18.806 18.806 21.191 -2.385 19439
2814 1 12 . 1 1 62 62 ALA H H 62 8.487 8.487 8.958 -0.471 19439
2815 1 12 . 1 1 63 63 LEU N N 63 120.199 120.199 120.838 -0.639 19439
2816 1 12 . 1 1 63 63 LEU HA H 63 4.828 4.828 4.954 -0.126 19439
2817 1 12 . 1 1 63 63 LEU CA C 63 51.852 51.852 53.020 -1.168 19439
2818 1 12 . 1 1 63 63 LEU CB C 63 44.081 44.081 45.370 -1.289 19439
2819 1 12 . 1 1 63 63 LEU H H 63 7.927 7.927 8.306 -0.379 19439
2820 1 12 . 1 1 64 64 HIS N N 64 122.277 122.277 119.226 3.051 19439
2821 1 12 . 1 1 64 64 HIS HA H 64 4.114 4.114 4.566 -0.452 19439
2822 1 12 . 1 1 64 64 HIS CA C 64 58.038 58.038 57.018 1.020 19439
2823 1 12 . 1 1 64 64 HIS CB C 64 31.228 31.228 31.461 -0.233 19439
2824 1 12 . 1 1 64 64 HIS H H 64 8.477 8.477 8.817 -0.340 19439
2825 1 12 . 1 1 65 65 ALA HA H 65 4.339 4.339 4.463 -0.124 19439
2826 1 12 . 1 1 65 65 ALA CA C 65 53.281 53.281 52.444 0.836 19439
2827 1 12 . 1 1 65 65 ALA CB C 65 20.276 20.276 19.972 0.304 19439
2828 1 12 . 1 1 66 66 GLU N N 66 113.868 113.868 117.443 -3.575 19439
2829 1 12 . 1 1 66 66 GLU HA H 66 4.619 4.619 4.515 0.104 19439
2830 1 12 . 1 1 66 66 GLU CA C 66 54.727 54.727 55.033 -0.306 19439
2831 1 12 . 1 1 66 66 GLU CB C 66 32.894 32.894 32.801 0.093 19439
2832 1 12 . 1 1 66 66 GLU H H 66 7.759 7.759 8.002 -0.243 19439
2833 1 12 . 1 1 68 68 PRO HA H 68 4.219 4.219 4.285 -0.066 19439
2834 1 12 . 1 1 68 68 PRO CA C 68 64.664 64.664 65.039 -0.375 19439
2835 1 12 . 1 1 68 68 PRO CB C 68 32.066 32.066 31.689 0.377 19439
2836 1 12 . 1 1 69 69 LEU N N 69 117.262 117.262 118.457 -1.195 19439
2837 1 12 . 1 1 69 69 LEU HA H 69 4.182 4.182 4.215 -0.033 19439
2838 1 12 . 1 1 69 69 LEU CA C 69 52.430 52.430 53.710 -1.280 19439
2839 1 12 . 1 1 69 69 LEU CB C 69 40.907 40.907 41.527 -0.620 19439
2840 1 12 . 1 1 69 69 LEU H H 69 8.439 8.439 7.964 0.475 19439
2841 1 12 . 1 1 70 70 ALA N N 70 120.426 120.426 121.065 -0.639 19439
2842 1 12 . 1 1 70 70 ALA HA H 70 3.411 3.411 4.210 -0.799 19439
2843 1 12 . 1 1 70 70 ALA CA C 70 53.685 53.685 53.490 0.195 19439
2844 1 12 . 1 1 70 70 ALA CB C 70 17.914 17.914 18.630 -0.716 19439
2845 1 12 . 1 1 70 70 ALA H H 70 7.113 7.113 7.428 -0.315 19439
2846 1 12 . 1 1 71 71 GLY N N 71 108.911 108.911 113.886 -4.975 19439
2847 1 12 . 1 1 71 71 GLY CA C 71 45.215 45.215 45.134 0.081 19439
2848 1 12 . 1 1 71 71 GLY H H 71 8.856 8.856 8.910 -0.054 19439
2849 1 12 . 1 1 72 72 LEU N N 72 120.000 120.000 120.675 -0.675 19439
2850 1 12 . 1 1 72 72 LEU HA H 72 4.769 4.769 4.987 -0.218 19439
2851 1 12 . 1 1 72 72 LEU CA C 72 51.972 51.972 51.545 0.427 19439
2852 1 12 . 1 1 72 72 LEU CB C 72 41.255 41.255 42.948 -1.693 19439
2853 1 12 . 1 1 72 72 LEU H H 72 8.136 8.136 7.930 0.206 19439
2854 1 12 . 1 1 73 73 PRO HA H 73 4.739 4.739 4.627 0.112 19439
2855 1 12 . 1 1 73 73 PRO CA C 73 61.456 61.456 62.865 -1.409 19439
2856 1 12 . 1 1 73 73 PRO CB C 73 31.245 31.245 31.966 -0.721 19439
2857 1 12 . 1 1 74 74 VAL N N 74 121.723 121.723 120.921 0.802 19439
2858 1 12 . 1 1 74 74 VAL HA H 74 3.446 3.446 3.708 -0.262 19439
2859 1 12 . 1 1 74 74 VAL CA C 74 65.744 65.744 64.213 1.531 19439
2860 1 12 . 1 1 74 74 VAL CB C 74 31.236 31.236 31.938 -0.702 19439
2861 1 12 . 1 1 74 74 VAL H H 74 7.710 7.710 8.130 -0.420 19439
2862 1 12 . 1 1 75 75 THR N N 75 108.893 108.893 112.681 -3.788 19439
2863 1 12 . 1 1 75 75 THR HA H 75 4.937 4.937 4.611 0.326 19439
2864 1 12 . 1 1 75 75 THR CA C 75 59.892 59.892 59.347 0.545 19439
2865 1 12 . 1 1 75 75 THR CB C 75 12.018 12.018 70.709 -58.691 19439
2866 1 12 . 1 1 75 75 THR H H 75 8.710 8.710 8.185 0.525 19439
2867 1 12 . 1 1 76 76 ARG HA H 76 3.873 3.873 4.028 -0.155 19439
2868 1 12 . 1 1 76 76 ARG H H 76 8.447 8.447 8.824 -0.377 19439
2869 1 12 . 1 1 77 77 SER N N 77 114.482 114.482 116.052 -1.570 19439
2870 1 12 . 1 1 77 77 SER HA H 77 4.061 4.061 4.098 -0.037 19439
2871 1 12 . 1 1 77 77 SER CA C 77 60.467 60.467 61.586 -1.119 19439
2872 1 12 . 1 1 77 77 SER CB C 77 62.449 62.449 62.914 -0.465 19439
2873 1 12 . 1 1 77 77 SER H H 77 8.105 8.105 7.906 0.199 19439
2874 1 12 . 1 1 78 78 ASP N N 78 120.538 120.538 122.440 -1.902 19439
2875 1 12 . 1 1 78 78 ASP HA H 78 4.333 4.333 4.400 -0.067 19439
2876 1 12 . 1 1 78 78 ASP CA C 78 58.020 58.020 56.976 1.044 19439
2877 1 12 . 1 1 78 78 ASP CB C 78 43.252 43.252 40.366 2.886 19439
2878 1 12 . 1 1 78 78 ASP H H 78 7.300 7.300 7.688 -0.388 19439
2879 1 12 . 1 1 79 79 ALA N N 79 120.614 120.614 122.966 -2.352 19439
2880 1 12 . 1 1 79 79 ALA HA H 79 3.672 3.672 3.826 -0.154 19439
2881 1 12 . 1 1 79 79 ALA CA C 79 54.886 54.886 55.139 -0.253 19439
2882 1 12 . 1 1 79 79 ALA CB C 79 19.628 19.628 18.343 1.286 19439
2883 1 12 . 1 1 79 79 ALA H H 79 7.767 7.767 8.118 -0.351 19439
2884 1 12 . 1 1 80 80 ARG N N 80 116.203 116.203 118.993 -2.790 19439
2885 1 12 . 1 1 80 80 ARG HA H 80 3.732 3.732 3.994 -0.262 19439
2886 1 12 . 1 1 80 80 ARG CA C 80 61.441 61.441 59.532 1.909 19439
2887 1 12 . 1 1 80 80 ARG CB C 80 30.266 30.266 30.229 0.037 19439
2888 1 12 . 1 1 80 80 ARG H H 80 7.981 7.981 8.324 -0.343 19439
2889 1 12 . 1 1 81 81 VAL N N 81 119.192 119.192 120.023 -0.831 19439
2890 1 12 . 1 1 81 81 VAL HA H 81 3.582 3.582 3.948 -0.366 19439
2891 1 12 . 1 1 81 81 VAL CA C 81 66.909 66.909 66.605 0.304 19439
2892 1 12 . 1 1 81 81 VAL CB C 81 31.668 31.668 31.583 0.085 19439
2893 1 12 . 1 1 81 81 VAL H H 81 7.338 7.338 8.083 -0.745 19439
2894 1 12 . 1 1 82 82 LEU N N 82 118.722 118.722 121.634 -2.912 19439
2895 1 12 . 1 1 82 82 LEU HA H 82 4.044 4.044 3.896 0.148 19439
2896 1 12 . 1 1 82 82 LEU CA C 82 58.356 58.356 58.681 -0.325 19439
2897 1 12 . 1 1 82 82 LEU CB C 82 41.627 41.627 41.616 0.011 19439
2898 1 12 . 1 1 82 82 LEU H H 82 7.599 7.599 8.501 -0.902 19439
2899 1 12 . 1 1 83 83 ILE N N 83 120.893 120.893 120.076 0.817 19439
2900 1 12 . 1 1 83 83 ILE HA H 83 3.642 3.642 3.797 -0.155 19439
2901 1 12 . 1 1 83 83 ILE CA C 83 65.669 65.669 65.539 0.130 19439
2902 1 12 . 1 1 83 83 ILE CB C 83 38.579 38.579 38.008 0.571 19439
2903 1 12 . 1 1 83 83 ILE H H 83 8.546 8.546 8.471 0.075 19439
2904 1 12 . 1 1 84 84 PHE N N 84 123.343 123.343 120.587 2.756 19439
2905 1 12 . 1 1 84 84 PHE HA H 84 4.084 4.084 4.109 -0.025 19439
2906 1 12 . 1 1 84 84 PHE CA C 84 62.593 62.593 60.652 1.941 19439
2907 1 12 . 1 1 84 84 PHE CB C 84 39.211 39.211 38.822 0.389 19439
2908 1 12 . 1 1 84 84 PHE H H 84 8.622 8.622 8.742 -0.120 19439
2909 1 12 . 1 1 85 85 ASN N N 85 118.037 118.037 118.981 -0.944 19439
2910 1 12 . 1 1 85 85 ASN HA H 85 4.426 4.426 4.000 0.426 19439
2911 1 12 . 1 1 85 85 ASN CA C 85 56.045 56.045 56.708 -0.663 19439
2912 1 12 . 1 1 85 85 ASN CB C 85 37.785 37.785 38.480 -0.695 19439
2913 1 12 . 1 1 85 85 ASN H H 85 8.834 8.834 8.563 0.271 19439
2914 1 12 . 1 1 86 86 GLU N N 86 121.098 121.098 122.105 -1.007 19439
2915 1 12 . 1 1 86 86 GLU HA H 86 4.052 4.052 4.008 0.044 19439
2916 1 12 . 1 1 86 86 GLU CA C 86 59.328 59.328 59.652 -0.324 19439
2917 1 12 . 1 1 86 86 GLU CB C 86 30.253 30.253 29.591 0.662 19439
2918 1 12 . 1 1 86 86 GLU H H 86 8.105 8.105 8.346 -0.241 19439
2919 1 12 . 1 1 87 87 TRP N N 87 122.584 122.584 122.021 0.563 19439
2920 1 12 . 1 1 87 87 TRP HA H 87 4.006 4.006 4.172 -0.166 19439
2921 1 12 . 1 1 87 87 TRP CA C 87 61.545 61.545 61.900 -0.355 19439
2922 1 12 . 1 1 87 87 TRP CB C 87 27.943 27.943 29.492 -1.549 19439
2923 1 12 . 1 1 87 87 TRP H H 87 8.099 8.099 8.763 -0.664 19439
2924 1 12 . 1 1 88 88 GLU N N 88 117.357 117.357 118.494 -1.137 19439
2925 1 12 . 1 1 88 88 GLU HA H 88 2.919 2.919 3.274 -0.355 19439
2926 1 12 . 1 1 88 88 GLU CA C 88 59.804 59.804 59.782 0.022 19439
2927 1 12 . 1 1 88 88 GLU CB C 88 29.546 29.546 29.296 0.250 19439
2928 1 12 . 1 1 88 88 GLU H H 88 8.440 8.440 8.572 -0.132 19439
2929 1 12 . 1 1 89 89 GLU N N 89 116.109 116.109 118.925 -2.816 19439
2930 1 12 . 1 1 89 89 GLU HA H 89 3.995 3.995 3.863 0.132 19439
2931 1 12 . 1 1 89 89 GLU CA C 89 58.329 58.329 59.389 -1.060 19439
2932 1 12 . 1 1 89 89 GLU CB C 89 29.649 29.649 29.543 0.106 19439
2933 1 12 . 1 1 89 89 GLU H H 89 7.244 7.244 8.018 -0.774 19439
2934 1 12 . 1 1 90 90 ARG N N 90 120.512 120.512 118.651 1.861 19439
2935 1 12 . 1 1 90 90 ARG HA H 90 3.920 3.920 3.914 0.006 19439
2936 1 12 . 1 1 90 90 ARG CA C 90 58.683 58.683 58.971 -0.288 19439
2937 1 12 . 1 1 90 90 ARG CB C 90 30.659 30.659 29.687 0.972 19439
2938 1 12 . 1 1 90 90 ARG H H 90 8.368 8.368 8.221 0.147 19439
2939 1 12 . 1 1 91 91 LYS N N 91 120.024 120.024 119.721 0.303 19439
2940 1 12 . 1 1 91 91 LYS HA H 91 3.964 3.964 4.084 -0.120 19439
2941 1 12 . 1 1 91 91 LYS CA C 91 57.278 57.278 58.552 -1.274 19439
2942 1 12 . 1 1 91 91 LYS CB C 91 30.582 30.582 31.382 -0.800 19439
2943 1 12 . 1 1 91 91 LYS H H 91 8.491 8.491 7.986 0.505 19439
2944 1 12 . 1 1 92 92 LYS N N 92 118.192 118.192 118.197 -0.005 19439
2945 1 12 . 1 1 92 92 LYS HA H 92 3.796 3.796 4.041 -0.245 19439
2946 1 12 . 1 1 92 92 LYS CA C 92 58.976 58.976 58.767 0.209 19439
2947 1 12 . 1 1 92 92 LYS CB C 92 32.188 32.188 32.106 0.082 19439
2948 1 12 . 1 1 92 92 LYS H H 92 6.933 6.933 7.939 -1.006 19439
2949 1 12 . 1 1 93 93 SER N N 93 110.447 110.447 113.730 -3.283 19439
2950 1 12 . 1 1 93 93 SER HA H 93 4.484 4.484 4.321 0.163 19439
2951 1 12 . 1 1 93 93 SER CA C 93 58.386 58.386 60.225 -1.839 19439
2952 1 12 . 1 1 93 93 SER CB C 93 64.173 64.173 64.171 0.002 19439
2953 1 12 . 1 1 93 93 SER H H 93 7.282 7.282 7.676 -0.394 19439
2954 1 12 . 1 1 94 94 ASP N N 94 120.163 120.163 119.793 0.370 19439
2955 1 12 . 1 1 94 94 ASP HA H 94 4.872 4.872 5.053 -0.181 19439
2956 1 12 . 1 1 94 94 ASP CA C 94 51.157 51.157 52.616 -1.459 19439
2957 1 12 . 1 1 94 94 ASP CB C 94 41.256 41.256 43.060 -1.804 19439
2958 1 12 . 1 1 94 94 ASP H H 94 7.303 7.303 8.137 -0.834 19439
2959 1 12 . 1 1 95 95 PRO CA C 95 63.871 63.871 63.617 0.254 19439
2960 1 12 . 1 1 95 95 PRO CB C 95 31.497 31.497 32.245 -0.747 19439
2961 1 12 . 1 1 96 96 TRP N N 96 117.486 117.486 117.029 0.457 19439
2962 1 12 . 1 1 96 96 TRP HA H 96 4.637 4.637 4.575 0.062 19439
2963 1 12 . 1 1 96 96 TRP CA C 96 56.061 56.061 54.222 1.839 19439
2964 1 12 . 1 1 96 96 TRP CB C 96 28.605 28.605 28.288 0.317 19439
2965 1 12 . 1 1 96 96 TRP H H 96 7.484 7.484 7.884 -0.400 19439
2966 1 12 . 1 1 97 97 LEU N N 97 123.510 123.510 121.346 2.164 19439
2967 1 12 . 1 1 97 97 LEU HA H 97 4.098 4.098 3.124 0.974 19439
2968 1 12 . 1 1 97 97 LEU CA C 97 56.024 56.024 54.497 1.527 19439
2969 1 12 . 1 1 97 97 LEU CB C 97 42.893 42.893 42.178 0.715 19439
2970 1 12 . 1 1 97 97 LEU H H 97 7.137 7.137 6.816 0.321 19439
2971 1 12 . 1 1 98 98 ARG N N 98 129.724 129.724 125.252 4.472 19439
2972 1 12 . 1 1 98 98 ARG HA H 98 4.486 4.486 4.615 -0.129 19439
2973 1 12 . 1 1 98 98 ARG CA C 98 55.622 55.622 54.751 0.871 19439
2974 1 12 . 1 1 98 98 ARG CB C 98 31.229 31.229 31.481 -0.252 19439
2975 1 12 . 1 1 98 98 ARG H H 98 8.825 8.825 8.362 0.463 19439
2976 1 12 . 1 1 99 99 LEU N N 99 127.814 127.814 123.066 4.748 19439
2977 1 12 . 1 1 99 99 LEU HA H 99 3.586 3.586 4.277 -0.691 19439
2978 1 12 . 1 1 99 99 LEU CA C 99 54.352 54.352 54.453 -0.101 19439
2979 1 12 . 1 1 99 99 LEU CB C 99 40.485 40.485 41.734 -1.249 19439
2980 1 12 . 1 1 99 99 LEU H H 99 8.236 8.236 8.159 0.077 19439
2981 1 12 . 1 1 100 100 ASP N N 100 126.633 126.633 127.674 -1.041 19439
2982 1 12 . 1 1 100 100 ASP HA H 100 4.646 4.646 4.882 -0.236 19439
2983 1 12 . 1 1 100 100 ASP CA C 100 52.894 52.894 53.907 -1.012 19439
2984 1 12 . 1 1 100 100 ASP CB C 100 41.224 41.224 42.831 -1.607 19439
2985 1 12 . 1 1 100 100 ASP H H 100 8.018 8.018 8.597 -0.579 19439
2986 1 12 . 1 1 101 101 MET N N 101 122.473 122.473 119.604 2.869 19439
2987 1 12 . 1 1 101 101 MET HA H 101 4.481 4.481 4.660 -0.179 19439
2988 1 12 . 1 1 101 101 MET CA C 101 53.398 53.398 54.547 -1.149 19439
2989 1 12 . 1 1 101 101 MET CB C 101 33.296 33.296 32.921 0.375 19439
2990 1 12 . 1 1 101 101 MET H H 101 8.639 8.639 7.942 0.697 19439
2991 1 12 . 1 1 102 102 SER N N 102 116.243 116.243 116.548 -0.305 19439
2992 1 12 . 1 1 102 102 SER HA H 102 4.114 4.114 4.333 -0.219 19439
2993 1 12 . 1 1 102 102 SER CA C 102 58.709 58.709 57.619 1.090 19439
2994 1 12 . 1 1 102 102 SER CB C 102 64.701 64.701 65.075 -0.374 19439
2995 1 12 . 1 1 102 102 SER H H 102 8.096 8.096 7.893 0.203 19439
2996 1 12 . 1 1 103 103 ASP N N 103 121.639 121.639 124.290 -2.651 19439
2997 1 12 . 1 1 103 103 ASP HA H 103 3.724 3.724 3.984 -0.260 19439
2998 1 12 . 1 1 103 103 ASP CA C 103 57.296 57.296 56.501 0.795 19439
2999 1 12 . 1 1 103 103 ASP CB C 103 38.720 38.720 40.353 -1.633 19439
3000 1 12 . 1 1 103 103 ASP H H 103 8.669 8.669 8.779 -0.110 19439
3001 1 12 . 1 1 104 104 LYS N N 104 116.276 116.276 119.295 -3.019 19439
3002 1 12 . 1 1 104 104 LYS HA H 104 3.678 3.678 3.935 -0.257 19439
3003 1 12 . 1 1 104 104 LYS CA C 104 59.833 59.833 59.735 0.098 19439
3004 1 12 . 1 1 104 104 LYS CB C 104 32.090 32.090 32.194 -0.104 19439
3005 1 12 . 1 1 104 104 LYS H H 104 7.775 7.775 7.557 0.218 19439
3006 1 12 . 1 1 105 105 ALA N N 105 122.257 122.257 122.421 -0.164 19439
3007 1 12 . 1 1 105 105 ALA HA H 105 3.873 3.873 4.085 -0.212 19439
3008 1 12 . 1 1 105 105 ALA CA C 105 55.008 55.008 54.782 0.226 19439
3009 1 12 . 1 1 105 105 ALA CB C 105 17.741 17.741 18.099 -0.358 19439
3010 1 12 . 1 1 105 105 ALA H H 105 7.266 7.266 7.648 -0.382 19439
3011 1 12 . 1 1 106 106 ILE N N 106 119.452 119.452 119.836 -0.384 19439
3012 1 12 . 1 1 106 106 ILE HA H 106 3.419 3.419 3.805 -0.386 19439
3013 1 12 . 1 1 106 106 ILE CA C 106 65.971 65.971 64.553 1.418 19439
3014 1 12 . 1 1 106 106 ILE CB C 106 37.430 37.430 37.551 -0.121 19439
3015 1 12 . 1 1 106 106 ILE H H 106 7.974 7.974 7.679 0.295 19439
3016 1 12 . 1 1 107 107 PHE N N 107 117.814 117.814 118.982 -1.168 19439
3017 1 12 . 1 1 107 107 PHE HA H 107 4.368 4.368 4.672 -0.304 19439
3018 1 12 . 1 1 107 107 PHE CA C 107 56.844 56.844 58.752 -1.908 19439
3019 1 12 . 1 1 107 107 PHE CB C 107 37.150 37.150 37.572 -0.421 19439
3020 1 12 . 1 1 107 107 PHE H H 107 8.434 8.434 8.143 0.291 19439
3021 1 12 . 1 1 108 108 ARG N N 108 117.368 117.368 118.907 -1.539 19439
3022 1 12 . 1 1 108 108 ARG HA H 108 3.994 3.994 4.181 -0.187 19439
3023 1 12 . 1 1 108 108 ARG CA C 108 58.682 58.682 58.286 0.396 19439
3024 1 12 . 1 1 108 108 ARG CB C 108 30.287 30.287 29.784 0.503 19439
3025 1 12 . 1 1 108 108 ARG H H 108 7.474 7.474 8.190 -0.716 19439
3026 1 12 . 1 1 109 109 ARG N N 109 117.440 117.440 116.974 0.466 19439
3027 1 12 . 1 1 109 109 ARG HA H 109 3.900 3.900 3.979 -0.079 19439
3028 1 12 . 1 1 109 109 ARG CA C 109 57.312 57.312 58.126 -0.814 19439
3029 1 12 . 1 1 109 109 ARG CB C 109 31.626 31.626 30.861 0.765 19439
3030 1 12 . 1 1 109 109 ARG H H 109 7.118 7.118 7.703 -0.585 19439
3031 1 12 . 1 1 110 110 TYR N N 110 116.060 116.060 116.670 -0.610 19439
3032 1 12 . 1 1 110 110 TYR HA H 110 5.265 5.265 5.149 0.116 19439
3033 1 12 . 1 1 110 110 TYR CA C 110 54.188 54.188 54.769 -0.581 19439
3034 1 12 . 1 1 110 110 TYR CB C 110 38.484 38.484 38.498 -0.014 19439
3035 1 12 . 1 1 110 110 TYR H H 110 8.707 8.707 8.205 0.502 19439
3036 1 12 . 1 1 111 111 PRO HA H 111 4.388 4.388 4.667 -0.279 19439
3037 1 12 . 1 1 111 111 PRO CA C 111 64.847 64.847 64.336 0.511 19439
3038 1 12 . 1 1 111 111 PRO CB C 111 31.381 31.381 32.250 -0.869 19439
3039 1 12 . 1 1 112 112 HIS N N 112 115.542 115.542 114.005 1.537 19439
3040 1 12 . 1 1 112 112 HIS HA H 112 4.482 4.482 4.498 -0.016 19439
3041 1 12 . 1 1 112 112 HIS CA C 112 58.498 58.498 57.182 1.316 19439
3042 1 12 . 1 1 112 112 HIS CB C 112 29.654 29.654 28.593 1.061 19439
3043 1 12 . 1 1 112 112 HIS H H 112 8.196 8.196 8.236 -0.040 19439
3044 1 12 . 1 1 113 113 LEU N N 113 120.583 120.583 119.813 0.770 19439
3045 1 12 . 1 1 113 113 LEU HA H 113 4.165 4.165 4.287 -0.122 19439
3046 1 12 . 1 1 113 113 LEU CA C 113 54.013 54.013 55.193 -1.180 19439
3047 1 12 . 1 1 113 113 LEU CB C 113 41.669 41.669 41.862 -0.194 19439
3048 1 12 . 1 1 113 113 LEU H H 113 7.527 7.527 7.415 0.112 19439
3049 1 13 . 1 1 59 59 ALA N N 59 123.310 123.310 122.135 1.175 19439
3050 1 13 . 1 1 59 59 ALA HA H 59 4.232 4.232 4.626 -0.394 19439
3051 1 13 . 1 1 59 59 ALA CA C 59 52.274 52.274 51.644 0.630 19439
3052 1 13 . 1 1 59 59 ALA CB C 59 19.623 19.623 21.049 -1.426 19439
3053 1 13 . 1 1 59 59 ALA H H 59 7.894 7.894 8.007 -0.113 19439
3054 1 13 . 1 1 60 60 LEU N N 60 120.936 120.936 117.800 3.136 19439
3055 1 13 . 1 1 60 60 LEU HA H 60 4.364 4.364 4.529 -0.165 19439
3056 1 13 . 1 1 60 60 LEU CA C 60 54.130 54.130 55.196 -1.066 19439
3057 1 13 . 1 1 60 60 LEU CB C 60 43.209 43.209 42.105 1.105 19439
3058 1 13 . 1 1 60 60 LEU H H 60 8.046 8.046 8.499 -0.453 19439
3059 1 13 . 1 1 61 61 ALA N N 61 125.460 125.460 122.449 3.011 19439
3060 1 13 . 1 1 61 61 ALA HA H 61 4.364 4.364 4.364 -0.000 19439
3061 1 13 . 1 1 61 61 ALA CA C 61 51.176 51.176 51.543 -0.367 19439
3062 1 13 . 1 1 61 61 ALA CB C 61 20.172 20.172 19.689 0.483 19439
3063 1 13 . 1 1 61 61 ALA H H 61 8.338 8.338 7.350 0.988 19439
3064 1 13 . 1 1 62 62 ALA N N 62 127.765 127.765 125.025 2.740 19439
3065 1 13 . 1 1 62 62 ALA HA H 62 4.394 4.394 4.660 -0.266 19439
3066 1 13 . 1 1 62 62 ALA CA C 62 51.888 51.888 50.988 0.900 19439
3067 1 13 . 1 1 62 62 ALA CB C 62 18.806 18.806 20.850 -2.044 19439
3068 1 13 . 1 1 62 62 ALA H H 62 8.487 8.487 8.892 -0.405 19439
3069 1 13 . 1 1 63 63 LEU N N 63 120.199 120.199 121.070 -0.871 19439
3070 1 13 . 1 1 63 63 LEU HA H 63 4.828 4.828 4.951 -0.123 19439
3071 1 13 . 1 1 63 63 LEU CA C 63 51.852 51.852 52.907 -1.055 19439
3072 1 13 . 1 1 63 63 LEU CB C 63 44.081 44.081 45.537 -1.456 19439
3073 1 13 . 1 1 63 63 LEU H H 63 7.927 7.927 8.286 -0.359 19439
3074 1 13 . 1 1 64 64 HIS N N 64 122.277 122.277 119.476 2.801 19439
3075 1 13 . 1 1 64 64 HIS HA H 64 4.114 4.114 4.557 -0.443 19439
3076 1 13 . 1 1 64 64 HIS CA C 64 58.038 58.038 57.034 1.004 19439
3077 1 13 . 1 1 64 64 HIS CB C 64 31.228 31.228 31.171 0.057 19439
3078 1 13 . 1 1 64 64 HIS H H 64 8.477 8.477 8.816 -0.339 19439
3079 1 13 . 1 1 65 65 ALA HA H 65 4.339 4.339 4.365 -0.026 19439
3080 1 13 . 1 1 65 65 ALA CA C 65 53.281 53.281 53.061 0.220 19439
3081 1 13 . 1 1 65 65 ALA CB C 65 20.276 20.276 19.762 0.513 19439
3082 1 13 . 1 1 66 66 GLU N N 66 113.868 113.868 116.434 -2.566 19439
3083 1 13 . 1 1 66 66 GLU HA H 66 4.619 4.619 4.509 0.110 19439
3084 1 13 . 1 1 66 66 GLU CA C 66 54.727 54.727 55.364 -0.637 19439
3085 1 13 . 1 1 66 66 GLU CB C 66 32.894 32.894 32.545 0.349 19439
3086 1 13 . 1 1 66 66 GLU H H 66 7.759 7.759 7.940 -0.181 19439
3087 1 13 . 1 1 68 68 PRO HA H 68 4.219 4.219 4.240 -0.021 19439
3088 1 13 . 1 1 68 68 PRO CA C 68 64.664 64.664 65.080 -0.416 19439
3089 1 13 . 1 1 68 68 PRO CB C 68 32.066 32.066 31.733 0.333 19439
3090 1 13 . 1 1 69 69 LEU N N 69 117.262 117.262 117.330 -0.068 19439
3091 1 13 . 1 1 69 69 LEU HA H 69 4.182 4.182 4.394 -0.212 19439
3092 1 13 . 1 1 69 69 LEU CA C 69 52.430 52.430 53.220 -0.790 19439
3093 1 13 . 1 1 69 69 LEU CB C 69 40.907 40.907 40.965 -0.058 19439
3094 1 13 . 1 1 69 69 LEU H H 69 8.439 8.439 7.930 0.509 19439
3095 1 13 . 1 1 70 70 ALA N N 70 120.426 120.426 121.561 -1.135 19439
3096 1 13 . 1 1 70 70 ALA HA H 70 3.411 3.411 4.118 -0.707 19439
3097 1 13 . 1 1 70 70 ALA CA C 70 53.685 53.685 53.452 0.233 19439
3098 1 13 . 1 1 70 70 ALA CB C 70 17.914 17.914 18.654 -0.740 19439
3099 1 13 . 1 1 70 70 ALA H H 70 7.113 7.113 7.583 -0.470 19439
3100 1 13 . 1 1 71 71 GLY N N 71 108.911 108.911 112.063 -3.152 19439
3101 1 13 . 1 1 71 71 GLY CA C 71 45.215 45.215 45.015 0.200 19439
3102 1 13 . 1 1 71 71 GLY H H 71 8.856 8.856 8.904 -0.048 19439
3103 1 13 . 1 1 72 72 LEU N N 72 120.000 120.000 121.673 -1.673 19439
3104 1 13 . 1 1 72 72 LEU HA H 72 4.769 4.769 4.922 -0.153 19439
3105 1 13 . 1 1 72 72 LEU CA C 72 51.972 51.972 51.537 0.435 19439
3106 1 13 . 1 1 72 72 LEU CB C 72 41.255 41.255 42.804 -1.549 19439
3107 1 13 . 1 1 72 72 LEU H H 72 8.136 8.136 8.034 0.102 19439
3108 1 13 . 1 1 73 73 PRO HA H 73 4.739 4.739 4.643 0.096 19439
3109 1 13 . 1 1 73 73 PRO CA C 73 61.456 61.456 62.851 -1.395 19439
3110 1 13 . 1 1 73 73 PRO CB C 73 31.245 31.245 32.031 -0.786 19439
3111 1 13 . 1 1 74 74 VAL N N 74 121.723 121.723 119.418 2.305 19439
3112 1 13 . 1 1 74 74 VAL HA H 74 3.446 3.446 3.885 -0.439 19439
3113 1 13 . 1 1 74 74 VAL CA C 74 65.744 65.744 63.788 1.956 19439
3114 1 13 . 1 1 74 74 VAL CB C 74 31.236 31.236 31.935 -0.699 19439
3115 1 13 . 1 1 74 74 VAL H H 74 7.710 7.710 8.011 -0.301 19439
3116 1 13 . 1 1 75 75 THR N N 75 108.893 108.893 108.475 0.418 19439
3117 1 13 . 1 1 75 75 THR HA H 75 4.937 4.937 4.590 0.347 19439
3118 1 13 . 1 1 75 75 THR CA C 75 59.892 59.892 59.829 0.063 19439
3119 1 13 . 1 1 75 75 THR CB C 75 12.018 12.018 71.766 -59.748 19439
3120 1 13 . 1 1 75 75 THR H H 75 8.710 8.710 7.357 1.353 19439
3121 1 13 . 1 1 76 76 ARG HA H 76 3.873 3.873 4.092 -0.219 19439
3122 1 13 . 1 1 76 76 ARG H H 76 8.447 8.447 8.807 -0.360 19439
3123 1 13 . 1 1 77 77 SER N N 77 114.482 114.482 115.868 -1.386 19439
3124 1 13 . 1 1 77 77 SER HA H 77 4.061 4.061 4.200 -0.139 19439
3125 1 13 . 1 1 77 77 SER CA C 77 60.467 60.467 61.208 -0.741 19439
3126 1 13 . 1 1 77 77 SER CB C 77 62.449 62.449 62.846 -0.397 19439
3127 1 13 . 1 1 77 77 SER H H 77 8.105 8.105 7.875 0.230 19439
3128 1 13 . 1 1 78 78 ASP N N 78 120.538 120.538 122.085 -1.547 19439
3129 1 13 . 1 1 78 78 ASP HA H 78 4.333 4.333 4.328 0.005 19439
3130 1 13 . 1 1 78 78 ASP CA C 78 58.020 58.020 57.304 0.716 19439
3131 1 13 . 1 1 78 78 ASP CB C 78 43.252 43.252 40.464 2.788 19439
3132 1 13 . 1 1 78 78 ASP H H 78 7.300 7.300 8.098 -0.798 19439
3133 1 13 . 1 1 79 79 ALA N N 79 120.614 120.614 123.041 -2.427 19439
3134 1 13 . 1 1 79 79 ALA HA H 79 3.672 3.672 3.901 -0.229 19439
3135 1 13 . 1 1 79 79 ALA CA C 79 54.886 54.886 55.279 -0.393 19439
3136 1 13 . 1 1 79 79 ALA CB C 79 19.628 19.628 18.241 1.387 19439
3137 1 13 . 1 1 79 79 ALA H H 79 7.767 7.767 8.371 -0.604 19439
3138 1 13 . 1 1 80 80 ARG N N 80 116.203 116.203 119.327 -3.124 19439
3139 1 13 . 1 1 80 80 ARG HA H 80 3.732 3.732 4.088 -0.356 19439
3140 1 13 . 1 1 80 80 ARG CA C 80 61.441 61.441 59.127 2.314 19439
3141 1 13 . 1 1 80 80 ARG CB C 80 30.266 30.266 30.134 0.132 19439
3142 1 13 . 1 1 80 80 ARG H H 80 7.981 7.981 8.119 -0.138 19439
3143 1 13 . 1 1 81 81 VAL N N 81 119.192 119.192 119.899 -0.707 19439
3144 1 13 . 1 1 81 81 VAL HA H 81 3.582 3.582 3.969 -0.387 19439
3145 1 13 . 1 1 81 81 VAL CA C 81 66.909 66.909 66.644 0.265 19439
3146 1 13 . 1 1 81 81 VAL CB C 81 31.668 31.668 31.707 -0.039 19439
3147 1 13 . 1 1 81 81 VAL H H 81 7.338 7.338 8.180 -0.842 19439
3148 1 13 . 1 1 82 82 LEU N N 82 118.722 118.722 121.311 -2.589 19439
3149 1 13 . 1 1 82 82 LEU HA H 82 4.044 4.044 3.938 0.106 19439
3150 1 13 . 1 1 82 82 LEU CA C 82 58.356 58.356 58.673 -0.317 19439
3151 1 13 . 1 1 82 82 LEU CB C 82 41.627 41.627 41.688 -0.061 19439
3152 1 13 . 1 1 82 82 LEU H H 82 7.599 7.599 8.353 -0.754 19439
3153 1 13 . 1 1 83 83 ILE N N 83 120.893 120.893 119.591 1.302 19439
3154 1 13 . 1 1 83 83 ILE HA H 83 3.642 3.642 3.729 -0.087 19439
3155 1 13 . 1 1 83 83 ILE CA C 83 65.669 65.669 65.606 0.063 19439
3156 1 13 . 1 1 83 83 ILE CB C 83 38.579 38.579 37.923 0.656 19439
3157 1 13 . 1 1 83 83 ILE H H 83 8.546 8.546 8.382 0.164 19439
3158 1 13 . 1 1 84 84 PHE N N 84 123.343 123.343 120.515 2.828 19439
3159 1 13 . 1 1 84 84 PHE HA H 84 4.084 4.084 4.103 -0.019 19439
3160 1 13 . 1 1 84 84 PHE CA C 84 62.593 62.593 60.147 2.446 19439
3161 1 13 . 1 1 84 84 PHE CB C 84 39.211 39.211 38.620 0.591 19439
3162 1 13 . 1 1 84 84 PHE H H 84 8.622 8.622 8.537 0.085 19439
3163 1 13 . 1 1 85 85 ASN N N 85 118.037 118.037 117.363 0.674 19439
3164 1 13 . 1 1 85 85 ASN HA H 85 4.426 4.426 4.147 0.279 19439
3165 1 13 . 1 1 85 85 ASN CA C 85 56.045 56.045 56.553 -0.508 19439
3166 1 13 . 1 1 85 85 ASN CB C 85 37.785 37.785 38.617 -0.833 19439
3167 1 13 . 1 1 85 85 ASN H H 85 8.834 8.834 8.613 0.221 19439
3168 1 13 . 1 1 86 86 GLU N N 86 121.098 121.098 122.237 -1.139 19439
3169 1 13 . 1 1 86 86 GLU HA H 86 4.052 4.052 4.016 0.036 19439
3170 1 13 . 1 1 86 86 GLU CA C 86 59.328 59.328 59.657 -0.330 19439
3171 1 13 . 1 1 86 86 GLU CB C 86 30.253 30.253 29.766 0.487 19439
3172 1 13 . 1 1 86 86 GLU H H 86 8.105 8.105 8.332 -0.227 19439
3173 1 13 . 1 1 87 87 TRP N N 87 122.584 122.584 122.225 0.359 19439
3174 1 13 . 1 1 87 87 TRP HA H 87 4.006 4.006 4.209 -0.203 19439
3175 1 13 . 1 1 87 87 TRP CA C 87 61.545 61.545 61.778 -0.233 19439
3176 1 13 . 1 1 87 87 TRP CB C 87 27.943 27.943 29.566 -1.623 19439
3177 1 13 . 1 1 87 87 TRP H H 87 8.099 8.099 8.754 -0.655 19439
3178 1 13 . 1 1 88 88 GLU N N 88 117.357 117.357 118.737 -1.380 19439
3179 1 13 . 1 1 88 88 GLU HA H 88 2.919 2.919 3.367 -0.448 19439
3180 1 13 . 1 1 88 88 GLU CA C 88 59.804 59.804 59.696 0.108 19439
3181 1 13 . 1 1 88 88 GLU CB C 88 29.546 29.546 29.043 0.503 19439
3182 1 13 . 1 1 88 88 GLU H H 88 8.440 8.440 8.487 -0.047 19439
3183 1 13 . 1 1 89 89 GLU N N 89 116.109 116.109 120.160 -4.051 19439
3184 1 13 . 1 1 89 89 GLU HA H 89 3.995 3.995 3.891 0.104 19439
3185 1 13 . 1 1 89 89 GLU CA C 89 58.329 58.329 59.312 -0.983 19439
3186 1 13 . 1 1 89 89 GLU CB C 89 29.649 29.649 29.479 0.170 19439
3187 1 13 . 1 1 89 89 GLU H H 89 7.244 7.244 8.029 -0.785 19439
3188 1 13 . 1 1 90 90 ARG N N 90 120.512 120.512 118.453 2.059 19439
3189 1 13 . 1 1 90 90 ARG HA H 90 3.920 3.920 3.976 -0.056 19439
3190 1 13 . 1 1 90 90 ARG CA C 90 58.683 58.683 58.877 -0.194 19439
3191 1 13 . 1 1 90 90 ARG CB C 90 30.659 30.659 29.842 0.817 19439
3192 1 13 . 1 1 90 90 ARG H H 90 8.368 8.368 8.098 0.270 19439
3193 1 13 . 1 1 91 91 LYS N N 91 120.024 120.024 119.875 0.149 19439
3194 1 13 . 1 1 91 91 LYS HA H 91 3.964 3.964 3.939 0.025 19439
3195 1 13 . 1 1 91 91 LYS CA C 91 57.278 57.278 58.514 -1.236 19439
3196 1 13 . 1 1 91 91 LYS CB C 91 30.582 30.582 31.189 -0.608 19439
3197 1 13 . 1 1 91 91 LYS H H 91 8.491 8.491 8.078 0.413 19439
3198 1 13 . 1 1 92 92 LYS N N 92 118.192 118.192 117.179 1.013 19439
3199 1 13 . 1 1 92 92 LYS HA H 92 3.796 3.796 4.040 -0.244 19439
3200 1 13 . 1 1 92 92 LYS CA C 92 58.976 58.976 58.324 0.652 19439
3201 1 13 . 1 1 92 92 LYS CB C 92 32.188 32.188 32.196 -0.008 19439
3202 1 13 . 1 1 92 92 LYS H H 92 6.933 6.933 7.789 -0.856 19439
3203 1 13 . 1 1 93 93 SER N N 93 110.447 110.447 112.604 -2.157 19439
3204 1 13 . 1 1 93 93 SER HA H 93 4.484 4.484 4.114 0.370 19439
3205 1 13 . 1 1 93 93 SER CA C 93 58.386 58.386 60.458 -2.072 19439
3206 1 13 . 1 1 93 93 SER CB C 93 64.173 64.173 64.409 -0.236 19439
3207 1 13 . 1 1 93 93 SER H H 93 7.282 7.282 7.839 -0.557 19439
3208 1 13 . 1 1 94 94 ASP N N 94 120.163 120.163 119.340 0.823 19439
3209 1 13 . 1 1 94 94 ASP HA H 94 4.872 4.872 5.032 -0.160 19439
3210 1 13 . 1 1 94 94 ASP CA C 94 51.157 51.157 52.584 -1.427 19439
3211 1 13 . 1 1 94 94 ASP CB C 94 41.256 41.256 42.803 -1.547 19439
3212 1 13 . 1 1 94 94 ASP H H 94 7.303 7.303 8.175 -0.872 19439
3213 1 13 . 1 1 95 95 PRO CA C 95 63.871 63.871 64.255 -0.384 19439
3214 1 13 . 1 1 95 95 PRO CB C 95 31.497 31.497 32.422 -0.925 19439
3215 1 13 . 1 1 96 96 TRP N N 96 117.486 117.486 117.872 -0.386 19439
3216 1 13 . 1 1 96 96 TRP HA H 96 4.637 4.637 4.621 0.016 19439
3217 1 13 . 1 1 96 96 TRP CA C 96 56.061 56.061 55.483 0.579 19439
3218 1 13 . 1 1 96 96 TRP CB C 96 28.605 28.605 28.100 0.505 19439
3219 1 13 . 1 1 96 96 TRP H H 96 7.484 7.484 7.935 -0.451 19439
3220 1 13 . 1 1 97 97 LEU N N 97 123.510 123.510 120.830 2.680 19439
3221 1 13 . 1 1 97 97 LEU HA H 97 4.098 4.098 3.157 0.941 19439
3222 1 13 . 1 1 97 97 LEU CA C 97 56.024 56.024 54.586 1.438 19439
3223 1 13 . 1 1 97 97 LEU CB C 97 42.893 42.893 42.868 0.025 19439
3224 1 13 . 1 1 97 97 LEU H H 97 7.137 7.137 6.866 0.271 19439
3225 1 13 . 1 1 98 98 ARG N N 98 129.724 129.724 123.988 5.736 19439
3226 1 13 . 1 1 98 98 ARG HA H 98 4.486 4.486 4.734 -0.248 19439
3227 1 13 . 1 1 98 98 ARG CA C 98 55.622 55.622 54.397 1.225 19439
3228 1 13 . 1 1 98 98 ARG CB C 98 31.229 31.229 31.984 -0.755 19439
3229 1 13 . 1 1 98 98 ARG H H 98 8.825 8.825 8.269 0.556 19439
3230 1 13 . 1 1 99 99 LEU N N 99 127.814 127.814 122.798 5.016 19439
3231 1 13 . 1 1 99 99 LEU HA H 99 3.586 3.586 4.250 -0.664 19439
3232 1 13 . 1 1 99 99 LEU CA C 99 54.352 54.352 54.157 0.195 19439
3233 1 13 . 1 1 99 99 LEU CB C 99 40.485 40.485 41.810 -1.325 19439
3234 1 13 . 1 1 99 99 LEU H H 99 8.236 8.236 8.068 0.168 19439
3235 1 13 . 1 1 100 100 ASP N N 100 126.633 126.633 128.554 -1.921 19439
3236 1 13 . 1 1 100 100 ASP HA H 100 4.646 4.646 4.838 -0.192 19439
3237 1 13 . 1 1 100 100 ASP CA C 100 52.894 52.894 54.154 -1.260 19439
3238 1 13 . 1 1 100 100 ASP CB C 100 41.224 41.224 42.679 -1.455 19439
3239 1 13 . 1 1 100 100 ASP H H 100 8.018 8.018 8.704 -0.686 19439
3240 1 13 . 1 1 101 101 MET N N 101 122.473 122.473 120.229 2.244 19439
3241 1 13 . 1 1 101 101 MET HA H 101 4.481 4.481 4.552 -0.071 19439
3242 1 13 . 1 1 101 101 MET CA C 101 53.398 53.398 54.222 -0.824 19439
3243 1 13 . 1 1 101 101 MET CB C 101 33.296 33.296 33.239 0.057 19439
3244 1 13 . 1 1 101 101 MET H H 101 8.639 8.639 7.891 0.748 19439
3245 1 13 . 1 1 102 102 SER N N 102 116.243 116.243 116.412 -0.169 19439
3246 1 13 . 1 1 102 102 SER HA H 102 4.114 4.114 4.386 -0.272 19439
3247 1 13 . 1 1 102 102 SER CA C 102 58.709 58.709 57.750 0.959 19439
3248 1 13 . 1 1 102 102 SER CB C 102 64.701 64.701 64.493 0.208 19439
3249 1 13 . 1 1 102 102 SER H H 102 8.096 8.096 7.753 0.343 19439
3250 1 13 . 1 1 103 103 ASP N N 103 121.639 121.639 123.055 -1.416 19439
3251 1 13 . 1 1 103 103 ASP HA H 103 3.724 3.724 3.851 -0.127 19439
3252 1 13 . 1 1 103 103 ASP CA C 103 57.296 57.296 57.919 -0.623 19439
3253 1 13 . 1 1 103 103 ASP CB C 103 38.720 38.720 40.298 -1.578 19439
3254 1 13 . 1 1 103 103 ASP H H 103 8.669 8.669 8.733 -0.064 19439
3255 1 13 . 1 1 104 104 LYS N N 104 116.276 116.276 119.025 -2.749 19439
3256 1 13 . 1 1 104 104 LYS HA H 104 3.678 3.678 3.960 -0.282 19439
3257 1 13 . 1 1 104 104 LYS CA C 104 59.833 59.833 58.995 0.838 19439
3258 1 13 . 1 1 104 104 LYS CB C 104 32.090 32.090 32.169 -0.079 19439
3259 1 13 . 1 1 104 104 LYS H H 104 7.775 7.775 8.085 -0.310 19439
3260 1 13 . 1 1 105 105 ALA N N 105 122.257 122.257 122.444 -0.187 19439
3261 1 13 . 1 1 105 105 ALA HA H 105 3.873 3.873 4.043 -0.170 19439
3262 1 13 . 1 1 105 105 ALA CA C 105 55.008 55.008 54.858 0.150 19439
3263 1 13 . 1 1 105 105 ALA CB C 105 17.741 17.741 18.158 -0.417 19439
3264 1 13 . 1 1 105 105 ALA H H 105 7.266 7.266 7.481 -0.215 19439
3265 1 13 . 1 1 106 106 ILE N N 106 119.452 119.452 119.629 -0.177 19439
3266 1 13 . 1 1 106 106 ILE HA H 106 3.419 3.419 3.823 -0.404 19439
3267 1 13 . 1 1 106 106 ILE CA C 106 65.971 65.971 64.581 1.390 19439
3268 1 13 . 1 1 106 106 ILE CB C 106 37.430 37.430 37.652 -0.222 19439
3269 1 13 . 1 1 106 106 ILE H H 106 7.974 7.974 7.904 0.070 19439
3270 1 13 . 1 1 107 107 PHE N N 107 117.814 117.814 119.120 -1.306 19439
3271 1 13 . 1 1 107 107 PHE HA H 107 4.368 4.368 4.699 -0.331 19439
3272 1 13 . 1 1 107 107 PHE CA C 107 56.844 56.844 58.385 -1.541 19439
3273 1 13 . 1 1 107 107 PHE CB C 107 37.150 37.150 37.523 -0.373 19439
3274 1 13 . 1 1 107 107 PHE H H 107 8.434 8.434 8.056 0.378 19439
3275 1 13 . 1 1 108 108 ARG N N 108 117.368 117.368 118.925 -1.557 19439
3276 1 13 . 1 1 108 108 ARG HA H 108 3.994 3.994 4.191 -0.197 19439
3277 1 13 . 1 1 108 108 ARG CA C 108 58.682 58.682 58.229 0.453 19439
3278 1 13 . 1 1 108 108 ARG CB C 108 30.287 30.287 29.807 0.480 19439
3279 1 13 . 1 1 108 108 ARG H H 108 7.474 7.474 8.358 -0.884 19439
3280 1 13 . 1 1 109 109 ARG N N 109 117.440 117.440 117.072 0.368 19439
3281 1 13 . 1 1 109 109 ARG HA H 109 3.900 3.900 3.983 -0.083 19439
3282 1 13 . 1 1 109 109 ARG CA C 109 57.312 57.312 58.172 -0.860 19439
3283 1 13 . 1 1 109 109 ARG CB C 109 31.626 31.626 30.772 0.854 19439
3284 1 13 . 1 1 109 109 ARG H H 109 7.118 7.118 7.675 -0.557 19439
3285 1 13 . 1 1 110 110 TYR N N 110 116.060 116.060 116.637 -0.577 19439
3286 1 13 . 1 1 110 110 TYR HA H 110 5.265 5.265 5.162 0.103 19439
3287 1 13 . 1 1 110 110 TYR CA C 110 54.188 54.188 54.573 -0.385 19439
3288 1 13 . 1 1 110 110 TYR CB C 110 38.484 38.484 38.368 0.116 19439
3289 1 13 . 1 1 110 110 TYR H H 110 8.707 8.707 8.181 0.526 19439
3290 1 13 . 1 1 111 111 PRO HA H 111 4.388 4.388 4.683 -0.295 19439
3291 1 13 . 1 1 111 111 PRO CA C 111 64.847 64.847 64.110 0.737 19439
3292 1 13 . 1 1 111 111 PRO CB C 111 31.381 31.381 32.144 -0.763 19439
3293 1 13 . 1 1 112 112 HIS N N 112 115.542 115.542 115.461 0.081 19439
3294 1 13 . 1 1 112 112 HIS HA H 112 4.482 4.482 4.615 -0.133 19439
3295 1 13 . 1 1 112 112 HIS CA C 112 58.498 58.498 56.644 1.854 19439
3296 1 13 . 1 1 112 112 HIS CB C 112 29.654 29.654 28.888 0.766 19439
3297 1 13 . 1 1 112 112 HIS H H 112 8.196 8.196 8.441 -0.245 19439
3298 1 13 . 1 1 113 113 LEU N N 113 120.583 120.583 120.605 -0.022 19439
3299 1 13 . 1 1 113 113 LEU HA H 113 4.165 4.165 4.164 0.001 19439
3300 1 13 . 1 1 113 113 LEU CA C 113 54.013 54.013 55.644 -1.631 19439
3301 1 13 . 1 1 113 113 LEU CB C 113 41.669 41.669 42.091 -0.422 19439
3302 1 13 . 1 1 113 113 LEU H H 113 7.527 7.527 7.573 -0.046 19439
3303 1 14 . 1 1 59 59 ALA N N 59 123.310 123.310 124.172 -0.862 19439
3304 1 14 . 1 1 59 59 ALA HA H 59 4.232 4.232 4.562 -0.330 19439
3305 1 14 . 1 1 59 59 ALA CA C 59 52.274 52.274 52.443 -0.169 19439
3306 1 14 . 1 1 59 59 ALA CB C 59 19.623 19.623 19.375 0.248 19439
3307 1 14 . 1 1 59 59 ALA H H 59 7.894 7.894 8.377 -0.483 19439
3308 1 14 . 1 1 60 60 LEU N N 60 120.936 120.936 115.068 5.868 19439
3309 1 14 . 1 1 60 60 LEU HA H 60 4.364 4.364 4.359 0.005 19439
3310 1 14 . 1 1 60 60 LEU CA C 60 54.130 54.130 54.806 -0.676 19439
3311 1 14 . 1 1 60 60 LEU CB C 60 43.209 43.209 40.902 2.307 19439
3312 1 14 . 1 1 60 60 LEU H H 60 8.046 8.046 7.696 0.350 19439
3313 1 14 . 1 1 61 61 ALA N N 61 125.460 125.460 121.894 3.566 19439
3314 1 14 . 1 1 61 61 ALA HA H 61 4.364 4.364 4.308 0.056 19439
3315 1 14 . 1 1 61 61 ALA CA C 61 51.176 51.176 51.823 -0.647 19439
3316 1 14 . 1 1 61 61 ALA CB C 61 20.172 20.172 19.674 0.498 19439
3317 1 14 . 1 1 61 61 ALA H H 61 8.338 8.338 7.656 0.682 19439
3318 1 14 . 1 1 62 62 ALA N N 62 127.765 127.765 126.564 1.201 19439
3319 1 14 . 1 1 62 62 ALA HA H 62 4.394 4.394 4.674 -0.280 19439
3320 1 14 . 1 1 62 62 ALA CA C 62 51.888 51.888 50.807 1.081 19439
3321 1 14 . 1 1 62 62 ALA CB C 62 18.806 18.806 21.181 -2.375 19439
3322 1 14 . 1 1 62 62 ALA H H 62 8.487 8.487 9.010 -0.523 19439
3323 1 14 . 1 1 63 63 LEU N N 63 120.199 120.199 120.584 -0.385 19439
3324 1 14 . 1 1 63 63 LEU HA H 63 4.828 4.828 4.960 -0.132 19439
3325 1 14 . 1 1 63 63 LEU CA C 63 51.852 51.852 53.041 -1.189 19439
3326 1 14 . 1 1 63 63 LEU CB C 63 44.081 44.081 45.583 -1.502 19439
3327 1 14 . 1 1 63 63 LEU H H 63 7.927 7.927 8.282 -0.355 19439
3328 1 14 . 1 1 64 64 HIS N N 64 122.277 122.277 119.246 3.031 19439
3329 1 14 . 1 1 64 64 HIS HA H 64 4.114 4.114 4.585 -0.471 19439
3330 1 14 . 1 1 64 64 HIS CA C 64 58.038 58.038 56.945 1.093 19439
3331 1 14 . 1 1 64 64 HIS CB C 64 31.228 31.228 31.527 -0.299 19439
3332 1 14 . 1 1 64 64 HIS H H 64 8.477 8.477 8.870 -0.393 19439
3333 1 14 . 1 1 65 65 ALA HA H 65 4.339 4.339 4.466 -0.127 19439
3334 1 14 . 1 1 65 65 ALA CA C 65 53.281 53.281 52.439 0.842 19439
3335 1 14 . 1 1 65 65 ALA CB C 65 20.276 20.276 19.988 0.288 19439
3336 1 14 . 1 1 66 66 GLU N N 66 113.868 113.868 117.428 -3.560 19439
3337 1 14 . 1 1 66 66 GLU HA H 66 4.619 4.619 4.514 0.105 19439
3338 1 14 . 1 1 66 66 GLU CA C 66 54.727 54.727 55.023 -0.296 19439
3339 1 14 . 1 1 66 66 GLU CB C 66 32.894 32.894 32.821 0.074 19439
3340 1 14 . 1 1 66 66 GLU H H 66 7.759 7.759 7.996 -0.237 19439
3341 1 14 . 1 1 68 68 PRO HA H 68 4.219 4.219 4.286 -0.067 19439
3342 1 14 . 1 1 68 68 PRO CA C 68 64.664 64.664 65.028 -0.364 19439
3343 1 14 . 1 1 68 68 PRO CB C 68 32.066 32.066 31.683 0.383 19439
3344 1 14 . 1 1 69 69 LEU N N 69 117.262 117.262 118.257 -0.995 19439
3345 1 14 . 1 1 69 69 LEU HA H 69 4.182 4.182 4.199 -0.017 19439
3346 1 14 . 1 1 69 69 LEU CA C 69 52.430 52.430 53.507 -1.077 19439
3347 1 14 . 1 1 69 69 LEU CB C 69 40.907 40.907 41.211 -0.304 19439
3348 1 14 . 1 1 69 69 LEU H H 69 8.439 8.439 7.932 0.507 19439
3349 1 14 . 1 1 70 70 ALA N N 70 120.426 120.426 121.076 -0.650 19439
3350 1 14 . 1 1 70 70 ALA HA H 70 3.411 3.411 4.204 -0.793 19439
3351 1 14 . 1 1 70 70 ALA CA C 70 53.685 53.685 53.489 0.196 19439
3352 1 14 . 1 1 70 70 ALA CB C 70 17.914 17.914 18.639 -0.725 19439
3353 1 14 . 1 1 70 70 ALA H H 70 7.113 7.113 7.427 -0.314 19439
3354 1 14 . 1 1 71 71 GLY N N 71 108.911 108.911 112.685 -3.774 19439
3355 1 14 . 1 1 71 71 GLY CA C 71 45.215 45.215 45.057 0.158 19439
3356 1 14 . 1 1 71 71 GLY H H 71 8.856 8.856 8.784 0.072 19439
3357 1 14 . 1 1 72 72 LEU N N 72 120.000 120.000 121.623 -1.623 19439
3358 1 14 . 1 1 72 72 LEU HA H 72 4.769 4.769 4.937 -0.168 19439
3359 1 14 . 1 1 72 72 LEU CA C 72 51.972 51.972 51.570 0.402 19439
3360 1 14 . 1 1 72 72 LEU CB C 72 41.255 41.255 42.859 -1.604 19439
3361 1 14 . 1 1 72 72 LEU H H 72 8.136 8.136 8.045 0.091 19439
3362 1 14 . 1 1 73 73 PRO HA H 73 4.739 4.739 4.659 0.080 19439
3363 1 14 . 1 1 73 73 PRO CA C 73 61.456 61.456 62.808 -1.352 19439
3364 1 14 . 1 1 73 73 PRO CB C 73 31.245 31.245 31.953 -0.708 19439
3365 1 14 . 1 1 74 74 VAL N N 74 121.723 121.723 120.269 1.454 19439
3366 1 14 . 1 1 74 74 VAL HA H 74 3.446 3.446 3.726 -0.280 19439
3367 1 14 . 1 1 74 74 VAL CA C 74 65.744 65.744 63.925 1.819 19439
3368 1 14 . 1 1 74 74 VAL CB C 74 31.236 31.236 31.920 -0.684 19439
3369 1 14 . 1 1 74 74 VAL H H 74 7.710 7.710 8.110 -0.400 19439
3370 1 14 . 1 1 75 75 THR N N 75 108.893 108.893 109.380 -0.487 19439
3371 1 14 . 1 1 75 75 THR HA H 75 4.937 4.937 4.643 0.294 19439
3372 1 14 . 1 1 75 75 THR CA C 75 59.892 59.892 59.662 0.230 19439
3373 1 14 . 1 1 75 75 THR CB C 75 12.018 12.018 71.864 -59.846 19439
3374 1 14 . 1 1 75 75 THR H H 75 8.710 8.710 7.863 0.847 19439
3375 1 14 . 1 1 76 76 ARG HA H 76 3.873 3.873 4.050 -0.177 19439
3376 1 14 . 1 1 76 76 ARG H H 76 8.447 8.447 8.810 -0.363 19439
3377 1 14 . 1 1 77 77 SER N N 77 114.482 114.482 116.550 -2.068 19439
3378 1 14 . 1 1 77 77 SER HA H 77 4.061 4.061 4.151 -0.090 19439
3379 1 14 . 1 1 77 77 SER CA C 77 60.467 60.467 61.768 -1.301 19439
3380 1 14 . 1 1 77 77 SER CB C 77 62.449 62.449 62.870 -0.421 19439
3381 1 14 . 1 1 77 77 SER H H 77 8.105 8.105 7.823 0.282 19439
3382 1 14 . 1 1 78 78 ASP N N 78 120.538 120.538 122.579 -2.041 19439
3383 1 14 . 1 1 78 78 ASP HA H 78 4.333 4.333 4.346 -0.013 19439
3384 1 14 . 1 1 78 78 ASP CA C 78 58.020 58.020 57.232 0.788 19439
3385 1 14 . 1 1 78 78 ASP CB C 78 43.252 43.252 40.346 2.906 19439
3386 1 14 . 1 1 78 78 ASP H H 78 7.300 7.300 8.020 -0.720 19439
3387 1 14 . 1 1 79 79 ALA N N 79 120.614 120.614 122.788 -2.174 19439
3388 1 14 . 1 1 79 79 ALA HA H 79 3.672 3.672 3.850 -0.178 19439
3389 1 14 . 1 1 79 79 ALA CA C 79 54.886 54.886 55.209 -0.323 19439
3390 1 14 . 1 1 79 79 ALA CB C 79 19.628 19.628 18.310 1.318 19439
3391 1 14 . 1 1 79 79 ALA H H 79 7.767 7.767 8.260 -0.493 19439
3392 1 14 . 1 1 80 80 ARG N N 80 116.203 116.203 119.084 -2.881 19439
3393 1 14 . 1 1 80 80 ARG HA H 80 3.732 3.732 4.049 -0.317 19439
3394 1 14 . 1 1 80 80 ARG CA C 80 61.441 61.441 59.452 1.989 19439
3395 1 14 . 1 1 80 80 ARG CB C 80 30.266 30.266 30.373 -0.107 19439
3396 1 14 . 1 1 80 80 ARG H H 80 7.981 7.981 8.128 -0.147 19439
3397 1 14 . 1 1 81 81 VAL N N 81 119.192 119.192 120.017 -0.825 19439
3398 1 14 . 1 1 81 81 VAL HA H 81 3.582 3.582 3.936 -0.354 19439
3399 1 14 . 1 1 81 81 VAL CA C 81 66.909 66.909 66.573 0.336 19439
3400 1 14 . 1 1 81 81 VAL CB C 81 31.668 31.668 31.753 -0.085 19439
3401 1 14 . 1 1 81 81 VAL H H 81 7.338 7.338 8.100 -0.762 19439
3402 1 14 . 1 1 82 82 LEU N N 82 118.722 118.722 121.939 -3.217 19439
3403 1 14 . 1 1 82 82 LEU HA H 82 4.044 4.044 3.956 0.088 19439
3404 1 14 . 1 1 82 82 LEU CA C 82 58.356 58.356 58.658 -0.302 19439
3405 1 14 . 1 1 82 82 LEU CB C 82 41.627 41.627 41.637 -0.010 19439
3406 1 14 . 1 1 82 82 LEU H H 82 7.599 7.599 8.430 -0.831 19439
3407 1 14 . 1 1 83 83 ILE N N 83 120.893 120.893 119.840 1.053 19439
3408 1 14 . 1 1 83 83 ILE HA H 83 3.642 3.642 3.731 -0.089 19439
3409 1 14 . 1 1 83 83 ILE CA C 83 65.669 65.669 65.657 0.012 19439
3410 1 14 . 1 1 83 83 ILE CB C 83 38.579 38.579 37.947 0.632 19439
3411 1 14 . 1 1 83 83 ILE H H 83 8.546 8.546 8.412 0.134 19439
3412 1 14 . 1 1 84 84 PHE N N 84 123.343 123.343 120.723 2.620 19439
3413 1 14 . 1 1 84 84 PHE HA H 84 4.084 4.084 4.099 -0.015 19439
3414 1 14 . 1 1 84 84 PHE CA C 84 62.593 62.593 60.731 1.862 19439
3415 1 14 . 1 1 84 84 PHE CB C 84 39.211 39.211 38.708 0.503 19439
3416 1 14 . 1 1 84 84 PHE H H 84 8.622 8.622 8.487 0.135 19439
3417 1 14 . 1 1 85 85 ASN N N 85 118.037 118.037 117.439 0.598 19439
3418 1 14 . 1 1 85 85 ASN HA H 85 4.426 4.426 4.108 0.318 19439
3419 1 14 . 1 1 85 85 ASN CA C 85 56.045 56.045 56.064 -0.019 19439
3420 1 14 . 1 1 85 85 ASN CB C 85 37.785 37.785 38.187 -0.402 19439
3421 1 14 . 1 1 85 85 ASN H H 85 8.834 8.834 8.538 0.296 19439
3422 1 14 . 1 1 86 86 GLU N N 86 121.098 121.098 122.102 -1.004 19439
3423 1 14 . 1 1 86 86 GLU HA H 86 4.052 4.052 4.011 0.041 19439
3424 1 14 . 1 1 86 86 GLU CA C 86 59.328 59.328 59.669 -0.341 19439
3425 1 14 . 1 1 86 86 GLU CB C 86 30.253 30.253 29.761 0.492 19439
3426 1 14 . 1 1 86 86 GLU H H 86 8.105 8.105 8.349 -0.244 19439
3427 1 14 . 1 1 87 87 TRP N N 87 122.584 122.584 122.055 0.529 19439
3428 1 14 . 1 1 87 87 TRP HA H 87 4.006 4.006 4.196 -0.190 19439
3429 1 14 . 1 1 87 87 TRP CA C 87 61.545 61.545 61.918 -0.373 19439
3430 1 14 . 1 1 87 87 TRP CB C 87 27.943 27.943 29.477 -1.534 19439
3431 1 14 . 1 1 87 87 TRP H H 87 8.099 8.099 8.765 -0.666 19439
3432 1 14 . 1 1 88 88 GLU N N 88 117.357 117.357 118.284 -0.927 19439
3433 1 14 . 1 1 88 88 GLU HA H 88 2.919 2.919 3.417 -0.498 19439
3434 1 14 . 1 1 88 88 GLU CA C 88 59.804 59.804 60.020 -0.216 19439
3435 1 14 . 1 1 88 88 GLU CB C 88 29.546 29.546 28.757 0.789 19439
3436 1 14 . 1 1 88 88 GLU H H 88 8.440 8.440 8.538 -0.098 19439
3437 1 14 . 1 1 89 89 GLU N N 89 116.109 116.109 119.714 -3.605 19439
3438 1 14 . 1 1 89 89 GLU HA H 89 3.995 3.995 3.847 0.148 19439
3439 1 14 . 1 1 89 89 GLU CA C 89 58.329 58.329 59.468 -1.139 19439
3440 1 14 . 1 1 89 89 GLU CB C 89 29.649 29.649 29.573 0.076 19439
3441 1 14 . 1 1 89 89 GLU H H 89 7.244 7.244 7.966 -0.722 19439
3442 1 14 . 1 1 90 90 ARG N N 90 120.512 120.512 118.510 2.002 19439
3443 1 14 . 1 1 90 90 ARG HA H 90 3.920 3.920 3.915 0.005 19439
3444 1 14 . 1 1 90 90 ARG CA C 90 58.683 58.683 58.882 -0.199 19439
3445 1 14 . 1 1 90 90 ARG CB C 90 30.659 30.659 29.650 1.009 19439
3446 1 14 . 1 1 90 90 ARG H H 90 8.368 8.368 8.485 -0.117 19439
3447 1 14 . 1 1 91 91 LYS N N 91 120.024 120.024 119.776 0.248 19439
3448 1 14 . 1 1 91 91 LYS HA H 91 3.964 3.964 4.044 -0.080 19439
3449 1 14 . 1 1 91 91 LYS CA C 91 57.278 57.278 58.770 -1.492 19439
3450 1 14 . 1 1 91 91 LYS CB C 91 30.582 30.582 31.355 -0.773 19439
3451 1 14 . 1 1 91 91 LYS H H 91 8.491 8.491 7.964 0.527 19439
3452 1 14 . 1 1 92 92 LYS N N 92 118.192 118.192 117.215 0.977 19439
3453 1 14 . 1 1 92 92 LYS HA H 92 3.796 3.796 4.125 -0.329 19439
3454 1 14 . 1 1 92 92 LYS CA C 92 58.976 58.976 58.870 0.106 19439
3455 1 14 . 1 1 92 92 LYS CB C 92 32.188 32.188 32.274 -0.086 19439
3456 1 14 . 1 1 92 92 LYS H H 92 6.933 6.933 7.872 -0.939 19439
3457 1 14 . 1 1 93 93 SER N N 93 110.447 110.447 112.366 -1.919 19439
3458 1 14 . 1 1 93 93 SER HA H 93 4.484 4.484 4.428 0.056 19439
3459 1 14 . 1 1 93 93 SER CA C 93 58.386 58.386 60.311 -1.925 19439
3460 1 14 . 1 1 93 93 SER CB C 93 64.173 64.173 64.370 -0.197 19439
3461 1 14 . 1 1 93 93 SER H H 93 7.282 7.282 7.741 -0.459 19439
3462 1 14 . 1 1 94 94 ASP N N 94 120.163 120.163 119.431 0.732 19439
3463 1 14 . 1 1 94 94 ASP HA H 94 4.872 4.872 5.217 -0.345 19439
3464 1 14 . 1 1 94 94 ASP CA C 94 51.157 51.157 53.095 -1.938 19439
3465 1 14 . 1 1 94 94 ASP CB C 94 41.256 41.256 43.202 -1.946 19439
3466 1 14 . 1 1 94 94 ASP H H 94 7.303 7.303 8.229 -0.926 19439
3467 1 14 . 1 1 95 95 PRO CA C 95 63.871 63.871 63.596 0.275 19439
3468 1 14 . 1 1 95 95 PRO CB C 95 31.497 31.497 31.937 -0.440 19439
3469 1 14 . 1 1 96 96 TRP N N 96 117.486 117.486 117.283 0.203 19439
3470 1 14 . 1 1 96 96 TRP HA H 96 4.637 4.637 4.563 0.074 19439
3471 1 14 . 1 1 96 96 TRP CA C 96 56.061 56.061 54.941 1.120 19439
3472 1 14 . 1 1 96 96 TRP CB C 96 28.605 28.605 28.557 0.048 19439
3473 1 14 . 1 1 96 96 TRP H H 96 7.484 7.484 7.922 -0.438 19439
3474 1 14 . 1 1 97 97 LEU N N 97 123.510 123.510 121.867 1.643 19439
3475 1 14 . 1 1 97 97 LEU HA H 97 4.098 4.098 3.299 0.799 19439
3476 1 14 . 1 1 97 97 LEU CA C 97 56.024 56.024 54.545 1.479 19439
3477 1 14 . 1 1 97 97 LEU CB C 97 42.893 42.893 42.353 0.540 19439
3478 1 14 . 1 1 97 97 LEU H H 97 7.137 7.137 6.895 0.242 19439
3479 1 14 . 1 1 98 98 ARG N N 98 129.724 129.724 124.768 4.956 19439
3480 1 14 . 1 1 98 98 ARG HA H 98 4.486 4.486 4.614 -0.128 19439
3481 1 14 . 1 1 98 98 ARG CA C 98 55.622 55.622 54.834 0.788 19439
3482 1 14 . 1 1 98 98 ARG CB C 98 31.229 31.229 31.566 -0.337 19439
3483 1 14 . 1 1 98 98 ARG H H 98 8.825 8.825 8.275 0.550 19439
3484 1 14 . 1 1 99 99 LEU N N 99 127.814 127.814 123.134 4.680 19439
3485 1 14 . 1 1 99 99 LEU HA H 99 3.586 3.586 4.251 -0.665 19439
3486 1 14 . 1 1 99 99 LEU CA C 99 54.352 54.352 54.208 0.144 19439
3487 1 14 . 1 1 99 99 LEU CB C 99 40.485 40.485 41.600 -1.115 19439
3488 1 14 . 1 1 99 99 LEU H H 99 8.236 8.236 8.079 0.157 19439
3489 1 14 . 1 1 100 100 ASP N N 100 126.633 126.633 128.080 -1.447 19439
3490 1 14 . 1 1 100 100 ASP HA H 100 4.646 4.646 4.878 -0.232 19439
3491 1 14 . 1 1 100 100 ASP CA C 100 52.894 52.894 53.944 -1.050 19439
3492 1 14 . 1 1 100 100 ASP CB C 100 41.224 41.224 43.017 -1.793 19439
3493 1 14 . 1 1 100 100 ASP H H 100 8.018 8.018 8.608 -0.590 19439
3494 1 14 . 1 1 101 101 MET N N 101 122.473 122.473 119.647 2.826 19439
3495 1 14 . 1 1 101 101 MET HA H 101 4.481 4.481 4.638 -0.157 19439
3496 1 14 . 1 1 101 101 MET CA C 101 53.398 53.398 54.641 -1.243 19439
3497 1 14 . 1 1 101 101 MET CB C 101 33.296 33.296 33.139 0.157 19439
3498 1 14 . 1 1 101 101 MET H H 101 8.639 8.639 8.105 0.534 19439
3499 1 14 . 1 1 102 102 SER N N 102 116.243 116.243 117.319 -1.076 19439
3500 1 14 . 1 1 102 102 SER HA H 102 4.114 4.114 4.459 -0.345 19439
3501 1 14 . 1 1 102 102 SER CA C 102 58.709 58.709 56.877 1.832 19439
3502 1 14 . 1 1 102 102 SER CB C 102 64.701 64.701 65.263 -0.562 19439
3503 1 14 . 1 1 102 102 SER H H 102 8.096 8.096 8.224 -0.128 19439
3504 1 14 . 1 1 103 103 ASP N N 103 121.639 121.639 122.760 -1.121 19439
3505 1 14 . 1 1 103 103 ASP HA H 103 3.724 3.724 3.873 -0.149 19439
3506 1 14 . 1 1 103 103 ASP CA C 103 57.296 57.296 57.311 -0.015 19439
3507 1 14 . 1 1 103 103 ASP CB C 103 38.720 38.720 40.379 -1.659 19439
3508 1 14 . 1 1 103 103 ASP H H 103 8.669 8.669 8.743 -0.074 19439
3509 1 14 . 1 1 104 104 LYS N N 104 116.276 116.276 119.151 -2.875 19439
3510 1 14 . 1 1 104 104 LYS HA H 104 3.678 3.678 4.050 -0.372 19439
3511 1 14 . 1 1 104 104 LYS CA C 104 59.833 59.833 58.938 0.895 19439
3512 1 14 . 1 1 104 104 LYS CB C 104 32.090 32.090 32.188 -0.098 19439
3513 1 14 . 1 1 104 104 LYS H H 104 7.775 7.775 7.928 -0.153 19439
3514 1 14 . 1 1 105 105 ALA N N 105 122.257 122.257 122.632 -0.375 19439
3515 1 14 . 1 1 105 105 ALA HA H 105 3.873 3.873 4.098 -0.225 19439
3516 1 14 . 1 1 105 105 ALA CA C 105 55.008 55.008 54.786 0.222 19439
3517 1 14 . 1 1 105 105 ALA CB C 105 17.741 17.741 18.149 -0.408 19439
3518 1 14 . 1 1 105 105 ALA H H 105 7.266 7.266 7.597 -0.331 19439
3519 1 14 . 1 1 106 106 ILE N N 106 119.452 119.452 119.886 -0.434 19439
3520 1 14 . 1 1 106 106 ILE HA H 106 3.419 3.419 3.844 -0.425 19439
3521 1 14 . 1 1 106 106 ILE CA C 106 65.971 65.971 64.446 1.525 19439
3522 1 14 . 1 1 106 106 ILE CB C 106 37.430 37.430 37.595 -0.165 19439
3523 1 14 . 1 1 106 106 ILE H H 106 7.974 7.974 7.793 0.181 19439
3524 1 14 . 1 1 107 107 PHE N N 107 117.814 117.814 118.941 -1.127 19439
3525 1 14 . 1 1 107 107 PHE HA H 107 4.368 4.368 4.690 -0.322 19439
3526 1 14 . 1 1 107 107 PHE CA C 107 56.844 56.844 58.408 -1.564 19439
3527 1 14 . 1 1 107 107 PHE CB C 107 37.150 37.150 37.697 -0.547 19439
3528 1 14 . 1 1 107 107 PHE H H 107 8.434 8.434 8.269 0.165 19439
3529 1 14 . 1 1 108 108 ARG N N 108 117.368 117.368 120.226 -2.858 19439
3530 1 14 . 1 1 108 108 ARG HA H 108 3.994 3.994 4.120 -0.126 19439
3531 1 14 . 1 1 108 108 ARG CA C 108 58.682 58.682 58.917 -0.235 19439
3532 1 14 . 1 1 108 108 ARG CB C 108 30.287 30.287 30.297 -0.010 19439
3533 1 14 . 1 1 108 108 ARG H H 108 7.474 7.474 8.206 -0.732 19439
3534 1 14 . 1 1 109 109 ARG N N 109 117.440 117.440 116.808 0.632 19439
3535 1 14 . 1 1 109 109 ARG HA H 109 3.900 3.900 3.956 -0.056 19439
3536 1 14 . 1 1 109 109 ARG CA C 109 57.312 57.312 58.184 -0.872 19439
3537 1 14 . 1 1 109 109 ARG CB C 109 31.626 31.626 31.037 0.589 19439
3538 1 14 . 1 1 109 109 ARG H H 109 7.118 7.118 7.689 -0.571 19439
3539 1 14 . 1 1 110 110 TYR N N 110 116.060 116.060 116.535 -0.475 19439
3540 1 14 . 1 1 110 110 TYR HA H 110 5.265 5.265 5.136 0.129 19439
3541 1 14 . 1 1 110 110 TYR CA C 110 54.188 54.188 54.836 -0.648 19439
3542 1 14 . 1 1 110 110 TYR CB C 110 38.484 38.484 38.678 -0.194 19439
3543 1 14 . 1 1 110 110 TYR H H 110 8.707 8.707 8.093 0.614 19439
3544 1 14 . 1 1 111 111 PRO HA H 111 4.388 4.388 4.672 -0.284 19439
3545 1 14 . 1 1 111 111 PRO CA C 111 64.847 64.847 64.315 0.532 19439
3546 1 14 . 1 1 111 111 PRO CB C 111 31.381 31.381 32.111 -0.730 19439
3547 1 14 . 1 1 112 112 HIS N N 112 115.542 115.542 113.327 2.215 19439
3548 1 14 . 1 1 112 112 HIS HA H 112 4.482 4.482 4.535 -0.053 19439
3549 1 14 . 1 1 112 112 HIS CA C 112 58.498 58.498 56.952 1.546 19439
3550 1 14 . 1 1 112 112 HIS CB C 112 29.654 29.654 28.581 1.073 19439
3551 1 14 . 1 1 112 112 HIS H H 112 8.196 8.196 8.403 -0.207 19439
3552 1 14 . 1 1 113 113 LEU N N 113 120.583 120.583 119.997 0.586 19439
3553 1 14 . 1 1 113 113 LEU HA H 113 4.165 4.165 4.320 -0.155 19439
3554 1 14 . 1 1 113 113 LEU CA C 113 54.013 54.013 55.072 -1.059 19439
3555 1 14 . 1 1 113 113 LEU CB C 113 41.669 41.669 41.708 -0.039 19439
3556 1 14 . 1 1 113 113 LEU H H 113 7.527 7.527 7.382 0.145 19439
3557 1 15 . 1 1 59 59 ALA N N 59 123.310 123.310 123.000 0.310 19439
3558 1 15 . 1 1 59 59 ALA HA H 59 4.232 4.232 4.556 -0.324 19439
3559 1 15 . 1 1 59 59 ALA CA C 59 52.274 52.274 52.060 0.214 19439
3560 1 15 . 1 1 59 59 ALA CB C 59 19.623 19.623 19.876 -0.253 19439
3561 1 15 . 1 1 59 59 ALA H H 59 7.894 7.894 7.963 -0.069 19439
3562 1 15 . 1 1 60 60 LEU N N 60 120.936 120.936 120.288 0.648 19439
3563 1 15 . 1 1 60 60 LEU HA H 60 4.364 4.364 4.298 0.066 19439
3564 1 15 . 1 1 60 60 LEU CA C 60 54.130 54.130 53.967 0.164 19439
3565 1 15 . 1 1 60 60 LEU CB C 60 43.209 43.209 43.239 -0.030 19439
3566 1 15 . 1 1 60 60 LEU H H 60 8.046 8.046 7.571 0.475 19439
3567 1 15 . 1 1 61 61 ALA N N 61 125.460 125.460 124.775 0.685 19439
3568 1 15 . 1 1 61 61 ALA HA H 61 4.364 4.364 4.284 0.080 19439
3569 1 15 . 1 1 61 61 ALA CA C 61 51.176 51.176 52.454 -1.278 19439
3570 1 15 . 1 1 61 61 ALA CB C 61 20.172 20.172 19.249 0.923 19439
3571 1 15 . 1 1 61 61 ALA H H 61 8.338 8.338 8.227 0.111 19439
3572 1 15 . 1 1 62 62 ALA N N 62 127.765 127.765 125.715 2.050 19439
3573 1 15 . 1 1 62 62 ALA HA H 62 4.394 4.394 4.639 -0.245 19439
3574 1 15 . 1 1 62 62 ALA CA C 62 51.888 51.888 50.765 1.123 19439
3575 1 15 . 1 1 62 62 ALA CB C 62 18.806 18.806 20.853 -2.047 19439
3576 1 15 . 1 1 62 62 ALA H H 62 8.487 8.487 8.847 -0.360 19439
3577 1 15 . 1 1 63 63 LEU N N 63 120.199 120.199 120.327 -0.128 19439
3578 1 15 . 1 1 63 63 LEU HA H 63 4.828 4.828 4.942 -0.114 19439
3579 1 15 . 1 1 63 63 LEU CA C 63 51.852 51.852 53.328 -1.476 19439
3580 1 15 . 1 1 63 63 LEU CB C 63 44.081 44.081 45.202 -1.121 19439
3581 1 15 . 1 1 63 63 LEU H H 63 7.927 7.927 8.252 -0.325 19439
3582 1 15 . 1 1 64 64 HIS N N 64 122.277 122.277 119.191 3.086 19439
3583 1 15 . 1 1 64 64 HIS HA H 64 4.114 4.114 4.552 -0.438 19439
3584 1 15 . 1 1 64 64 HIS CA C 64 58.038 58.038 57.062 0.976 19439
3585 1 15 . 1 1 64 64 HIS CB C 64 31.228 31.228 31.434 -0.206 19439
3586 1 15 . 1 1 64 64 HIS H H 64 8.477 8.477 8.825 -0.348 19439
3587 1 15 . 1 1 65 65 ALA HA H 65 4.339 4.339 4.457 -0.118 19439
3588 1 15 . 1 1 65 65 ALA CA C 65 53.281 53.281 52.474 0.807 19439
3589 1 15 . 1 1 65 65 ALA CB C 65 20.276 20.276 19.948 0.328 19439
3590 1 15 . 1 1 66 66 GLU N N 66 113.868 113.868 117.348 -3.480 19439
3591 1 15 . 1 1 66 66 GLU HA H 66 4.619 4.619 4.511 0.108 19439
3592 1 15 . 1 1 66 66 GLU CA C 66 54.727 54.727 55.044 -0.317 19439
3593 1 15 . 1 1 66 66 GLU CB C 66 32.894 32.894 32.802 0.092 19439
3594 1 15 . 1 1 66 66 GLU H H 66 7.759 7.759 8.004 -0.245 19439
3595 1 15 . 1 1 68 68 PRO HA H 68 4.219 4.219 4.288 -0.069 19439
3596 1 15 . 1 1 68 68 PRO CA C 68 64.664 64.664 65.027 -0.363 19439
3597 1 15 . 1 1 68 68 PRO CB C 68 32.066 32.066 31.686 0.380 19439
3598 1 15 . 1 1 69 69 LEU N N 69 117.262 117.262 118.486 -1.224 19439
3599 1 15 . 1 1 69 69 LEU HA H 69 4.182 4.182 4.221 -0.039 19439
3600 1 15 . 1 1 69 69 LEU CA C 69 52.430 52.430 53.671 -1.241 19439
3601 1 15 . 1 1 69 69 LEU CB C 69 40.907 40.907 41.495 -0.588 19439
3602 1 15 . 1 1 69 69 LEU H H 69 8.439 8.439 7.953 0.486 19439
3603 1 15 . 1 1 70 70 ALA N N 70 120.426 120.426 121.082 -0.656 19439
3604 1 15 . 1 1 70 70 ALA HA H 70 3.411 3.411 4.211 -0.800 19439
3605 1 15 . 1 1 70 70 ALA CA C 70 53.685 53.685 53.490 0.195 19439
3606 1 15 . 1 1 70 70 ALA CB C 70 17.914 17.914 18.650 -0.736 19439
3607 1 15 . 1 1 70 70 ALA H H 70 7.113 7.113 7.425 -0.312 19439
3608 1 15 . 1 1 71 71 GLY N N 71 108.911 108.911 112.681 -3.770 19439
3609 1 15 . 1 1 71 71 GLY CA C 71 45.215 45.215 45.052 0.163 19439
3610 1 15 . 1 1 71 71 GLY H H 71 8.856 8.856 8.792 0.064 19439
3611 1 15 . 1 1 72 72 LEU N N 72 120.000 120.000 121.607 -1.607 19439
3612 1 15 . 1 1 72 72 LEU HA H 72 4.769 4.769 4.933 -0.164 19439
3613 1 15 . 1 1 72 72 LEU CA C 72 51.972 51.972 51.543 0.429 19439
3614 1 15 . 1 1 72 72 LEU CB C 72 41.255 41.255 42.845 -1.590 19439
3615 1 15 . 1 1 72 72 LEU H H 72 8.136 8.136 8.034 0.102 19439
3616 1 15 . 1 1 73 73 PRO HA H 73 4.739 4.739 4.645 0.094 19439
3617 1 15 . 1 1 73 73 PRO CA C 73 61.456 61.456 62.771 -1.315 19439
3618 1 15 . 1 1 73 73 PRO CB C 73 31.245 31.245 31.961 -0.716 19439
3619 1 15 . 1 1 74 74 VAL N N 74 121.723 121.723 120.717 1.006 19439
3620 1 15 . 1 1 74 74 VAL HA H 74 3.446 3.446 3.715 -0.269 19439
3621 1 15 . 1 1 74 74 VAL CA C 74 65.744 65.744 64.113 1.631 19439
3622 1 15 . 1 1 74 74 VAL CB C 74 31.236 31.236 31.926 -0.690 19439
3623 1 15 . 1 1 74 74 VAL H H 74 7.710 7.710 8.118 -0.408 19439
3624 1 15 . 1 1 75 75 THR N N 75 108.893 108.893 112.542 -3.649 19439
3625 1 15 . 1 1 75 75 THR HA H 75 4.937 4.937 4.593 0.344 19439
3626 1 15 . 1 1 75 75 THR CA C 75 59.892 59.892 59.353 0.538 19439
3627 1 15 . 1 1 75 75 THR CB C 75 12.018 12.018 70.668 -58.650 19439
3628 1 15 . 1 1 75 75 THR H H 75 8.710 8.710 8.243 0.467 19439
3629 1 15 . 1 1 76 76 ARG HA H 76 3.873 3.873 4.027 -0.154 19439
3630 1 15 . 1 1 76 76 ARG H H 76 8.447 8.447 8.850 -0.403 19439
3631 1 15 . 1 1 77 77 SER N N 77 114.482 114.482 114.965 -0.483 19439
3632 1 15 . 1 1 77 77 SER HA H 77 4.061 4.061 4.149 -0.088 19439
3633 1 15 . 1 1 77 77 SER CA C 77 60.467 60.467 61.262 -0.795 19439
3634 1 15 . 1 1 77 77 SER CB C 77 62.449 62.449 62.783 -0.334 19439
3635 1 15 . 1 1 77 77 SER H H 77 8.105 8.105 7.938 0.167 19439
3636 1 15 . 1 1 78 78 ASP N N 78 120.538 120.538 122.216 -1.678 19439
3637 1 15 . 1 1 78 78 ASP HA H 78 4.333 4.333 4.290 0.043 19439
3638 1 15 . 1 1 78 78 ASP CA C 78 58.020 58.020 57.093 0.927 19439
3639 1 15 . 1 1 78 78 ASP CB C 78 43.252 43.252 40.269 2.983 19439
3640 1 15 . 1 1 78 78 ASP H H 78 7.300 7.300 7.650 -0.350 19439
3641 1 15 . 1 1 79 79 ALA N N 79 120.614 120.614 122.946 -2.332 19439
3642 1 15 . 1 1 79 79 ALA HA H 79 3.672 3.672 3.901 -0.229 19439
3643 1 15 . 1 1 79 79 ALA CA C 79 54.886 54.886 55.227 -0.341 19439
3644 1 15 . 1 1 79 79 ALA CB C 79 19.628 19.628 18.346 1.282 19439
3645 1 15 . 1 1 79 79 ALA H H 79 7.767 7.767 8.158 -0.391 19439
3646 1 15 . 1 1 80 80 ARG N N 80 116.203 116.203 119.587 -3.384 19439
3647 1 15 . 1 1 80 80 ARG HA H 80 3.732 3.732 4.129 -0.397 19439
3648 1 15 . 1 1 80 80 ARG CA C 80 61.441 61.441 59.406 2.035 19439
3649 1 15 . 1 1 80 80 ARG CB C 80 30.266 30.266 30.381 -0.115 19439
3650 1 15 . 1 1 80 80 ARG H H 80 7.981 7.981 8.287 -0.306 19439
3651 1 15 . 1 1 81 81 VAL N N 81 119.192 119.192 119.769 -0.577 19439
3652 1 15 . 1 1 81 81 VAL HA H 81 3.582 3.582 3.738 -0.156 19439
3653 1 15 . 1 1 81 81 VAL CA C 81 66.909 66.909 66.521 0.388 19439
3654 1 15 . 1 1 81 81 VAL CB C 81 31.668 31.668 31.542 0.126 19439
3655 1 15 . 1 1 81 81 VAL H H 81 7.338 7.338 8.043 -0.705 19439
3656 1 15 . 1 1 82 82 LEU N N 82 118.722 118.722 121.149 -2.427 19439
3657 1 15 . 1 1 82 82 LEU HA H 82 4.044 4.044 3.991 0.053 19439
3658 1 15 . 1 1 82 82 LEU CA C 82 58.356 58.356 58.650 -0.294 19439
3659 1 15 . 1 1 82 82 LEU CB C 82 41.627 41.627 41.720 -0.093 19439
3660 1 15 . 1 1 82 82 LEU H H 82 7.599 7.599 8.422 -0.823 19439
3661 1 15 . 1 1 83 83 ILE N N 83 120.893 120.893 119.928 0.965 19439
3662 1 15 . 1 1 83 83 ILE HA H 83 3.642 3.642 3.782 -0.140 19439
3663 1 15 . 1 1 83 83 ILE CA C 83 65.669 65.669 65.501 0.168 19439
3664 1 15 . 1 1 83 83 ILE CB C 83 38.579 38.579 38.055 0.524 19439
3665 1 15 . 1 1 83 83 ILE H H 83 8.546 8.546 8.368 0.178 19439
3666 1 15 . 1 1 84 84 PHE N N 84 123.343 123.343 120.903 2.440 19439
3667 1 15 . 1 1 84 84 PHE HA H 84 4.084 4.084 4.187 -0.103 19439
3668 1 15 . 1 1 84 84 PHE CA C 84 62.593 62.593 62.340 0.253 19439
3669 1 15 . 1 1 84 84 PHE CB C 84 39.211 39.211 39.167 0.044 19439
3670 1 15 . 1 1 84 84 PHE H H 84 8.622 8.622 8.828 -0.206 19439
3671 1 15 . 1 1 85 85 ASN N N 85 118.037 118.037 117.820 0.217 19439
3672 1 15 . 1 1 85 85 ASN HA H 85 4.426 4.426 4.226 0.200 19439
3673 1 15 . 1 1 85 85 ASN CA C 85 56.045 56.045 56.806 -0.761 19439
3674 1 15 . 1 1 85 85 ASN CB C 85 37.785 37.785 38.513 -0.728 19439
3675 1 15 . 1 1 85 85 ASN H H 85 8.834 8.834 8.654 0.180 19439
3676 1 15 . 1 1 86 86 GLU N N 86 121.098 121.098 121.810 -0.712 19439
3677 1 15 . 1 1 86 86 GLU HA H 86 4.052 4.052 3.951 0.101 19439
3678 1 15 . 1 1 86 86 GLU CA C 86 59.328 59.328 59.589 -0.261 19439
3679 1 15 . 1 1 86 86 GLU CB C 86 30.253 30.253 29.713 0.540 19439
3680 1 15 . 1 1 86 86 GLU H H 86 8.105 8.105 8.246 -0.141 19439
3681 1 15 . 1 1 87 87 TRP N N 87 122.584 122.584 121.965 0.619 19439
3682 1 15 . 1 1 87 87 TRP HA H 87 4.006 4.006 4.109 -0.103 19439
3683 1 15 . 1 1 87 87 TRP CA C 87 61.545 61.545 61.524 0.021 19439
3684 1 15 . 1 1 87 87 TRP CB C 87 27.943 27.943 29.327 -1.384 19439
3685 1 15 . 1 1 87 87 TRP H H 87 8.099 8.099 8.553 -0.454 19439
3686 1 15 . 1 1 88 88 GLU N N 88 117.357 117.357 119.059 -1.702 19439
3687 1 15 . 1 1 88 88 GLU HA H 88 2.919 2.919 2.890 0.029 19439
3688 1 15 . 1 1 88 88 GLU CA C 88 59.804 59.804 59.316 0.488 19439
3689 1 15 . 1 1 88 88 GLU CB C 88 29.546 29.546 28.927 0.619 19439
3690 1 15 . 1 1 88 88 GLU H H 88 8.440 8.440 8.440 0.000 19439
3691 1 15 . 1 1 89 89 GLU N N 89 116.109 116.109 119.742 -3.633 19439
3692 1 15 . 1 1 89 89 GLU HA H 89 3.995 3.995 3.882 0.113 19439
3693 1 15 . 1 1 89 89 GLU CA C 89 58.329 58.329 59.394 -1.065 19439
3694 1 15 . 1 1 89 89 GLU CB C 89 29.649 29.649 29.514 0.135 19439
3695 1 15 . 1 1 89 89 GLU H H 89 7.244 7.244 7.886 -0.642 19439
3696 1 15 . 1 1 90 90 ARG N N 90 120.512 120.512 118.284 2.228 19439
3697 1 15 . 1 1 90 90 ARG HA H 90 3.920 3.920 3.888 0.032 19439
3698 1 15 . 1 1 90 90 ARG CA C 90 58.683 58.683 58.931 -0.248 19439
3699 1 15 . 1 1 90 90 ARG CB C 90 30.659 30.659 29.718 0.942 19439
3700 1 15 . 1 1 90 90 ARG H H 90 8.368 8.368 8.186 0.182 19439
3701 1 15 . 1 1 91 91 LYS N N 91 120.024 120.024 119.369 0.655 19439
3702 1 15 . 1 1 91 91 LYS HA H 91 3.964 3.964 4.039 -0.075 19439
3703 1 15 . 1 1 91 91 LYS CA C 91 57.278 57.278 58.577 -1.299 19439
3704 1 15 . 1 1 91 91 LYS CB C 91 30.582 30.582 31.339 -0.757 19439
3705 1 15 . 1 1 91 91 LYS H H 91 8.491 8.491 7.969 0.522 19439
3706 1 15 . 1 1 92 92 LYS N N 92 118.192 118.192 119.324 -1.132 19439
3707 1 15 . 1 1 92 92 LYS HA H 92 3.796 3.796 4.034 -0.238 19439
3708 1 15 . 1 1 92 92 LYS CA C 92 58.976 58.976 58.399 0.577 19439
3709 1 15 . 1 1 92 92 LYS CB C 92 32.188 32.188 32.037 0.151 19439
3710 1 15 . 1 1 92 92 LYS H H 92 6.933 6.933 7.652 -0.719 19439
3711 1 15 . 1 1 93 93 SER N N 93 110.447 110.447 113.507 -3.060 19439
3712 1 15 . 1 1 93 93 SER HA H 93 4.484 4.484 4.304 0.180 19439
3713 1 15 . 1 1 93 93 SER CA C 93 58.386 58.386 60.530 -2.144 19439
3714 1 15 . 1 1 93 93 SER CB C 93 64.173 64.173 64.153 0.020 19439
3715 1 15 . 1 1 93 93 SER H H 93 7.282 7.282 7.717 -0.435 19439
3716 1 15 . 1 1 94 94 ASP N N 94 120.163 120.163 119.429 0.734 19439
3717 1 15 . 1 1 94 94 ASP HA H 94 4.872 4.872 5.046 -0.174 19439
3718 1 15 . 1 1 94 94 ASP CA C 94 51.157 51.157 52.508 -1.351 19439
3719 1 15 . 1 1 94 94 ASP CB C 94 41.256 41.256 42.976 -1.720 19439
3720 1 15 . 1 1 94 94 ASP H H 94 7.303 7.303 8.119 -0.816 19439
3721 1 15 . 1 1 95 95 PRO CA C 95 63.871 63.871 63.596 0.275 19439
3722 1 15 . 1 1 95 95 PRO CB C 95 31.497 31.497 32.183 -0.686 19439
3723 1 15 . 1 1 96 96 TRP N N 96 117.486 117.486 116.740 0.746 19439
3724 1 15 . 1 1 96 96 TRP HA H 96 4.637 4.637 4.674 -0.037 19439
3725 1 15 . 1 1 96 96 TRP CA C 96 56.061 56.061 54.695 1.366 19439
3726 1 15 . 1 1 96 96 TRP CB C 96 28.605 28.605 28.157 0.448 19439
3727 1 15 . 1 1 96 96 TRP H H 96 7.484 7.484 7.776 -0.292 19439
3728 1 15 . 1 1 97 97 LEU N N 97 123.510 123.510 121.331 2.179 19439
3729 1 15 . 1 1 97 97 LEU HA H 97 4.098 4.098 3.133 0.965 19439
3730 1 15 . 1 1 97 97 LEU CA C 97 56.024 56.024 54.051 1.973 19439
3731 1 15 . 1 1 97 97 LEU CB C 97 42.893 42.893 42.343 0.550 19439
3732 1 15 . 1 1 97 97 LEU H H 97 7.137 7.137 6.624 0.513 19439
3733 1 15 . 1 1 98 98 ARG N N 98 129.724 129.724 125.885 3.839 19439
3734 1 15 . 1 1 98 98 ARG HA H 98 4.486 4.486 4.392 0.094 19439
3735 1 15 . 1 1 98 98 ARG CA C 98 55.622 55.622 55.076 0.546 19439
3736 1 15 . 1 1 98 98 ARG CB C 98 31.229 31.229 30.869 0.360 19439
3737 1 15 . 1 1 98 98 ARG H H 98 8.825 8.825 8.210 0.615 19439
3738 1 15 . 1 1 99 99 LEU N N 99 127.814 127.814 126.230 1.584 19439
3739 1 15 . 1 1 99 99 LEU HA H 99 3.586 3.586 4.203 -0.617 19439
3740 1 15 . 1 1 99 99 LEU CA C 99 54.352 54.352 54.871 -0.519 19439
3741 1 15 . 1 1 99 99 LEU CB C 99 40.485 40.485 41.723 -1.238 19439
3742 1 15 . 1 1 99 99 LEU H H 99 8.236 8.236 8.253 -0.017 19439
3743 1 15 . 1 1 100 100 ASP N N 100 126.633 126.633 128.745 -2.112 19439
3744 1 15 . 1 1 100 100 ASP HA H 100 4.646 4.646 4.914 -0.268 19439
3745 1 15 . 1 1 100 100 ASP CA C 100 52.894 52.894 53.968 -1.074 19439
3746 1 15 . 1 1 100 100 ASP CB C 100 41.224 41.224 42.138 -0.914 19439
3747 1 15 . 1 1 100 100 ASP H H 100 8.018 8.018 8.625 -0.607 19439
3748 1 15 . 1 1 101 101 MET N N 101 122.473 122.473 122.138 0.335 19439
3749 1 15 . 1 1 101 101 MET HA H 101 4.481 4.481 4.722 -0.241 19439
3750 1 15 . 1 1 101 101 MET CA C 101 53.398 53.398 54.883 -1.485 19439
3751 1 15 . 1 1 101 101 MET CB C 101 33.296 33.296 35.635 -2.339 19439
3752 1 15 . 1 1 101 101 MET H H 101 8.639 8.639 8.125 0.514 19439
3753 1 15 . 1 1 102 102 SER N N 102 116.243 116.243 115.745 0.498 19439
3754 1 15 . 1 1 102 102 SER HA H 102 4.114 4.114 4.687 -0.573 19439
3755 1 15 . 1 1 102 102 SER CA C 102 58.709 58.709 56.601 2.108 19439
3756 1 15 . 1 1 102 102 SER CB C 102 64.701 64.701 65.615 -0.914 19439
3757 1 15 . 1 1 102 102 SER H H 102 8.096 8.096 8.342 -0.246 19439
3758 1 15 . 1 1 103 103 ASP N N 103 121.639 121.639 122.202 -0.563 19439
3759 1 15 . 1 1 103 103 ASP HA H 103 3.724 3.724 3.953 -0.229 19439
3760 1 15 . 1 1 103 103 ASP CA C 103 57.296 57.296 57.284 0.012 19439
3761 1 15 . 1 1 103 103 ASP CB C 103 38.720 38.720 40.370 -1.650 19439
3762 1 15 . 1 1 103 103 ASP H H 103 8.669 8.669 8.721 -0.052 19439
3763 1 15 . 1 1 104 104 LYS N N 104 116.276 116.276 119.104 -2.828 19439
3764 1 15 . 1 1 104 104 LYS HA H 104 3.678 3.678 4.017 -0.339 19439
3765 1 15 . 1 1 104 104 LYS CA C 104 59.833 59.833 59.058 0.775 19439
3766 1 15 . 1 1 104 104 LYS CB C 104 32.090 32.090 32.159 -0.069 19439
3767 1 15 . 1 1 104 104 LYS H H 104 7.775 7.775 8.027 -0.252 19439
3768 1 15 . 1 1 105 105 ALA N N 105 122.257 122.257 122.571 -0.314 19439
3769 1 15 . 1 1 105 105 ALA HA H 105 3.873 3.873 4.108 -0.235 19439
3770 1 15 . 1 1 105 105 ALA CA C 105 55.008 55.008 54.780 0.228 19439
3771 1 15 . 1 1 105 105 ALA CB C 105 17.741 17.741 18.149 -0.409 19439
3772 1 15 . 1 1 105 105 ALA H H 105 7.266 7.266 7.605 -0.339 19439
3773 1 15 . 1 1 106 106 ILE N N 106 119.452 119.452 119.891 -0.439 19439
3774 1 15 . 1 1 106 106 ILE HA H 106 3.419 3.419 3.837 -0.418 19439
3775 1 15 . 1 1 106 106 ILE CA C 106 65.971 65.971 64.528 1.443 19439
3776 1 15 . 1 1 106 106 ILE CB C 106 37.430 37.430 37.648 -0.218 19439
3777 1 15 . 1 1 106 106 ILE H H 106 7.974 7.974 7.869 0.105 19439
3778 1 15 . 1 1 107 107 PHE N N 107 117.814 117.814 119.178 -1.364 19439
3779 1 15 . 1 1 107 107 PHE HA H 107 4.368 4.368 4.709 -0.341 19439
3780 1 15 . 1 1 107 107 PHE CA C 107 56.844 56.844 58.252 -1.408 19439
3781 1 15 . 1 1 107 107 PHE CB C 107 37.150 37.150 37.672 -0.522 19439
3782 1 15 . 1 1 107 107 PHE H H 107 8.434 8.434 8.330 0.104 19439
3783 1 15 . 1 1 108 108 ARG N N 108 117.368 117.368 120.165 -2.797 19439
3784 1 15 . 1 1 108 108 ARG HA H 108 3.994 3.994 4.114 -0.120 19439
3785 1 15 . 1 1 108 108 ARG CA C 108 58.682 58.682 59.038 -0.356 19439
3786 1 15 . 1 1 108 108 ARG CB C 108 30.287 30.287 30.311 -0.024 19439
3787 1 15 . 1 1 108 108 ARG H H 108 7.474 7.474 8.193 -0.719 19439
3788 1 15 . 1 1 109 109 ARG N N 109 117.440 117.440 117.994 -0.554 19439
3789 1 15 . 1 1 109 109 ARG HA H 109 3.900 3.900 4.024 -0.124 19439
3790 1 15 . 1 1 109 109 ARG CA C 109 57.312 57.312 58.093 -0.781 19439
3791 1 15 . 1 1 109 109 ARG CB C 109 31.626 31.626 31.172 0.454 19439
3792 1 15 . 1 1 109 109 ARG H H 109 7.118 7.118 7.682 -0.564 19439
3793 1 15 . 1 1 110 110 TYR N N 110 116.060 116.060 117.935 -1.875 19439
3794 1 15 . 1 1 110 110 TYR HA H 110 5.265 5.265 5.154 0.111 19439
3795 1 15 . 1 1 110 110 TYR CA C 110 54.188 54.188 54.211 -0.023 19439
3796 1 15 . 1 1 110 110 TYR CB C 110 38.484 38.484 38.330 0.154 19439
3797 1 15 . 1 1 110 110 TYR H H 110 8.707 8.707 8.190 0.517 19439
3798 1 15 . 1 1 111 111 PRO HA H 111 4.388 4.388 4.675 -0.287 19439
3799 1 15 . 1 1 111 111 PRO CA C 111 64.847 64.847 64.367 0.480 19439
3800 1 15 . 1 1 111 111 PRO CB C 111 31.381 31.381 32.132 -0.751 19439
3801 1 15 . 1 1 112 112 HIS N N 112 115.542 115.542 113.393 2.149 19439
3802 1 15 . 1 1 112 112 HIS HA H 112 4.482 4.482 4.533 -0.051 19439
3803 1 15 . 1 1 112 112 HIS CA C 112 58.498 58.498 56.904 1.594 19439
3804 1 15 . 1 1 112 112 HIS CB C 112 29.654 29.654 28.539 1.115 19439
3805 1 15 . 1 1 112 112 HIS H H 112 8.196 8.196 8.409 -0.213 19439
3806 1 15 . 1 1 113 113 LEU N N 113 120.583 120.583 120.114 0.469 19439
3807 1 15 . 1 1 113 113 LEU HA H 113 4.165 4.165 4.293 -0.128 19439
3808 1 15 . 1 1 113 113 LEU CA C 113 54.013 54.013 55.108 -1.095 19439
3809 1 15 . 1 1 113 113 LEU CB C 113 41.669 41.669 41.625 0.044 19439
3810 1 15 . 1 1 113 113 LEU H H 113 7.527 7.527 7.364 0.163 19439
3811 1 16 . 1 1 59 59 ALA N N 59 123.310 123.310 124.160 -0.850 19439
3812 1 16 . 1 1 59 59 ALA HA H 59 4.232 4.232 4.296 -0.064 19439
3813 1 16 . 1 1 59 59 ALA CA C 59 52.274 52.274 53.117 -0.843 19439
3814 1 16 . 1 1 59 59 ALA CB C 59 19.623 19.623 18.657 0.966 19439
3815 1 16 . 1 1 59 59 ALA H H 59 7.894 7.894 7.940 -0.046 19439
3816 1 16 . 1 1 60 60 LEU N N 60 120.936 120.936 119.183 1.753 19439
3817 1 16 . 1 1 60 60 LEU HA H 60 4.364 4.364 4.225 0.139 19439
3818 1 16 . 1 1 60 60 LEU CA C 60 54.130 54.130 55.712 -1.583 19439
3819 1 16 . 1 1 60 60 LEU CB C 60 43.209 43.209 41.979 1.230 19439
3820 1 16 . 1 1 60 60 LEU H H 60 8.046 8.046 7.656 0.390 19439
3821 1 16 . 1 1 61 61 ALA N N 61 125.460 125.460 120.644 4.816 19439
3822 1 16 . 1 1 61 61 ALA HA H 61 4.364 4.364 4.495 -0.131 19439
3823 1 16 . 1 1 61 61 ALA CA C 61 51.176 51.176 51.235 -0.059 19439
3824 1 16 . 1 1 61 61 ALA CB C 61 20.172 20.172 20.507 -0.335 19439
3825 1 16 . 1 1 61 61 ALA H H 61 8.338 8.338 7.290 1.048 19439
3826 1 16 . 1 1 62 62 ALA N N 62 127.765 127.765 124.142 3.623 19439
3827 1 16 . 1 1 62 62 ALA HA H 62 4.394 4.394 4.756 -0.362 19439
3828 1 16 . 1 1 62 62 ALA CA C 62 51.888 51.888 50.714 1.174 19439
3829 1 16 . 1 1 62 62 ALA CB C 62 18.806 18.806 21.002 -2.196 19439
3830 1 16 . 1 1 62 62 ALA H H 62 8.487 8.487 8.819 -0.332 19439
3831 1 16 . 1 1 63 63 LEU N N 63 120.199 120.199 120.489 -0.290 19439
3832 1 16 . 1 1 63 63 LEU HA H 63 4.828 4.828 4.922 -0.094 19439
3833 1 16 . 1 1 63 63 LEU CA C 63 51.852 51.852 52.960 -1.108 19439
3834 1 16 . 1 1 63 63 LEU CB C 63 44.081 44.081 45.816 -1.735 19439
3835 1 16 . 1 1 63 63 LEU H H 63 7.927 7.927 8.270 -0.343 19439
3836 1 16 . 1 1 64 64 HIS N N 64 122.277 122.277 119.614 2.663 19439
3837 1 16 . 1 1 64 64 HIS HA H 64 4.114 4.114 4.561 -0.447 19439
3838 1 16 . 1 1 64 64 HIS CA C 64 58.038 58.038 57.004 1.034 19439
3839 1 16 . 1 1 64 64 HIS CB C 64 31.228 31.228 31.136 0.092 19439
3840 1 16 . 1 1 64 64 HIS H H 64 8.477 8.477 8.803 -0.326 19439
3841 1 16 . 1 1 65 65 ALA HA H 65 4.339 4.339 4.379 -0.040 19439
3842 1 16 . 1 1 65 65 ALA CA C 65 53.281 53.281 52.795 0.486 19439
3843 1 16 . 1 1 65 65 ALA CB C 65 20.276 20.276 19.773 0.502 19439
3844 1 16 . 1 1 66 66 GLU N N 66 113.868 113.868 116.433 -2.565 19439
3845 1 16 . 1 1 66 66 GLU HA H 66 4.619 4.619 4.483 0.136 19439
3846 1 16 . 1 1 66 66 GLU CA C 66 54.727 54.727 54.895 -0.168 19439
3847 1 16 . 1 1 66 66 GLU CB C 66 32.894 32.894 31.874 1.020 19439
3848 1 16 . 1 1 66 66 GLU H H 66 7.759 7.759 8.009 -0.250 19439
3849 1 16 . 1 1 68 68 PRO HA H 68 4.219 4.219 4.245 -0.026 19439
3850 1 16 . 1 1 68 68 PRO CA C 68 64.664 64.664 65.071 -0.407 19439
3851 1 16 . 1 1 68 68 PRO CB C 68 32.066 32.066 31.739 0.327 19439
3852 1 16 . 1 1 69 69 LEU N N 69 117.262 117.262 117.360 -0.098 19439
3853 1 16 . 1 1 69 69 LEU HA H 69 4.182 4.182 4.417 -0.235 19439
3854 1 16 . 1 1 69 69 LEU CA C 69 52.430 52.430 53.162 -0.732 19439
3855 1 16 . 1 1 69 69 LEU CB C 69 40.907 40.907 40.937 -0.030 19439
3856 1 16 . 1 1 69 69 LEU H H 69 8.439 8.439 7.914 0.525 19439
3857 1 16 . 1 1 70 70 ALA N N 70 120.426 120.426 121.617 -1.191 19439
3858 1 16 . 1 1 70 70 ALA HA H 70 3.411 3.411 4.118 -0.707 19439
3859 1 16 . 1 1 70 70 ALA CA C 70 53.685 53.685 53.466 0.219 19439
3860 1 16 . 1 1 70 70 ALA CB C 70 17.914 17.914 18.662 -0.748 19439
3861 1 16 . 1 1 70 70 ALA H H 70 7.113 7.113 7.591 -0.478 19439
3862 1 16 . 1 1 71 71 GLY N N 71 108.911 108.911 112.064 -3.153 19439
3863 1 16 . 1 1 71 71 GLY CA C 71 45.215 45.215 45.024 0.191 19439
3864 1 16 . 1 1 71 71 GLY H H 71 8.856 8.856 8.885 -0.029 19439
3865 1 16 . 1 1 72 72 LEU N N 72 120.000 120.000 121.737 -1.737 19439
3866 1 16 . 1 1 72 72 LEU HA H 72 4.769 4.769 4.936 -0.167 19439
3867 1 16 . 1 1 72 72 LEU CA C 72 51.972 51.972 51.577 0.395 19439
3868 1 16 . 1 1 72 72 LEU CB C 72 41.255 41.255 42.741 -1.486 19439
3869 1 16 . 1 1 72 72 LEU H H 72 8.136 8.136 8.038 0.098 19439
3870 1 16 . 1 1 73 73 PRO HA H 73 4.739 4.739 4.625 0.114 19439
3871 1 16 . 1 1 73 73 PRO CA C 73 61.456 61.456 62.893 -1.437 19439
3872 1 16 . 1 1 73 73 PRO CB C 73 31.245 31.245 31.997 -0.752 19439
3873 1 16 . 1 1 74 74 VAL N N 74 121.723 121.723 119.851 1.872 19439
3874 1 16 . 1 1 74 74 VAL HA H 74 3.446 3.446 3.888 -0.442 19439
3875 1 16 . 1 1 74 74 VAL CA C 74 65.744 65.744 63.899 1.845 19439
3876 1 16 . 1 1 74 74 VAL CB C 74 31.236 31.236 31.964 -0.728 19439
3877 1 16 . 1 1 74 74 VAL H H 74 7.710 7.710 8.140 -0.430 19439
3878 1 16 . 1 1 75 75 THR N N 75 108.893 108.893 109.396 -0.503 19439
3879 1 16 . 1 1 75 75 THR HA H 75 4.937 4.937 4.637 0.300 19439
3880 1 16 . 1 1 75 75 THR CA C 75 59.892 59.892 59.677 0.215 19439
3881 1 16 . 1 1 75 75 THR CB C 75 12.018 12.018 71.798 -59.780 19439
3882 1 16 . 1 1 75 75 THR H H 75 8.710 8.710 7.911 0.799 19439
3883 1 16 . 1 1 76 76 ARG HA H 76 3.873 3.873 4.029 -0.156 19439
3884 1 16 . 1 1 76 76 ARG H H 76 8.447 8.447 8.813 -0.366 19439
3885 1 16 . 1 1 77 77 SER N N 77 114.482 114.482 116.828 -2.346 19439
3886 1 16 . 1 1 77 77 SER HA H 77 4.061 4.061 4.213 -0.152 19439
3887 1 16 . 1 1 77 77 SER CA C 77 60.467 60.467 61.284 -0.817 19439
3888 1 16 . 1 1 77 77 SER CB C 77 62.449 62.449 62.817 -0.368 19439
3889 1 16 . 1 1 77 77 SER H H 77 8.105 8.105 7.815 0.290 19439
3890 1 16 . 1 1 78 78 ASP N N 78 120.538 120.538 122.676 -2.138 19439
3891 1 16 . 1 1 78 78 ASP HA H 78 4.333 4.333 4.356 -0.023 19439
3892 1 16 . 1 1 78 78 ASP CA C 78 58.020 58.020 57.232 0.788 19439
3893 1 16 . 1 1 78 78 ASP CB C 78 43.252 43.252 40.363 2.889 19439
3894 1 16 . 1 1 78 78 ASP H H 78 7.300 7.300 8.085 -0.785 19439
3895 1 16 . 1 1 79 79 ALA N N 79 120.614 120.614 122.882 -2.268 19439
3896 1 16 . 1 1 79 79 ALA HA H 79 3.672 3.672 3.861 -0.189 19439
3897 1 16 . 1 1 79 79 ALA CA C 79 54.886 54.886 55.233 -0.347 19439
3898 1 16 . 1 1 79 79 ALA CB C 79 19.628 19.628 18.268 1.360 19439
3899 1 16 . 1 1 79 79 ALA H H 79 7.767 7.767 8.321 -0.554 19439
3900 1 16 . 1 1 80 80 ARG N N 80 116.203 116.203 119.152 -2.949 19439
3901 1 16 . 1 1 80 80 ARG HA H 80 3.732 3.732 4.025 -0.293 19439
3902 1 16 . 1 1 80 80 ARG CA C 80 61.441 61.441 59.511 1.930 19439
3903 1 16 . 1 1 80 80 ARG CB C 80 30.266 30.266 30.386 -0.120 19439
3904 1 16 . 1 1 80 80 ARG H H 80 7.981 7.981 8.083 -0.102 19439
3905 1 16 . 1 1 81 81 VAL N N 81 119.192 119.192 119.765 -0.573 19439
3906 1 16 . 1 1 81 81 VAL HA H 81 3.582 3.582 3.936 -0.354 19439
3907 1 16 . 1 1 81 81 VAL CA C 81 66.909 66.909 66.697 0.212 19439
3908 1 16 . 1 1 81 81 VAL CB C 81 31.668 31.668 31.760 -0.092 19439
3909 1 16 . 1 1 81 81 VAL H H 81 7.338 7.338 8.091 -0.753 19439
3910 1 16 . 1 1 82 82 LEU N N 82 118.722 118.722 121.753 -3.031 19439
3911 1 16 . 1 1 82 82 LEU HA H 82 4.044 4.044 3.933 0.111 19439
3912 1 16 . 1 1 82 82 LEU CA C 82 58.356 58.356 58.739 -0.383 19439
3913 1 16 . 1 1 82 82 LEU CB C 82 41.627 41.627 41.651 -0.024 19439
3914 1 16 . 1 1 82 82 LEU H H 82 7.599 7.599 8.405 -0.806 19439
3915 1 16 . 1 1 83 83 ILE N N 83 120.893 120.893 119.741 1.152 19439
3916 1 16 . 1 1 83 83 ILE HA H 83 3.642 3.642 3.718 -0.076 19439
3917 1 16 . 1 1 83 83 ILE CA C 83 65.669 65.669 65.738 -0.069 19439
3918 1 16 . 1 1 83 83 ILE CB C 83 38.579 38.579 37.905 0.674 19439
3919 1 16 . 1 1 83 83 ILE H H 83 8.546 8.546 8.461 0.085 19439
3920 1 16 . 1 1 84 84 PHE N N 84 123.343 123.343 120.275 3.068 19439
3921 1 16 . 1 1 84 84 PHE HA H 84 4.084 4.084 4.121 -0.037 19439
3922 1 16 . 1 1 84 84 PHE CA C 84 62.593 62.593 60.605 1.988 19439
3923 1 16 . 1 1 84 84 PHE CB C 84 39.211 39.211 38.859 0.352 19439
3924 1 16 . 1 1 84 84 PHE H H 84 8.622 8.622 8.591 0.031 19439
3925 1 16 . 1 1 85 85 ASN N N 85 118.037 118.037 118.354 -0.317 19439
3926 1 16 . 1 1 85 85 ASN HA H 85 4.426 4.426 4.007 0.419 19439
3927 1 16 . 1 1 85 85 ASN CA C 85 56.045 56.045 56.963 -0.918 19439
3928 1 16 . 1 1 85 85 ASN CB C 85 37.785 37.785 38.511 -0.726 19439
3929 1 16 . 1 1 85 85 ASN H H 85 8.834 8.834 8.644 0.190 19439
3930 1 16 . 1 1 86 86 GLU N N 86 121.098 121.098 121.567 -0.469 19439
3931 1 16 . 1 1 86 86 GLU HA H 86 4.052 4.052 3.974 0.078 19439
3932 1 16 . 1 1 86 86 GLU CA C 86 59.328 59.328 59.645 -0.318 19439
3933 1 16 . 1 1 86 86 GLU CB C 86 30.253 30.253 29.574 0.679 19439
3934 1 16 . 1 1 86 86 GLU H H 86 8.105 8.105 8.216 -0.111 19439
3935 1 16 . 1 1 87 87 TRP N N 87 122.584 122.584 121.889 0.695 19439
3936 1 16 . 1 1 87 87 TRP HA H 87 4.006 4.006 4.196 -0.190 19439
3937 1 16 . 1 1 87 87 TRP CA C 87 61.545 61.545 61.681 -0.136 19439
3938 1 16 . 1 1 87 87 TRP CB C 87 27.943 27.943 29.488 -1.545 19439
3939 1 16 . 1 1 87 87 TRP H H 87 8.099 8.099 8.609 -0.510 19439
3940 1 16 . 1 1 88 88 GLU N N 88 117.357 117.357 118.626 -1.269 19439
3941 1 16 . 1 1 88 88 GLU HA H 88 2.919 2.919 3.398 -0.479 19439
3942 1 16 . 1 1 88 88 GLU CA C 88 59.804 59.804 59.458 0.346 19439
3943 1 16 . 1 1 88 88 GLU CB C 88 29.546 29.546 28.853 0.693 19439
3944 1 16 . 1 1 88 88 GLU H H 88 8.440 8.440 8.412 0.028 19439
3945 1 16 . 1 1 89 89 GLU N N 89 116.109 116.109 118.966 -2.857 19439
3946 1 16 . 1 1 89 89 GLU HA H 89 3.995 3.995 3.955 0.040 19439
3947 1 16 . 1 1 89 89 GLU CA C 89 58.329 58.329 59.047 -0.718 19439
3948 1 16 . 1 1 89 89 GLU CB C 89 29.649 29.649 29.271 0.378 19439
3949 1 16 . 1 1 89 89 GLU H H 89 7.244 7.244 7.985 -0.741 19439
3950 1 16 . 1 1 90 90 ARG N N 90 120.512 120.512 118.935 1.577 19439
3951 1 16 . 1 1 90 90 ARG HA H 90 3.920 3.920 4.007 -0.087 19439
3952 1 16 . 1 1 90 90 ARG CA C 90 58.683 58.683 58.783 -0.100 19439
3953 1 16 . 1 1 90 90 ARG CB C 90 30.659 30.659 29.794 0.865 19439
3954 1 16 . 1 1 90 90 ARG H H 90 8.368 8.368 8.263 0.105 19439
3955 1 16 . 1 1 91 91 LYS N N 91 120.024 120.024 119.212 0.812 19439
3956 1 16 . 1 1 91 91 LYS HA H 91 3.964 3.964 3.972 -0.008 19439
3957 1 16 . 1 1 91 91 LYS CA C 91 57.278 57.278 58.694 -1.416 19439
3958 1 16 . 1 1 91 91 LYS CB C 91 30.582 30.582 31.321 -0.739 19439
3959 1 16 . 1 1 91 91 LYS H H 91 8.491 8.491 8.005 0.486 19439
3960 1 16 . 1 1 92 92 LYS N N 92 118.192 118.192 119.686 -1.494 19439
3961 1 16 . 1 1 92 92 LYS HA H 92 3.796 3.796 4.056 -0.260 19439
3962 1 16 . 1 1 92 92 LYS CA C 92 58.976 58.976 58.642 0.334 19439
3963 1 16 . 1 1 92 92 LYS CB C 92 32.188 32.188 32.300 -0.112 19439
3964 1 16 . 1 1 92 92 LYS H H 92 6.933 6.933 7.786 -0.853 19439
3965 1 16 . 1 1 93 93 SER N N 93 110.447 110.447 112.231 -1.784 19439
3966 1 16 . 1 1 93 93 SER HA H 93 4.484 4.484 4.434 0.050 19439
3967 1 16 . 1 1 93 93 SER CA C 93 58.386 58.386 59.447 -1.061 19439
3968 1 16 . 1 1 93 93 SER CB C 93 64.173 64.173 64.628 -0.455 19439
3969 1 16 . 1 1 93 93 SER H H 93 7.282 7.282 7.794 -0.512 19439
3970 1 16 . 1 1 94 94 ASP N N 94 120.163 120.163 122.056 -1.893 19439
3971 1 16 . 1 1 94 94 ASP HA H 94 4.872 4.872 5.069 -0.197 19439
3972 1 16 . 1 1 94 94 ASP CA C 94 51.157 51.157 52.723 -1.566 19439
3973 1 16 . 1 1 94 94 ASP CB C 94 41.256 41.256 43.410 -2.154 19439
3974 1 16 . 1 1 94 94 ASP H H 94 7.303 7.303 8.341 -1.038 19439
3975 1 16 . 1 1 95 95 PRO CA C 95 63.871 63.871 63.552 0.319 19439
3976 1 16 . 1 1 95 95 PRO CB C 95 31.497 31.497 32.254 -0.757 19439
3977 1 16 . 1 1 96 96 TRP N N 96 117.486 117.486 117.331 0.155 19439
3978 1 16 . 1 1 96 96 TRP HA H 96 4.637 4.637 4.592 0.045 19439
3979 1 16 . 1 1 96 96 TRP CA C 96 56.061 56.061 55.059 1.002 19439
3980 1 16 . 1 1 96 96 TRP CB C 96 28.605 28.605 28.614 -0.009 19439
3981 1 16 . 1 1 96 96 TRP H H 96 7.484 7.484 7.910 -0.426 19439
3982 1 16 . 1 1 97 97 LEU N N 97 123.510 123.510 122.241 1.269 19439
3983 1 16 . 1 1 97 97 LEU HA H 97 4.098 4.098 3.076 1.022 19439
3984 1 16 . 1 1 97 97 LEU CA C 97 56.024 56.024 54.285 1.739 19439
3985 1 16 . 1 1 97 97 LEU CB C 97 42.893 42.893 42.578 0.315 19439
3986 1 16 . 1 1 97 97 LEU H H 97 7.137 7.137 6.929 0.208 19439
3987 1 16 . 1 1 98 98 ARG N N 98 129.724 129.724 125.150 4.574 19439
3988 1 16 . 1 1 98 98 ARG HA H 98 4.486 4.486 4.545 -0.059 19439
3989 1 16 . 1 1 98 98 ARG CA C 98 55.622 55.622 54.974 0.648 19439
3990 1 16 . 1 1 98 98 ARG CB C 98 31.229 31.229 31.292 -0.063 19439
3991 1 16 . 1 1 98 98 ARG H H 98 8.825 8.825 8.233 0.592 19439
3992 1 16 . 1 1 99 99 LEU N N 99 127.814 127.814 122.795 5.019 19439
3993 1 16 . 1 1 99 99 LEU HA H 99 3.586 3.586 4.301 -0.715 19439
3994 1 16 . 1 1 99 99 LEU CA C 99 54.352 54.352 54.157 0.195 19439
3995 1 16 . 1 1 99 99 LEU CB C 99 40.485 40.485 41.834 -1.349 19439
3996 1 16 . 1 1 99 99 LEU H H 99 8.236 8.236 8.133 0.103 19439
3997 1 16 . 1 1 100 100 ASP N N 100 126.633 126.633 128.530 -1.897 19439
3998 1 16 . 1 1 100 100 ASP HA H 100 4.646 4.646 4.941 -0.295 19439
3999 1 16 . 1 1 100 100 ASP CA C 100 52.894 52.894 54.111 -1.216 19439
4000 1 16 . 1 1 100 100 ASP CB C 100 41.224 41.224 42.827 -1.603 19439
4001 1 16 . 1 1 100 100 ASP H H 100 8.018 8.018 8.715 -0.697 19439
4002 1 16 . 1 1 101 101 MET N N 101 122.473 122.473 119.781 2.692 19439
4003 1 16 . 1 1 101 101 MET HA H 101 4.481 4.481 4.683 -0.202 19439
4004 1 16 . 1 1 101 101 MET CA C 101 53.398 53.398 54.333 -0.935 19439
4005 1 16 . 1 1 101 101 MET CB C 101 33.296 33.296 33.000 0.296 19439
4006 1 16 . 1 1 101 101 MET H H 101 8.639 8.639 8.162 0.477 19439
4007 1 16 . 1 1 102 102 SER N N 102 116.243 116.243 115.794 0.449 19439
4008 1 16 . 1 1 102 102 SER HA H 102 4.114 4.114 4.291 -0.177 19439
4009 1 16 . 1 1 102 102 SER CA C 102 58.709 58.709 58.255 0.454 19439
4010 1 16 . 1 1 102 102 SER CB C 102 64.701 64.701 64.770 -0.069 19439
4011 1 16 . 1 1 102 102 SER H H 102 8.096 8.096 7.636 0.460 19439
4012 1 16 . 1 1 103 103 ASP N N 103 121.639 121.639 124.039 -2.400 19439
4013 1 16 . 1 1 103 103 ASP HA H 103 3.724 3.724 3.955 -0.231 19439
4014 1 16 . 1 1 103 103 ASP CA C 103 57.296 57.296 58.008 -0.712 19439
4015 1 16 . 1 1 103 103 ASP CB C 103 38.720 38.720 40.572 -1.852 19439
4016 1 16 . 1 1 103 103 ASP H H 103 8.669 8.669 8.591 0.078 19439
4017 1 16 . 1 1 104 104 LYS N N 104 116.276 116.276 119.619 -3.343 19439
4018 1 16 . 1 1 104 104 LYS HA H 104 3.678 3.678 3.925 -0.247 19439
4019 1 16 . 1 1 104 104 LYS CA C 104 59.833 59.833 59.602 0.231 19439
4020 1 16 . 1 1 104 104 LYS CB C 104 32.090 32.090 32.266 -0.176 19439
4021 1 16 . 1 1 104 104 LYS H H 104 7.775 7.775 8.284 -0.509 19439
4022 1 16 . 1 1 105 105 ALA N N 105 122.257 122.257 121.575 0.682 19439
4023 1 16 . 1 1 105 105 ALA HA H 105 3.873 3.873 4.066 -0.193 19439
4024 1 16 . 1 1 105 105 ALA CA C 105 55.008 55.008 54.799 0.209 19439
4025 1 16 . 1 1 105 105 ALA CB C 105 17.741 17.741 18.138 -0.397 19439
4026 1 16 . 1 1 105 105 ALA H H 105 7.266 7.266 7.432 -0.166 19439
4027 1 16 . 1 1 106 106 ILE N N 106 119.452 119.452 120.007 -0.555 19439
4028 1 16 . 1 1 106 106 ILE HA H 106 3.419 3.419 3.751 -0.332 19439
4029 1 16 . 1 1 106 106 ILE CA C 106 65.971 65.971 64.705 1.266 19439
4030 1 16 . 1 1 106 106 ILE CB C 106 37.430 37.430 37.529 -0.099 19439
4031 1 16 . 1 1 106 106 ILE H H 106 7.974 7.974 7.780 0.194 19439
4032 1 16 . 1 1 107 107 PHE N N 107 117.814 117.814 118.804 -0.990 19439
4033 1 16 . 1 1 107 107 PHE HA H 107 4.368 4.368 4.664 -0.296 19439
4034 1 16 . 1 1 107 107 PHE CA C 107 56.844 56.844 58.739 -1.895 19439
4035 1 16 . 1 1 107 107 PHE CB C 107 37.150 37.150 37.657 -0.506 19439
4036 1 16 . 1 1 107 107 PHE H H 107 8.434 8.434 7.980 0.454 19439
4037 1 16 . 1 1 108 108 ARG N N 108 117.368 117.368 120.324 -2.956 19439
4038 1 16 . 1 1 108 108 ARG HA H 108 3.994 3.994 4.129 -0.135 19439
4039 1 16 . 1 1 108 108 ARG CA C 108 58.682 58.682 58.888 -0.206 19439
4040 1 16 . 1 1 108 108 ARG CB C 108 30.287 30.287 30.299 -0.012 19439
4041 1 16 . 1 1 108 108 ARG H H 108 7.474 7.474 8.328 -0.854 19439
4042 1 16 . 1 1 109 109 ARG N N 109 117.440 117.440 116.907 0.533 19439
4043 1 16 . 1 1 109 109 ARG HA H 109 3.900 3.900 3.940 -0.040 19439
4044 1 16 . 1 1 109 109 ARG CA C 109 57.312 57.312 58.239 -0.927 19439
4045 1 16 . 1 1 109 109 ARG CB C 109 31.626 31.626 30.900 0.726 19439
4046 1 16 . 1 1 109 109 ARG H H 109 7.118 7.118 7.631 -0.513 19439
4047 1 16 . 1 1 110 110 TYR N N 110 116.060 116.060 116.601 -0.541 19439
4048 1 16 . 1 1 110 110 TYR HA H 110 5.265 5.265 5.158 0.107 19439
4049 1 16 . 1 1 110 110 TYR CA C 110 54.188 54.188 54.744 -0.556 19439
4050 1 16 . 1 1 110 110 TYR CB C 110 38.484 38.484 38.413 0.070 19439
4051 1 16 . 1 1 110 110 TYR H H 110 8.707 8.707 8.180 0.527 19439
4052 1 16 . 1 1 111 111 PRO HA H 111 4.388 4.388 4.682 -0.294 19439
4053 1 16 . 1 1 111 111 PRO CA C 111 64.847 64.847 64.289 0.558 19439
4054 1 16 . 1 1 111 111 PRO CB C 111 31.381 31.381 32.224 -0.843 19439
4055 1 16 . 1 1 112 112 HIS N N 112 115.542 115.542 114.480 1.062 19439
4056 1 16 . 1 1 112 112 HIS HA H 112 4.482 4.482 4.497 -0.015 19439
4057 1 16 . 1 1 112 112 HIS CA C 112 58.498 58.498 57.463 1.035 19439
4058 1 16 . 1 1 112 112 HIS CB C 112 29.654 29.654 28.516 1.138 19439
4059 1 16 . 1 1 112 112 HIS H H 112 8.196 8.196 8.328 -0.132 19439
4060 1 16 . 1 1 113 113 LEU N N 113 120.583 120.583 119.614 0.969 19439
4061 1 16 . 1 1 113 113 LEU HA H 113 4.165 4.165 4.278 -0.113 19439
4062 1 16 . 1 1 113 113 LEU CA C 113 54.013 54.013 55.051 -1.038 19439
4063 1 16 . 1 1 113 113 LEU CB C 113 41.669 41.669 42.129 -0.460 19439
4064 1 16 . 1 1 113 113 LEU H H 113 7.527 7.527 7.320 0.207 19439
4065 1 17 . 1 1 59 59 ALA N N 59 123.310 123.310 123.465 -0.155 19439
4066 1 17 . 1 1 59 59 ALA HA H 59 4.232 4.232 4.409 -0.177 19439
4067 1 17 . 1 1 59 59 ALA CA C 59 52.274 52.274 52.194 0.080 19439
4068 1 17 . 1 1 59 59 ALA CB C 59 19.623 19.623 17.448 2.175 19439
4069 1 17 . 1 1 59 59 ALA H H 59 7.894 7.894 8.309 -0.415 19439
4070 1 17 . 1 1 60 60 LEU N N 60 120.936 120.936 119.551 1.385 19439
4071 1 17 . 1 1 60 60 LEU HA H 60 4.364 4.364 4.174 0.190 19439
4072 1 17 . 1 1 60 60 LEU CA C 60 54.130 54.130 55.007 -0.877 19439
4073 1 17 . 1 1 60 60 LEU CB C 60 43.209 43.209 42.007 1.202 19439
4074 1 17 . 1 1 60 60 LEU H H 60 8.046 8.046 7.567 0.479 19439
4075 1 17 . 1 1 61 61 ALA N N 61 125.460 125.460 120.687 4.773 19439
4076 1 17 . 1 1 61 61 ALA HA H 61 4.364 4.364 4.297 0.067 19439
4077 1 17 . 1 1 61 61 ALA CA C 61 51.176 51.176 51.735 -0.559 19439
4078 1 17 . 1 1 61 61 ALA CB C 61 20.172 20.172 19.804 0.368 19439
4079 1 17 . 1 1 61 61 ALA H H 61 8.338 8.338 7.560 0.778 19439
4080 1 17 . 1 1 62 62 ALA N N 62 127.765 127.765 125.793 1.972 19439
4081 1 17 . 1 1 62 62 ALA HA H 62 4.394 4.394 4.705 -0.311 19439
4082 1 17 . 1 1 62 62 ALA CA C 62 51.888 51.888 50.812 1.076 19439
4083 1 17 . 1 1 62 62 ALA CB C 62 18.806 18.806 21.560 -2.754 19439
4084 1 17 . 1 1 62 62 ALA H H 62 8.487 8.487 8.858 -0.371 19439
4085 1 17 . 1 1 63 63 LEU N N 63 120.199 120.199 120.568 -0.369 19439
4086 1 17 . 1 1 63 63 LEU HA H 63 4.828 4.828 4.946 -0.118 19439
4087 1 17 . 1 1 63 63 LEU CA C 63 51.852 51.852 52.994 -1.142 19439
4088 1 17 . 1 1 63 63 LEU CB C 63 44.081 44.081 45.301 -1.220 19439
4089 1 17 . 1 1 63 63 LEU H H 63 7.927 7.927 8.313 -0.386 19439
4090 1 17 . 1 1 64 64 HIS N N 64 122.277 122.277 119.131 3.146 19439
4091 1 17 . 1 1 64 64 HIS HA H 64 4.114 4.114 4.563 -0.449 19439
4092 1 17 . 1 1 64 64 HIS CA C 64 58.038 58.038 57.020 1.018 19439
4093 1 17 . 1 1 64 64 HIS CB C 64 31.228 31.228 31.459 -0.231 19439
4094 1 17 . 1 1 64 64 HIS H H 64 8.477 8.477 8.821 -0.344 19439
4095 1 17 . 1 1 65 65 ALA HA H 65 4.339 4.339 4.448 -0.109 19439
4096 1 17 . 1 1 65 65 ALA CA C 65 53.281 53.281 52.516 0.765 19439
4097 1 17 . 1 1 65 65 ALA CB C 65 20.276 20.276 19.922 0.354 19439
4098 1 17 . 1 1 66 66 GLU N N 66 113.868 113.868 117.247 -3.379 19439
4099 1 17 . 1 1 66 66 GLU HA H 66 4.619 4.619 4.510 0.109 19439
4100 1 17 . 1 1 66 66 GLU CA C 66 54.727 54.727 55.033 -0.306 19439
4101 1 17 . 1 1 66 66 GLU CB C 66 32.894 32.894 32.815 0.079 19439
4102 1 17 . 1 1 66 66 GLU H H 66 7.759 7.759 8.001 -0.242 19439
4103 1 17 . 1 1 68 68 PRO HA H 68 4.219 4.219 4.289 -0.070 19439
4104 1 17 . 1 1 68 68 PRO CA C 68 64.664 64.664 65.029 -0.365 19439
4105 1 17 . 1 1 68 68 PRO CB C 68 32.066 32.066 31.685 0.381 19439
4106 1 17 . 1 1 69 69 LEU N N 69 117.262 117.262 118.481 -1.219 19439
4107 1 17 . 1 1 69 69 LEU HA H 69 4.182 4.182 4.219 -0.037 19439
4108 1 17 . 1 1 69 69 LEU CA C 69 52.430 52.430 53.669 -1.239 19439
4109 1 17 . 1 1 69 69 LEU CB C 69 40.907 40.907 41.506 -0.599 19439
4110 1 17 . 1 1 69 69 LEU H H 69 8.439 8.439 7.955 0.484 19439
4111 1 17 . 1 1 70 70 ALA N N 70 120.426 120.426 121.096 -0.670 19439
4112 1 17 . 1 1 70 70 ALA HA H 70 3.411 3.411 4.209 -0.798 19439
4113 1 17 . 1 1 70 70 ALA CA C 70 53.685 53.685 53.496 0.189 19439
4114 1 17 . 1 1 70 70 ALA CB C 70 17.914 17.914 18.657 -0.743 19439
4115 1 17 . 1 1 70 70 ALA H H 70 7.113 7.113 7.428 -0.315 19439
4116 1 17 . 1 1 71 71 GLY N N 71 108.911 108.911 112.664 -3.753 19439
4117 1 17 . 1 1 71 71 GLY CA C 71 45.215 45.215 45.065 0.150 19439
4118 1 17 . 1 1 71 71 GLY H H 71 8.856 8.856 8.799 0.057 19439
4119 1 17 . 1 1 72 72 LEU N N 72 120.000 120.000 121.543 -1.543 19439
4120 1 17 . 1 1 72 72 LEU HA H 72 4.769 4.769 4.917 -0.148 19439
4121 1 17 . 1 1 72 72 LEU CA C 72 51.972 51.972 51.524 0.448 19439
4122 1 17 . 1 1 72 72 LEU CB C 72 41.255 41.255 42.910 -1.655 19439
4123 1 17 . 1 1 72 72 LEU H H 72 8.136 8.136 8.029 0.107 19439
4124 1 17 . 1 1 73 73 PRO HA H 73 4.739 4.739 4.665 0.074 19439
4125 1 17 . 1 1 73 73 PRO CA C 73 61.456 61.456 62.774 -1.318 19439
4126 1 17 . 1 1 73 73 PRO CB C 73 31.245 31.245 31.967 -0.722 19439
4127 1 17 . 1 1 74 74 VAL N N 74 121.723 121.723 120.821 0.902 19439
4128 1 17 . 1 1 74 74 VAL HA H 74 3.446 3.446 3.773 -0.327 19439
4129 1 17 . 1 1 74 74 VAL CA C 74 65.744 65.744 64.041 1.703 19439
4130 1 17 . 1 1 74 74 VAL CB C 74 31.236 31.236 31.979 -0.743 19439
4131 1 17 . 1 1 74 74 VAL H H 74 7.710 7.710 8.139 -0.429 19439
4132 1 17 . 1 1 75 75 THR N N 75 108.893 108.893 112.375 -3.482 19439
4133 1 17 . 1 1 75 75 THR HA H 75 4.937 4.937 4.592 0.345 19439
4134 1 17 . 1 1 75 75 THR CA C 75 59.892 59.892 59.546 0.346 19439
4135 1 17 . 1 1 75 75 THR CB C 75 12.018 12.018 70.928 -58.910 19439
4136 1 17 . 1 1 75 75 THR H H 75 8.710 8.710 8.303 0.407 19439
4137 1 17 . 1 1 76 76 ARG HA H 76 3.873 3.873 4.094 -0.221 19439
4138 1 17 . 1 1 76 76 ARG H H 76 8.447 8.447 8.884 -0.437 19439
4139 1 17 . 1 1 77 77 SER N N 77 114.482 114.482 115.731 -1.249 19439
4140 1 17 . 1 1 77 77 SER HA H 77 4.061 4.061 4.132 -0.071 19439
4141 1 17 . 1 1 77 77 SER CA C 77 60.467 60.467 61.364 -0.897 19439
4142 1 17 . 1 1 77 77 SER CB C 77 62.449 62.449 62.719 -0.270 19439
4143 1 17 . 1 1 77 77 SER H H 77 8.105 8.105 8.138 -0.033 19439
4144 1 17 . 1 1 78 78 ASP N N 78 120.538 120.538 122.506 -1.968 19439
4145 1 17 . 1 1 78 78 ASP HA H 78 4.333 4.333 4.413 -0.080 19439
4146 1 17 . 1 1 78 78 ASP CA C 78 58.020 58.020 56.918 1.102 19439
4147 1 17 . 1 1 78 78 ASP CB C 78 43.252 43.252 40.345 2.907 19439
4148 1 17 . 1 1 78 78 ASP H H 78 7.300 7.300 7.659 -0.359 19439
4149 1 17 . 1 1 79 79 ALA N N 79 120.614 120.614 123.168 -2.554 19439
4150 1 17 . 1 1 79 79 ALA HA H 79 3.672 3.672 3.874 -0.202 19439
4151 1 17 . 1 1 79 79 ALA CA C 79 54.886 54.886 55.205 -0.319 19439
4152 1 17 . 1 1 79 79 ALA CB C 79 19.628 19.628 18.251 1.377 19439
4153 1 17 . 1 1 79 79 ALA H H 79 7.767 7.767 8.149 -0.382 19439
4154 1 17 . 1 1 80 80 ARG N N 80 116.203 116.203 119.197 -2.994 19439
4155 1 17 . 1 1 80 80 ARG HA H 80 3.732 3.732 4.073 -0.341 19439
4156 1 17 . 1 1 80 80 ARG CA C 80 61.441 61.441 59.154 2.287 19439
4157 1 17 . 1 1 80 80 ARG CB C 80 30.266 30.266 30.126 0.140 19439
4158 1 17 . 1 1 80 80 ARG H H 80 7.981 7.981 8.386 -0.405 19439
4159 1 17 . 1 1 81 81 VAL N N 81 119.192 119.192 119.889 -0.697 19439
4160 1 17 . 1 1 81 81 VAL HA H 81 3.582 3.582 3.907 -0.325 19439
4161 1 17 . 1 1 81 81 VAL CA C 81 66.909 66.909 66.879 0.029 19439
4162 1 17 . 1 1 81 81 VAL CB C 81 31.668 31.668 31.656 0.012 19439
4163 1 17 . 1 1 81 81 VAL H H 81 7.338 7.338 8.057 -0.719 19439
4164 1 17 . 1 1 82 82 LEU N N 82 118.722 118.722 121.161 -2.439 19439
4165 1 17 . 1 1 82 82 LEU HA H 82 4.044 4.044 3.935 0.109 19439
4166 1 17 . 1 1 82 82 LEU CA C 82 58.356 58.356 58.694 -0.338 19439
4167 1 17 . 1 1 82 82 LEU CB C 82 41.627 41.627 41.627 -0.000 19439
4168 1 17 . 1 1 82 82 LEU H H 82 7.599 7.599 8.435 -0.836 19439
4169 1 17 . 1 1 83 83 ILE N N 83 120.893 120.893 119.244 1.649 19439
4170 1 17 . 1 1 83 83 ILE HA H 83 3.642 3.642 3.698 -0.056 19439
4171 1 17 . 1 1 83 83 ILE CA C 83 65.669 65.669 65.566 0.103 19439
4172 1 17 . 1 1 83 83 ILE CB C 83 38.579 38.579 37.910 0.669 19439
4173 1 17 . 1 1 83 83 ILE H H 83 8.546 8.546 8.354 0.192 19439
4174 1 17 . 1 1 84 84 PHE N N 84 123.343 123.343 120.701 2.642 19439
4175 1 17 . 1 1 84 84 PHE HA H 84 4.084 4.084 4.083 0.001 19439
4176 1 17 . 1 1 84 84 PHE CA C 84 62.593 62.593 59.699 2.894 19439
4177 1 17 . 1 1 84 84 PHE CB C 84 39.211 39.211 38.449 0.762 19439
4178 1 17 . 1 1 84 84 PHE H H 84 8.622 8.622 8.594 0.028 19439
4179 1 17 . 1 1 85 85 ASN N N 85 118.037 118.037 118.265 -0.228 19439
4180 1 17 . 1 1 85 85 ASN HA H 85 4.426 4.426 4.337 0.089 19439
4181 1 17 . 1 1 85 85 ASN CA C 85 56.045 56.045 56.370 -0.325 19439
4182 1 17 . 1 1 85 85 ASN CB C 85 37.785 37.785 38.664 -0.879 19439
4183 1 17 . 1 1 85 85 ASN H H 85 8.834 8.834 8.665 0.169 19439
4184 1 17 . 1 1 86 86 GLU N N 86 121.098 121.098 121.580 -0.482 19439
4185 1 17 . 1 1 86 86 GLU HA H 86 4.052 4.052 3.970 0.082 19439
4186 1 17 . 1 1 86 86 GLU CA C 86 59.328 59.328 59.709 -0.381 19439
4187 1 17 . 1 1 86 86 GLU CB C 86 30.253 30.253 29.698 0.555 19439
4188 1 17 . 1 1 86 86 GLU H H 86 8.105 8.105 8.322 -0.217 19439
4189 1 17 . 1 1 87 87 TRP N N 87 122.584 122.584 122.040 0.544 19439
4190 1 17 . 1 1 87 87 TRP HA H 87 4.006 4.006 4.212 -0.206 19439
4191 1 17 . 1 1 87 87 TRP CA C 87 61.545 61.545 61.857 -0.312 19439
4192 1 17 . 1 1 87 87 TRP CB C 87 27.943 27.943 29.489 -1.546 19439
4193 1 17 . 1 1 87 87 TRP H H 87 8.099 8.099 8.684 -0.585 19439
4194 1 17 . 1 1 88 88 GLU N N 88 117.357 117.357 119.750 -2.393 19439
4195 1 17 . 1 1 88 88 GLU HA H 88 2.919 2.919 3.361 -0.442 19439
4196 1 17 . 1 1 88 88 GLU CA C 88 59.804 59.804 59.965 -0.161 19439
4197 1 17 . 1 1 88 88 GLU CB C 88 29.546 29.546 29.640 -0.094 19439
4198 1 17 . 1 1 88 88 GLU H H 88 8.440 8.440 8.821 -0.381 19439
4199 1 17 . 1 1 89 89 GLU N N 89 116.109 116.109 119.132 -3.023 19439
4200 1 17 . 1 1 89 89 GLU HA H 89 3.995 3.995 3.957 0.038 19439
4201 1 17 . 1 1 89 89 GLU CA C 89 58.329 58.329 59.348 -1.019 19439
4202 1 17 . 1 1 89 89 GLU CB C 89 29.649 29.649 29.493 0.156 19439
4203 1 17 . 1 1 89 89 GLU H H 89 7.244 7.244 8.197 -0.953 19439
4204 1 17 . 1 1 90 90 ARG N N 90 120.512 120.512 118.753 1.759 19439
4205 1 17 . 1 1 90 90 ARG HA H 90 3.920 3.920 3.957 -0.037 19439
4206 1 17 . 1 1 90 90 ARG CA C 90 58.683 58.683 58.735 -0.052 19439
4207 1 17 . 1 1 90 90 ARG CB C 90 30.659 30.659 29.640 1.019 19439
4208 1 17 . 1 1 90 90 ARG H H 90 8.368 8.368 8.140 0.228 19439
4209 1 17 . 1 1 91 91 LYS N N 91 120.024 120.024 119.858 0.166 19439
4210 1 17 . 1 1 91 91 LYS HA H 91 3.964 3.964 4.054 -0.090 19439
4211 1 17 . 1 1 91 91 LYS CA C 91 57.278 57.278 58.718 -1.440 19439
4212 1 17 . 1 1 91 91 LYS CB C 91 30.582 30.582 31.319 -0.737 19439
4213 1 17 . 1 1 91 91 LYS H H 91 8.491 8.491 8.043 0.448 19439
4214 1 17 . 1 1 92 92 LYS N N 92 118.192 118.192 118.505 -0.313 19439
4215 1 17 . 1 1 92 92 LYS HA H 92 3.796 3.796 4.018 -0.222 19439
4216 1 17 . 1 1 92 92 LYS CA C 92 58.976 58.976 58.675 0.301 19439
4217 1 17 . 1 1 92 92 LYS CB C 92 32.188 32.188 32.237 -0.049 19439
4218 1 17 . 1 1 92 92 LYS H H 92 6.933 6.933 7.911 -0.978 19439
4219 1 17 . 1 1 93 93 SER N N 93 110.447 110.447 113.624 -3.177 19439
4220 1 17 . 1 1 93 93 SER HA H 93 4.484 4.484 4.333 0.151 19439
4221 1 17 . 1 1 93 93 SER CA C 93 58.386 58.386 60.295 -1.909 19439
4222 1 17 . 1 1 93 93 SER CB C 93 64.173 64.173 64.182 -0.009 19439
4223 1 17 . 1 1 93 93 SER H H 93 7.282 7.282 7.697 -0.415 19439
4224 1 17 . 1 1 94 94 ASP N N 94 120.163 120.163 119.645 0.518 19439
4225 1 17 . 1 1 94 94 ASP HA H 94 4.872 4.872 5.059 -0.187 19439
4226 1 17 . 1 1 94 94 ASP CA C 94 51.157 51.157 52.728 -1.571 19439
4227 1 17 . 1 1 94 94 ASP CB C 94 41.256 41.256 43.119 -1.863 19439
4228 1 17 . 1 1 94 94 ASP H H 94 7.303 7.303 8.204 -0.901 19439
4229 1 17 . 1 1 95 95 PRO CA C 95 63.871 63.871 63.965 -0.094 19439
4230 1 17 . 1 1 95 95 PRO CB C 95 31.497 31.497 32.385 -0.888 19439
4231 1 17 . 1 1 96 96 TRP N N 96 117.486 117.486 117.705 -0.219 19439
4232 1 17 . 1 1 96 96 TRP HA H 96 4.637 4.637 4.648 -0.011 19439
4233 1 17 . 1 1 96 96 TRP CA C 96 56.061 56.061 55.374 0.687 19439
4234 1 17 . 1 1 96 96 TRP CB C 96 28.605 28.605 28.294 0.311 19439
4235 1 17 . 1 1 96 96 TRP H H 96 7.484 7.484 8.010 -0.526 19439
4236 1 17 . 1 1 97 97 LEU N N 97 123.510 123.510 121.380 2.130 19439
4237 1 17 . 1 1 97 97 LEU HA H 97 4.098 4.098 3.342 0.756 19439
4238 1 17 . 1 1 97 97 LEU CA C 97 56.024 56.024 54.416 1.608 19439
4239 1 17 . 1 1 97 97 LEU CB C 97 42.893 42.893 42.374 0.519 19439
4240 1 17 . 1 1 97 97 LEU H H 97 7.137 7.137 6.922 0.215 19439
4241 1 17 . 1 1 98 98 ARG N N 98 129.724 129.724 125.153 4.571 19439
4242 1 17 . 1 1 98 98 ARG HA H 98 4.486 4.486 4.614 -0.128 19439
4243 1 17 . 1 1 98 98 ARG CA C 98 55.622 55.622 54.794 0.828 19439
4244 1 17 . 1 1 98 98 ARG CB C 98 31.229 31.229 32.142 -0.913 19439
4245 1 17 . 1 1 98 98 ARG H H 98 8.825 8.825 8.310 0.515 19439
4246 1 17 . 1 1 99 99 LEU N N 99 127.814 127.814 124.950 2.864 19439
4247 1 17 . 1 1 99 99 LEU HA H 99 3.586 3.586 4.088 -0.502 19439
4248 1 17 . 1 1 99 99 LEU CA C 99 54.352 54.352 54.274 0.078 19439
4249 1 17 . 1 1 99 99 LEU CB C 99 40.485 40.485 41.374 -0.889 19439
4250 1 17 . 1 1 99 99 LEU H H 99 8.236 8.236 7.992 0.244 19439
4251 1 17 . 1 1 100 100 ASP N N 100 126.633 126.633 126.729 -0.096 19439
4252 1 17 . 1 1 100 100 ASP HA H 100 4.646 4.646 4.789 -0.143 19439
4253 1 17 . 1 1 100 100 ASP CA C 100 52.894 52.894 53.760 -0.866 19439
4254 1 17 . 1 1 100 100 ASP CB C 100 41.224 41.224 43.020 -1.796 19439
4255 1 17 . 1 1 100 100 ASP H H 100 8.018 8.018 8.434 -0.416 19439
4256 1 17 . 1 1 101 101 MET N N 101 122.473 122.473 119.597 2.876 19439
4257 1 17 . 1 1 101 101 MET HA H 101 4.481 4.481 4.611 -0.130 19439
4258 1 17 . 1 1 101 101 MET CA C 101 53.398 53.398 54.321 -0.923 19439
4259 1 17 . 1 1 101 101 MET CB C 101 33.296 33.296 33.149 0.147 19439
4260 1 17 . 1 1 101 101 MET H H 101 8.639 8.639 7.823 0.816 19439
4261 1 17 . 1 1 102 102 SER N N 102 116.243 116.243 118.583 -2.340 19439
4262 1 17 . 1 1 102 102 SER HA H 102 4.114 4.114 4.409 -0.295 19439
4263 1 17 . 1 1 102 102 SER CA C 102 58.709 58.709 57.584 1.125 19439
4264 1 17 . 1 1 102 102 SER CB C 102 64.701 64.701 64.225 0.476 19439
4265 1 17 . 1 1 102 102 SER H H 102 8.096 8.096 7.958 0.138 19439
4266 1 17 . 1 1 103 103 ASP N N 103 121.639 121.639 122.907 -1.268 19439
4267 1 17 . 1 1 103 103 ASP HA H 103 3.724 3.724 3.841 -0.117 19439
4268 1 17 . 1 1 103 103 ASP CA C 103 57.296 57.296 57.116 0.180 19439
4269 1 17 . 1 1 103 103 ASP CB C 103 38.720 38.720 40.015 -1.295 19439
4270 1 17 . 1 1 103 103 ASP H H 103 8.669 8.669 8.719 -0.050 19439
4271 1 17 . 1 1 104 104 LYS N N 104 116.276 116.276 118.978 -2.702 19439
4272 1 17 . 1 1 104 104 LYS HA H 104 3.678 3.678 4.028 -0.350 19439
4273 1 17 . 1 1 104 104 LYS CA C 104 59.833 59.833 58.818 1.015 19439
4274 1 17 . 1 1 104 104 LYS CB C 104 32.090 32.090 32.064 0.026 19439
4275 1 17 . 1 1 104 104 LYS H H 104 7.775 7.775 8.252 -0.477 19439
4276 1 17 . 1 1 105 105 ALA N N 105 122.257 122.257 122.663 -0.406 19439
4277 1 17 . 1 1 105 105 ALA HA H 105 3.873 3.873 4.069 -0.196 19439
4278 1 17 . 1 1 105 105 ALA CA C 105 55.008 55.008 54.761 0.247 19439
4279 1 17 . 1 1 105 105 ALA CB C 105 17.741 17.741 18.119 -0.378 19439
4280 1 17 . 1 1 105 105 ALA H H 105 7.266 7.266 7.579 -0.313 19439
4281 1 17 . 1 1 106 106 ILE N N 106 119.452 119.452 119.802 -0.350 19439
4282 1 17 . 1 1 106 106 ILE HA H 106 3.419 3.419 3.804 -0.385 19439
4283 1 17 . 1 1 106 106 ILE CA C 106 65.971 65.971 64.412 1.559 19439
4284 1 17 . 1 1 106 106 ILE CB C 106 37.430 37.430 37.583 -0.153 19439
4285 1 17 . 1 1 106 106 ILE H H 106 7.974 7.974 7.819 0.155 19439
4286 1 17 . 1 1 107 107 PHE N N 107 117.814 117.814 118.780 -0.966 19439
4287 1 17 . 1 1 107 107 PHE HA H 107 4.368 4.368 4.752 -0.384 19439
4288 1 17 . 1 1 107 107 PHE CA C 107 56.844 56.844 58.164 -1.320 19439
4289 1 17 . 1 1 107 107 PHE CB C 107 37.150 37.150 37.682 -0.532 19439
4290 1 17 . 1 1 107 107 PHE H H 107 8.434 8.434 8.107 0.327 19439
4291 1 17 . 1 1 108 108 ARG N N 108 117.368 117.368 120.264 -2.896 19439
4292 1 17 . 1 1 108 108 ARG HA H 108 3.994 3.994 4.120 -0.126 19439
4293 1 17 . 1 1 108 108 ARG CA C 108 58.682 58.682 58.816 -0.134 19439
4294 1 17 . 1 1 108 108 ARG CB C 108 30.287 30.287 30.342 -0.055 19439
4295 1 17 . 1 1 108 108 ARG H H 108 7.474 7.474 8.146 -0.672 19439
4296 1 17 . 1 1 109 109 ARG N N 109 117.440 117.440 117.258 0.182 19439
4297 1 17 . 1 1 109 109 ARG HA H 109 3.900 3.900 3.921 -0.021 19439
4298 1 17 . 1 1 109 109 ARG CA C 109 57.312 57.312 57.737 -0.425 19439
4299 1 17 . 1 1 109 109 ARG CB C 109 31.626 31.626 30.651 0.976 19439
4300 1 17 . 1 1 109 109 ARG H H 109 7.118 7.118 7.710 -0.592 19439
4301 1 17 . 1 1 110 110 TYR N N 110 116.060 116.060 117.111 -1.051 19439
4302 1 17 . 1 1 110 110 TYR HA H 110 5.265 5.265 5.107 0.158 19439
4303 1 17 . 1 1 110 110 TYR CA C 110 54.188 54.188 54.657 -0.469 19439
4304 1 17 . 1 1 110 110 TYR CB C 110 38.484 38.484 38.440 0.044 19439
4305 1 17 . 1 1 110 110 TYR H H 110 8.707 8.707 8.071 0.636 19439
4306 1 17 . 1 1 111 111 PRO HA H 111 4.388 4.388 4.670 -0.282 19439
4307 1 17 . 1 1 111 111 PRO CA C 111 64.847 64.847 64.370 0.477 19439
4308 1 17 . 1 1 111 111 PRO CB C 111 31.381 31.381 32.149 -0.768 19439
4309 1 17 . 1 1 112 112 HIS N N 112 115.542 115.542 115.151 0.391 19439
4310 1 17 . 1 1 112 112 HIS HA H 112 4.482 4.482 4.512 -0.030 19439
4311 1 17 . 1 1 112 112 HIS CA C 112 58.498 58.498 57.267 1.231 19439
4312 1 17 . 1 1 112 112 HIS CB C 112 29.654 29.654 28.382 1.272 19439
4313 1 17 . 1 1 112 112 HIS H H 112 8.196 8.196 8.402 -0.206 19439
4314 1 17 . 1 1 113 113 LEU N N 113 120.583 120.583 119.617 0.966 19439
4315 1 17 . 1 1 113 113 LEU HA H 113 4.165 4.165 4.336 -0.171 19439
4316 1 17 . 1 1 113 113 LEU CA C 113 54.013 54.013 55.224 -1.211 19439
4317 1 17 . 1 1 113 113 LEU CB C 113 41.669 41.669 41.480 0.189 19439
4318 1 17 . 1 1 113 113 LEU H H 113 7.527 7.527 7.761 -0.234 19439
4319 1 18 . 1 1 59 59 ALA N N 59 123.310 123.310 122.581 0.729 19439
4320 1 18 . 1 1 59 59 ALA HA H 59 4.232 4.232 4.778 -0.546 19439
4321 1 18 . 1 1 59 59 ALA CA C 59 52.274 52.274 52.100 0.174 19439
4322 1 18 . 1 1 59 59 ALA CB C 59 19.623 19.623 20.819 -1.196 19439
4323 1 18 . 1 1 59 59 ALA H H 59 7.894 7.894 7.703 0.191 19439
4324 1 18 . 1 1 60 60 LEU N N 60 120.936 120.936 116.800 4.136 19439
4325 1 18 . 1 1 60 60 LEU HA H 60 4.364 4.364 4.967 -0.603 19439
4326 1 18 . 1 1 60 60 LEU CA C 60 54.130 54.130 54.163 -0.033 19439
4327 1 18 . 1 1 60 60 LEU CB C 60 43.209 43.209 44.731 -1.522 19439
4328 1 18 . 1 1 60 60 LEU H H 60 8.046 8.046 8.372 -0.326 19439
4329 1 18 . 1 1 61 61 ALA N N 61 125.460 125.460 122.356 3.104 19439
4330 1 18 . 1 1 61 61 ALA HA H 61 4.364 4.364 4.985 -0.621 19439
4331 1 18 . 1 1 61 61 ALA CA C 61 51.176 51.176 51.781 -0.605 19439
4332 1 18 . 1 1 61 61 ALA CB C 61 20.172 20.172 21.600 -1.428 19439
4333 1 18 . 1 1 61 61 ALA H H 61 8.338 8.338 8.355 -0.017 19439
4334 1 18 . 1 1 62 62 ALA N N 62 127.765 127.765 123.187 4.578 19439
4335 1 18 . 1 1 62 62 ALA HA H 62 4.394 4.394 4.760 -0.366 19439
4336 1 18 . 1 1 62 62 ALA CA C 62 51.888 51.888 50.724 1.165 19439
4337 1 18 . 1 1 62 62 ALA CB C 62 18.806 18.806 20.815 -2.009 19439
4338 1 18 . 1 1 62 62 ALA H H 62 8.487 8.487 9.086 -0.599 19439
4339 1 18 . 1 1 63 63 LEU N N 63 120.199 120.199 119.783 0.416 19439
4340 1 18 . 1 1 63 63 LEU HA H 63 4.828 4.828 4.993 -0.165 19439
4341 1 18 . 1 1 63 63 LEU CA C 63 51.852 51.852 53.330 -1.478 19439
4342 1 18 . 1 1 63 63 LEU CB C 63 44.081 44.081 45.781 -1.700 19439
4343 1 18 . 1 1 63 63 LEU H H 63 7.927 7.927 8.217 -0.290 19439
4344 1 18 . 1 1 64 64 HIS N N 64 122.277 122.277 119.471 2.806 19439
4345 1 18 . 1 1 64 64 HIS HA H 64 4.114 4.114 4.568 -0.454 19439
4346 1 18 . 1 1 64 64 HIS CA C 64 58.038 58.038 57.027 1.011 19439
4347 1 18 . 1 1 64 64 HIS CB C 64 31.228 31.228 31.250 -0.022 19439
4348 1 18 . 1 1 64 64 HIS H H 64 8.477 8.477 8.821 -0.344 19439
4349 1 18 . 1 1 65 65 ALA HA H 65 4.339 4.339 4.414 -0.075 19439
4350 1 18 . 1 1 65 65 ALA CA C 65 53.281 53.281 52.813 0.468 19439
4351 1 18 . 1 1 65 65 ALA CB C 65 20.276 20.276 19.855 0.421 19439
4352 1 18 . 1 1 66 66 GLU N N 66 113.868 113.868 116.624 -2.756 19439
4353 1 18 . 1 1 66 66 GLU HA H 66 4.619 4.619 4.514 0.105 19439
4354 1 18 . 1 1 66 66 GLU CA C 66 54.727 54.727 55.080 -0.353 19439
4355 1 18 . 1 1 66 66 GLU CB C 66 32.894 32.894 32.864 0.030 19439
4356 1 18 . 1 1 66 66 GLU H H 66 7.759 7.759 8.056 -0.297 19439
4357 1 18 . 1 1 68 68 PRO HA H 68 4.219 4.219 4.243 -0.024 19439
4358 1 18 . 1 1 68 68 PRO CA C 68 64.664 64.664 65.062 -0.398 19439
4359 1 18 . 1 1 68 68 PRO CB C 68 32.066 32.066 31.738 0.328 19439
4360 1 18 . 1 1 69 69 LEU N N 69 117.262 117.262 117.395 -0.133 19439
4361 1 18 . 1 1 69 69 LEU HA H 69 4.182 4.182 4.386 -0.204 19439
4362 1 18 . 1 1 69 69 LEU CA C 69 52.430 52.430 53.405 -0.975 19439
4363 1 18 . 1 1 69 69 LEU CB C 69 40.907 40.907 41.227 -0.320 19439
4364 1 18 . 1 1 69 69 LEU H H 69 8.439 8.439 7.880 0.559 19439
4365 1 18 . 1 1 70 70 ALA N N 70 120.426 120.426 121.586 -1.160 19439
4366 1 18 . 1 1 70 70 ALA HA H 70 3.411 3.411 4.110 -0.699 19439
4367 1 18 . 1 1 70 70 ALA CA C 70 53.685 53.685 53.463 0.222 19439
4368 1 18 . 1 1 70 70 ALA CB C 70 17.914 17.914 18.682 -0.768 19439
4369 1 18 . 1 1 70 70 ALA H H 70 7.113 7.113 7.585 -0.472 19439
4370 1 18 . 1 1 71 71 GLY N N 71 108.911 108.911 113.248 -4.337 19439
4371 1 18 . 1 1 71 71 GLY CA C 71 45.215 45.215 45.015 0.200 19439
4372 1 18 . 1 1 71 71 GLY H H 71 8.856 8.856 8.991 -0.135 19439
4373 1 18 . 1 1 72 72 LEU N N 72 120.000 120.000 120.741 -0.741 19439
4374 1 18 . 1 1 72 72 LEU HA H 72 4.769 4.769 4.994 -0.225 19439
4375 1 18 . 1 1 72 72 LEU CA C 72 51.972 51.972 51.569 0.403 19439
4376 1 18 . 1 1 72 72 LEU CB C 72 41.255 41.255 42.941 -1.686 19439
4377 1 18 . 1 1 72 72 LEU H H 72 8.136 8.136 7.938 0.198 19439
4378 1 18 . 1 1 73 73 PRO HA H 73 4.739 4.739 4.647 0.092 19439
4379 1 18 . 1 1 73 73 PRO CA C 73 61.456 61.456 62.860 -1.404 19439
4380 1 18 . 1 1 73 73 PRO CB C 73 31.245 31.245 31.984 -0.739 19439
4381 1 18 . 1 1 74 74 VAL N N 74 121.723 121.723 119.825 1.898 19439
4382 1 18 . 1 1 74 74 VAL HA H 74 3.446 3.446 3.912 -0.466 19439
4383 1 18 . 1 1 74 74 VAL CA C 74 65.744 65.744 63.804 1.940 19439
4384 1 18 . 1 1 74 74 VAL CB C 74 31.236 31.236 32.006 -0.770 19439
4385 1 18 . 1 1 74 74 VAL H H 74 7.710 7.710 8.152 -0.442 19439
4386 1 18 . 1 1 75 75 THR N N 75 108.893 108.893 109.823 -0.930 19439
4387 1 18 . 1 1 75 75 THR HA H 75 4.937 4.937 4.644 0.293 19439
4388 1 18 . 1 1 75 75 THR CA C 75 59.892 59.892 59.645 0.247 19439
4389 1 18 . 1 1 75 75 THR CB C 75 12.018 12.018 71.897 -59.879 19439
4390 1 18 . 1 1 75 75 THR H H 75 8.710 8.710 8.048 0.662 19439
4391 1 18 . 1 1 76 76 ARG HA H 76 3.873 3.873 4.064 -0.191 19439
4392 1 18 . 1 1 76 76 ARG H H 76 8.447 8.447 8.810 -0.363 19439
4393 1 18 . 1 1 77 77 SER N N 77 114.482 114.482 116.133 -1.651 19439
4394 1 18 . 1 1 77 77 SER HA H 77 4.061 4.061 4.133 -0.072 19439
4395 1 18 . 1 1 77 77 SER CA C 77 60.467 60.467 61.457 -0.990 19439
4396 1 18 . 1 1 77 77 SER CB C 77 62.449 62.449 63.059 -0.610 19439
4397 1 18 . 1 1 77 77 SER H H 77 8.105 8.105 7.822 0.283 19439
4398 1 18 . 1 1 78 78 ASP N N 78 120.538 120.538 122.439 -1.901 19439
4399 1 18 . 1 1 78 78 ASP HA H 78 4.333 4.333 4.323 0.010 19439
4400 1 18 . 1 1 78 78 ASP CA C 78 58.020 58.020 57.334 0.686 19439
4401 1 18 . 1 1 78 78 ASP CB C 78 43.252 43.252 40.330 2.922 19439
4402 1 18 . 1 1 78 78 ASP H H 78 7.300 7.300 8.079 -0.779 19439
4403 1 18 . 1 1 79 79 ALA N N 79 120.614 120.614 122.644 -2.030 19439
4404 1 18 . 1 1 79 79 ALA HA H 79 3.672 3.672 3.829 -0.157 19439
4405 1 18 . 1 1 79 79 ALA CA C 79 54.886 54.886 55.135 -0.249 19439
4406 1 18 . 1 1 79 79 ALA CB C 79 19.628 19.628 18.351 1.277 19439
4407 1 18 . 1 1 79 79 ALA H H 79 7.767 7.767 8.250 -0.483 19439
4408 1 18 . 1 1 80 80 ARG N N 80 116.203 116.203 119.047 -2.844 19439
4409 1 18 . 1 1 80 80 ARG HA H 80 3.732 3.732 4.017 -0.285 19439
4410 1 18 . 1 1 80 80 ARG CA C 80 61.441 61.441 59.469 1.972 19439
4411 1 18 . 1 1 80 80 ARG CB C 80 30.266 30.266 30.256 0.010 19439
4412 1 18 . 1 1 80 80 ARG H H 80 7.981 7.981 8.183 -0.202 19439
4413 1 18 . 1 1 81 81 VAL N N 81 119.192 119.192 120.110 -0.918 19439
4414 1 18 . 1 1 81 81 VAL HA H 81 3.582 3.582 3.979 -0.397 19439
4415 1 18 . 1 1 81 81 VAL CA C 81 66.909 66.909 66.454 0.455 19439
4416 1 18 . 1 1 81 81 VAL CB C 81 31.668 31.668 31.512 0.156 19439
4417 1 18 . 1 1 81 81 VAL H H 81 7.338 7.338 8.256 -0.918 19439
4418 1 18 . 1 1 82 82 LEU N N 82 118.722 118.722 121.449 -2.727 19439
4419 1 18 . 1 1 82 82 LEU HA H 82 4.044 4.044 3.961 0.083 19439
4420 1 18 . 1 1 82 82 LEU CA C 82 58.356 58.356 58.662 -0.306 19439
4421 1 18 . 1 1 82 82 LEU CB C 82 41.627 41.627 41.688 -0.061 19439
4422 1 18 . 1 1 82 82 LEU H H 82 7.599 7.599 8.396 -0.797 19439
4423 1 18 . 1 1 83 83 ILE N N 83 120.893 120.893 120.135 0.758 19439
4424 1 18 . 1 1 83 83 ILE HA H 83 3.642 3.642 3.791 -0.149 19439
4425 1 18 . 1 1 83 83 ILE CA C 83 65.669 65.669 65.518 0.151 19439
4426 1 18 . 1 1 83 83 ILE CB C 83 38.579 38.579 38.025 0.554 19439
4427 1 18 . 1 1 83 83 ILE H H 83 8.546 8.546 8.439 0.107 19439
4428 1 18 . 1 1 84 84 PHE N N 84 123.343 123.343 120.461 2.882 19439
4429 1 18 . 1 1 84 84 PHE HA H 84 4.084 4.084 4.103 -0.019 19439
4430 1 18 . 1 1 84 84 PHE CA C 84 62.593 62.593 60.392 2.201 19439
4431 1 18 . 1 1 84 84 PHE CB C 84 39.211 39.211 38.769 0.442 19439
4432 1 18 . 1 1 84 84 PHE H H 84 8.622 8.622 8.648 -0.026 19439
4433 1 18 . 1 1 85 85 ASN N N 85 118.037 118.037 118.421 -0.384 19439
4434 1 18 . 1 1 85 85 ASN HA H 85 4.426 4.426 3.994 0.432 19439
4435 1 18 . 1 1 85 85 ASN CA C 85 56.045 56.045 56.683 -0.638 19439
4436 1 18 . 1 1 85 85 ASN CB C 85 37.785 37.785 38.473 -0.688 19439
4437 1 18 . 1 1 85 85 ASN H H 85 8.834 8.834 8.563 0.271 19439
4438 1 18 . 1 1 86 86 GLU N N 86 121.098 121.098 121.788 -0.690 19439
4439 1 18 . 1 1 86 86 GLU HA H 86 4.052 4.052 3.966 0.086 19439
4440 1 18 . 1 1 86 86 GLU CA C 86 59.328 59.328 59.695 -0.367 19439
4441 1 18 . 1 1 86 86 GLU CB C 86 30.253 30.253 29.561 0.692 19439
4442 1 18 . 1 1 86 86 GLU H H 86 8.105 8.105 8.271 -0.166 19439
4443 1 18 . 1 1 87 87 TRP N N 87 122.584 122.584 122.050 0.534 19439
4444 1 18 . 1 1 87 87 TRP HA H 87 4.006 4.006 4.176 -0.170 19439
4445 1 18 . 1 1 87 87 TRP CA C 87 61.545 61.545 61.843 -0.298 19439
4446 1 18 . 1 1 87 87 TRP CB C 87 27.943 27.943 29.509 -1.566 19439
4447 1 18 . 1 1 87 87 TRP H H 87 8.099 8.099 8.706 -0.607 19439
4448 1 18 . 1 1 88 88 GLU N N 88 117.357 117.357 118.874 -1.517 19439
4449 1 18 . 1 1 88 88 GLU HA H 88 2.919 2.919 3.408 -0.489 19439
4450 1 18 . 1 1 88 88 GLU CA C 88 59.804 59.804 59.856 -0.052 19439
4451 1 18 . 1 1 88 88 GLU CB C 88 29.546 29.546 29.190 0.356 19439
4452 1 18 . 1 1 88 88 GLU H H 88 8.440 8.440 8.553 -0.113 19439
4453 1 18 . 1 1 89 89 GLU N N 89 116.109 116.109 118.550 -2.441 19439
4454 1 18 . 1 1 89 89 GLU HA H 89 3.995 3.995 3.870 0.125 19439
4455 1 18 . 1 1 89 89 GLU CA C 89 58.329 58.329 59.125 -0.796 19439
4456 1 18 . 1 1 89 89 GLU CB C 89 29.649 29.649 29.260 0.389 19439
4457 1 18 . 1 1 89 89 GLU H H 89 7.244 7.244 7.933 -0.689 19439
4458 1 18 . 1 1 90 90 ARG N N 90 120.512 120.512 118.703 1.809 19439
4459 1 18 . 1 1 90 90 ARG HA H 90 3.920 3.920 3.920 0.000 19439
4460 1 18 . 1 1 90 90 ARG CA C 90 58.683 58.683 58.885 -0.202 19439
4461 1 18 . 1 1 90 90 ARG CB C 90 30.659 30.659 29.626 1.033 19439
4462 1 18 . 1 1 90 90 ARG H H 90 8.368 8.368 8.367 0.001 19439
4463 1 18 . 1 1 91 91 LYS N N 91 120.024 120.024 119.664 0.360 19439
4464 1 18 . 1 1 91 91 LYS HA H 91 3.964 3.964 4.044 -0.080 19439
4465 1 18 . 1 1 91 91 LYS CA C 91 57.278 57.278 58.649 -1.371 19439
4466 1 18 . 1 1 91 91 LYS CB C 91 30.582 30.582 31.341 -0.759 19439
4467 1 18 . 1 1 91 91 LYS H H 91 8.491 8.491 7.962 0.529 19439
4468 1 18 . 1 1 92 92 LYS N N 92 118.192 118.192 117.192 1.000 19439
4469 1 18 . 1 1 92 92 LYS HA H 92 3.796 3.796 3.980 -0.184 19439
4470 1 18 . 1 1 92 92 LYS CA C 92 58.976 58.976 58.856 0.120 19439
4471 1 18 . 1 1 92 92 LYS CB C 92 32.188 32.188 32.157 0.031 19439
4472 1 18 . 1 1 92 92 LYS H H 92 6.933 6.933 7.801 -0.868 19439
4473 1 18 . 1 1 93 93 SER N N 93 110.447 110.447 112.760 -2.313 19439
4474 1 18 . 1 1 93 93 SER HA H 93 4.484 4.484 4.412 0.072 19439
4475 1 18 . 1 1 93 93 SER CA C 93 58.386 58.386 59.863 -1.477 19439
4476 1 18 . 1 1 93 93 SER CB C 93 64.173 64.173 64.298 -0.125 19439
4477 1 18 . 1 1 93 93 SER H H 93 7.282 7.282 7.668 -0.386 19439
4478 1 18 . 1 1 94 94 ASP N N 94 120.163 120.163 119.632 0.531 19439
4479 1 18 . 1 1 94 94 ASP HA H 94 4.872 4.872 5.078 -0.206 19439
4480 1 18 . 1 1 94 94 ASP CA C 94 51.157 51.157 52.643 -1.486 19439
4481 1 18 . 1 1 94 94 ASP CB C 94 41.256 41.256 43.104 -1.848 19439
4482 1 18 . 1 1 94 94 ASP H H 94 7.303 7.303 8.179 -0.876 19439
4483 1 18 . 1 1 95 95 PRO CA C 95 63.871 63.871 63.668 0.203 19439
4484 1 18 . 1 1 95 95 PRO CB C 95 31.497 31.497 32.263 -0.766 19439
4485 1 18 . 1 1 96 96 TRP N N 96 117.486 117.486 117.032 0.454 19439
4486 1 18 . 1 1 96 96 TRP HA H 96 4.637 4.637 4.549 0.088 19439
4487 1 18 . 1 1 96 96 TRP CA C 96 56.061 56.061 55.265 0.796 19439
4488 1 18 . 1 1 96 96 TRP CB C 96 28.605 28.605 28.088 0.517 19439
4489 1 18 . 1 1 96 96 TRP H H 96 7.484 7.484 7.835 -0.351 19439
4490 1 18 . 1 1 97 97 LEU N N 97 123.510 123.510 120.681 2.829 19439
4491 1 18 . 1 1 97 97 LEU HA H 97 4.098 4.098 3.194 0.904 19439
4492 1 18 . 1 1 97 97 LEU CA C 97 56.024 56.024 54.596 1.428 19439
4493 1 18 . 1 1 97 97 LEU CB C 97 42.893 42.893 42.720 0.173 19439
4494 1 18 . 1 1 97 97 LEU H H 97 7.137 7.137 6.882 0.255 19439
4495 1 18 . 1 1 98 98 ARG N N 98 129.724 129.724 124.705 5.019 19439
4496 1 18 . 1 1 98 98 ARG HA H 98 4.486 4.486 4.692 -0.206 19439
4497 1 18 . 1 1 98 98 ARG CA C 98 55.622 55.622 54.460 1.162 19439
4498 1 18 . 1 1 98 98 ARG CB C 98 31.229 31.229 31.465 -0.236 19439
4499 1 18 . 1 1 98 98 ARG H H 98 8.825 8.825 8.324 0.501 19439
4500 1 18 . 1 1 99 99 LEU N N 99 127.814 127.814 123.266 4.548 19439
4501 1 18 . 1 1 99 99 LEU HA H 99 3.586 3.586 4.340 -0.754 19439
4502 1 18 . 1 1 99 99 LEU CA C 99 54.352 54.352 54.326 0.026 19439
4503 1 18 . 1 1 99 99 LEU CB C 99 40.485 40.485 41.827 -1.342 19439
4504 1 18 . 1 1 99 99 LEU H H 99 8.236 8.236 8.138 0.098 19439
4505 1 18 . 1 1 100 100 ASP N N 100 126.633 126.633 128.787 -2.154 19439
4506 1 18 . 1 1 100 100 ASP HA H 100 4.646 4.646 4.861 -0.215 19439
4507 1 18 . 1 1 100 100 ASP CA C 100 52.894 52.894 54.234 -1.341 19439
4508 1 18 . 1 1 100 100 ASP CB C 100 41.224 41.224 42.591 -1.367 19439
4509 1 18 . 1 1 100 100 ASP H H 100 8.018 8.018 8.746 -0.728 19439
4510 1 18 . 1 1 101 101 MET N N 101 122.473 122.473 120.221 2.252 19439
4511 1 18 . 1 1 101 101 MET HA H 101 4.481 4.481 4.637 -0.156 19439
4512 1 18 . 1 1 101 101 MET CA C 101 53.398 53.398 54.853 -1.455 19439
4513 1 18 . 1 1 101 101 MET CB C 101 33.296 33.296 33.244 0.052 19439
4514 1 18 . 1 1 101 101 MET H H 101 8.639 8.639 8.034 0.605 19439
4515 1 18 . 1 1 102 102 SER N N 102 116.243 116.243 117.141 -0.898 19439
4516 1 18 . 1 1 102 102 SER HA H 102 4.114 4.114 4.301 -0.187 19439
4517 1 18 . 1 1 102 102 SER CA C 102 58.709 58.709 57.574 1.135 19439
4518 1 18 . 1 1 102 102 SER CB C 102 64.701 64.701 64.933 -0.232 19439
4519 1 18 . 1 1 102 102 SER H H 102 8.096 8.096 8.121 -0.025 19439
4520 1 18 . 1 1 103 103 ASP N N 103 121.639 121.639 123.676 -2.037 19439
4521 1 18 . 1 1 103 103 ASP HA H 103 3.724 3.724 3.885 -0.161 19439
4522 1 18 . 1 1 103 103 ASP CA C 103 57.296 57.296 57.646 -0.350 19439
4523 1 18 . 1 1 103 103 ASP CB C 103 38.720 38.720 40.486 -1.766 19439
4524 1 18 . 1 1 103 103 ASP H H 103 8.669 8.669 8.810 -0.141 19439
4525 1 18 . 1 1 104 104 LYS N N 104 116.276 116.276 119.249 -2.973 19439
4526 1 18 . 1 1 104 104 LYS HA H 104 3.678 3.678 4.048 -0.370 19439
4527 1 18 . 1 1 104 104 LYS CA C 104 59.833 59.833 59.087 0.746 19439
4528 1 18 . 1 1 104 104 LYS CB C 104 32.090 32.090 32.302 -0.212 19439
4529 1 18 . 1 1 104 104 LYS H H 104 7.775 7.775 7.702 0.073 19439
4530 1 18 . 1 1 105 105 ALA N N 105 122.257 122.257 122.648 -0.391 19439
4531 1 18 . 1 1 105 105 ALA HA H 105 3.873 3.873 4.086 -0.213 19439
4532 1 18 . 1 1 105 105 ALA CA C 105 55.008 55.008 54.780 0.228 19439
4533 1 18 . 1 1 105 105 ALA CB C 105 17.741 17.741 18.120 -0.379 19439
4534 1 18 . 1 1 105 105 ALA H H 105 7.266 7.266 7.639 -0.373 19439
4535 1 18 . 1 1 106 106 ILE N N 106 119.452 119.452 119.903 -0.451 19439
4536 1 18 . 1 1 106 106 ILE HA H 106 3.419 3.419 3.817 -0.398 19439
4537 1 18 . 1 1 106 106 ILE CA C 106 65.971 65.971 64.492 1.479 19439
4538 1 18 . 1 1 106 106 ILE CB C 106 37.430 37.430 37.585 -0.155 19439
4539 1 18 . 1 1 106 106 ILE H H 106 7.974 7.974 7.738 0.236 19439
4540 1 18 . 1 1 107 107 PHE N N 107 117.814 117.814 118.669 -0.855 19439
4541 1 18 . 1 1 107 107 PHE HA H 107 4.368 4.368 4.688 -0.320 19439
4542 1 18 . 1 1 107 107 PHE CA C 107 56.844 56.844 58.618 -1.774 19439
4543 1 18 . 1 1 107 107 PHE CB C 107 37.150 37.150 37.661 -0.511 19439
4544 1 18 . 1 1 107 107 PHE H H 107 8.434 8.434 8.084 0.350 19439
4545 1 18 . 1 1 108 108 ARG N N 108 117.368 117.368 120.263 -2.895 19439
4546 1 18 . 1 1 108 108 ARG HA H 108 3.994 3.994 4.120 -0.126 19439
4547 1 18 . 1 1 108 108 ARG CA C 108 58.682 58.682 58.888 -0.206 19439
4548 1 18 . 1 1 108 108 ARG CB C 108 30.287 30.287 30.279 0.008 19439
4549 1 18 . 1 1 108 108 ARG H H 108 7.474 7.474 8.191 -0.717 19439
4550 1 18 . 1 1 109 109 ARG N N 109 117.440 117.440 117.066 0.374 19439
4551 1 18 . 1 1 109 109 ARG HA H 109 3.900 3.900 3.924 -0.024 19439
4552 1 18 . 1 1 109 109 ARG CA C 109 57.312 57.312 58.268 -0.956 19439
4553 1 18 . 1 1 109 109 ARG CB C 109 31.626 31.626 30.812 0.814 19439
4554 1 18 . 1 1 109 109 ARG H H 109 7.118 7.118 7.632 -0.514 19439
4555 1 18 . 1 1 110 110 TYR N N 110 116.060 116.060 116.311 -0.251 19439
4556 1 18 . 1 1 110 110 TYR HA H 110 5.265 5.265 5.184 0.081 19439
4557 1 18 . 1 1 110 110 TYR CA C 110 54.188 54.188 54.632 -0.444 19439
4558 1 18 . 1 1 110 110 TYR CB C 110 38.484 38.484 38.158 0.326 19439
4559 1 18 . 1 1 110 110 TYR H H 110 8.707 8.707 8.111 0.596 19439
4560 1 18 . 1 1 111 111 PRO HA H 111 4.388 4.388 4.655 -0.267 19439
4561 1 18 . 1 1 111 111 PRO CA C 111 64.847 64.847 64.408 0.439 19439
4562 1 18 . 1 1 111 111 PRO CB C 111 31.381 31.381 32.027 -0.646 19439
4563 1 18 . 1 1 112 112 HIS N N 112 115.542 115.542 115.186 0.356 19439
4564 1 18 . 1 1 112 112 HIS HA H 112 4.482 4.482 4.500 -0.018 19439
4565 1 18 . 1 1 112 112 HIS CA C 112 58.498 58.498 57.500 0.998 19439
4566 1 18 . 1 1 112 112 HIS CB C 112 29.654 29.654 28.440 1.214 19439
4567 1 18 . 1 1 112 112 HIS H H 112 8.196 8.196 8.420 -0.224 19439
4568 1 18 . 1 1 113 113 LEU N N 113 120.583 120.583 119.365 1.218 19439
4569 1 18 . 1 1 113 113 LEU HA H 113 4.165 4.165 4.343 -0.178 19439
4570 1 18 . 1 1 113 113 LEU CA C 113 54.013 54.013 55.275 -1.262 19439
4571 1 18 . 1 1 113 113 LEU CB C 113 41.669 41.669 41.342 0.327 19439
4572 1 18 . 1 1 113 113 LEU H H 113 7.527 7.527 7.584 -0.057 19439
4573 1 19 . 1 1 59 59 ALA N N 59 123.310 123.310 123.446 -0.136 19439
4574 1 19 . 1 1 59 59 ALA HA H 59 4.232 4.232 4.573 -0.341 19439
4575 1 19 . 1 1 59 59 ALA CA C 59 52.274 52.274 52.117 0.157 19439
4576 1 19 . 1 1 59 59 ALA CB C 59 19.623 19.623 18.970 0.653 19439
4577 1 19 . 1 1 59 59 ALA H H 59 7.894 7.894 8.279 -0.385 19439
4578 1 19 . 1 1 60 60 LEU N N 60 120.936 120.936 116.005 4.931 19439
4579 1 19 . 1 1 60 60 LEU HA H 60 4.364 4.364 4.357 0.007 19439
4580 1 19 . 1 1 60 60 LEU CA C 60 54.130 54.130 54.955 -0.825 19439
4581 1 19 . 1 1 60 60 LEU CB C 60 43.209 43.209 41.327 1.882 19439
4582 1 19 . 1 1 60 60 LEU H H 60 8.046 8.046 7.337 0.709 19439
4583 1 19 . 1 1 61 61 ALA N N 61 125.460 125.460 122.020 3.440 19439
4584 1 19 . 1 1 61 61 ALA HA H 61 4.364 4.364 4.306 0.058 19439
4585 1 19 . 1 1 61 61 ALA CA C 61 51.176 51.176 51.795 -0.619 19439
4586 1 19 . 1 1 61 61 ALA CB C 61 20.172 20.172 19.547 0.625 19439
4587 1 19 . 1 1 61 61 ALA H H 61 8.338 8.338 7.563 0.775 19439
4588 1 19 . 1 1 62 62 ALA N N 62 127.765 127.765 127.329 0.436 19439
4589 1 19 . 1 1 62 62 ALA HA H 62 4.394 4.394 4.671 -0.277 19439
4590 1 19 . 1 1 62 62 ALA CA C 62 51.888 51.888 50.796 1.092 19439
4591 1 19 . 1 1 62 62 ALA CB C 62 18.806 18.806 21.070 -2.264 19439
4592 1 19 . 1 1 62 62 ALA H H 62 8.487 8.487 9.024 -0.537 19439
4593 1 19 . 1 1 63 63 LEU N N 63 120.199 120.199 120.691 -0.492 19439
4594 1 19 . 1 1 63 63 LEU HA H 63 4.828 4.828 4.973 -0.145 19439
4595 1 19 . 1 1 63 63 LEU CA C 63 51.852 51.852 53.016 -1.164 19439
4596 1 19 . 1 1 63 63 LEU CB C 63 44.081 44.081 45.521 -1.440 19439
4597 1 19 . 1 1 63 63 LEU H H 63 7.927 7.927 8.276 -0.349 19439
4598 1 19 . 1 1 64 64 HIS N N 64 122.277 122.277 119.260 3.017 19439
4599 1 19 . 1 1 64 64 HIS HA H 64 4.114 4.114 4.578 -0.464 19439
4600 1 19 . 1 1 64 64 HIS CA C 64 58.038 58.038 56.988 1.050 19439
4601 1 19 . 1 1 64 64 HIS CB C 64 31.228 31.228 31.477 -0.249 19439
4602 1 19 . 1 1 64 64 HIS H H 64 8.477 8.477 8.848 -0.371 19439
4603 1 19 . 1 1 65 65 ALA HA H 65 4.339 4.339 4.475 -0.136 19439
4604 1 19 . 1 1 65 65 ALA CA C 65 53.281 53.281 52.379 0.902 19439
4605 1 19 . 1 1 65 65 ALA CB C 65 20.276 20.276 19.997 0.279 19439
4606 1 19 . 1 1 66 66 GLU N N 66 113.868 113.868 117.613 -3.745 19439
4607 1 19 . 1 1 66 66 GLU HA H 66 4.619 4.619 4.517 0.102 19439
4608 1 19 . 1 1 66 66 GLU CA C 66 54.727 54.727 55.034 -0.307 19439
4609 1 19 . 1 1 66 66 GLU CB C 66 32.894 32.894 32.790 0.104 19439
4610 1 19 . 1 1 66 66 GLU H H 66 7.759 7.759 8.001 -0.242 19439
4611 1 19 . 1 1 68 68 PRO HA H 68 4.219 4.219 4.284 -0.065 19439
4612 1 19 . 1 1 68 68 PRO CA C 68 64.664 64.664 65.026 -0.362 19439
4613 1 19 . 1 1 68 68 PRO CB C 68 32.066 32.066 31.685 0.381 19439
4614 1 19 . 1 1 69 69 LEU N N 69 117.262 117.262 118.288 -1.026 19439
4615 1 19 . 1 1 69 69 LEU HA H 69 4.182 4.182 4.191 -0.009 19439
4616 1 19 . 1 1 69 69 LEU CA C 69 52.430 52.430 53.548 -1.118 19439
4617 1 19 . 1 1 69 69 LEU CB C 69 40.907 40.907 41.248 -0.341 19439
4618 1 19 . 1 1 69 69 LEU H H 69 8.439 8.439 7.933 0.506 19439
4619 1 19 . 1 1 70 70 ALA N N 70 120.426 120.426 121.038 -0.612 19439
4620 1 19 . 1 1 70 70 ALA HA H 70 3.411 3.411 4.211 -0.800 19439
4621 1 19 . 1 1 70 70 ALA CA C 70 53.685 53.685 53.492 0.193 19439
4622 1 19 . 1 1 70 70 ALA CB C 70 17.914 17.914 18.620 -0.706 19439
4623 1 19 . 1 1 70 70 ALA H H 70 7.113 7.113 7.427 -0.314 19439
4624 1 19 . 1 1 71 71 GLY N N 71 108.911 108.911 113.884 -4.973 19439
4625 1 19 . 1 1 71 71 GLY CA C 71 45.215 45.215 45.103 0.112 19439
4626 1 19 . 1 1 71 71 GLY H H 71 8.856 8.856 8.897 -0.041 19439
4627 1 19 . 1 1 72 72 LEU N N 72 120.000 120.000 120.785 -0.785 19439
4628 1 19 . 1 1 72 72 LEU HA H 72 4.769 4.769 4.983 -0.214 19439
4629 1 19 . 1 1 72 72 LEU CA C 72 51.972 51.972 51.574 0.398 19439
4630 1 19 . 1 1 72 72 LEU CB C 72 41.255 41.255 42.959 -1.704 19439
4631 1 19 . 1 1 72 72 LEU H H 72 8.136 8.136 7.941 0.195 19439
4632 1 19 . 1 1 73 73 PRO HA H 73 4.739 4.739 4.655 0.084 19439
4633 1 19 . 1 1 73 73 PRO CA C 73 61.456 61.456 62.858 -1.401 19439
4634 1 19 . 1 1 73 73 PRO CB C 73 31.245 31.245 31.988 -0.743 19439
4635 1 19 . 1 1 74 74 VAL N N 74 121.723 121.723 120.197 1.526 19439
4636 1 19 . 1 1 74 74 VAL HA H 74 3.446 3.446 3.762 -0.316 19439
4637 1 19 . 1 1 74 74 VAL CA C 74 65.744 65.744 63.937 1.807 19439
4638 1 19 . 1 1 74 74 VAL CB C 74 31.236 31.236 31.932 -0.696 19439
4639 1 19 . 1 1 74 74 VAL H H 74 7.710 7.710 8.136 -0.426 19439
4640 1 19 . 1 1 75 75 THR N N 75 108.893 108.893 109.504 -0.611 19439
4641 1 19 . 1 1 75 75 THR HA H 75 4.937 4.937 4.669 0.268 19439
4642 1 19 . 1 1 75 75 THR CA C 75 59.892 59.892 59.662 0.230 19439
4643 1 19 . 1 1 75 75 THR CB C 75 12.018 12.018 72.014 -59.996 19439
4644 1 19 . 1 1 75 75 THR H H 75 8.710 8.710 7.979 0.731 19439
4645 1 19 . 1 1 76 76 ARG HA H 76 3.873 3.873 4.049 -0.176 19439
4646 1 19 . 1 1 76 76 ARG H H 76 8.447 8.447 8.856 -0.409 19439
4647 1 19 . 1 1 77 77 SER N N 77 114.482 114.482 116.569 -2.087 19439
4648 1 19 . 1 1 77 77 SER HA H 77 4.061 4.061 4.215 -0.154 19439
4649 1 19 . 1 1 77 77 SER CA C 77 60.467 60.467 61.396 -0.929 19439
4650 1 19 . 1 1 77 77 SER CB C 77 62.449 62.449 62.689 -0.240 19439
4651 1 19 . 1 1 77 77 SER H H 77 8.105 8.105 7.801 0.304 19439
4652 1 19 . 1 1 78 78 ASP N N 78 120.538 120.538 122.760 -2.222 19439
4653 1 19 . 1 1 78 78 ASP HA H 78 4.333 4.333 4.353 -0.020 19439
4654 1 19 . 1 1 78 78 ASP CA C 78 58.020 58.020 57.263 0.757 19439
4655 1 19 . 1 1 78 78 ASP CB C 78 43.252 43.252 40.346 2.906 19439
4656 1 19 . 1 1 78 78 ASP H H 78 7.300 7.300 8.046 -0.746 19439
4657 1 19 . 1 1 79 79 ALA N N 79 120.614 120.614 122.807 -2.193 19439
4658 1 19 . 1 1 79 79 ALA HA H 79 3.672 3.672 3.851 -0.179 19439
4659 1 19 . 1 1 79 79 ALA CA C 79 54.886 54.886 55.195 -0.309 19439
4660 1 19 . 1 1 79 79 ALA CB C 79 19.628 19.628 18.297 1.331 19439
4661 1 19 . 1 1 79 79 ALA H H 79 7.767 7.767 8.240 -0.473 19439
4662 1 19 . 1 1 80 80 ARG N N 80 116.203 116.203 119.155 -2.952 19439
4663 1 19 . 1 1 80 80 ARG HA H 80 3.732 3.732 4.044 -0.312 19439
4664 1 19 . 1 1 80 80 ARG CA C 80 61.441 61.441 59.524 1.917 19439
4665 1 19 . 1 1 80 80 ARG CB C 80 30.266 30.266 30.418 -0.152 19439
4666 1 19 . 1 1 80 80 ARG H H 80 7.981 7.981 8.207 -0.226 19439
4667 1 19 . 1 1 81 81 VAL N N 81 119.192 119.192 119.770 -0.578 19439
4668 1 19 . 1 1 81 81 VAL HA H 81 3.582 3.582 3.960 -0.378 19439
4669 1 19 . 1 1 81 81 VAL CA C 81 66.909 66.909 66.515 0.394 19439
4670 1 19 . 1 1 81 81 VAL CB C 81 31.668 31.668 31.768 -0.100 19439
4671 1 19 . 1 1 81 81 VAL H H 81 7.338 7.338 8.100 -0.762 19439
4672 1 19 . 1 1 82 82 LEU N N 82 118.722 118.722 121.579 -2.857 19439
4673 1 19 . 1 1 82 82 LEU HA H 82 4.044 4.044 3.941 0.103 19439
4674 1 19 . 1 1 82 82 LEU CA C 82 58.356 58.356 58.730 -0.374 19439
4675 1 19 . 1 1 82 82 LEU CB C 82 41.627 41.627 41.644 -0.017 19439
4676 1 19 . 1 1 82 82 LEU H H 82 7.599 7.599 8.416 -0.817 19439
4677 1 19 . 1 1 83 83 ILE N N 83 120.893 120.893 119.528 1.365 19439
4678 1 19 . 1 1 83 83 ILE HA H 83 3.642 3.642 3.701 -0.059 19439
4679 1 19 . 1 1 83 83 ILE CA C 83 65.669 65.669 65.689 -0.020 19439
4680 1 19 . 1 1 83 83 ILE CB C 83 38.579 38.579 37.942 0.637 19439
4681 1 19 . 1 1 83 83 ILE H H 83 8.546 8.546 8.485 0.061 19439
4682 1 19 . 1 1 84 84 PHE N N 84 123.343 123.343 120.594 2.749 19439
4683 1 19 . 1 1 84 84 PHE HA H 84 4.084 4.084 4.117 -0.033 19439
4684 1 19 . 1 1 84 84 PHE CA C 84 62.593 62.593 60.724 1.869 19439
4685 1 19 . 1 1 84 84 PHE CB C 84 39.211 39.211 38.770 0.441 19439
4686 1 19 . 1 1 84 84 PHE H H 84 8.622 8.622 8.542 0.080 19439
4687 1 19 . 1 1 85 85 ASN N N 85 118.037 118.037 118.386 -0.349 19439
4688 1 19 . 1 1 85 85 ASN HA H 85 4.426 4.426 4.032 0.394 19439
4689 1 19 . 1 1 85 85 ASN CA C 85 56.045 56.045 56.619 -0.574 19439
4690 1 19 . 1 1 85 85 ASN CB C 85 37.785 37.785 38.521 -0.736 19439
4691 1 19 . 1 1 85 85 ASN H H 85 8.834 8.834 8.679 0.155 19439
4692 1 19 . 1 1 86 86 GLU N N 86 121.098 121.098 121.402 -0.304 19439
4693 1 19 . 1 1 86 86 GLU HA H 86 4.052 4.052 3.906 0.146 19439
4694 1 19 . 1 1 86 86 GLU CA C 86 59.328 59.328 59.647 -0.319 19439
4695 1 19 . 1 1 86 86 GLU CB C 86 30.253 30.253 29.680 0.573 19439
4696 1 19 . 1 1 86 86 GLU H H 86 8.105 8.105 8.263 -0.158 19439
4697 1 19 . 1 1 87 87 TRP N N 87 122.584 122.584 122.082 0.502 19439
4698 1 19 . 1 1 87 87 TRP HA H 87 4.006 4.006 4.126 -0.120 19439
4699 1 19 . 1 1 87 87 TRP CA C 87 61.545 61.545 61.922 -0.377 19439
4700 1 19 . 1 1 87 87 TRP CB C 87 27.943 27.943 29.373 -1.430 19439
4701 1 19 . 1 1 87 87 TRP H H 87 8.099 8.099 8.655 -0.556 19439
4702 1 19 . 1 1 88 88 GLU N N 88 117.357 117.357 118.453 -1.096 19439
4703 1 19 . 1 1 88 88 GLU HA H 88 2.919 2.919 3.156 -0.237 19439
4704 1 19 . 1 1 88 88 GLU CA C 88 59.804 59.804 59.805 -0.001 19439
4705 1 19 . 1 1 88 88 GLU CB C 88 29.546 29.546 29.107 0.439 19439
4706 1 19 . 1 1 88 88 GLU H H 88 8.440 8.440 8.499 -0.059 19439
4707 1 19 . 1 1 89 89 GLU N N 89 116.109 116.109 119.043 -2.934 19439
4708 1 19 . 1 1 89 89 GLU HA H 89 3.995 3.995 3.874 0.121 19439
4709 1 19 . 1 1 89 89 GLU CA C 89 58.329 58.329 59.278 -0.949 19439
4710 1 19 . 1 1 89 89 GLU CB C 89 29.649 29.649 29.429 0.220 19439
4711 1 19 . 1 1 89 89 GLU H H 89 7.244 7.244 8.012 -0.768 19439
4712 1 19 . 1 1 90 90 ARG N N 90 120.512 120.512 118.614 1.898 19439
4713 1 19 . 1 1 90 90 ARG HA H 90 3.920 3.920 3.923 -0.003 19439
4714 1 19 . 1 1 90 90 ARG CA C 90 58.683 58.683 58.724 -0.041 19439
4715 1 19 . 1 1 90 90 ARG CB C 90 30.659 30.659 29.613 1.046 19439
4716 1 19 . 1 1 90 90 ARG H H 90 8.368 8.368 8.085 0.283 19439
4717 1 19 . 1 1 91 91 LYS N N 91 120.024 120.024 119.744 0.280 19439
4718 1 19 . 1 1 91 91 LYS HA H 91 3.964 3.964 4.022 -0.058 19439
4719 1 19 . 1 1 91 91 LYS CA C 91 57.278 57.278 58.782 -1.504 19439
4720 1 19 . 1 1 91 91 LYS CB C 91 30.582 30.582 31.309 -0.727 19439
4721 1 19 . 1 1 91 91 LYS H H 91 8.491 8.491 7.990 0.501 19439
4722 1 19 . 1 1 92 92 LYS N N 92 118.192 118.192 118.225 -0.033 19439
4723 1 19 . 1 1 92 92 LYS HA H 92 3.796 3.796 4.008 -0.212 19439
4724 1 19 . 1 1 92 92 LYS CA C 92 58.976 58.976 58.563 0.413 19439
4725 1 19 . 1 1 92 92 LYS CB C 92 32.188 32.188 32.214 -0.026 19439
4726 1 19 . 1 1 92 92 LYS H H 92 6.933 6.933 7.697 -0.764 19439
4727 1 19 . 1 1 93 93 SER N N 93 110.447 110.447 113.801 -3.354 19439
4728 1 19 . 1 1 93 93 SER HA H 93 4.484 4.484 4.325 0.159 19439
4729 1 19 . 1 1 93 93 SER CA C 93 58.386 58.386 60.283 -1.897 19439
4730 1 19 . 1 1 93 93 SER CB C 93 64.173 64.173 64.209 -0.036 19439
4731 1 19 . 1 1 93 93 SER H H 93 7.282 7.282 7.667 -0.385 19439
4732 1 19 . 1 1 94 94 ASP N N 94 120.163 120.163 119.472 0.691 19439
4733 1 19 . 1 1 94 94 ASP HA H 94 4.872 4.872 5.026 -0.154 19439
4734 1 19 . 1 1 94 94 ASP CA C 94 51.157 51.157 52.916 -1.759 19439
4735 1 19 . 1 1 94 94 ASP CB C 94 41.256 41.256 43.169 -1.913 19439
4736 1 19 . 1 1 94 94 ASP H H 94 7.303 7.303 8.247 -0.944 19439
4737 1 19 . 1 1 95 95 PRO CA C 95 63.871 63.871 63.734 0.137 19439
4738 1 19 . 1 1 95 95 PRO CB C 95 31.497 31.497 32.323 -0.826 19439
4739 1 19 . 1 1 96 96 TRP N N 96 117.486 117.486 117.651 -0.165 19439
4740 1 19 . 1 1 96 96 TRP HA H 96 4.637 4.637 4.556 0.081 19439
4741 1 19 . 1 1 96 96 TRP CA C 96 56.061 56.061 55.403 0.658 19439
4742 1 19 . 1 1 96 96 TRP CB C 96 28.605 28.605 27.903 0.702 19439
4743 1 19 . 1 1 96 96 TRP H H 96 7.484 7.484 7.857 -0.373 19439
4744 1 19 . 1 1 97 97 LEU N N 97 123.510 123.510 121.883 1.627 19439
4745 1 19 . 1 1 97 97 LEU HA H 97 4.098 4.098 3.614 0.484 19439
4746 1 19 . 1 1 97 97 LEU CA C 97 56.024 56.024 54.291 1.733 19439
4747 1 19 . 1 1 97 97 LEU CB C 97 42.893 42.893 42.952 -0.059 19439
4748 1 19 . 1 1 97 97 LEU H H 97 7.137 7.137 6.987 0.150 19439
4749 1 19 . 1 1 98 98 ARG N N 98 129.724 129.724 125.128 4.596 19439
4750 1 19 . 1 1 98 98 ARG HA H 98 4.486 4.486 4.545 -0.059 19439
4751 1 19 . 1 1 98 98 ARG CA C 98 55.622 55.622 55.362 0.260 19439
4752 1 19 . 1 1 98 98 ARG CB C 98 31.229 31.229 31.643 -0.414 19439
4753 1 19 . 1 1 98 98 ARG H H 98 8.825 8.825 8.295 0.530 19439
4754 1 19 . 1 1 99 99 LEU N N 99 127.814 127.814 126.650 1.164 19439
4755 1 19 . 1 1 99 99 LEU HA H 99 3.586 3.586 4.255 -0.669 19439
4756 1 19 . 1 1 99 99 LEU CA C 99 54.352 54.352 54.851 -0.499 19439
4757 1 19 . 1 1 99 99 LEU CB C 99 40.485 40.485 41.591 -1.106 19439
4758 1 19 . 1 1 99 99 LEU H H 99 8.236 8.236 8.288 -0.052 19439
4759 1 19 . 1 1 100 100 ASP N N 100 126.633 126.633 127.449 -0.816 19439
4760 1 19 . 1 1 100 100 ASP HA H 100 4.646 4.646 4.886 -0.240 19439
4761 1 19 . 1 1 100 100 ASP CA C 100 52.894 52.894 53.772 -0.878 19439
4762 1 19 . 1 1 100 100 ASP CB C 100 41.224 41.224 43.149 -1.925 19439
4763 1 19 . 1 1 100 100 ASP H H 100 8.018 8.018 8.550 -0.532 19439
4764 1 19 . 1 1 101 101 MET N N 101 122.473 122.473 119.959 2.514 19439
4765 1 19 . 1 1 101 101 MET HA H 101 4.481 4.481 4.643 -0.162 19439
4766 1 19 . 1 1 101 101 MET CA C 101 53.398 53.398 54.398 -1.000 19439
4767 1 19 . 1 1 101 101 MET CB C 101 33.296 33.296 32.980 0.316 19439
4768 1 19 . 1 1 101 101 MET H H 101 8.639 8.639 7.954 0.685 19439
4769 1 19 . 1 1 102 102 SER N N 102 116.243 116.243 117.153 -0.910 19439
4770 1 19 . 1 1 102 102 SER HA H 102 4.114 4.114 4.362 -0.248 19439
4771 1 19 . 1 1 102 102 SER CA C 102 58.709 58.709 57.387 1.322 19439
4772 1 19 . 1 1 102 102 SER CB C 102 64.701 64.701 65.127 -0.426 19439
4773 1 19 . 1 1 102 102 SER H H 102 8.096 8.096 8.109 -0.013 19439
4774 1 19 . 1 1 103 103 ASP N N 103 121.639 121.639 125.569 -3.930 19439
4775 1 19 . 1 1 103 103 ASP HA H 103 3.724 3.724 3.932 -0.208 19439
4776 1 19 . 1 1 103 103 ASP CA C 103 57.296 57.296 56.924 0.372 19439
4777 1 19 . 1 1 103 103 ASP CB C 103 38.720 38.720 40.321 -1.601 19439
4778 1 19 . 1 1 103 103 ASP H H 103 8.669 8.669 8.757 -0.088 19439
4779 1 19 . 1 1 104 104 LYS N N 104 116.276 116.276 119.755 -3.479 19439
4780 1 19 . 1 1 104 104 LYS HA H 104 3.678 3.678 3.997 -0.319 19439
4781 1 19 . 1 1 104 104 LYS CA C 104 59.833 59.833 59.237 0.596 19439
4782 1 19 . 1 1 104 104 LYS CB C 104 32.090 32.090 32.386 -0.296 19439
4783 1 19 . 1 1 104 104 LYS H H 104 7.775 7.775 7.431 0.344 19439
4784 1 19 . 1 1 105 105 ALA N N 105 122.257 122.257 121.972 0.285 19439
4785 1 19 . 1 1 105 105 ALA HA H 105 3.873 3.873 4.068 -0.195 19439
4786 1 19 . 1 1 105 105 ALA CA C 105 55.008 55.008 54.815 0.193 19439
4787 1 19 . 1 1 105 105 ALA CB C 105 17.741 17.741 18.109 -0.368 19439
4788 1 19 . 1 1 105 105 ALA H H 105 7.266 7.266 7.610 -0.344 19439
4789 1 19 . 1 1 106 106 ILE N N 106 119.452 119.452 119.938 -0.486 19439
4790 1 19 . 1 1 106 106 ILE HA H 106 3.419 3.419 3.832 -0.413 19439
4791 1 19 . 1 1 106 106 ILE CA C 106 65.971 65.971 64.581 1.390 19439
4792 1 19 . 1 1 106 106 ILE CB C 106 37.430 37.430 37.616 -0.186 19439
4793 1 19 . 1 1 106 106 ILE H H 106 7.974 7.974 7.723 0.251 19439
4794 1 19 . 1 1 107 107 PHE N N 107 117.814 117.814 118.669 -0.855 19439
4795 1 19 . 1 1 107 107 PHE HA H 107 4.368 4.368 4.701 -0.333 19439
4796 1 19 . 1 1 107 107 PHE CA C 107 56.844 56.844 58.377 -1.533 19439
4797 1 19 . 1 1 107 107 PHE CB C 107 37.150 37.150 37.638 -0.488 19439
4798 1 19 . 1 1 107 107 PHE H H 107 8.434 8.434 8.203 0.231 19439
4799 1 19 . 1 1 108 108 ARG N N 108 117.368 117.368 120.417 -3.049 19439
4800 1 19 . 1 1 108 108 ARG HA H 108 3.994 3.994 4.109 -0.115 19439
4801 1 19 . 1 1 108 108 ARG CA C 108 58.682 58.682 58.957 -0.275 19439
4802 1 19 . 1 1 108 108 ARG CB C 108 30.287 30.287 30.279 0.008 19439
4803 1 19 . 1 1 108 108 ARG H H 108 7.474 7.474 8.221 -0.747 19439
4804 1 19 . 1 1 109 109 ARG N N 109 117.440 117.440 116.719 0.721 19439
4805 1 19 . 1 1 109 109 ARG HA H 109 3.900 3.900 3.934 -0.034 19439
4806 1 19 . 1 1 109 109 ARG CA C 109 57.312 57.312 58.162 -0.850 19439
4807 1 19 . 1 1 109 109 ARG CB C 109 31.626 31.626 30.936 0.690 19439
4808 1 19 . 1 1 109 109 ARG H H 109 7.118 7.118 7.663 -0.545 19439
4809 1 19 . 1 1 110 110 TYR N N 110 116.060 116.060 116.464 -0.404 19439
4810 1 19 . 1 1 110 110 TYR HA H 110 5.265 5.265 5.153 0.112 19439
4811 1 19 . 1 1 110 110 TYR CA C 110 54.188 54.188 54.749 -0.561 19439
4812 1 19 . 1 1 110 110 TYR CB C 110 38.484 38.484 38.566 -0.082 19439
4813 1 19 . 1 1 110 110 TYR H H 110 8.707 8.707 8.186 0.521 19439
4814 1 19 . 1 1 111 111 PRO HA H 111 4.388 4.388 4.706 -0.318 19439
4815 1 19 . 1 1 111 111 PRO CA C 111 64.847 64.847 64.190 0.657 19439
4816 1 19 . 1 1 111 111 PRO CB C 111 31.381 31.381 32.098 -0.717 19439
4817 1 19 . 1 1 112 112 HIS N N 112 115.542 115.542 114.026 1.516 19439
4818 1 19 . 1 1 112 112 HIS HA H 112 4.482 4.482 4.566 -0.084 19439
4819 1 19 . 1 1 112 112 HIS CA C 112 58.498 58.498 56.809 1.689 19439
4820 1 19 . 1 1 112 112 HIS CB C 112 29.654 29.654 28.671 0.983 19439
4821 1 19 . 1 1 112 112 HIS H H 112 8.196 8.196 8.358 -0.162 19439
4822 1 19 . 1 1 113 113 LEU N N 113 120.583 120.583 120.255 0.328 19439
4823 1 19 . 1 1 113 113 LEU HA H 113 4.165 4.165 4.218 -0.053 19439
4824 1 19 . 1 1 113 113 LEU CA C 113 54.013 54.013 55.523 -1.510 19439
4825 1 19 . 1 1 113 113 LEU CB C 113 41.669 41.669 42.466 -0.797 19439
4826 1 19 . 1 1 113 113 LEU H H 113 7.527 7.527 7.386 0.141 19439
4827 1 20 . 1 1 59 59 ALA N N 59 123.310 123.310 124.246 -0.936 19439
4828 1 20 . 1 1 59 59 ALA HA H 59 4.232 4.232 4.470 -0.238 19439
4829 1 20 . 1 1 59 59 ALA CA C 59 52.274 52.274 51.997 0.277 19439
4830 1 20 . 1 1 59 59 ALA CB C 59 19.623 19.623 18.062 1.561 19439
4831 1 20 . 1 1 59 59 ALA H H 59 7.894 7.894 8.357 -0.463 19439
4832 1 20 . 1 1 60 60 LEU N N 60 120.936 120.936 116.757 4.179 19439
4833 1 20 . 1 1 60 60 LEU HA H 60 4.364 4.364 4.382 -0.018 19439
4834 1 20 . 1 1 60 60 LEU CA C 60 54.130 54.130 55.237 -1.107 19439
4835 1 20 . 1 1 60 60 LEU CB C 60 43.209 43.209 41.500 1.709 19439
4836 1 20 . 1 1 60 60 LEU H H 60 8.046 8.046 7.395 0.651 19439
4837 1 20 . 1 1 61 61 ALA N N 61 125.460 125.460 121.942 3.518 19439
4838 1 20 . 1 1 61 61 ALA HA H 61 4.364 4.364 4.310 0.054 19439
4839 1 20 . 1 1 61 61 ALA CA C 61 51.176 51.176 51.677 -0.501 19439
4840 1 20 . 1 1 61 61 ALA CB C 61 20.172 20.172 19.726 0.446 19439
4841 1 20 . 1 1 61 61 ALA H H 61 8.338 8.338 7.526 0.812 19439
4842 1 20 . 1 1 62 62 ALA N N 62 127.765 127.765 126.056 1.709 19439
4843 1 20 . 1 1 62 62 ALA HA H 62 4.394 4.394 4.673 -0.279 19439
4844 1 20 . 1 1 62 62 ALA CA C 62 51.888 51.888 50.859 1.028 19439
4845 1 20 . 1 1 62 62 ALA CB C 62 18.806 18.806 21.023 -2.217 19439
4846 1 20 . 1 1 62 62 ALA H H 62 8.487 8.487 9.028 -0.541 19439
4847 1 20 . 1 1 63 63 LEU N N 63 120.199 120.199 120.520 -0.321 19439
4848 1 20 . 1 1 63 63 LEU HA H 63 4.828 4.828 4.934 -0.106 19439
4849 1 20 . 1 1 63 63 LEU CA C 63 51.852 51.852 52.959 -1.107 19439
4850 1 20 . 1 1 63 63 LEU CB C 63 44.081 44.081 45.776 -1.695 19439
4851 1 20 . 1 1 63 63 LEU H H 63 7.927 7.927 8.250 -0.323 19439
4852 1 20 . 1 1 64 64 HIS N N 64 122.277 122.277 119.530 2.747 19439
4853 1 20 . 1 1 64 64 HIS HA H 64 4.114 4.114 4.571 -0.457 19439
4854 1 20 . 1 1 64 64 HIS CA C 64 58.038 58.038 56.997 1.041 19439
4855 1 20 . 1 1 64 64 HIS CB C 64 31.228 31.228 31.181 0.047 19439
4856 1 20 . 1 1 64 64 HIS H H 64 8.477 8.477 8.820 -0.343 19439
4857 1 20 . 1 1 65 65 ALA HA H 65 4.339 4.339 4.405 -0.066 19439
4858 1 20 . 1 1 65 65 ALA CA C 65 53.281 53.281 52.887 0.394 19439
4859 1 20 . 1 1 65 65 ALA CB C 65 20.276 20.276 19.830 0.446 19439
4860 1 20 . 1 1 66 66 GLU N N 66 113.868 113.868 116.497 -2.629 19439
4861 1 20 . 1 1 66 66 GLU HA H 66 4.619 4.619 4.516 0.103 19439
4862 1 20 . 1 1 66 66 GLU CA C 66 54.727 54.727 55.064 -0.337 19439
4863 1 20 . 1 1 66 66 GLU CB C 66 32.894 32.894 32.876 0.018 19439
4864 1 20 . 1 1 66 66 GLU H H 66 7.759 7.759 8.053 -0.294 19439
4865 1 20 . 1 1 68 68 PRO HA H 68 4.219 4.219 4.247 -0.028 19439
4866 1 20 . 1 1 68 68 PRO CA C 68 64.664 64.664 65.064 -0.400 19439
4867 1 20 . 1 1 68 68 PRO CB C 68 32.066 32.066 31.740 0.326 19439
4868 1 20 . 1 1 69 69 LEU N N 69 117.262 117.262 117.428 -0.166 19439
4869 1 20 . 1 1 69 69 LEU HA H 69 4.182 4.182 4.401 -0.219 19439
4870 1 20 . 1 1 69 69 LEU CA C 69 52.430 52.430 53.383 -0.953 19439
4871 1 20 . 1 1 69 69 LEU CB C 69 40.907 40.907 41.250 -0.343 19439
4872 1 20 . 1 1 69 69 LEU H H 69 8.439 8.439 7.884 0.555 19439
4873 1 20 . 1 1 70 70 ALA N N 70 120.426 120.426 121.627 -1.201 19439
4874 1 20 . 1 1 70 70 ALA HA H 70 3.411 3.411 4.117 -0.706 19439
4875 1 20 . 1 1 70 70 ALA CA C 70 53.685 53.685 53.473 0.212 19439
4876 1 20 . 1 1 70 70 ALA CB C 70 17.914 17.914 18.669 -0.755 19439
4877 1 20 . 1 1 70 70 ALA H H 70 7.113 7.113 7.591 -0.478 19439
4878 1 20 . 1 1 71 71 GLY N N 71 108.911 108.911 112.047 -3.136 19439
4879 1 20 . 1 1 71 71 GLY CA C 71 45.215 45.215 45.039 0.176 19439
4880 1 20 . 1 1 71 71 GLY H H 71 8.856 8.856 8.922 -0.066 19439
4881 1 20 . 1 1 72 72 LEU N N 72 120.000 120.000 121.676 -1.676 19439
4882 1 20 . 1 1 72 72 LEU HA H 72 4.769 4.769 4.963 -0.194 19439
4883 1 20 . 1 1 72 72 LEU CA C 72 51.972 51.972 51.568 0.404 19439
4884 1 20 . 1 1 72 72 LEU CB C 72 41.255 41.255 42.847 -1.592 19439
4885 1 20 . 1 1 72 72 LEU H H 72 8.136 8.136 8.044 0.092 19439
4886 1 20 . 1 1 73 73 PRO HA H 73 4.739 4.739 4.656 0.083 19439
4887 1 20 . 1 1 73 73 PRO CA C 73 61.456 61.456 62.892 -1.436 19439
4888 1 20 . 1 1 73 73 PRO CB C 73 31.245 31.245 32.002 -0.757 19439
4889 1 20 . 1 1 74 74 VAL N N 74 121.723 121.723 119.933 1.790 19439
4890 1 20 . 1 1 74 74 VAL HA H 74 3.446 3.446 3.910 -0.464 19439
4891 1 20 . 1 1 74 74 VAL CA C 74 65.744 65.744 63.859 1.885 19439
4892 1 20 . 1 1 74 74 VAL CB C 74 31.236 31.236 31.981 -0.745 19439
4893 1 20 . 1 1 74 74 VAL H H 74 7.710 7.710 8.150 -0.440 19439
4894 1 20 . 1 1 75 75 THR N N 75 108.893 108.893 109.649 -0.756 19439
4895 1 20 . 1 1 75 75 THR HA H 75 4.937 4.937 4.651 0.286 19439
4896 1 20 . 1 1 75 75 THR CA C 75 59.892 59.892 59.650 0.242 19439
4897 1 20 . 1 1 75 75 THR CB C 75 12.018 12.018 71.895 -59.877 19439
4898 1 20 . 1 1 75 75 THR H H 75 8.710 8.710 7.909 0.801 19439
4899 1 20 . 1 1 76 76 ARG HA H 76 3.873 3.873 4.053 -0.180 19439
4900 1 20 . 1 1 76 76 ARG H H 76 8.447 8.447 8.820 -0.373 19439
4901 1 20 . 1 1 77 77 SER N N 77 114.482 114.482 115.758 -1.276 19439
4902 1 20 . 1 1 77 77 SER HA H 77 4.061 4.061 4.196 -0.135 19439
4903 1 20 . 1 1 77 77 SER CA C 77 60.467 60.467 61.201 -0.734 19439
4904 1 20 . 1 1 77 77 SER CB C 77 62.449 62.449 62.792 -0.343 19439
4905 1 20 . 1 1 77 77 SER H H 77 8.105 8.105 7.860 0.245 19439
4906 1 20 . 1 1 78 78 ASP N N 78 120.538 120.538 122.068 -1.530 19439
4907 1 20 . 1 1 78 78 ASP HA H 78 4.333 4.333 4.313 0.020 19439
4908 1 20 . 1 1 78 78 ASP CA C 78 58.020 58.020 57.262 0.758 19439
4909 1 20 . 1 1 78 78 ASP CB C 78 43.252 43.252 40.379 2.873 19439
4910 1 20 . 1 1 78 78 ASP H H 78 7.300 7.300 8.100 -0.800 19439
4911 1 20 . 1 1 79 79 ALA N N 79 120.614 120.614 122.797 -2.183 19439
4912 1 20 . 1 1 79 79 ALA HA H 79 3.672 3.672 3.844 -0.172 19439
4913 1 20 . 1 1 79 79 ALA CA C 79 54.886 54.886 55.198 -0.312 19439
4914 1 20 . 1 1 79 79 ALA CB C 79 19.628 19.628 18.278 1.350 19439
4915 1 20 . 1 1 79 79 ALA H H 79 7.767 7.767 8.263 -0.496 19439
4916 1 20 . 1 1 80 80 ARG N N 80 116.203 116.203 119.214 -3.011 19439
4917 1 20 . 1 1 80 80 ARG HA H 80 3.732 3.732 4.039 -0.307 19439
4918 1 20 . 1 1 80 80 ARG CA C 80 61.441 61.441 59.495 1.946 19439
4919 1 20 . 1 1 80 80 ARG CB C 80 30.266 30.266 30.396 -0.130 19439
4920 1 20 . 1 1 80 80 ARG H H 80 7.981 7.981 8.077 -0.096 19439
4921 1 20 . 1 1 81 81 VAL N N 81 119.192 119.192 119.859 -0.667 19439
4922 1 20 . 1 1 81 81 VAL HA H 81 3.582 3.582 3.969 -0.387 19439
4923 1 20 . 1 1 81 81 VAL CA C 81 66.909 66.909 66.642 0.266 19439
4924 1 20 . 1 1 81 81 VAL CB C 81 31.668 31.668 31.728 -0.060 19439
4925 1 20 . 1 1 81 81 VAL H H 81 7.338 7.338 8.201 -0.863 19439
4926 1 20 . 1 1 82 82 LEU N N 82 118.722 118.722 121.528 -2.806 19439
4927 1 20 . 1 1 82 82 LEU HA H 82 4.044 4.044 3.863 0.181 19439
4928 1 20 . 1 1 82 82 LEU CA C 82 58.356 58.356 58.764 -0.408 19439
4929 1 20 . 1 1 82 82 LEU CB C 82 41.627 41.627 41.618 0.009 19439
4930 1 20 . 1 1 82 82 LEU H H 82 7.599 7.599 8.443 -0.844 19439
4931 1 20 . 1 1 83 83 ILE N N 83 120.893 120.893 119.586 1.307 19439
4932 1 20 . 1 1 83 83 ILE HA H 83 3.642 3.642 3.728 -0.086 19439
4933 1 20 . 1 1 83 83 ILE CA C 83 65.669 65.669 65.584 0.085 19439
4934 1 20 . 1 1 83 83 ILE CB C 83 38.579 38.579 37.936 0.643 19439
4935 1 20 . 1 1 83 83 ILE H H 83 8.546 8.546 8.331 0.215 19439
4936 1 20 . 1 1 84 84 PHE N N 84 123.343 123.343 120.393 2.950 19439
4937 1 20 . 1 1 84 84 PHE HA H 84 4.084 4.084 4.126 -0.042 19439
4938 1 20 . 1 1 84 84 PHE CA C 84 62.593 62.593 59.870 2.723 19439
4939 1 20 . 1 1 84 84 PHE CB C 84 39.211 39.211 38.645 0.566 19439
4940 1 20 . 1 1 84 84 PHE H H 84 8.622 8.622 8.574 0.048 19439
4941 1 20 . 1 1 85 85 ASN N N 85 118.037 118.037 119.000 -0.963 19439
4942 1 20 . 1 1 85 85 ASN HA H 85 4.426 4.426 4.229 0.197 19439
4943 1 20 . 1 1 85 85 ASN CA C 85 56.045 56.045 56.675 -0.630 19439
4944 1 20 . 1 1 85 85 ASN CB C 85 37.785 37.785 38.587 -0.801 19439
4945 1 20 . 1 1 85 85 ASN H H 85 8.834 8.834 8.594 0.240 19439
4946 1 20 . 1 1 86 86 GLU N N 86 121.098 121.098 122.443 -1.345 19439
4947 1 20 . 1 1 86 86 GLU HA H 86 4.052 4.052 4.058 -0.006 19439
4948 1 20 . 1 1 86 86 GLU CA C 86 59.328 59.328 59.701 -0.373 19439
4949 1 20 . 1 1 86 86 GLU CB C 86 30.253 30.253 29.669 0.584 19439
4950 1 20 . 1 1 86 86 GLU H H 86 8.105 8.105 8.358 -0.253 19439
4951 1 20 . 1 1 87 87 TRP N N 87 122.584 122.584 122.220 0.364 19439
4952 1 20 . 1 1 87 87 TRP HA H 87 4.006 4.006 4.200 -0.194 19439
4953 1 20 . 1 1 87 87 TRP CA C 87 61.545 61.545 61.733 -0.189 19439
4954 1 20 . 1 1 87 87 TRP CB C 87 27.943 27.943 29.462 -1.519 19439
4955 1 20 . 1 1 87 87 TRP H H 87 8.099 8.099 8.837 -0.738 19439
4956 1 20 . 1 1 88 88 GLU N N 88 117.357 117.357 119.566 -2.209 19439
4957 1 20 . 1 1 88 88 GLU HA H 88 2.919 2.919 3.239 -0.320 19439
4958 1 20 . 1 1 88 88 GLU CA C 88 59.804 59.804 59.560 0.244 19439
4959 1 20 . 1 1 88 88 GLU CB C 88 29.546 29.546 29.011 0.535 19439
4960 1 20 . 1 1 88 88 GLU H H 88 8.440 8.440 8.559 -0.119 19439
4961 1 20 . 1 1 89 89 GLU N N 89 116.109 116.109 119.692 -3.583 19439
4962 1 20 . 1 1 89 89 GLU HA H 89 3.995 3.995 3.946 0.049 19439
4963 1 20 . 1 1 89 89 GLU CA C 89 58.329 58.329 59.424 -1.095 19439
4964 1 20 . 1 1 89 89 GLU CB C 89 29.649 29.649 29.467 0.182 19439
4965 1 20 . 1 1 89 89 GLU H H 89 7.244 7.244 7.961 -0.717 19439
4966 1 20 . 1 1 90 90 ARG N N 90 120.512 120.512 118.569 1.943 19439
4967 1 20 . 1 1 90 90 ARG HA H 90 3.920 3.920 3.990 -0.070 19439
4968 1 20 . 1 1 90 90 ARG CA C 90 58.683 58.683 58.557 0.126 19439
4969 1 20 . 1 1 90 90 ARG CB C 90 30.659 30.659 29.612 1.047 19439
4970 1 20 . 1 1 90 90 ARG H H 90 8.368 8.368 8.229 0.139 19439
4971 1 20 . 1 1 91 91 LYS N N 91 120.024 120.024 119.410 0.614 19439
4972 1 20 . 1 1 91 91 LYS HA H 91 3.964 3.964 4.106 -0.142 19439
4973 1 20 . 1 1 91 91 LYS CA C 91 57.278 57.278 58.526 -1.248 19439
4974 1 20 . 1 1 91 91 LYS CB C 91 30.582 30.582 31.409 -0.827 19439
4975 1 20 . 1 1 91 91 LYS H H 91 8.491 8.491 8.017 0.474 19439
4976 1 20 . 1 1 92 92 LYS N N 92 118.192 118.192 118.976 -0.784 19439
4977 1 20 . 1 1 92 92 LYS HA H 92 3.796 3.796 3.973 -0.177 19439
4978 1 20 . 1 1 92 92 LYS CA C 92 58.976 58.976 58.801 0.175 19439
4979 1 20 . 1 1 92 92 LYS CB C 92 32.188 32.188 32.006 0.182 19439
4980 1 20 . 1 1 92 92 LYS H H 92 6.933 6.933 7.970 -1.037 19439
4981 1 20 . 1 1 93 93 SER N N 93 110.447 110.447 111.888 -1.441 19439
4982 1 20 . 1 1 93 93 SER HA H 93 4.484 4.484 4.435 0.049 19439
4983 1 20 . 1 1 93 93 SER CA C 93 58.386 58.386 60.225 -1.839 19439
4984 1 20 . 1 1 93 93 SER CB C 93 64.173 64.173 64.021 0.152 19439
4985 1 20 . 1 1 93 93 SER H H 93 7.282 7.282 7.743 -0.461 19439
4986 1 20 . 1 1 94 94 ASP N N 94 120.163 120.163 118.986 1.177 19439
4987 1 20 . 1 1 94 94 ASP HA H 94 4.872 4.872 5.274 -0.402 19439
4988 1 20 . 1 1 94 94 ASP CA C 94 51.157 51.157 52.836 -1.679 19439
4989 1 20 . 1 1 94 94 ASP CB C 94 41.256 41.256 43.156 -1.900 19439
4990 1 20 . 1 1 94 94 ASP H H 94 7.303 7.303 8.256 -0.953 19439
4991 1 20 . 1 1 95 95 PRO CA C 95 63.871 63.871 64.213 -0.342 19439
4992 1 20 . 1 1 95 95 PRO CB C 95 31.497 31.497 32.443 -0.946 19439
4993 1 20 . 1 1 96 96 TRP N N 96 117.486 117.486 118.770 -1.284 19439
4994 1 20 . 1 1 96 96 TRP HA H 96 4.637 4.637 4.575 0.062 19439
4995 1 20 . 1 1 96 96 TRP CA C 96 56.061 56.061 55.339 0.722 19439
4996 1 20 . 1 1 96 96 TRP CB C 96 28.605 28.605 28.381 0.224 19439
4997 1 20 . 1 1 96 96 TRP H H 96 7.484 7.484 8.137 -0.653 19439
4998 1 20 . 1 1 97 97 LEU N N 97 123.510 123.510 120.512 2.998 19439
4999 1 20 . 1 1 97 97 LEU HA H 97 4.098 4.098 3.315 0.783 19439
5000 1 20 . 1 1 97 97 LEU CA C 97 56.024 56.024 54.368 1.656 19439
5001 1 20 . 1 1 97 97 LEU CB C 97 42.893 42.893 42.421 0.472 19439
5002 1 20 . 1 1 97 97 LEU H H 97 7.137 7.137 6.840 0.297 19439
5003 1 20 . 1 1 98 98 ARG N N 98 129.724 129.724 125.158 4.566 19439
5004 1 20 . 1 1 98 98 ARG HA H 98 4.486 4.486 4.533 -0.047 19439
5005 1 20 . 1 1 98 98 ARG CA C 98 55.622 55.622 55.151 0.471 19439
5006 1 20 . 1 1 98 98 ARG CB C 98 31.229 31.229 31.868 -0.639 19439
5007 1 20 . 1 1 98 98 ARG H H 98 8.825 8.825 8.297 0.528 19439
5008 1 20 . 1 1 99 99 LEU N N 99 127.814 127.814 122.615 5.199 19439
5009 1 20 . 1 1 99 99 LEU HA H 99 3.586 3.586 4.161 -0.575 19439
5010 1 20 . 1 1 99 99 LEU CA C 99 54.352 54.352 54.110 0.242 19439
5011 1 20 . 1 1 99 99 LEU CB C 99 40.485 40.485 41.519 -1.034 19439
5012 1 20 . 1 1 99 99 LEU H H 99 8.236 8.236 7.989 0.247 19439
5013 1 20 . 1 1 100 100 ASP N N 100 126.633 126.633 127.222 -0.589 19439
5014 1 20 . 1 1 100 100 ASP HA H 100 4.646 4.646 4.844 -0.198 19439
5015 1 20 . 1 1 100 100 ASP CA C 100 52.894 52.894 53.835 -0.941 19439
5016 1 20 . 1 1 100 100 ASP CB C 100 41.224 41.224 42.937 -1.713 19439
5017 1 20 . 1 1 100 100 ASP H H 100 8.018 8.018 8.557 -0.539 19439
5018 1 20 . 1 1 101 101 MET N N 101 122.473 122.473 119.113 3.360 19439
5019 1 20 . 1 1 101 101 MET HA H 101 4.481 4.481 4.620 -0.139 19439
5020 1 20 . 1 1 101 101 MET CA C 101 53.398 53.398 54.388 -0.990 19439
5021 1 20 . 1 1 101 101 MET CB C 101 33.296 33.296 32.883 0.413 19439
5022 1 20 . 1 1 101 101 MET H H 101 8.639 8.639 7.954 0.685 19439
5023 1 20 . 1 1 102 102 SER N N 102 116.243 116.243 118.073 -1.830 19439
5024 1 20 . 1 1 102 102 SER HA H 102 4.114 4.114 4.334 -0.220 19439
5025 1 20 . 1 1 102 102 SER CA C 102 58.709 58.709 57.758 0.951 19439
5026 1 20 . 1 1 102 102 SER CB C 102 64.701 64.701 64.270 0.431 19439
5027 1 20 . 1 1 102 102 SER H H 102 8.096 8.096 7.764 0.332 19439
5028 1 20 . 1 1 103 103 ASP N N 103 121.639 121.639 124.007 -2.368 19439
5029 1 20 . 1 1 103 103 ASP HA H 103 3.724 3.724 3.881 -0.157 19439
5030 1 20 . 1 1 103 103 ASP CA C 103 57.296 57.296 57.819 -0.523 19439
5031 1 20 . 1 1 103 103 ASP CB C 103 38.720 38.720 40.483 -1.764 19439
5032 1 20 . 1 1 103 103 ASP H H 103 8.669 8.669 8.666 0.003 19439
5033 1 20 . 1 1 104 104 LYS N N 104 116.276 116.276 118.898 -2.622 19439
5034 1 20 . 1 1 104 104 LYS HA H 104 3.678 3.678 4.051 -0.373 19439
5035 1 20 . 1 1 104 104 LYS CA C 104 59.833 59.833 58.880 0.953 19439
5036 1 20 . 1 1 104 104 LYS CB C 104 32.090 32.090 32.183 -0.093 19439
5037 1 20 . 1 1 104 104 LYS H H 104 7.775 7.775 8.247 -0.472 19439
5038 1 20 . 1 1 105 105 ALA N N 105 122.257 122.257 122.726 -0.469 19439
5039 1 20 . 1 1 105 105 ALA HA H 105 3.873 3.873 4.088 -0.215 19439
5040 1 20 . 1 1 105 105 ALA CA C 105 55.008 55.008 54.815 0.193 19439
5041 1 20 . 1 1 105 105 ALA CB C 105 17.741 17.741 18.157 -0.416 19439
5042 1 20 . 1 1 105 105 ALA H H 105 7.266 7.266 7.622 -0.356 19439
5043 1 20 . 1 1 106 106 ILE N N 106 119.452 119.452 119.849 -0.397 19439
5044 1 20 . 1 1 106 106 ILE HA H 106 3.419 3.419 3.852 -0.433 19439
5045 1 20 . 1 1 106 106 ILE CA C 106 65.971 65.971 64.411 1.560 19439
5046 1 20 . 1 1 106 106 ILE CB C 106 37.430 37.430 37.584 -0.154 19439
5047 1 20 . 1 1 106 106 ILE H H 106 7.974 7.974 7.835 0.139 19439
5048 1 20 . 1 1 107 107 PHE N N 107 117.814 117.814 118.742 -0.928 19439
5049 1 20 . 1 1 107 107 PHE HA H 107 4.368 4.368 4.696 -0.328 19439
5050 1 20 . 1 1 107 107 PHE CA C 107 56.844 56.844 58.413 -1.569 19439
5051 1 20 . 1 1 107 107 PHE CB C 107 37.150 37.150 37.698 -0.548 19439
5052 1 20 . 1 1 107 107 PHE H H 107 8.434 8.434 8.287 0.147 19439
5053 1 20 . 1 1 108 108 ARG N N 108 117.368 117.368 120.291 -2.923 19439
5054 1 20 . 1 1 108 108 ARG HA H 108 3.994 3.994 4.108 -0.114 19439
5055 1 20 . 1 1 108 108 ARG CA C 108 58.682 58.682 58.971 -0.289 19439
5056 1 20 . 1 1 108 108 ARG CB C 108 30.287 30.287 30.321 -0.034 19439
5057 1 20 . 1 1 108 108 ARG H H 108 7.474 7.474 8.173 -0.699 19439
5058 1 20 . 1 1 109 109 ARG N N 109 117.440 117.440 117.281 0.159 19439
5059 1 20 . 1 1 109 109 ARG HA H 109 3.900 3.900 4.026 -0.126 19439
5060 1 20 . 1 1 109 109 ARG CA C 109 57.312 57.312 57.667 -0.355 19439
5061 1 20 . 1 1 109 109 ARG CB C 109 31.626 31.626 30.736 0.890 19439
5062 1 20 . 1 1 109 109 ARG H H 109 7.118 7.118 7.750 -0.632 19439
5063 1 20 . 1 1 110 110 TYR N N 110 116.060 116.060 116.954 -0.894 19439
5064 1 20 . 1 1 110 110 TYR HA H 110 5.265 5.265 5.128 0.137 19439
5065 1 20 . 1 1 110 110 TYR CA C 110 54.188 54.188 54.699 -0.511 19439
5066 1 20 . 1 1 110 110 TYR CB C 110 38.484 38.484 38.662 -0.178 19439
5067 1 20 . 1 1 110 110 TYR H H 110 8.707 8.707 8.131 0.576 19439
5068 1 20 . 1 1 111 111 PRO HA H 111 4.388 4.388 4.672 -0.284 19439
5069 1 20 . 1 1 111 111 PRO CA C 111 64.847 64.847 64.293 0.554 19439
5070 1 20 . 1 1 111 111 PRO CB C 111 31.381 31.381 32.079 -0.698 19439
5071 1 20 . 1 1 112 112 HIS N N 112 115.542 115.542 114.303 1.239 19439
5072 1 20 . 1 1 112 112 HIS HA H 112 4.482 4.482 4.524 -0.042 19439
5073 1 20 . 1 1 112 112 HIS CA C 112 58.498 58.498 57.199 1.299 19439
5074 1 20 . 1 1 112 112 HIS CB C 112 29.654 29.654 28.541 1.113 19439
5075 1 20 . 1 1 112 112 HIS H H 112 8.196 8.196 8.388 -0.192 19439
5076 1 20 . 1 1 113 113 LEU N N 113 120.583 120.583 119.744 0.839 19439
5077 1 20 . 1 1 113 113 LEU HA H 113 4.165 4.165 4.344 -0.179 19439
5078 1 20 . 1 1 113 113 LEU CA C 113 54.013 54.013 55.212 -1.198 19439
5079 1 20 . 1 1 113 113 LEU CB C 113 41.669 41.669 42.019 -0.350 19439
5080 1 20 . 1 1 113 113 LEU H H 113 7.527 7.527 7.452 0.075 19439
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 48 2.144 0.177 2.160 19439
2 1 1 "Average Difference" HA 56 0.304 0.057 0.301 19439
3 1 1 "Average Difference" C 0 0.000 0.000 0.000 19439
4 1 1 "Average Difference" CA 53 0.984 0.022 0.993 19439
5 1 1 "Average Difference" CB 52 8.359 1.234 8.348 19439
6 1 1 "Average Difference" HN 49 0.490 0.107 0.483 19439
7 1 2 "Average Difference" N 48 2.056 0.313 2.053 19439
8 1 2 "Average Difference" HA 56 0.318 0.096 0.306 19439
9 1 2 "Average Difference" C 0 0.000 0.000 0.000 19439
10 1 2 "Average Difference" CA 53 1.023 0.015 1.033 19439
11 1 2 "Average Difference" CB 52 8.207 1.355 8.173 19439
12 1 2 "Average Difference" HN 49 0.432 0.157 0.407 19439
13 1 3 "Average Difference" N 48 2.164 0.251 2.172 19439
14 1 3 "Average Difference" HA 56 0.307 0.115 0.288 19439
15 1 3 "Average Difference" C 0 0.000 0.000 0.000 19439
16 1 3 "Average Difference" CA 53 0.972 -0.005 0.982 19439
17 1 3 "Average Difference" CB 52 8.344 1.388 8.308 19439
18 1 3 "Average Difference" HN 49 0.482 0.146 0.464 19439
19 1 4 "Average Difference" N 48 2.101 0.052 2.123 19439
20 1 4 "Average Difference" HA 56 0.304 0.087 0.294 19439
21 1 4 "Average Difference" C 0 0.000 0.000 0.000 19439
22 1 4 "Average Difference" CA 53 0.982 0.028 0.991 19439
23 1 4 "Average Difference" CB 52 8.347 1.303 8.325 19439
24 1 4 "Average Difference" HN 49 0.499 0.122 0.489 19439
25 1 5 "Average Difference" N 48 2.485 0.191 2.504 19439
26 1 5 "Average Difference" HA 56 0.289 0.092 0.277 19439
27 1 5 "Average Difference" C 0 0.000 0.000 0.000 19439
28 1 5 "Average Difference" CA 53 1.005 -0.034 1.014 19439
29 1 5 "Average Difference" CB 52 8.207 1.243 8.192 19439
30 1 5 "Average Difference" HN 49 0.452 0.106 0.444 19439
31 1 6 "Average Difference" N 48 2.012 0.153 2.028 19439
32 1 6 "Average Difference" HA 56 0.292 0.082 0.283 19439
33 1 6 "Average Difference" C 0 0.000 0.000 0.000 19439
34 1 6 "Average Difference" CA 53 0.992 0.002 1.001 19439
35 1 6 "Average Difference" CB 52 8.374 1.205 8.368 19439
36 1 6 "Average Difference" HN 49 0.485 0.157 0.464 19439
37 1 7 "Average Difference" N 48 2.329 0.088 2.352 19439
38 1 7 "Average Difference" HA 56 0.319 0.108 0.303 19439
39 1 7 "Average Difference" C 0 0.000 0.000 0.000 19439
40 1 7 "Average Difference" CA 53 1.029 -0.027 1.039 19439
41 1 7 "Average Difference" CB 52 8.356 1.433 8.313 19439
42 1 7 "Average Difference" HN 49 0.458 0.138 0.442 19439
43 1 8 "Average Difference" N 48 2.217 0.147 2.235 19439
44 1 8 "Average Difference" HA 56 0.310 0.101 0.295 19439
45 1 8 "Average Difference" C 0 0.000 0.000 0.000 19439
46 1 8 "Average Difference" CA 53 1.009 -0.008 1.018 19439
47 1 8 "Average Difference" CB 52 8.338 1.278 8.320 19439
48 1 8 "Average Difference" HN 49 0.487 0.120 0.477 19439
49 1 9 "Average Difference" N 48 2.546 -0.066 2.572 19439
50 1 9 "Average Difference" HA 56 0.296 0.084 0.286 19439
51 1 9 "Average Difference" C 0 0.000 0.000 0.000 19439
52 1 9 "Average Difference" CA 53 1.073 0.023 1.083 19439
53 1 9 "Average Difference" CB 52 8.361 1.312 8.338 19439
54 1 9 "Average Difference" HN 49 0.486 0.140 0.470 19439
55 1 10 "Average Difference" N 48 2.177 0.147 2.195 19439
56 1 10 "Average Difference" HA 56 0.280 0.069 0.273 19439
57 1 10 "Average Difference" C 0 0.000 0.000 0.000 19439
58 1 10 "Average Difference" CA 53 1.012 0.005 1.021 19439
59 1 10 "Average Difference" CB 52 8.379 1.326 8.354 19439
60 1 10 "Average Difference" HN 49 0.455 0.110 0.446 19439
61 1 11 "Average Difference" N 48 2.021 0.134 2.038 19439
62 1 11 "Average Difference" HA 56 0.320 0.069 0.316 19439
63 1 11 "Average Difference" C 0 0.000 0.000 0.000 19439
64 1 11 "Average Difference" CA 53 0.973 0.010 0.982 19439
65 1 11 "Average Difference" CB 52 8.366 1.280 8.349 19439
66 1 11 "Average Difference" HN 49 0.470 0.139 0.453 19439
67 1 12 "Average Difference" N 48 2.271 0.225 2.283 19439
68 1 12 "Average Difference" HA 56 0.298 0.083 0.289 19439
69 1 12 "Average Difference" C 0 0.000 0.000 0.000 19439
70 1 12 "Average Difference" CA 53 0.997 0.009 1.007 19439
71 1 12 "Average Difference" CB 52 8.197 1.240 8.182 19439
72 1 12 "Average Difference" HN 49 0.453 0.122 0.441 19439
73 1 13 "Average Difference" N 48 2.134 -0.010 2.156 19439
74 1 13 "Average Difference" HA 56 0.307 0.090 0.296 19439
75 1 13 "Average Difference" C 0 0.000 0.000 0.000 19439
76 1 13 "Average Difference" CA 53 1.017 -0.007 1.026 19439
77 1 13 "Average Difference" CB 52 8.335 1.323 8.310 19439
78 1 13 "Average Difference" HN 49 0.520 0.127 0.509 19439
79 1 14 "Average Difference" N 48 2.249 0.066 2.272 19439
80 1 14 "Average Difference" HA 56 0.298 0.101 0.283 19439
81 1 14 "Average Difference" C 0 0.000 0.000 0.000 19439
82 1 14 "Average Difference" CA 53 1.013 0.014 1.023 19439
83 1 14 "Average Difference" CB 52 8.355 1.303 8.333 19439
84 1 14 "Average Difference" HN 49 0.475 0.141 0.459 19439
85 1 15 "Average Difference" N 48 1.941 0.438 1.911 19439
86 1 15 "Average Difference" HA 56 0.299 0.083 0.289 19439
87 1 15 "Average Difference" C 0 0.000 0.000 0.000 19439
88 1 15 "Average Difference" CA 53 1.006 -0.011 1.016 19439
89 1 15 "Average Difference" CB 52 8.186 1.332 8.156 19439
90 1 15 "Average Difference" HN 49 0.413 0.129 0.396 19439
91 1 16 "Average Difference" N 48 2.178 0.146 2.196 19439
92 1 16 "Average Difference" HA 56 0.306 0.082 0.298 19439
93 1 16 "Average Difference" C 0 0.000 0.000 0.000 19439
94 1 16 "Average Difference" CA 53 0.940 0.054 0.947 19439
95 1 16 "Average Difference" CB 52 8.346 1.303 8.324 19439
96 1 16 "Average Difference" HN 49 0.493 0.108 0.486 19439
97 1 17 "Average Difference" N 48 2.120 0.311 2.119 19439
98 1 17 "Average Difference" HA 56 0.280 0.088 0.268 19439
99 1 17 "Average Difference" C 0 0.000 0.000 0.000 19439
100 1 17 "Average Difference" CA 53 1.000 -0.029 1.010 19439
101 1 17 "Average Difference" CB 52 8.230 1.242 8.216 19439
102 1 17 "Average Difference" HN 49 0.473 0.146 0.455 19439
103 1 18 "Average Difference" N 48 2.202 -0.004 2.226 19439
104 1 18 "Average Difference" HA 56 0.333 0.120 0.313 19439
105 1 18 "Average Difference" C 0 0.000 0.000 0.000 19439
106 1 18 "Average Difference" CA 53 0.970 0.023 0.979 19439
107 1 18 "Average Difference" CB 52 8.360 1.408 8.321 19439
108 1 18 "Average Difference" HN 49 0.460 0.159 0.436 19439
109 1 19 "Average Difference" N 48 2.187 0.288 2.191 19439
110 1 19 "Average Difference" HA 56 0.275 0.090 0.262 19439
111 1 19 "Average Difference" C 0 0.000 0.000 0.000 19439
112 1 19 "Average Difference" CA 53 0.980 0.031 0.989 19439
113 1 19 "Average Difference" CB 52 8.375 1.319 8.351 19439
114 1 19 "Average Difference" HN 49 0.473 0.111 0.464 19439
115 1 20 "Average Difference" N 48 2.190 0.131 2.209 19439
116 1 20 "Average Difference" HA 56 0.287 0.097 0.272 19439
117 1 20 "Average Difference" C 0 0.000 0.000 0.000 19439
118 1 20 "Average Difference" CA 53 0.980 0.009 0.989 19439
119 1 20 "Average Difference" CB 52 8.361 1.268 8.345 19439
120 1 20 "Average Difference" HN 49 0.513 0.142 0.498 19439
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 19439
_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 59 59 ALA N N 59 123.310 123.310 123.300 0.010 19439
2 1 . 1 1 59 59 ALA HA H 59 4.232 4.232 4.499 -0.267 19439
3 1 . 1 1 59 59 ALA CA C 59 52.274 52.274 52.247 0.027 19439
4 1 . 1 1 59 59 ALA CB C 59 19.623 19.623 19.143 0.480 19439
5 1 . 1 1 59 59 ALA H H 59 7.894 7.894 8.118 -0.224 19439
6 1 . 1 1 60 60 LEU N N 60 120.936 120.936 118.330 2.606 19439
7 1 . 1 1 60 60 LEU HA H 60 4.364 4.364 4.385 -0.021 19439
8 1 . 1 1 60 60 LEU CA C 60 54.130 54.130 55.081 -0.951 19439
9 1 . 1 1 60 60 LEU CB C 60 43.209 43.209 42.292 0.917 19439
10 1 . 1 1 60 60 LEU H H 60 8.046 8.046 7.888 0.158 19439
11 1 . 1 1 61 61 ALA N N 61 125.460 125.460 121.911 3.549 19439
12 1 . 1 1 61 61 ALA HA H 61 4.364 4.364 4.430 -0.066 19439
13 1 . 1 1 61 61 ALA CA C 61 51.176 51.176 51.774 -0.598 19439
14 1 . 1 1 61 61 ALA CB C 61 20.172 20.172 20.034 0.138 19439
15 1 . 1 1 61 61 ALA H H 61 8.338 8.338 7.786 0.552 19439
16 1 . 1 1 62 62 ALA N N 62 127.765 127.765 125.513 2.252 19439
17 1 . 1 1 62 62 ALA HA H 62 4.394 4.394 4.706 -0.312 19439
18 1 . 1 1 62 62 ALA CA C 62 51.888 51.888 50.742 1.146 19439
19 1 . 1 1 62 62 ALA CB C 62 18.806 18.806 21.002 -2.196 19439
20 1 . 1 1 62 62 ALA H H 62 8.487 8.487 8.958 -0.471 19439
21 1 . 1 1 63 63 LEU N N 63 120.199 120.199 120.427 -0.228 19439
22 1 . 1 1 63 63 LEU HA H 63 4.828 4.828 4.959 -0.131 19439
23 1 . 1 1 63 63 LEU CA C 63 51.852 51.852 53.053 -1.201 19439
24 1 . 1 1 63 63 LEU CB C 63 44.081 44.081 45.545 -1.464 19439
25 1 . 1 1 63 63 LEU H H 63 7.927 7.927 8.271 -0.344 19439
26 1 . 1 1 64 64 HIS N N 64 122.277 122.277 119.273 3.004 19439
27 1 . 1 1 64 64 HIS HA H 64 4.114 4.114 4.569 -0.455 19439
28 1 . 1 1 64 64 HIS CA C 64 58.038 58.038 57.020 1.018 19439
29 1 . 1 1 64 64 HIS CB C 64 31.228 31.228 31.381 -0.153 19439
30 1 . 1 1 64 64 HIS H H 64 8.477 8.477 8.825 -0.348 19439
31 1 . 1 1 65 65 ALA HA H 65 4.339 4.339 4.436 -0.097 19439
32 1 . 1 1 65 65 ALA CA C 65 53.281 53.281 52.581 0.700 19439
33 1 . 1 1 65 65 ALA CB C 65 20.276 20.276 19.905 0.371 19439
34 1 . 1 1 66 66 GLU N N 66 113.868 113.868 117.116 -3.248 19439
35 1 . 1 1 66 66 GLU HA H 66 4.619 4.619 4.511 0.108 19439
36 1 . 1 1 66 66 GLU CA C 66 54.727 54.727 55.066 -0.339 19439
37 1 . 1 1 66 66 GLU CB C 66 32.894 32.894 32.646 0.248 19439
38 1 . 1 1 66 66 GLU H H 66 7.759 7.759 8.005 -0.246 19439
39 1 . 1 1 68 68 PRO HA H 68 4.219 4.219 4.272 -0.053 19439
40 1 . 1 1 68 68 PRO CA C 68 64.664 64.664 65.040 -0.376 19439
41 1 . 1 1 68 68 PRO CB C 68 32.066 32.066 31.704 0.362 19439
42 1 . 1 1 69 69 LEU N N 69 117.262 117.262 118.040 -0.778 19439
43 1 . 1 1 69 69 LEU HA H 69 4.182 4.182 4.274 -0.092 19439
44 1 . 1 1 69 69 LEU CA C 69 52.430 52.430 53.507 -1.077 19439
45 1 . 1 1 69 69 LEU CB C 69 40.907 40.907 41.286 -0.379 19439
46 1 . 1 1 69 69 LEU H H 69 8.439 8.439 7.926 0.513 19439
47 1 . 1 1 70 70 ALA N N 70 120.426 120.426 121.246 -0.820 19439
48 1 . 1 1 70 70 ALA HA H 70 3.411 3.411 4.176 -0.765 19439
49 1 . 1 1 70 70 ALA CA C 70 53.685 53.685 53.484 0.201 19439
50 1 . 1 1 70 70 ALA CB C 70 17.914 17.914 18.657 -0.743 19439
51 1 . 1 1 70 70 ALA H H 70 7.113 7.113 7.482 -0.369 19439
52 1 . 1 1 71 71 GLY N N 71 108.911 108.911 112.992 -4.081 19439
53 1 . 1 1 71 71 GLY CA C 71 45.215 45.215 45.064 0.151 19439
54 1 . 1 1 71 71 GLY H H 71 8.856 8.856 8.873 -0.017 19439
55 1 . 1 1 72 72 LEU N N 72 120.000 120.000 121.251 -1.251 19439
56 1 . 1 1 72 72 LEU HA H 72 4.769 4.769 4.957 -0.188 19439
57 1 . 1 1 72 72 LEU CA C 72 51.972 51.972 51.563 0.409 19439
58 1 . 1 1 72 72 LEU CB C 72 41.255 41.255 42.878 -1.623 19439
59 1 . 1 1 72 72 LEU H H 72 8.136 8.136 7.992 0.144 19439
60 1 . 1 1 73 73 PRO HA H 73 4.739 4.739 4.650 0.089 19439
61 1 . 1 1 73 73 PRO CA C 73 61.456 61.456 62.821 -1.365 19439
62 1 . 1 1 73 73 PRO CB C 73 31.245 31.245 31.981 -0.736 19439
63 1 . 1 1 74 74 VAL N N 74 121.723 121.723 120.137 1.586 19439
64 1 . 1 1 74 74 VAL HA H 74 3.446 3.446 3.804 -0.358 19439
65 1 . 1 1 74 74 VAL CA C 74 65.744 65.744 63.913 1.831 19439
66 1 . 1 1 74 74 VAL CB C 74 31.236 31.236 31.952 -0.716 19439
67 1 . 1 1 74 74 VAL H H 74 7.710 7.710 8.140 -0.430 19439
68 1 . 1 1 75 75 THR N N 75 108.893 108.893 110.116 -1.223 19439
69 1 . 1 1 75 75 THR HA H 75 4.937 4.937 4.602 0.335 19439
70 1 . 1 1 75 75 THR CA C 75 59.892 59.892 59.593 0.299 19439
71 1 . 1 1 75 75 THR CB C 75 12.018 12.018 71.610 -59.592 19439
72 1 . 1 1 75 75 THR H H 75 8.710 8.710 7.931 0.779 19439
73 1 . 1 1 76 76 ARG HA H 76 3.873 3.873 4.038 -0.165 19439
74 1 . 1 1 76 76 ARG H H 76 8.447 8.447 8.826 -0.379 19439
75 1 . 1 1 77 77 SER N N 77 114.482 114.482 115.622 -1.140 19439
76 1 . 1 1 77 77 SER HA H 77 4.061 4.061 4.167 -0.106 19439
77 1 . 1 1 77 77 SER CA C 77 60.467 60.467 61.406 -0.939 19439
78 1 . 1 1 77 77 SER CB C 77 62.449 62.449 62.747 -0.298 19439
79 1 . 1 1 77 77 SER H H 77 8.105 8.105 7.934 0.171 19439
80 1 . 1 1 78 78 ASP N N 78 120.538 120.538 122.417 -1.880 19439
81 1 . 1 1 78 78 ASP HA H 78 4.333 4.333 4.351 -0.018 19439
82 1 . 1 1 78 78 ASP CA C 78 58.020 58.020 57.198 0.822 19439
83 1 . 1 1 78 78 ASP CB C 78 43.252 43.252 40.361 2.891 19439
84 1 . 1 1 78 78 ASP H H 78 7.300 7.300 7.983 -0.683 19439
85 1 . 1 1 79 79 ALA N N 79 120.614 120.614 122.881 -2.267 19439
86 1 . 1 1 79 79 ALA HA H 79 3.672 3.672 3.857 -0.185 19439
87 1 . 1 1 79 79 ALA CA C 79 54.886 54.886 55.199 -0.313 19439
88 1 . 1 1 79 79 ALA CB C 79 19.628 19.628 18.297 1.331 19439
89 1 . 1 1 79 79 ALA H H 79 7.767 7.767 8.236 -0.469 19439
90 1 . 1 1 80 80 ARG N N 80 116.203 116.203 119.170 -2.967 19439
91 1 . 1 1 80 80 ARG HA H 80 3.732 3.732 4.044 -0.312 19439
92 1 . 1 1 80 80 ARG CA C 80 61.441 61.441 59.421 2.020 19439
93 1 . 1 1 80 80 ARG CB C 80 30.266 30.266 30.316 -0.050 19439
94 1 . 1 1 80 80 ARG H H 80 7.981 7.981 8.191 -0.210 19439
95 1 . 1 1 81 81 VAL N N 81 119.192 119.192 119.879 -0.687 19439
96 1 . 1 1 81 81 VAL HA H 81 3.582 3.582 3.945 -0.363 19439
97 1 . 1 1 81 81 VAL CA C 81 66.909 66.909 66.628 0.281 19439
98 1 . 1 1 81 81 VAL CB C 81 31.668 31.668 31.697 -0.029 19439
99 1 . 1 1 81 81 VAL H H 81 7.338 7.338 8.135 -0.797 19439
100 1 . 1 1 82 82 LEU N N 82 118.722 118.722 121.508 -2.786 19439
101 1 . 1 1 82 82 LEU HA H 82 4.044 4.044 3.934 0.110 19439
102 1 . 1 1 82 82 LEU CA C 82 58.356 58.356 58.700 -0.345 19439
103 1 . 1 1 82 82 LEU CB C 82 41.627 41.627 41.653 -0.026 19439
104 1 . 1 1 82 82 LEU H H 82 7.599 7.599 8.406 -0.807 19439
105 1 . 1 1 83 83 ILE N N 83 120.893 120.893 119.657 1.236 19439
106 1 . 1 1 83 83 ILE HA H 83 3.642 3.642 3.727 -0.085 19439
107 1 . 1 1 83 83 ILE CA C 83 65.669 65.669 65.601 0.068 19439
108 1 . 1 1 83 83 ILE CB C 83 38.579 38.579 37.955 0.624 19439
109 1 . 1 1 83 83 ILE H H 83 8.546 8.546 8.394 0.152 19439
110 1 . 1 1 84 84 PHE N N 84 123.343 123.343 120.639 2.704 19439
111 1 . 1 1 84 84 PHE HA H 84 4.084 4.084 4.109 -0.025 19439
112 1 . 1 1 84 84 PHE CA C 84 62.593 62.593 60.549 2.044 19439
113 1 . 1 1 84 84 PHE CB C 84 39.211 39.211 38.750 0.461 19439
114 1 . 1 1 84 84 PHE H H 84 8.622 8.622 8.584 0.038 19439
115 1 . 1 1 85 85 ASN N N 85 118.037 118.037 118.146 -0.109 19439
116 1 . 1 1 85 85 ASN HA H 85 4.426 4.426 4.101 0.325 19439
117 1 . 1 1 85 85 ASN CA C 85 56.045 56.045 56.541 -0.496 19439
118 1 . 1 1 85 85 ASN CB C 85 37.785 37.785 38.444 -0.659 19439
119 1 . 1 1 85 85 ASN H H 85 8.834 8.834 8.612 0.222 19439
120 1 . 1 1 86 86 GLU N N 86 121.098 121.098 121.940 -0.842 19439
121 1 . 1 1 86 86 GLU HA H 86 4.052 4.052 3.987 0.065 19439
122 1 . 1 1 86 86 GLU CA C 86 59.328 59.328 59.663 -0.335 19439
123 1 . 1 1 86 86 GLU CB C 86 30.253 30.253 29.650 0.603 19439
124 1 . 1 1 86 86 GLU H H 86 8.105 8.105 8.293 -0.188 19439
125 1 . 1 1 87 87 TRP N N 87 122.584 122.584 122.012 0.572 19439
126 1 . 1 1 87 87 TRP HA H 87 4.006 4.006 4.179 -0.173 19439
127 1 . 1 1 87 87 TRP CA C 87 61.545 61.545 61.758 -0.213 19439
128 1 . 1 1 87 87 TRP CB C 87 27.943 27.943 29.482 -1.539 19439
129 1 . 1 1 87 87 TRP H H 87 8.099 8.099 8.687 -0.588 19439
130 1 . 1 1 88 88 GLU N N 88 117.357 117.357 118.904 -1.547 19439
131 1 . 1 1 88 88 GLU HA H 88 2.919 2.919 3.265 -0.346 19439
132 1 . 1 1 88 88 GLU CA C 88 59.804 59.804 59.678 0.126 19439
133 1 . 1 1 88 88 GLU CB C 88 29.546 29.546 29.099 0.447 19439
134 1 . 1 1 88 88 GLU H H 88 8.440 8.440 8.548 -0.108 19439
135 1 . 1 1 89 89 GLU N N 89 116.109 116.109 119.489 -3.380 19439
136 1 . 1 1 89 89 GLU HA H 89 3.995 3.995 3.883 0.112 19439
137 1 . 1 1 89 89 GLU CA C 89 58.329 58.329 59.364 -1.035 19439
138 1 . 1 1 89 89 GLU CB C 89 29.649 29.649 29.451 0.198 19439
139 1 . 1 1 89 89 GLU H H 89 7.244 7.244 8.006 -0.762 19439
140 1 . 1 1 90 90 ARG N N 90 120.512 120.512 118.515 1.997 19439
141 1 . 1 1 90 90 ARG HA H 90 3.920 3.920 3.935 -0.015 19439
142 1 . 1 1 90 90 ARG CA C 90 58.683 58.683 58.755 -0.072 19439
143 1 . 1 1 90 90 ARG CB C 90 30.659 30.659 29.680 0.979 19439
144 1 . 1 1 90 90 ARG H H 90 8.368 8.368 8.186 0.182 19439
145 1 . 1 1 91 91 LYS N N 91 120.024 120.024 119.791 0.233 19439
146 1 . 1 1 91 91 LYS HA H 91 3.964 3.964 3.997 -0.033 19439
147 1 . 1 1 91 91 LYS CA C 91 57.278 57.278 58.666 -1.388 19439
148 1 . 1 1 91 91 LYS CB C 91 30.582 30.582 31.298 -0.716 19439
149 1 . 1 1 91 91 LYS H H 91 8.491 8.491 8.004 0.487 19439
150 1 . 1 1 92 92 LYS N N 92 118.192 118.192 118.306 -0.114 19439
151 1 . 1 1 92 92 LYS HA H 92 3.796 3.796 4.035 -0.239 19439
152 1 . 1 1 92 92 LYS CA C 92 58.976 58.976 58.664 0.312 19439
153 1 . 1 1 92 92 LYS CB C 92 32.188 32.188 32.194 -0.006 19439
154 1 . 1 1 92 92 LYS H H 92 6.933 6.933 7.781 -0.848 19439
155 1 . 1 1 93 93 SER N N 93 110.447 110.447 113.175 -2.728 19439
156 1 . 1 1 93 93 SER HA H 93 4.484 4.484 4.342 0.142 19439
157 1 . 1 1 93 93 SER CA C 93 58.386 58.386 60.332 -1.946 19439
158 1 . 1 1 93 93 SER CB C 93 64.173 64.173 64.262 -0.089 19439
159 1 . 1 1 93 93 SER H H 93 7.282 7.282 7.721 -0.439 19439
160 1 . 1 1 94 94 ASP N N 94 120.163 120.163 119.598 0.565 19439
161 1 . 1 1 94 94 ASP HA H 94 4.872 4.872 5.077 -0.205 19439
162 1 . 1 1 94 94 ASP CA C 94 51.157 51.157 52.708 -1.551 19439
163 1 . 1 1 94 94 ASP CB C 94 41.256 41.256 43.180 -1.924 19439
164 1 . 1 1 94 94 ASP H H 94 7.303 7.303 8.191 -0.888 19439
165 1 . 1 1 95 95 PRO CA C 95 63.871 63.871 63.852 0.019 19439
166 1 . 1 1 95 95 PRO CB C 95 31.497 31.497 32.326 -0.829 19439
167 1 . 1 1 96 96 TRP N N 96 117.486 117.486 117.530 -0.044 19439
168 1 . 1 1 96 96 TRP HA H 96 4.637 4.637 4.563 0.074 19439
169 1 . 1 1 96 96 TRP CA C 96 56.061 56.061 55.355 0.706 19439
170 1 . 1 1 96 96 TRP CB C 96 28.605 28.605 28.257 0.348 19439
171 1 . 1 1 96 96 TRP H H 96 7.484 7.484 7.941 -0.457 19439
172 1 . 1 1 97 97 LEU N N 97 123.510 123.510 121.358 2.152 19439
173 1 . 1 1 97 97 LEU HA H 97 4.098 4.098 3.233 0.866 19439
174 1 . 1 1 97 97 LEU CA C 97 56.024 56.024 54.416 1.608 19439
175 1 . 1 1 97 97 LEU CB C 97 42.893 42.893 42.597 0.296 19439
176 1 . 1 1 97 97 LEU H H 97 7.137 7.137 6.837 0.300 19439
177 1 . 1 1 98 98 ARG N N 98 129.724 129.724 124.781 4.943 19439
178 1 . 1 1 98 98 ARG HA H 98 4.486 4.486 4.590 -0.104 19439
179 1 . 1 1 98 98 ARG CA C 98 55.622 55.622 54.844 0.778 19439
180 1 . 1 1 98 98 ARG CB C 98 31.229 31.229 31.624 -0.395 19439
181 1 . 1 1 98 98 ARG H H 98 8.825 8.825 8.272 0.553 19439
182 1 . 1 1 99 99 LEU N N 99 127.814 127.814 123.895 3.919 19439
183 1 . 1 1 99 99 LEU HA H 99 3.586 3.586 4.223 -0.637 19439
184 1 . 1 1 99 99 LEU CA C 99 54.352 54.352 54.336 0.016 19439
185 1 . 1 1 99 99 LEU CB C 99 40.485 40.485 41.664 -1.179 19439
186 1 . 1 1 99 99 LEU H H 99 8.236 8.236 8.134 0.102 19439
187 1 . 1 1 100 100 ASP N N 100 126.633 126.633 127.899 -1.266 19439
188 1 . 1 1 100 100 ASP HA H 100 4.646 4.646 4.854 -0.208 19439
189 1 . 1 1 100 100 ASP CA C 100 52.894 52.894 53.943 -1.049 19439
190 1 . 1 1 100 100 ASP CB C 100 41.224 41.224 42.806 -1.582 19439
191 1 . 1 1 100 100 ASP H H 100 8.018 8.018 8.601 -0.583 19439
192 1 . 1 1 101 101 MET N N 101 122.473 122.473 119.880 2.593 19439
193 1 . 1 1 101 101 MET HA H 101 4.481 4.481 4.635 -0.154 19439
194 1 . 1 1 101 101 MET CA C 101 53.398 53.398 54.447 -1.049 19439
195 1 . 1 1 101 101 MET CB C 101 33.296 33.296 33.267 0.029 19439
196 1 . 1 1 101 101 MET H H 101 8.639 8.639 7.978 0.661 19439
197 1 . 1 1 102 102 SER N N 102 116.243 116.243 117.087 -0.844 19439
198 1 . 1 1 102 102 SER HA H 102 4.114 4.114 4.385 -0.271 19439
199 1 . 1 1 102 102 SER CA C 102 58.709 58.709 57.501 1.208 19439
200 1 . 1 1 102 102 SER CB C 102 64.701 64.701 64.863 -0.162 19439
201 1 . 1 1 102 102 SER H H 102 8.096 8.096 8.003 0.093 19439
202 1 . 1 1 103 103 ASP N N 103 121.639 121.639 123.670 -2.031 19439
203 1 . 1 1 103 103 ASP HA H 103 3.724 3.724 3.897 -0.173 19439
204 1 . 1 1 103 103 ASP CA C 103 57.296 57.296 57.369 -0.073 19439
205 1 . 1 1 103 103 ASP CB C 103 38.720 38.720 40.350 -1.630 19439
206 1 . 1 1 103 103 ASP H H 103 8.669 8.669 8.734 -0.065 19439
207 1 . 1 1 104 104 LYS N N 104 116.276 116.276 119.113 -2.837 19439
208 1 . 1 1 104 104 LYS HA H 104 3.678 3.678 4.020 -0.342 19439
209 1 . 1 1 104 104 LYS CA C 104 59.833 59.833 58.987 0.846 19439
210 1 . 1 1 104 104 LYS CB C 104 32.090 32.090 32.114 -0.024 19439
211 1 . 1 1 104 104 LYS H H 104 7.775 7.775 7.893 -0.118 19439
212 1 . 1 1 105 105 ALA N N 105 122.257 122.257 122.430 -0.173 19439
213 1 . 1 1 105 105 ALA HA H 105 3.873 3.873 4.071 -0.198 19439
214 1 . 1 1 105 105 ALA CA C 105 55.008 55.008 54.795 0.213 19439
215 1 . 1 1 105 105 ALA CB C 105 17.741 17.741 18.115 -0.374 19439
216 1 . 1 1 105 105 ALA H H 105 7.266 7.266 7.562 -0.296 19439
217 1 . 1 1 106 106 ILE N N 106 119.452 119.452 119.797 -0.345 19439
218 1 . 1 1 106 106 ILE HA H 106 3.419 3.419 3.818 -0.399 19439
219 1 . 1 1 106 106 ILE CA C 106 65.971 65.971 64.515 1.456 19439
220 1 . 1 1 106 106 ILE CB C 106 37.430 37.430 37.603 -0.173 19439
221 1 . 1 1 106 106 ILE H H 106 7.974 7.974 7.796 0.178 19439
222 1 . 1 1 107 107 PHE N N 107 117.814 117.814 118.851 -1.037 19439
223 1 . 1 1 107 107 PHE HA H 107 4.368 4.368 4.719 -0.351 19439
224 1 . 1 1 107 107 PHE CA C 107 56.844 56.844 58.371 -1.527 19439
225 1 . 1 1 107 107 PHE CB C 107 37.150 37.150 37.622 -0.472 19439
226 1 . 1 1 107 107 PHE H H 107 8.434 8.434 8.130 0.304 19439
227 1 . 1 1 108 108 ARG N N 108 117.368 117.368 119.818 -2.450 19439
228 1 . 1 1 108 108 ARG HA H 108 3.994 3.994 4.156 -0.162 19439
229 1 . 1 1 108 108 ARG CA C 108 58.682 58.682 58.615 0.067 19439
230 1 . 1 1 108 108 ARG CB C 108 30.287 30.287 30.113 0.174 19439
231 1 . 1 1 108 108 ARG H H 108 7.474 7.474 8.236 -0.762 19439
232 1 . 1 1 109 109 ARG N N 109 117.440 117.440 117.218 0.222 19439
233 1 . 1 1 109 109 ARG HA H 109 3.900 3.900 3.968 -0.068 19439
234 1 . 1 1 109 109 ARG CA C 109 57.312 57.312 58.082 -0.770 19439
235 1 . 1 1 109 109 ARG CB C 109 31.626 31.626 30.858 0.768 19439
236 1 . 1 1 109 109 ARG H H 109 7.118 7.118 7.690 -0.572 19439
237 1 . 1 1 110 110 TYR N N 110 116.060 116.060 116.805 -0.745 19439
238 1 . 1 1 110 110 TYR HA H 110 5.265 5.265 5.154 0.111 19439
239 1 . 1 1 110 110 TYR CA C 110 54.188 54.188 54.601 -0.413 19439
240 1 . 1 1 110 110 TYR CB C 110 38.484 38.484 38.390 0.094 19439
241 1 . 1 1 110 110 TYR H H 110 8.707 8.707 8.140 0.567 19439
242 1 . 1 1 111 111 PRO HA H 111 4.388 4.388 4.685 -0.297 19439
243 1 . 1 1 111 111 PRO CA C 111 64.847 64.847 64.303 0.544 19439
244 1 . 1 1 111 111 PRO CB C 111 31.381 31.381 32.115 -0.734 19439
245 1 . 1 1 112 112 HIS N N 112 115.542 115.542 114.151 1.391 19439
246 1 . 1 1 112 112 HIS HA H 112 4.482 4.482 4.533 -0.051 19439
247 1 . 1 1 112 112 HIS CA C 112 58.498 58.498 57.050 1.448 19439
248 1 . 1 1 112 112 HIS CB C 112 29.654 29.654 28.590 1.064 19439
249 1 . 1 1 112 112 HIS H H 112 8.196 8.196 8.369 -0.173 19439
250 1 . 1 1 113 113 LEU N N 113 120.583 120.583 119.895 0.688 19439
251 1 . 1 1 113 113 LEU HA H 113 4.165 4.165 4.287 -0.122 19439
252 1 . 1 1 113 113 LEU CA C 113 54.013 54.013 55.289 -1.276 19439
253 1 . 1 1 113 113 LEU CB C 113 41.669 41.669 41.845 -0.176 19439
254 1 . 1 1 113 113 LEU H H 113 7.527 7.527 7.477 0.050 19439
stop_
save_