data_19174
save_entry_information
_Entry.Sf_category entry_information
_Entry.NMR_STAR_version 3.0.9.13
_Entry.Entry_ID 19174
_Entry.PDB_ID 2M76
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 19174
_Entity_delta_chem_shifts.ID 1
loop_
_Delta_CS.Atom_chem_shift_ID
_Delta_CS.Entity_delta_chem_shifts_ID
_Delta_CS.Conformer_ID
_Delta_CS.Assembly_atom_ID
_Delta_CS.Entity_assembly_ID
_Delta_CS.Entity_ID
_Delta_CS.Comp_index_ID
_Delta_CS.Seq_ID
_Delta_CS.Comp_ID
_Delta_CS.Atom_ID
_Delta_CS.Atom_type
_Delta_CS.Auth_seq_ID
_Delta_CS.Original_CS_value
_Delta_CS.Corrected_CS_value
_Delta_CS.Sparta_CS_value
_Delta_CS.Delta_CS_value
_Delta_CS.Entry_ID
1 1 1 . 1 1 2 2 ALA N N 2 127.400 127.400 124.096 3.304 19174
2 1 1 . 1 1 2 2 ALA CA C 2 52.536 52.536 53.432 -0.896 19174
3 1 1 . 1 1 2 2 ALA CB C 2 19.031 19.031 19.070 -0.038 19174
4 1 1 . 1 1 2 2 ALA H H 2 8.593 8.593 8.073 0.520 19174
5 1 1 . 1 1 3 3 GLU N N 3 120.977 120.977 119.568 1.409 19174
6 1 1 . 1 1 3 3 GLU CA C 3 56.295 56.295 55.832 0.463 19174
7 1 1 . 1 1 3 3 GLU CB C 3 29.939 29.939 30.732 -0.793 19174
8 1 1 . 1 1 3 3 GLU H H 3 8.301 8.301 8.284 0.017 19174
9 1 1 . 1 1 4 4 ALA N N 4 125.568 125.568 126.064 -0.496 19174
10 1 1 . 1 1 4 4 ALA CA C 4 52.509 52.509 51.588 0.921 19174
11 1 1 . 1 1 4 4 ALA CB C 4 19.084 19.084 20.696 -1.612 19174
12 1 1 . 1 1 4 4 ALA H H 4 8.229 8.229 8.086 0.143 19174
13 1 1 . 1 1 5 5 HIS N N 5 117.815 117.815 119.578 -1.763 19174
14 1 1 . 1 1 5 5 HIS CA C 5 55.157 55.157 55.748 -0.591 19174
15 1 1 . 1 1 5 5 HIS CB C 5 28.827 28.827 32.031 -3.204 19174
16 1 1 . 1 1 5 5 HIS H H 5 8.363 8.363 8.382 -0.019 19174
17 1 1 . 1 1 6 6 GLN N N 6 121.556 121.556 123.133 -1.577 19174
18 1 1 . 1 1 6 6 GLN CA C 6 55.739 55.739 57.254 -1.515 19174
19 1 1 . 1 1 6 6 GLN CB C 6 29.409 29.409 29.407 0.002 19174
20 1 1 . 1 1 6 6 GLN H H 6 8.289 8.289 8.852 -0.563 19174
21 1 1 . 1 1 7 7 ALA N N 7 126.411 126.411 118.285 8.126 19174
22 1 1 . 1 1 7 7 ALA CA C 7 52.404 52.404 51.392 1.012 19174
23 1 1 . 1 1 7 7 ALA CB C 7 18.978 18.978 20.176 -1.198 19174
24 1 1 . 1 1 7 7 ALA H H 7 8.311 8.311 7.607 0.704 19174
25 1 1 . 1 1 8 8 VAL N N 8 119.771 119.771 120.165 -0.394 19174
26 1 1 . 1 1 8 8 VAL CA C 8 62.491 62.491 63.608 -1.117 19174
27 1 1 . 1 1 8 8 VAL CB C 8 32.586 32.586 31.815 0.771 19174
28 1 1 . 1 1 8 8 VAL H H 8 8.018 8.018 8.253 -0.235 19174
29 1 1 . 1 1 9 9 GLY N N 9 112.108 112.108 105.132 6.976 19174
30 1 1 . 1 1 9 9 GLY CA C 9 45.044 45.044 44.732 0.312 19174
31 1 1 . 1 1 9 9 GLY H H 9 8.243 8.243 7.619 0.624 19174
32 1 1 . 1 1 10 10 PHE N N 10 120.842 120.842 118.247 2.595 19174
33 1 1 . 1 1 10 10 PHE CA C 10 57.725 57.725 57.447 0.278 19174
34 1 1 . 1 1 10 10 PHE CB C 10 39.628 39.628 41.801 -2.173 19174
35 1 1 . 1 1 10 10 PHE H H 10 7.983 7.983 8.173 -0.190 19174
36 1 1 . 1 1 11 11 ARG N N 11 125.277 125.277 124.124 1.153 19174
37 1 1 . 1 1 11 11 ARG CA C 11 53.410 53.410 55.440 -2.030 19174
38 1 1 . 1 1 11 11 ARG CB C 11 30.574 30.574 29.824 0.750 19174
39 1 1 . 1 1 11 11 ARG H H 11 8.016 8.016 8.566 -0.550 19174
40 1 1 . 1 1 13 13 SER N N 13 115.938 115.938 118.339 -2.401 19174
41 1 1 . 1 1 13 13 SER CA C 13 58.043 58.043 60.941 -2.898 19174
42 1 1 . 1 1 13 13 SER CB C 13 63.774 63.774 62.534 1.240 19174
43 1 1 . 1 1 13 13 SER H H 13 8.197 8.197 8.619 -0.422 19174
44 1 1 . 1 1 14 14 LEU N N 14 124.186 124.186 120.911 3.275 19174
45 1 1 . 1 1 14 14 LEU CA C 14 55.422 55.422 56.951 -1.529 19174
46 1 1 . 1 1 14 14 LEU CB C 14 42.329 42.329 41.756 0.573 19174
47 1 1 . 1 1 14 14 LEU H H 14 8.256 8.256 7.851 0.405 19174
48 1 1 . 1 1 15 15 THR N N 15 112.858 112.858 108.653 4.205 19174
49 1 1 . 1 1 15 15 THR CA C 15 61.379 61.379 63.635 -2.256 19174
50 1 1 . 1 1 15 15 THR CB C 15 69.810 69.810 68.969 0.841 19174
51 1 1 . 1 1 15 15 THR H H 15 7.913 7.913 7.318 0.595 19174
52 1 1 . 1 1 16 16 SER N N 16 117.578 117.578 118.005 -0.427 19174
53 1 1 . 1 1 16 16 SER CA C 16 58.678 58.678 59.138 -0.459 19174
54 1 1 . 1 1 16 16 SER CB C 16 63.668 63.668 64.042 -0.374 19174
55 1 1 . 1 1 16 16 SER H H 16 8.154 8.154 7.546 0.608 19174
56 1 1 . 1 1 17 17 ASP N N 17 122.030 122.030 123.743 -1.713 19174
57 1 1 . 1 1 17 17 ASP CA C 17 54.680 54.680 53.862 0.818 19174
58 1 1 . 1 1 17 17 ASP CB C 17 40.899 40.899 40.945 -0.046 19174
59 1 1 . 1 1 17 17 ASP H H 17 8.263 8.263 8.391 -0.128 19174
60 1 1 . 1 1 18 18 GLY N N 18 108.815 108.815 110.617 -1.802 19174
61 1 1 . 1 1 18 18 GLY CA C 18 45.758 45.758 45.666 0.092 19174
62 1 1 . 1 1 18 18 GLY H H 18 8.239 8.239 8.557 -0.318 19174
63 1 1 . 1 1 19 19 ALA N N 19 123.128 123.128 122.271 0.857 19174
64 1 1 . 1 1 19 19 ALA CA C 19 53.164 53.164 51.699 1.466 19174
65 1 1 . 1 1 19 19 ALA CB C 19 19.084 19.084 19.724 -0.640 19174
66 1 1 . 1 1 19 19 ALA H H 19 8.001 8.001 7.809 0.192 19174
67 1 1 . 1 1 20 20 GLU N N 20 117.663 117.663 119.521 -1.858 19174
68 1 1 . 1 1 20 20 GLU CA C 20 57.275 57.275 57.467 -0.191 19174
69 1 1 . 1 1 20 20 GLU CB C 20 29.250 29.250 29.881 -0.631 19174
70 1 1 . 1 1 20 20 GLU H H 20 8.231 8.231 8.381 -0.150 19174
71 1 1 . 1 1 21 21 VAL N N 21 119.044 119.044 114.488 4.556 19174
72 1 1 . 1 1 21 21 VAL CA C 21 62.755 62.755 61.157 1.598 19174
73 1 1 . 1 1 21 21 VAL CB C 21 32.268 32.268 34.662 -2.394 19174
74 1 1 . 1 1 21 21 VAL H H 21 7.767 7.767 7.557 0.210 19174
75 1 1 . 1 1 22 22 GLU N N 22 121.765 121.765 121.084 0.681 19174
76 1 1 . 1 1 22 22 GLU CA C 22 56.613 56.613 56.117 0.496 19174
77 1 1 . 1 1 22 22 GLU CB C 22 29.833 29.833 30.473 -0.640 19174
78 1 1 . 1 1 22 22 GLU H H 22 7.969 7.969 8.625 -0.656 19174
79 1 1 . 1 1 23 23 LEU N N 23 120.996 120.996 121.494 -0.498 19174
80 1 1 . 1 1 23 23 LEU CA C 23 54.310 54.310 56.679 -2.369 19174
81 1 1 . 1 1 23 23 LEU CB C 23 42.223 42.223 42.323 -0.100 19174
82 1 1 . 1 1 23 23 LEU H H 23 7.917 7.917 7.867 0.050 19174
83 1 1 . 1 1 24 24 SER N N 24 114.702 114.702 109.364 5.338 19174
84 1 1 . 1 1 24 24 SER CA C 24 57.593 57.593 58.324 -0.731 19174
85 1 1 . 1 1 24 24 SER CB C 24 64.515 64.515 63.283 1.232 19174
86 1 1 . 1 1 24 24 SER H H 24 7.564 7.564 7.878 -0.314 19174
87 1 1 . 1 1 25 25 ALA N N 25 125.059 125.059 125.360 -0.301 19174
88 1 1 . 1 1 25 25 ALA CA C 25 55.898 55.898 56.129 -0.231 19174
89 1 1 . 1 1 25 25 ALA CB C 25 16.330 16.330 16.829 -0.499 19174
90 1 1 . 1 1 25 25 ALA H H 25 8.630 8.630 8.488 0.142 19174
91 1 1 . 1 1 27 27 VAL N N 27 118.016 118.016 117.325 0.691 19174
92 1 1 . 1 1 27 27 VAL CA C 27 65.826 65.826 66.364 -0.538 19174
93 1 1 . 1 1 27 27 VAL CB C 27 31.686 31.686 31.573 0.113 19174
94 1 1 . 1 1 27 27 VAL H H 27 7.294 7.294 7.328 -0.034 19174
95 1 1 . 1 1 28 28 LEU N N 28 119.933 119.933 120.421 -0.488 19174
96 1 1 . 1 1 28 28 LEU CA C 28 57.990 57.990 58.346 -0.356 19174
97 1 1 . 1 1 28 28 LEU CB C 28 41.429 41.429 41.376 0.053 19174
98 1 1 . 1 1 28 28 LEU H H 28 7.939 7.939 8.591 -0.652 19174
99 1 1 . 1 1 29 29 GLN N N 29 117.644 117.644 119.152 -1.508 19174
100 1 1 . 1 1 29 29 GLN CA C 29 59.367 59.367 59.531 -0.164 19174
101 1 1 . 1 1 29 29 GLN CB C 29 28.297 28.297 28.554 -0.257 19174
102 1 1 . 1 1 29 29 GLN H H 29 8.179 8.179 8.793 -0.614 19174
103 1 1 . 1 1 30 30 GLU N N 30 118.389 118.389 120.450 -2.061 19174
104 1 1 . 1 1 30 30 GLU CA C 30 59.128 59.128 59.375 -0.247 19174
105 1 1 . 1 1 30 30 GLU CB C 30 29.038 29.038 29.622 -0.584 19174
106 1 1 . 1 1 30 30 GLU H H 30 7.752 7.752 7.818 -0.066 19174
107 1 1 . 1 1 31 31 ILE N N 31 120.796 120.796 120.771 0.025 19174
108 1 1 . 1 1 31 31 ILE CA C 31 65.509 65.509 65.361 0.148 19174
109 1 1 . 1 1 31 31 ILE CB C 31 37.775 37.775 38.130 -0.355 19174
110 1 1 . 1 1 31 31 ILE H H 31 8.131 8.131 8.242 -0.111 19174
111 1 1 . 1 1 32 32 TYR N N 32 120.550 120.550 120.961 -0.411 19174
112 1 1 . 1 1 32 32 TYR CA C 32 61.405 61.405 62.220 -0.815 19174
113 1 1 . 1 1 32 32 TYR CB C 32 38.358 38.358 38.598 -0.240 19174
114 1 1 . 1 1 32 32 TYR H H 32 8.214 8.214 8.380 -0.166 19174
115 1 1 . 1 1 33 33 LEU N N 33 117.578 117.578 119.722 -2.144 19174
116 1 1 . 1 1 33 33 LEU CA C 33 57.513 57.513 57.553 -0.040 19174
117 1 1 . 1 1 33 33 LEU CB C 33 41.657 41.657 41.653 0.004 19174
118 1 1 . 1 1 33 33 LEU H H 33 8.347 8.347 8.310 0.037 19174
119 1 1 . 1 1 34 34 SER N N 34 114.635 114.635 115.018 -0.383 19174
120 1 1 . 1 1 34 34 SER CA C 34 61.405 61.405 61.541 -0.137 19174
121 1 1 . 1 1 34 34 SER CB C 34 63.403 63.403 62.281 1.122 19174
122 1 1 . 1 1 34 34 SER H H 34 7.986 7.986 8.344 -0.358 19174
123 1 1 . 1 1 35 35 GLY N N 35 110.749 110.749 110.698 0.051 19174
124 1 1 . 1 1 35 35 GLY CA C 35 46.897 46.897 46.796 0.101 19174
125 1 1 . 1 1 35 35 GLY H H 35 8.302 8.302 8.464 -0.162 19174
126 1 1 . 1 1 36 36 LEU N N 36 121.632 121.632 123.064 -1.432 19174
127 1 1 . 1 1 36 36 LEU CA C 36 57.619 57.619 57.277 0.342 19174
128 1 1 . 1 1 36 36 LEU CB C 36 41.799 41.799 41.631 0.168 19174
129 1 1 . 1 1 36 36 LEU H H 36 8.194 8.194 7.786 0.408 19174
130 1 1 . 1 1 37 37 ARG N N 37 118.274 118.274 118.535 -0.261 19174
131 1 1 . 1 1 37 37 ARG CA C 37 59.049 59.049 59.601 -0.552 19174
132 1 1 . 1 1 37 37 ARG CB C 37 30.044 30.044 30.032 0.012 19174
133 1 1 . 1 1 37 37 ARG H H 37 7.934 7.934 7.599 0.335 19174
134 1 1 . 1 1 38 38 SER N N 38 114.239 114.239 114.952 -0.713 19174
135 1 1 . 1 1 38 38 SER CA C 38 60.531 60.531 61.192 -0.661 19174
136 1 1 . 1 1 38 38 SER CB C 38 63.509 63.509 63.064 0.445 19174
137 1 1 . 1 1 38 38 SER H H 38 7.913 7.913 7.669 0.244 19174
138 1 1 . 1 1 39 39 TRP N N 39 123.095 123.095 124.433 -1.338 19174
139 1 1 . 1 1 39 39 TRP CA C 39 59.870 59.870 58.665 1.205 19174
140 1 1 . 1 1 39 39 TRP CB C 39 28.721 28.721 28.980 -0.259 19174
141 1 1 . 1 1 39 39 TRP H H 39 8.108 8.108 8.665 -0.557 19174
142 1 1 . 1 1 40 40 LYS N N 40 119.629 119.629 118.917 0.712 19174
143 1 1 . 1 1 40 40 LYS CA C 40 59.525 59.525 59.734 -0.209 19174
144 1 1 . 1 1 40 40 LYS CB C 40 32.109 32.109 32.154 -0.045 19174
145 1 1 . 1 1 40 40 LYS H H 40 7.938 7.938 7.837 0.101 19174
146 1 1 . 1 1 41 41 ARG N N 41 117.834 117.834 117.371 0.463 19174
147 1 1 . 1 1 41 41 ARG CA C 41 57.857 57.857 59.149 -1.292 19174
148 1 1 . 1 1 41 41 ARG CB C 41 30.203 30.203 30.037 0.166 19174
149 1 1 . 1 1 41 41 ARG H H 41 7.863 7.863 7.659 0.204 19174
150 1 1 . 1 1 42 42 HIS N N 42 115.774 115.774 119.421 -3.647 19174
151 1 1 . 1 1 42 42 HIS CA C 42 57.487 57.487 59.576 -2.089 19174
152 1 1 . 1 1 42 42 HIS CB C 42 30.786 30.786 29.968 0.818 19174
153 1 1 . 1 1 42 42 HIS H H 42 7.919 7.919 7.777 0.142 19174
154 1 1 . 1 1 43 43 LEU N N 43 120.243 120.243 119.946 0.297 19174
155 1 1 . 1 1 43 43 LEU CA C 43 56.745 56.745 55.949 0.796 19174
156 1 1 . 1 1 43 43 LEU CB C 43 42.276 42.276 41.496 0.780 19174
157 1 1 . 1 1 43 43 LEU H H 43 8.162 8.162 8.618 -0.456 19174
158 1 1 . 1 1 44 44 SER N N 44 114.616 114.616 116.769 -2.153 19174
159 1 1 . 1 1 44 44 SER CA C 44 60.987 60.987 62.891 -1.903 19174
160 1 1 . 1 1 44 44 SER CB C 44 62.768 62.768 62.441 0.327 19174
161 1 1 . 1 1 44 44 SER H H 44 8.033 8.033 8.137 -0.104 19174
162 1 1 . 1 1 45 45 ARG N N 45 120.757 120.757 120.810 -0.053 19174
163 1 1 . 1 1 45 45 ARG CA C 45 57.513 57.513 59.205 -1.692 19174
164 1 1 . 1 1 45 45 ARG CB C 45 29.462 29.462 29.990 -0.528 19174
165 1 1 . 1 1 45 45 ARG H H 45 7.763 7.763 8.121 -0.358 19174
166 1 1 . 1 1 46 46 PHE N N 46 118.237 118.237 117.154 1.083 19174
167 1 1 . 1 1 46 46 PHE CA C 46 59.155 59.155 60.761 -1.606 19174
168 1 1 . 1 1 46 46 PHE CB C 46 39.311 39.311 38.685 0.626 19174
169 1 1 . 1 1 46 46 PHE H H 46 7.673 7.673 7.978 -0.305 19174
170 1 1 . 1 1 47 47 TRP N N 47 118.484 118.484 119.527 -1.043 19174
171 1 1 . 1 1 47 47 TRP CA C 47 58.837 58.837 59.847 -1.010 19174
172 1 1 . 1 1 47 47 TRP CB C 47 29.833 29.833 29.927 -0.094 19174
173 1 1 . 1 1 47 47 TRP H H 47 7.614 7.614 8.532 -0.918 19174
174 1 1 . 1 1 48 48 ASN N N 48 114.629 114.629 116.367 -1.738 19174
175 1 1 . 1 1 48 48 ASN CA C 48 54.124 54.124 54.794 -0.670 19174
176 1 1 . 1 1 48 48 ASN CB C 48 38.887 38.887 38.846 0.041 19174
177 1 1 . 1 1 48 48 ASN H H 48 7.811 7.811 8.100 -0.289 19174
178 1 1 . 1 1 49 49 ASP N N 49 118.029 118.029 119.768 -1.739 19174
179 1 1 . 1 1 49 49 ASP CA C 49 54.310 54.310 52.674 1.636 19174
180 1 1 . 1 1 49 49 ASP CB C 49 40.793 40.793 40.630 0.163 19174
181 1 1 . 1 1 49 49 ASP H H 49 7.775 7.775 7.418 0.357 19174
182 1 2 . 1 1 2 2 ALA N N 2 127.400 127.400 125.279 2.121 19174
183 1 2 . 1 1 2 2 ALA CA C 2 52.536 52.536 54.214 -1.678 19174
184 1 2 . 1 1 2 2 ALA CB C 2 19.031 19.031 18.721 0.310 19174
185 1 2 . 1 1 2 2 ALA H H 2 8.593 8.593 8.765 -0.172 19174
186 1 2 . 1 1 3 3 GLU N N 3 120.977 120.977 117.063 3.914 19174
187 1 2 . 1 1 3 3 GLU CA C 3 56.295 56.295 57.482 -1.187 19174
188 1 2 . 1 1 3 3 GLU CB C 3 29.939 29.939 29.820 0.119 19174
189 1 2 . 1 1 3 3 GLU H H 3 8.301 8.301 8.372 -0.071 19174
190 1 2 . 1 1 4 4 ALA N N 4 125.568 125.568 120.394 5.174 19174
191 1 2 . 1 1 4 4 ALA CA C 4 52.509 52.509 50.812 1.697 19174
192 1 2 . 1 1 4 4 ALA CB C 4 19.084 19.084 20.687 -1.603 19174
193 1 2 . 1 1 4 4 ALA H H 4 8.229 8.229 7.333 0.896 19174
194 1 2 . 1 1 5 5 HIS N N 5 117.815 117.815 121.995 -4.180 19174
195 1 2 . 1 1 5 5 HIS CA C 5 55.157 55.157 60.885 -5.728 19174
196 1 2 . 1 1 5 5 HIS CB C 5 28.827 28.827 29.695 -0.868 19174
197 1 2 . 1 1 5 5 HIS H H 5 8.363 8.363 9.020 -0.657 19174
198 1 2 . 1 1 6 6 GLN N N 6 121.556 121.556 118.492 3.064 19174
199 1 2 . 1 1 6 6 GLN CA C 6 55.739 55.739 58.704 -2.965 19174
200 1 2 . 1 1 6 6 GLN CB C 6 29.409 29.409 27.727 1.681 19174
201 1 2 . 1 1 6 6 GLN H H 6 8.289 8.289 8.659 -0.370 19174
202 1 2 . 1 1 7 7 ALA N N 7 126.411 126.411 121.043 5.368 19174
203 1 2 . 1 1 7 7 ALA CA C 7 52.404 52.404 54.196 -1.792 19174
204 1 2 . 1 1 7 7 ALA CB C 7 18.978 18.978 18.145 0.833 19174
205 1 2 . 1 1 7 7 ALA H H 7 8.311 8.311 8.080 0.231 19174
206 1 2 . 1 1 8 8 VAL N N 8 119.771 119.771 117.473 2.298 19174
207 1 2 . 1 1 8 8 VAL CA C 8 62.491 62.491 63.861 -1.370 19174
208 1 2 . 1 1 8 8 VAL CB C 8 32.586 32.586 31.830 0.756 19174
209 1 2 . 1 1 8 8 VAL H H 8 8.018 8.018 7.331 0.687 19174
210 1 2 . 1 1 9 9 GLY N N 9 112.108 112.108 108.470 3.638 19174
211 1 2 . 1 1 9 9 GLY CA C 9 45.044 45.044 44.904 0.140 19174
212 1 2 . 1 1 9 9 GLY H H 9 8.243 8.243 7.448 0.795 19174
213 1 2 . 1 1 10 10 PHE N N 10 120.842 120.842 118.760 2.082 19174
214 1 2 . 1 1 10 10 PHE CA C 10 57.725 57.725 57.218 0.507 19174
215 1 2 . 1 1 10 10 PHE CB C 10 39.628 39.628 41.348 -1.720 19174
216 1 2 . 1 1 10 10 PHE H H 10 7.983 7.983 8.340 -0.357 19174
217 1 2 . 1 1 11 11 ARG N N 11 125.277 125.277 124.670 0.607 19174
218 1 2 . 1 1 11 11 ARG CA C 11 53.410 53.410 53.936 -0.526 19174
219 1 2 . 1 1 11 11 ARG CB C 11 30.574 30.574 30.462 0.112 19174
220 1 2 . 1 1 11 11 ARG H H 11 8.016 8.016 8.633 -0.617 19174
221 1 2 . 1 1 13 13 SER N N 13 115.938 115.938 117.400 -1.462 19174
222 1 2 . 1 1 13 13 SER CA C 13 58.043 58.043 58.344 -0.301 19174
223 1 2 . 1 1 13 13 SER CB C 13 63.774 63.774 63.896 -0.122 19174
224 1 2 . 1 1 13 13 SER H H 13 8.197 8.197 8.390 -0.193 19174
225 1 2 . 1 1 14 14 LEU N N 14 124.186 124.186 124.291 -0.105 19174
226 1 2 . 1 1 14 14 LEU CA C 14 55.422 55.422 54.711 0.711 19174
227 1 2 . 1 1 14 14 LEU CB C 14 42.329 42.329 43.562 -1.233 19174
228 1 2 . 1 1 14 14 LEU H H 14 8.256 8.256 8.358 -0.102 19174
229 1 2 . 1 1 15 15 THR N N 15 112.858 112.858 115.379 -2.521 19174
230 1 2 . 1 1 15 15 THR CA C 15 61.379 61.379 61.691 -0.312 19174
231 1 2 . 1 1 15 15 THR CB C 15 69.810 69.810 69.555 0.255 19174
232 1 2 . 1 1 15 15 THR H H 15 7.913 7.913 8.474 -0.561 19174
233 1 2 . 1 1 16 16 SER N N 16 117.578 117.578 118.066 -0.488 19174
234 1 2 . 1 1 16 16 SER CA C 16 58.678 58.678 60.657 -1.979 19174
235 1 2 . 1 1 16 16 SER CB C 16 63.668 63.668 62.690 0.978 19174
236 1 2 . 1 1 16 16 SER H H 16 8.154 8.154 8.148 0.006 19174
237 1 2 . 1 1 17 17 ASP N N 17 122.030 122.030 119.291 2.739 19174
238 1 2 . 1 1 17 17 ASP CA C 17 54.680 54.680 53.384 1.296 19174
239 1 2 . 1 1 17 17 ASP CB C 17 40.899 40.899 40.035 0.864 19174
240 1 2 . 1 1 17 17 ASP H H 17 8.263 8.263 8.126 0.137 19174
241 1 2 . 1 1 18 18 GLY N N 18 108.815 108.815 108.678 0.137 19174
242 1 2 . 1 1 18 18 GLY CA C 18 45.758 45.758 44.913 0.846 19174
243 1 2 . 1 1 18 18 GLY H H 18 8.239 8.239 7.591 0.648 19174
244 1 2 . 1 1 19 19 ALA N N 19 123.128 123.128 123.576 -0.448 19174
245 1 2 . 1 1 19 19 ALA CA C 19 53.164 53.164 51.439 1.725 19174
246 1 2 . 1 1 19 19 ALA CB C 19 19.084 19.084 20.323 -1.239 19174
247 1 2 . 1 1 19 19 ALA H H 19 8.001 8.001 7.949 0.052 19174
248 1 2 . 1 1 20 20 GLU N N 20 117.663 117.663 120.662 -2.999 19174
249 1 2 . 1 1 20 20 GLU CA C 20 57.275 57.275 57.606 -0.331 19174
250 1 2 . 1 1 20 20 GLU CB C 20 29.250 29.250 30.058 -0.808 19174
251 1 2 . 1 1 20 20 GLU H H 20 8.231 8.231 8.564 -0.333 19174
252 1 2 . 1 1 21 21 VAL N N 21 119.044 119.044 119.559 -0.515 19174
253 1 2 . 1 1 21 21 VAL CA C 21 62.755 62.755 61.124 1.631 19174
254 1 2 . 1 1 21 21 VAL CB C 21 32.268 32.268 33.331 -1.063 19174
255 1 2 . 1 1 21 21 VAL H H 21 7.767 7.767 7.603 0.164 19174
256 1 2 . 1 1 22 22 GLU N N 22 121.765 121.765 127.009 -5.244 19174
257 1 2 . 1 1 22 22 GLU CA C 22 56.613 56.613 58.128 -1.515 19174
258 1 2 . 1 1 22 22 GLU CB C 22 29.833 29.833 30.232 -0.399 19174
259 1 2 . 1 1 22 22 GLU H H 22 7.969 7.969 8.669 -0.700 19174
260 1 2 . 1 1 23 23 LEU N N 23 120.996 120.996 120.416 0.580 19174
261 1 2 . 1 1 23 23 LEU CA C 23 54.310 54.310 54.279 0.031 19174
262 1 2 . 1 1 23 23 LEU CB C 23 42.223 42.223 42.756 -0.533 19174
263 1 2 . 1 1 23 23 LEU H H 23 7.917 7.917 7.926 -0.009 19174
264 1 2 . 1 1 24 24 SER N N 24 114.702 114.702 120.227 -5.525 19174
265 1 2 . 1 1 24 24 SER CA C 24 57.593 57.593 58.937 -1.344 19174
266 1 2 . 1 1 24 24 SER CB C 24 64.515 64.515 64.260 0.255 19174
267 1 2 . 1 1 24 24 SER H H 24 7.564 7.564 8.743 -1.179 19174
268 1 2 . 1 1 25 25 ALA N N 25 125.059 125.059 125.921 -0.862 19174
269 1 2 . 1 1 25 25 ALA CA C 25 55.898 55.898 56.396 -0.498 19174
270 1 2 . 1 1 25 25 ALA CB C 25 16.330 16.330 16.649 -0.319 19174
271 1 2 . 1 1 25 25 ALA H H 25 8.630 8.630 8.697 -0.067 19174
272 1 2 . 1 1 27 27 VAL N N 27 118.016 118.016 117.803 0.213 19174
273 1 2 . 1 1 27 27 VAL CA C 27 65.826 65.826 66.502 -0.676 19174
274 1 2 . 1 1 27 27 VAL CB C 27 31.686 31.686 31.769 -0.083 19174
275 1 2 . 1 1 27 27 VAL H H 27 7.294 7.294 7.285 0.009 19174
276 1 2 . 1 1 28 28 LEU N N 28 119.933 119.933 120.214 -0.281 19174
277 1 2 . 1 1 28 28 LEU CA C 28 57.990 57.990 58.196 -0.206 19174
278 1 2 . 1 1 28 28 LEU CB C 28 41.429 41.429 41.359 0.070 19174
279 1 2 . 1 1 28 28 LEU H H 28 7.939 7.939 8.198 -0.259 19174
280 1 2 . 1 1 29 29 GLN N N 29 117.644 117.644 118.408 -0.764 19174
281 1 2 . 1 1 29 29 GLN CA C 29 59.367 59.367 59.423 -0.056 19174
282 1 2 . 1 1 29 29 GLN CB C 29 28.297 28.297 28.477 -0.180 19174
283 1 2 . 1 1 29 29 GLN H H 29 8.179 8.179 8.754 -0.575 19174
284 1 2 . 1 1 30 30 GLU N N 30 118.389 118.389 120.856 -2.467 19174
285 1 2 . 1 1 30 30 GLU CA C 30 59.128 59.128 58.941 0.187 19174
286 1 2 . 1 1 30 30 GLU CB C 30 29.038 29.038 29.215 -0.176 19174
287 1 2 . 1 1 30 30 GLU H H 30 7.752 7.752 7.873 -0.121 19174
288 1 2 . 1 1 31 31 ILE N N 31 120.796 120.796 121.251 -0.455 19174
289 1 2 . 1 1 31 31 ILE CA C 31 65.509 65.509 65.460 0.049 19174
290 1 2 . 1 1 31 31 ILE CB C 31 37.775 37.775 38.106 -0.331 19174
291 1 2 . 1 1 31 31 ILE H H 31 8.131 8.131 8.223 -0.092 19174
292 1 2 . 1 1 32 32 TYR N N 32 120.550 120.550 120.966 -0.416 19174
293 1 2 . 1 1 32 32 TYR CA C 32 61.405 61.405 62.187 -0.782 19174
294 1 2 . 1 1 32 32 TYR CB C 32 38.358 38.358 38.549 -0.191 19174
295 1 2 . 1 1 32 32 TYR H H 32 8.214 8.214 8.353 -0.139 19174
296 1 2 . 1 1 33 33 LEU N N 33 117.578 117.578 119.746 -2.168 19174
297 1 2 . 1 1 33 33 LEU CA C 33 57.513 57.513 57.394 0.119 19174
298 1 2 . 1 1 33 33 LEU CB C 33 41.657 41.657 41.758 -0.101 19174
299 1 2 . 1 1 33 33 LEU H H 33 8.347 8.347 8.420 -0.073 19174
300 1 2 . 1 1 34 34 SER N N 34 114.635 114.635 114.875 -0.240 19174
301 1 2 . 1 1 34 34 SER CA C 34 61.405 61.405 61.339 0.066 19174
302 1 2 . 1 1 34 34 SER CB C 34 63.403 63.403 62.929 0.474 19174
303 1 2 . 1 1 34 34 SER H H 34 7.986 7.986 8.422 -0.436 19174
304 1 2 . 1 1 35 35 GLY N N 35 110.749 110.749 110.770 -0.021 19174
305 1 2 . 1 1 35 35 GLY CA C 35 46.897 46.897 46.848 0.049 19174
306 1 2 . 1 1 35 35 GLY H H 35 8.302 8.302 8.344 -0.042 19174
307 1 2 . 1 1 36 36 LEU N N 36 121.632 121.632 122.611 -0.979 19174
308 1 2 . 1 1 36 36 LEU CA C 36 57.619 57.619 57.254 0.365 19174
309 1 2 . 1 1 36 36 LEU CB C 36 41.799 41.799 41.585 0.214 19174
310 1 2 . 1 1 36 36 LEU H H 36 8.194 8.194 7.781 0.413 19174
311 1 2 . 1 1 37 37 ARG N N 37 118.274 118.274 118.126 0.148 19174
312 1 2 . 1 1 37 37 ARG CA C 37 59.049 59.049 59.786 -0.737 19174
313 1 2 . 1 1 37 37 ARG CB C 37 30.044 30.044 30.057 -0.013 19174
314 1 2 . 1 1 37 37 ARG H H 37 7.934 7.934 7.718 0.216 19174
315 1 2 . 1 1 38 38 SER N N 38 114.239 114.239 114.818 -0.579 19174
316 1 2 . 1 1 38 38 SER CA C 38 60.531 60.531 60.904 -0.373 19174
317 1 2 . 1 1 38 38 SER CB C 38 63.509 63.509 62.707 0.802 19174
318 1 2 . 1 1 38 38 SER H H 38 7.913 7.913 7.801 0.112 19174
319 1 2 . 1 1 39 39 TRP N N 39 123.095 123.095 125.074 -1.979 19174
320 1 2 . 1 1 39 39 TRP CA C 39 59.870 59.870 60.722 -0.852 19174
321 1 2 . 1 1 39 39 TRP CB C 39 28.721 28.721 29.688 -0.967 19174
322 1 2 . 1 1 39 39 TRP H H 39 8.108 8.108 8.458 -0.350 19174
323 1 2 . 1 1 40 40 LYS N N 40 119.629 119.629 117.563 2.066 19174
324 1 2 . 1 1 40 40 LYS CA C 40 59.525 59.525 59.588 -0.063 19174
325 1 2 . 1 1 40 40 LYS CB C 40 32.109 32.109 31.931 0.178 19174
326 1 2 . 1 1 40 40 LYS H H 40 7.938 7.938 7.873 0.065 19174
327 1 2 . 1 1 41 41 ARG N N 41 117.834 117.834 119.144 -1.310 19174
328 1 2 . 1 1 41 41 ARG CA C 41 57.857 57.857 59.053 -1.196 19174
329 1 2 . 1 1 41 41 ARG CB C 41 30.203 30.203 30.072 0.131 19174
330 1 2 . 1 1 41 41 ARG H H 41 7.863 7.863 7.584 0.279 19174
331 1 2 . 1 1 42 42 HIS N N 42 115.774 115.774 117.081 -1.307 19174
332 1 2 . 1 1 42 42 HIS CA C 42 57.487 57.487 59.503 -2.016 19174
333 1 2 . 1 1 42 42 HIS CB C 42 30.786 30.786 29.564 1.222 19174
334 1 2 . 1 1 42 42 HIS H H 42 7.919 7.919 7.688 0.231 19174
335 1 2 . 1 1 43 43 LEU N N 43 120.243 120.243 119.976 0.267 19174
336 1 2 . 1 1 43 43 LEU CA C 43 56.745 56.745 54.918 1.827 19174
337 1 2 . 1 1 43 43 LEU CB C 43 42.276 42.276 41.613 0.663 19174
338 1 2 . 1 1 43 43 LEU H H 43 8.162 8.162 8.302 -0.140 19174
339 1 2 . 1 1 44 44 SER N N 44 114.616 114.616 117.478 -2.862 19174
340 1 2 . 1 1 44 44 SER CA C 44 60.987 60.987 62.521 -1.534 19174
341 1 2 . 1 1 44 44 SER CB C 44 62.768 62.768 62.181 0.587 19174
342 1 2 . 1 1 44 44 SER H H 44 8.033 8.033 8.029 0.004 19174
343 1 2 . 1 1 45 45 ARG N N 45 120.757 120.757 121.172 -0.415 19174
344 1 2 . 1 1 45 45 ARG CA C 45 57.513 57.513 59.157 -1.645 19174
345 1 2 . 1 1 45 45 ARG CB C 45 29.462 29.462 29.800 -0.338 19174
346 1 2 . 1 1 45 45 ARG H H 45 7.763 7.763 7.805 -0.042 19174
347 1 2 . 1 1 46 46 PHE N N 46 118.237 118.237 117.511 0.726 19174
348 1 2 . 1 1 46 46 PHE CA C 46 59.155 59.155 61.179 -2.024 19174
349 1 2 . 1 1 46 46 PHE CB C 46 39.311 39.311 38.725 0.586 19174
350 1 2 . 1 1 46 46 PHE H H 46 7.673 7.673 7.920 -0.247 19174
351 1 2 . 1 1 47 47 TRP N N 47 118.484 118.484 120.754 -2.270 19174
352 1 2 . 1 1 47 47 TRP CA C 47 58.837 58.837 60.233 -1.396 19174
353 1 2 . 1 1 47 47 TRP CB C 47 29.833 29.833 30.022 -0.189 19174
354 1 2 . 1 1 47 47 TRP H H 47 7.614 7.614 8.643 -1.029 19174
355 1 2 . 1 1 48 48 ASN N N 48 114.629 114.629 116.681 -2.052 19174
356 1 2 . 1 1 48 48 ASN CA C 48 54.124 54.124 55.245 -1.121 19174
357 1 2 . 1 1 48 48 ASN CB C 48 38.887 38.887 38.944 -0.057 19174
358 1 2 . 1 1 48 48 ASN H H 48 7.811 7.811 8.176 -0.365 19174
359 1 2 . 1 1 49 49 ASP N N 49 118.029 118.029 119.366 -1.337 19174
360 1 2 . 1 1 49 49 ASP CA C 49 54.310 54.310 53.665 0.645 19174
361 1 2 . 1 1 49 49 ASP CB C 49 40.793 40.793 40.735 0.058 19174
362 1 2 . 1 1 49 49 ASP H H 49 7.775 7.775 7.578 0.197 19174
363 1 3 . 1 1 2 2 ALA N N 2 127.400 127.400 123.344 4.056 19174
364 1 3 . 1 1 2 2 ALA CA C 2 52.536 52.536 51.744 0.792 19174
365 1 3 . 1 1 2 2 ALA CB C 2 19.031 19.031 20.326 -1.295 19174
366 1 3 . 1 1 2 2 ALA H H 2 8.593 8.593 7.723 0.870 19174
367 1 3 . 1 1 3 3 GLU N N 3 120.977 120.977 119.785 1.192 19174
368 1 3 . 1 1 3 3 GLU CA C 3 56.295 56.295 56.959 -0.665 19174
369 1 3 . 1 1 3 3 GLU CB C 3 29.939 29.939 29.927 0.012 19174
370 1 3 . 1 1 3 3 GLU H H 3 8.301 8.301 8.594 -0.293 19174
371 1 3 . 1 1 4 4 ALA N N 4 125.568 125.568 123.013 2.555 19174
372 1 3 . 1 1 4 4 ALA CA C 4 52.509 52.509 52.007 0.502 19174
373 1 3 . 1 1 4 4 ALA CB C 4 19.084 19.084 19.430 -0.346 19174
374 1 3 . 1 1 4 4 ALA H H 4 8.229 8.229 7.665 0.564 19174
375 1 3 . 1 1 5 5 HIS N N 5 117.815 117.815 118.748 -0.933 19174
376 1 3 . 1 1 5 5 HIS CA C 5 55.157 55.157 57.989 -2.832 19174
377 1 3 . 1 1 5 5 HIS CB C 5 28.827 28.827 30.397 -1.570 19174
378 1 3 . 1 1 5 5 HIS H H 5 8.363 8.363 8.547 -0.184 19174
379 1 3 . 1 1 6 6 GLN N N 6 121.556 121.556 116.218 5.338 19174
380 1 3 . 1 1 6 6 GLN CA C 6 55.739 55.739 55.128 0.611 19174
381 1 3 . 1 1 6 6 GLN CB C 6 29.409 29.409 30.824 -1.415 19174
382 1 3 . 1 1 6 6 GLN H H 6 8.289 8.289 7.661 0.628 19174
383 1 3 . 1 1 7 7 ALA N N 7 126.411 126.411 124.970 1.441 19174
384 1 3 . 1 1 7 7 ALA CA C 7 52.404 52.404 54.148 -1.744 19174
385 1 3 . 1 1 7 7 ALA CB C 7 18.978 18.978 19.141 -0.163 19174
386 1 3 . 1 1 7 7 ALA H H 7 8.311 8.311 8.520 -0.209 19174
387 1 3 . 1 1 8 8 VAL N N 8 119.771 119.771 117.709 2.062 19174
388 1 3 . 1 1 8 8 VAL CA C 8 62.491 62.491 61.404 1.087 19174
389 1 3 . 1 1 8 8 VAL CB C 8 32.586 32.586 34.637 -2.051 19174
390 1 3 . 1 1 8 8 VAL H H 8 8.018 8.018 7.236 0.782 19174
391 1 3 . 1 1 9 9 GLY N N 9 112.108 112.108 112.842 -0.734 19174
392 1 3 . 1 1 9 9 GLY CA C 9 45.044 45.044 44.312 0.732 19174
393 1 3 . 1 1 9 9 GLY H H 9 8.243 8.243 8.075 0.168 19174
394 1 3 . 1 1 10 10 PHE N N 10 120.842 120.842 118.372 2.470 19174
395 1 3 . 1 1 10 10 PHE CA C 10 57.725 57.725 60.340 -2.615 19174
396 1 3 . 1 1 10 10 PHE CB C 10 39.628 39.628 39.432 0.196 19174
397 1 3 . 1 1 10 10 PHE H H 10 7.983 7.983 8.343 -0.360 19174
398 1 3 . 1 1 11 11 ARG N N 11 125.277 125.277 115.550 9.727 19174
399 1 3 . 1 1 11 11 ARG CA C 11 53.410 53.410 56.305 -2.895 19174
400 1 3 . 1 1 11 11 ARG CB C 11 30.574 30.574 29.763 0.811 19174
401 1 3 . 1 1 11 11 ARG H H 11 8.016 8.016 7.922 0.094 19174
402 1 3 . 1 1 13 13 SER N N 13 115.938 115.938 116.727 -0.789 19174
403 1 3 . 1 1 13 13 SER CA C 13 58.043 58.043 58.263 -0.220 19174
404 1 3 . 1 1 13 13 SER CB C 13 63.774 63.774 64.121 -0.347 19174
405 1 3 . 1 1 13 13 SER H H 13 8.197 8.197 8.216 -0.019 19174
406 1 3 . 1 1 14 14 LEU N N 14 124.186 124.186 121.983 2.203 19174
407 1 3 . 1 1 14 14 LEU CA C 14 55.422 55.422 56.378 -0.956 19174
408 1 3 . 1 1 14 14 LEU CB C 14 42.329 42.329 41.894 0.435 19174
409 1 3 . 1 1 14 14 LEU H H 14 8.256 8.256 8.549 -0.293 19174
410 1 3 . 1 1 15 15 THR N N 15 112.858 112.858 110.519 2.339 19174
411 1 3 . 1 1 15 15 THR CA C 15 61.379 61.379 61.211 0.168 19174
412 1 3 . 1 1 15 15 THR CB C 15 69.810 69.810 70.747 -0.937 19174
413 1 3 . 1 1 15 15 THR H H 15 7.913 7.913 7.614 0.299 19174
414 1 3 . 1 1 16 16 SER N N 16 117.578 117.578 115.506 2.072 19174
415 1 3 . 1 1 16 16 SER CA C 16 58.678 58.678 57.482 1.196 19174
416 1 3 . 1 1 16 16 SER CB C 16 63.668 63.668 65.245 -1.577 19174
417 1 3 . 1 1 16 16 SER H H 16 8.154 8.154 8.031 0.123 19174
418 1 3 . 1 1 17 17 ASP N N 17 122.030 122.030 121.404 0.626 19174
419 1 3 . 1 1 17 17 ASP CA C 17 54.680 54.680 54.875 -0.195 19174
420 1 3 . 1 1 17 17 ASP CB C 17 40.899 40.899 41.172 -0.273 19174
421 1 3 . 1 1 17 17 ASP H H 17 8.263 8.263 8.487 -0.224 19174
422 1 3 . 1 1 18 18 GLY N N 18 108.815 108.815 108.506 0.309 19174
423 1 3 . 1 1 18 18 GLY CA C 18 45.758 45.758 44.941 0.816 19174
424 1 3 . 1 1 18 18 GLY H H 18 8.239 8.239 8.154 0.085 19174
425 1 3 . 1 1 19 19 ALA N N 19 123.128 123.128 122.370 0.758 19174
426 1 3 . 1 1 19 19 ALA CA C 19 53.164 53.164 52.493 0.671 19174
427 1 3 . 1 1 19 19 ALA CB C 19 19.084 19.084 19.543 -0.459 19174
428 1 3 . 1 1 19 19 ALA H H 19 8.001 8.001 8.191 -0.190 19174
429 1 3 . 1 1 20 20 GLU N N 20 117.663 117.663 120.652 -2.989 19174
430 1 3 . 1 1 20 20 GLU CA C 20 57.275 57.275 55.908 1.367 19174
431 1 3 . 1 1 20 20 GLU CB C 20 29.250 29.250 31.506 -2.256 19174
432 1 3 . 1 1 20 20 GLU H H 20 8.231 8.231 8.488 -0.257 19174
433 1 3 . 1 1 21 21 VAL N N 21 119.044 119.044 118.630 0.414 19174
434 1 3 . 1 1 21 21 VAL CA C 21 62.755 62.755 60.962 1.793 19174
435 1 3 . 1 1 21 21 VAL CB C 21 32.268 32.268 33.904 -1.635 19174
436 1 3 . 1 1 21 21 VAL H H 21 7.767 7.767 8.247 -0.480 19174
437 1 3 . 1 1 22 22 GLU N N 22 121.765 121.765 121.034 0.731 19174
438 1 3 . 1 1 22 22 GLU CA C 22 56.613 56.613 55.899 0.714 19174
439 1 3 . 1 1 22 22 GLU CB C 22 29.833 29.833 30.149 -0.316 19174
440 1 3 . 1 1 22 22 GLU H H 22 7.969 7.969 8.648 -0.679 19174
441 1 3 . 1 1 23 23 LEU N N 23 120.996 120.996 121.548 -0.552 19174
442 1 3 . 1 1 23 23 LEU CA C 23 54.310 54.310 57.070 -2.760 19174
443 1 3 . 1 1 23 23 LEU CB C 23 42.223 42.223 42.426 -0.203 19174
444 1 3 . 1 1 23 23 LEU H H 23 7.917 7.917 7.758 0.159 19174
445 1 3 . 1 1 24 24 SER N N 24 114.702 114.702 109.034 5.668 19174
446 1 3 . 1 1 24 24 SER CA C 24 57.593 57.593 58.291 -0.698 19174
447 1 3 . 1 1 24 24 SER CB C 24 64.515 64.515 62.823 1.692 19174
448 1 3 . 1 1 24 24 SER H H 24 7.564 7.564 7.829 -0.265 19174
449 1 3 . 1 1 25 25 ALA N N 25 125.059 125.059 125.168 -0.109 19174
450 1 3 . 1 1 25 25 ALA CA C 25 55.898 55.898 56.313 -0.415 19174
451 1 3 . 1 1 25 25 ALA CB C 25 16.330 16.330 16.872 -0.542 19174
452 1 3 . 1 1 25 25 ALA H H 25 8.630 8.630 8.424 0.206 19174
453 1 3 . 1 1 27 27 VAL N N 27 118.016 118.016 115.332 2.684 19174
454 1 3 . 1 1 27 27 VAL CA C 27 65.826 65.826 64.810 1.016 19174
455 1 3 . 1 1 27 27 VAL CB C 27 31.686 31.686 30.926 0.760 19174
456 1 3 . 1 1 27 27 VAL H H 27 7.294 7.294 7.305 -0.011 19174
457 1 3 . 1 1 28 28 LEU N N 28 119.933 119.933 121.315 -1.382 19174
458 1 3 . 1 1 28 28 LEU CA C 28 57.990 57.990 58.074 -0.083 19174
459 1 3 . 1 1 28 28 LEU CB C 28 41.429 41.429 41.025 0.404 19174
460 1 3 . 1 1 28 28 LEU H H 28 7.939 7.939 8.381 -0.442 19174
461 1 3 . 1 1 29 29 GLN N N 29 117.644 117.644 119.134 -1.490 19174
462 1 3 . 1 1 29 29 GLN CA C 29 59.367 59.367 59.445 -0.078 19174
463 1 3 . 1 1 29 29 GLN CB C 29 28.297 28.297 28.581 -0.284 19174
464 1 3 . 1 1 29 29 GLN H H 29 8.179 8.179 8.712 -0.533 19174
465 1 3 . 1 1 30 30 GLU N N 30 118.389 118.389 119.784 -1.395 19174
466 1 3 . 1 1 30 30 GLU CA C 30 59.128 59.128 58.952 0.176 19174
467 1 3 . 1 1 30 30 GLU CB C 30 29.038 29.038 29.470 -0.432 19174
468 1 3 . 1 1 30 30 GLU H H 30 7.752 7.752 7.701 0.051 19174
469 1 3 . 1 1 31 31 ILE N N 31 120.796 120.796 120.699 0.097 19174
470 1 3 . 1 1 31 31 ILE CA C 31 65.509 65.509 65.295 0.214 19174
471 1 3 . 1 1 31 31 ILE CB C 31 37.775 37.775 37.902 -0.127 19174
472 1 3 . 1 1 31 31 ILE H H 31 8.131 8.131 8.100 0.031 19174
473 1 3 . 1 1 32 32 TYR N N 32 120.550 120.550 120.986 -0.436 19174
474 1 3 . 1 1 32 32 TYR CA C 32 61.405 61.405 62.017 -0.612 19174
475 1 3 . 1 1 32 32 TYR CB C 32 38.358 38.358 38.496 -0.138 19174
476 1 3 . 1 1 32 32 TYR H H 32 8.214 8.214 8.318 -0.104 19174
477 1 3 . 1 1 33 33 LEU N N 33 117.578 117.578 119.400 -1.822 19174
478 1 3 . 1 1 33 33 LEU CA C 33 57.513 57.513 57.435 0.078 19174
479 1 3 . 1 1 33 33 LEU CB C 33 41.657 41.657 41.653 0.004 19174
480 1 3 . 1 1 33 33 LEU H H 33 8.347 8.347 8.235 0.112 19174
481 1 3 . 1 1 34 34 SER N N 34 114.635 114.635 114.477 0.158 19174
482 1 3 . 1 1 34 34 SER CA C 34 61.405 61.405 62.447 -1.042 19174
483 1 3 . 1 1 34 34 SER CB C 34 63.403 63.403 62.769 0.634 19174
484 1 3 . 1 1 34 34 SER H H 34 7.986 7.986 8.419 -0.433 19174
485 1 3 . 1 1 35 35 GLY N N 35 110.749 110.749 109.823 0.926 19174
486 1 3 . 1 1 35 35 GLY CA C 35 46.897 46.897 46.562 0.335 19174
487 1 3 . 1 1 35 35 GLY H H 35 8.302 8.302 8.072 0.230 19174
488 1 3 . 1 1 36 36 LEU N N 36 121.632 121.632 121.689 -0.057 19174
489 1 3 . 1 1 36 36 LEU CA C 36 57.619 57.619 57.372 0.247 19174
490 1 3 . 1 1 36 36 LEU CB C 36 41.799 41.799 41.233 0.566 19174
491 1 3 . 1 1 36 36 LEU H H 36 8.194 8.194 7.229 0.965 19174
492 1 3 . 1 1 37 37 ARG N N 37 118.274 118.274 118.199 0.075 19174
493 1 3 . 1 1 37 37 ARG CA C 37 59.049 59.049 59.531 -0.482 19174
494 1 3 . 1 1 37 37 ARG CB C 37 30.044 30.044 30.113 -0.069 19174
495 1 3 . 1 1 37 37 ARG H H 37 7.934 7.934 7.481 0.453 19174
496 1 3 . 1 1 38 38 SER N N 38 114.239 114.239 115.486 -1.247 19174
497 1 3 . 1 1 38 38 SER CA C 38 60.531 60.531 61.148 -0.617 19174
498 1 3 . 1 1 38 38 SER CB C 38 63.509 63.509 62.858 0.650 19174
499 1 3 . 1 1 38 38 SER H H 38 7.913 7.913 7.732 0.181 19174
500 1 3 . 1 1 39 39 TRP N N 39 123.095 123.095 123.961 -0.866 19174
501 1 3 . 1 1 39 39 TRP CA C 39 59.870 59.870 58.978 0.892 19174
502 1 3 . 1 1 39 39 TRP CB C 39 28.721 28.721 28.262 0.459 19174
503 1 3 . 1 1 39 39 TRP H H 39 8.108 8.108 8.646 -0.538 19174
504 1 3 . 1 1 40 40 LYS N N 40 119.629 119.629 118.834 0.795 19174
505 1 3 . 1 1 40 40 LYS CA C 40 59.525 59.525 59.554 -0.029 19174
506 1 3 . 1 1 40 40 LYS CB C 40 32.109 32.109 31.942 0.167 19174
507 1 3 . 1 1 40 40 LYS H H 40 7.938 7.938 7.857 0.081 19174
508 1 3 . 1 1 41 41 ARG N N 41 117.834 117.834 118.732 -0.898 19174
509 1 3 . 1 1 41 41 ARG CA C 41 57.857 57.857 59.135 -1.278 19174
510 1 3 . 1 1 41 41 ARG CB C 41 30.203 30.203 29.756 0.447 19174
511 1 3 . 1 1 41 41 ARG H H 41 7.863 7.863 7.604 0.259 19174
512 1 3 . 1 1 42 42 HIS N N 42 115.774 115.774 118.619 -2.845 19174
513 1 3 . 1 1 42 42 HIS CA C 42 57.487 57.487 59.133 -1.645 19174
514 1 3 . 1 1 42 42 HIS CB C 42 30.786 30.786 30.130 0.656 19174
515 1 3 . 1 1 42 42 HIS H H 42 7.919 7.919 7.603 0.316 19174
516 1 3 . 1 1 43 43 LEU N N 43 120.243 120.243 119.823 0.420 19174
517 1 3 . 1 1 43 43 LEU CA C 43 56.745 56.745 55.313 1.432 19174
518 1 3 . 1 1 43 43 LEU CB C 43 42.276 42.276 41.327 0.949 19174
519 1 3 . 1 1 43 43 LEU H H 43 8.162 8.162 8.872 -0.710 19174
520 1 3 . 1 1 44 44 SER N N 44 114.616 114.616 116.775 -2.159 19174
521 1 3 . 1 1 44 44 SER CA C 44 60.987 60.987 63.033 -2.046 19174
522 1 3 . 1 1 44 44 SER CB C 44 62.768 62.768 62.638 0.130 19174
523 1 3 . 1 1 44 44 SER H H 44 8.033 8.033 8.351 -0.318 19174
524 1 3 . 1 1 45 45 ARG N N 45 120.757 120.757 121.616 -0.859 19174
525 1 3 . 1 1 45 45 ARG CA C 45 57.513 57.513 59.462 -1.949 19174
526 1 3 . 1 1 45 45 ARG CB C 45 29.462 29.462 30.101 -0.639 19174
527 1 3 . 1 1 45 45 ARG H H 45 7.763 7.763 8.161 -0.398 19174
528 1 3 . 1 1 46 46 PHE N N 46 118.237 118.237 118.896 -0.659 19174
529 1 3 . 1 1 46 46 PHE CA C 46 59.155 59.155 60.804 -1.649 19174
530 1 3 . 1 1 46 46 PHE CB C 46 39.311 39.311 38.873 0.438 19174
531 1 3 . 1 1 46 46 PHE H H 46 7.673 7.673 8.163 -0.490 19174
532 1 3 . 1 1 47 47 TRP N N 47 118.484 118.484 122.102 -3.618 19174
533 1 3 . 1 1 47 47 TRP CA C 47 58.837 58.837 60.900 -2.063 19174
534 1 3 . 1 1 47 47 TRP CB C 47 29.833 29.833 29.464 0.369 19174
535 1 3 . 1 1 47 47 TRP H H 47 7.614 7.614 8.798 -1.184 19174
536 1 3 . 1 1 48 48 ASN N N 48 114.629 114.629 117.237 -2.608 19174
537 1 3 . 1 1 48 48 ASN CA C 48 54.124 54.124 54.927 -0.803 19174
538 1 3 . 1 1 48 48 ASN CB C 48 38.887 38.887 38.867 0.020 19174
539 1 3 . 1 1 48 48 ASN H H 48 7.811 7.811 8.475 -0.664 19174
540 1 3 . 1 1 49 49 ASP N N 49 118.029 118.029 119.860 -1.831 19174
541 1 3 . 1 1 49 49 ASP CA C 49 54.310 54.310 53.235 1.075 19174
542 1 3 . 1 1 49 49 ASP CB C 49 40.793 40.793 40.372 0.421 19174
543 1 3 . 1 1 49 49 ASP H H 49 7.775 7.775 7.549 0.226 19174
544 1 4 . 1 1 2 2 ALA N N 2 127.400 127.400 123.574 3.826 19174
545 1 4 . 1 1 2 2 ALA CA C 2 52.536 52.536 53.012 -0.476 19174
546 1 4 . 1 1 2 2 ALA CB C 2 19.031 19.031 18.895 0.136 19174
547 1 4 . 1 1 2 2 ALA H H 2 8.593 8.593 7.869 0.724 19174
548 1 4 . 1 1 3 3 GLU N N 3 120.977 120.977 119.061 1.916 19174
549 1 4 . 1 1 3 3 GLU CA C 3 56.295 56.295 56.159 0.136 19174
550 1 4 . 1 1 3 3 GLU CB C 3 29.939 29.939 30.277 -0.338 19174
551 1 4 . 1 1 3 3 GLU H H 3 8.301 8.301 8.123 0.178 19174
552 1 4 . 1 1 4 4 ALA N N 4 125.568 125.568 127.637 -2.069 19174
553 1 4 . 1 1 4 4 ALA CA C 4 52.509 52.509 53.634 -1.125 19174
554 1 4 . 1 1 4 4 ALA CB C 4 19.084 19.084 19.065 0.019 19174
555 1 4 . 1 1 4 4 ALA H H 4 8.229 8.229 8.327 -0.098 19174
556 1 4 . 1 1 5 5 HIS N N 5 117.815 117.815 117.616 0.199 19174
557 1 4 . 1 1 5 5 HIS CA C 5 55.157 55.157 55.211 -0.054 19174
558 1 4 . 1 1 5 5 HIS CB C 5 28.827 28.827 30.980 -2.153 19174
559 1 4 . 1 1 5 5 HIS H H 5 8.363 8.363 8.156 0.207 19174
560 1 4 . 1 1 6 6 GLN N N 6 121.556 121.556 122.634 -1.078 19174
561 1 4 . 1 1 6 6 GLN CA C 6 55.739 55.739 55.303 0.436 19174
562 1 4 . 1 1 6 6 GLN CB C 6 29.409 29.409 29.510 -0.101 19174
563 1 4 . 1 1 6 6 GLN H H 6 8.289 8.289 8.668 -0.379 19174
564 1 4 . 1 1 7 7 ALA N N 7 126.411 126.411 129.037 -2.626 19174
565 1 4 . 1 1 7 7 ALA CA C 7 52.404 52.404 53.681 -1.276 19174
566 1 4 . 1 1 7 7 ALA CB C 7 18.978 18.978 19.149 -0.171 19174
567 1 4 . 1 1 7 7 ALA H H 7 8.311 8.311 8.679 -0.368 19174
568 1 4 . 1 1 8 8 VAL N N 8 119.771 119.771 118.528 1.243 19174
569 1 4 . 1 1 8 8 VAL CA C 8 62.491 62.491 62.205 0.287 19174
570 1 4 . 1 1 8 8 VAL CB C 8 32.586 32.586 33.858 -1.272 19174
571 1 4 . 1 1 8 8 VAL H H 8 8.018 8.018 7.402 0.616 19174
572 1 4 . 1 1 9 9 GLY N N 9 112.108 112.108 113.196 -1.088 19174
573 1 4 . 1 1 9 9 GLY CA C 9 45.044 45.044 44.694 0.350 19174
574 1 4 . 1 1 9 9 GLY H H 9 8.243 8.243 8.157 0.086 19174
575 1 4 . 1 1 10 10 PHE N N 10 120.842 120.842 118.046 2.796 19174
576 1 4 . 1 1 10 10 PHE CA C 10 57.725 57.725 57.503 0.222 19174
577 1 4 . 1 1 10 10 PHE CB C 10 39.628 39.628 41.701 -2.073 19174
578 1 4 . 1 1 10 10 PHE H H 10 7.983 7.983 8.037 -0.054 19174
579 1 4 . 1 1 11 11 ARG N N 11 125.277 125.277 123.296 1.981 19174
580 1 4 . 1 1 11 11 ARG CA C 11 53.410 53.410 55.671 -2.261 19174
581 1 4 . 1 1 11 11 ARG CB C 11 30.574 30.574 29.257 1.317 19174
582 1 4 . 1 1 11 11 ARG H H 11 8.016 8.016 8.668 -0.652 19174
583 1 4 . 1 1 13 13 SER N N 13 115.938 115.938 117.833 -1.895 19174
584 1 4 . 1 1 13 13 SER CA C 13 58.043 58.043 58.239 -0.196 19174
585 1 4 . 1 1 13 13 SER CB C 13 63.774 63.774 64.281 -0.507 19174
586 1 4 . 1 1 13 13 SER H H 13 8.197 8.197 8.271 -0.074 19174
587 1 4 . 1 1 14 14 LEU N N 14 124.186 124.186 123.035 1.151 19174
588 1 4 . 1 1 14 14 LEU CA C 14 55.422 55.422 54.299 1.123 19174
589 1 4 . 1 1 14 14 LEU CB C 14 42.329 42.329 43.138 -0.809 19174
590 1 4 . 1 1 14 14 LEU H H 14 8.256 8.256 8.534 -0.278 19174
591 1 4 . 1 1 15 15 THR N N 15 112.858 112.858 114.771 -1.913 19174
592 1 4 . 1 1 15 15 THR CA C 15 61.379 61.379 63.692 -2.313 19174
593 1 4 . 1 1 15 15 THR CB C 15 69.810 69.810 69.121 0.689 19174
594 1 4 . 1 1 15 15 THR H H 15 7.913 7.913 8.560 -0.647 19174
595 1 4 . 1 1 16 16 SER N N 16 117.578 117.578 115.966 1.612 19174
596 1 4 . 1 1 16 16 SER CA C 16 58.678 58.678 59.537 -0.859 19174
597 1 4 . 1 1 16 16 SER CB C 16 63.668 63.668 63.318 0.350 19174
598 1 4 . 1 1 16 16 SER H H 16 8.154 8.154 7.949 0.205 19174
599 1 4 . 1 1 17 17 ASP N N 17 122.030 122.030 121.067 0.963 19174
600 1 4 . 1 1 17 17 ASP CA C 17 54.680 54.680 53.548 1.132 19174
601 1 4 . 1 1 17 17 ASP CB C 17 40.899 40.899 40.595 0.304 19174
602 1 4 . 1 1 17 17 ASP H H 17 8.263 8.263 7.971 0.292 19174
603 1 4 . 1 1 18 18 GLY N N 18 108.815 108.815 110.735 -1.920 19174
604 1 4 . 1 1 18 18 GLY CA C 18 45.758 45.758 44.882 0.876 19174
605 1 4 . 1 1 18 18 GLY H H 18 8.239 8.239 7.759 0.480 19174
606 1 4 . 1 1 19 19 ALA N N 19 123.128 123.128 121.863 1.265 19174
607 1 4 . 1 1 19 19 ALA CA C 19 53.164 53.164 51.901 1.263 19174
608 1 4 . 1 1 19 19 ALA CB C 19 19.084 19.084 19.727 -0.643 19174
609 1 4 . 1 1 19 19 ALA H H 19 8.001 8.001 8.091 -0.090 19174
610 1 4 . 1 1 20 20 GLU N N 20 117.663 117.663 121.412 -3.749 19174
611 1 4 . 1 1 20 20 GLU CA C 20 57.275 57.275 57.891 -0.616 19174
612 1 4 . 1 1 20 20 GLU CB C 20 29.250 29.250 29.931 -0.681 19174
613 1 4 . 1 1 20 20 GLU H H 20 8.231 8.231 8.592 -0.361 19174
614 1 4 . 1 1 21 21 VAL N N 21 119.044 119.044 117.191 1.853 19174
615 1 4 . 1 1 21 21 VAL CA C 21 62.755 62.755 61.525 1.230 19174
616 1 4 . 1 1 21 21 VAL CB C 21 32.268 32.268 34.308 -2.040 19174
617 1 4 . 1 1 21 21 VAL H H 21 7.767 7.767 7.533 0.234 19174
618 1 4 . 1 1 22 22 GLU N N 22 121.765 121.765 124.857 -3.092 19174
619 1 4 . 1 1 22 22 GLU CA C 22 56.613 56.613 57.915 -1.302 19174
620 1 4 . 1 1 22 22 GLU CB C 22 29.833 29.833 29.948 -0.115 19174
621 1 4 . 1 1 22 22 GLU H H 22 7.969 7.969 8.586 -0.617 19174
622 1 4 . 1 1 23 23 LEU N N 23 120.996 120.996 121.588 -0.592 19174
623 1 4 . 1 1 23 23 LEU CA C 23 54.310 54.310 54.802 -0.492 19174
624 1 4 . 1 1 23 23 LEU CB C 23 42.223 42.223 42.908 -0.685 19174
625 1 4 . 1 1 23 23 LEU H H 23 7.917 7.917 7.803 0.114 19174
626 1 4 . 1 1 24 24 SER N N 24 114.702 114.702 114.974 -0.272 19174
627 1 4 . 1 1 24 24 SER CA C 24 57.593 57.593 58.616 -1.023 19174
628 1 4 . 1 1 24 24 SER CB C 24 64.515 64.515 61.735 2.780 19174
629 1 4 . 1 1 24 24 SER H H 24 7.564 7.564 8.796 -1.232 19174
630 1 4 . 1 1 25 25 ALA N N 25 125.059 125.059 126.291 -1.232 19174
631 1 4 . 1 1 25 25 ALA CA C 25 55.898 55.898 56.186 -0.288 19174
632 1 4 . 1 1 25 25 ALA CB C 25 16.330 16.330 16.895 -0.565 19174
633 1 4 . 1 1 25 25 ALA H H 25 8.630 8.630 8.914 -0.284 19174
634 1 4 . 1 1 27 27 VAL N N 27 118.016 118.016 117.289 0.727 19174
635 1 4 . 1 1 27 27 VAL CA C 27 65.826 65.826 66.314 -0.488 19174
636 1 4 . 1 1 27 27 VAL CB C 27 31.686 31.686 31.388 0.298 19174
637 1 4 . 1 1 27 27 VAL H H 27 7.294 7.294 7.246 0.048 19174
638 1 4 . 1 1 28 28 LEU N N 28 119.933 119.933 120.390 -0.457 19174
639 1 4 . 1 1 28 28 LEU CA C 28 57.990 57.990 58.360 -0.370 19174
640 1 4 . 1 1 28 28 LEU CB C 28 41.429 41.429 41.333 0.096 19174
641 1 4 . 1 1 28 28 LEU H H 28 7.939 7.939 8.572 -0.633 19174
642 1 4 . 1 1 29 29 GLN N N 29 117.644 117.644 119.396 -1.752 19174
643 1 4 . 1 1 29 29 GLN CA C 29 59.367 59.367 59.555 -0.188 19174
644 1 4 . 1 1 29 29 GLN CB C 29 28.297 28.297 28.578 -0.281 19174
645 1 4 . 1 1 29 29 GLN H H 29 8.179 8.179 8.762 -0.583 19174
646 1 4 . 1 1 30 30 GLU N N 30 118.389 118.389 120.368 -1.979 19174
647 1 4 . 1 1 30 30 GLU CA C 30 59.128 59.128 59.380 -0.252 19174
648 1 4 . 1 1 30 30 GLU CB C 30 29.038 29.038 29.616 -0.578 19174
649 1 4 . 1 1 30 30 GLU H H 30 7.752 7.752 7.821 -0.069 19174
650 1 4 . 1 1 31 31 ILE N N 31 120.796 120.796 120.857 -0.061 19174
651 1 4 . 1 1 31 31 ILE CA C 31 65.509 65.509 65.453 0.056 19174
652 1 4 . 1 1 31 31 ILE CB C 31 37.775 37.775 37.904 -0.129 19174
653 1 4 . 1 1 31 31 ILE H H 31 8.131 8.131 8.358 -0.227 19174
654 1 4 . 1 1 32 32 TYR N N 32 120.550 120.550 120.988 -0.438 19174
655 1 4 . 1 1 32 32 TYR CA C 32 61.405 61.405 62.217 -0.812 19174
656 1 4 . 1 1 32 32 TYR CB C 32 38.358 38.358 38.535 -0.177 19174
657 1 4 . 1 1 32 32 TYR H H 32 8.214 8.214 8.308 -0.094 19174
658 1 4 . 1 1 33 33 LEU N N 33 117.578 117.578 119.676 -2.098 19174
659 1 4 . 1 1 33 33 LEU CA C 33 57.513 57.513 57.579 -0.066 19174
660 1 4 . 1 1 33 33 LEU CB C 33 41.657 41.657 41.559 0.098 19174
661 1 4 . 1 1 33 33 LEU H H 33 8.347 8.347 8.403 -0.056 19174
662 1 4 . 1 1 34 34 SER N N 34 114.635 114.635 114.294 0.341 19174
663 1 4 . 1 1 34 34 SER CA C 34 61.405 61.405 62.040 -0.635 19174
664 1 4 . 1 1 34 34 SER CB C 34 63.403 63.403 62.825 0.578 19174
665 1 4 . 1 1 34 34 SER H H 34 7.986 7.986 8.451 -0.465 19174
666 1 4 . 1 1 35 35 GLY N N 35 110.749 110.749 109.632 1.117 19174
667 1 4 . 1 1 35 35 GLY CA C 35 46.897 46.897 46.949 -0.052 19174
668 1 4 . 1 1 35 35 GLY H H 35 8.302 8.302 8.585 -0.283 19174
669 1 4 . 1 1 36 36 LEU N N 36 121.632 121.632 122.354 -0.722 19174
670 1 4 . 1 1 36 36 LEU CA C 36 57.619 57.619 57.140 0.479 19174
671 1 4 . 1 1 36 36 LEU CB C 36 41.799 41.799 41.550 0.249 19174
672 1 4 . 1 1 36 36 LEU H H 36 8.194 8.194 7.573 0.621 19174
673 1 4 . 1 1 37 37 ARG N N 37 118.274 118.274 117.904 0.370 19174
674 1 4 . 1 1 37 37 ARG CA C 37 59.049 59.049 59.722 -0.673 19174
675 1 4 . 1 1 37 37 ARG CB C 37 30.044 30.044 30.036 0.008 19174
676 1 4 . 1 1 37 37 ARG H H 37 7.934 7.934 7.554 0.380 19174
677 1 4 . 1 1 38 38 SER N N 38 114.239 114.239 114.870 -0.631 19174
678 1 4 . 1 1 38 38 SER CA C 38 60.531 60.531 60.838 -0.307 19174
679 1 4 . 1 1 38 38 SER CB C 38 63.509 63.509 63.108 0.401 19174
680 1 4 . 1 1 38 38 SER H H 38 7.913 7.913 7.750 0.163 19174
681 1 4 . 1 1 39 39 TRP N N 39 123.095 123.095 124.162 -1.067 19174
682 1 4 . 1 1 39 39 TRP CA C 39 59.870 59.870 60.207 -0.337 19174
683 1 4 . 1 1 39 39 TRP CB C 39 28.721 28.721 29.629 -0.908 19174
684 1 4 . 1 1 39 39 TRP H H 39 8.108 8.108 8.595 -0.487 19174
685 1 4 . 1 1 40 40 LYS N N 40 119.629 119.629 119.118 0.511 19174
686 1 4 . 1 1 40 40 LYS CA C 40 59.525 59.525 59.817 -0.292 19174
687 1 4 . 1 1 40 40 LYS CB C 40 32.109 32.109 32.116 -0.007 19174
688 1 4 . 1 1 40 40 LYS H H 40 7.938 7.938 7.807 0.131 19174
689 1 4 . 1 1 41 41 ARG N N 41 117.834 117.834 117.758 0.076 19174
690 1 4 . 1 1 41 41 ARG CA C 41 57.857 57.857 59.062 -1.205 19174
691 1 4 . 1 1 41 41 ARG CB C 41 30.203 30.203 29.919 0.284 19174
692 1 4 . 1 1 41 41 ARG H H 41 7.863 7.863 7.610 0.253 19174
693 1 4 . 1 1 42 42 HIS N N 42 115.774 115.774 118.439 -2.665 19174
694 1 4 . 1 1 42 42 HIS CA C 42 57.487 57.487 58.080 -0.593 19174
695 1 4 . 1 1 42 42 HIS CB C 42 30.786 30.786 29.840 0.945 19174
696 1 4 . 1 1 42 42 HIS H H 42 7.919 7.919 7.463 0.456 19174
697 1 4 . 1 1 43 43 LEU N N 43 120.243 120.243 118.697 1.546 19174
698 1 4 . 1 1 43 43 LEU CA C 43 56.745 56.745 55.228 1.517 19174
699 1 4 . 1 1 43 43 LEU CB C 43 42.276 42.276 41.616 0.660 19174
700 1 4 . 1 1 43 43 LEU H H 43 8.162 8.162 8.672 -0.510 19174
701 1 4 . 1 1 44 44 SER N N 44 114.616 114.616 116.316 -1.700 19174
702 1 4 . 1 1 44 44 SER CA C 44 60.987 60.987 61.979 -0.992 19174
703 1 4 . 1 1 44 44 SER CB C 44 62.768 62.768 62.874 -0.106 19174
704 1 4 . 1 1 44 44 SER H H 44 8.033 8.033 7.972 0.061 19174
705 1 4 . 1 1 45 45 ARG N N 45 120.757 120.757 122.469 -1.712 19174
706 1 4 . 1 1 45 45 ARG CA C 45 57.513 57.513 59.000 -1.487 19174
707 1 4 . 1 1 45 45 ARG CB C 45 29.462 29.462 29.836 -0.374 19174
708 1 4 . 1 1 45 45 ARG H H 45 7.763 7.763 8.010 -0.247 19174
709 1 4 . 1 1 46 46 PHE N N 46 118.237 118.237 117.485 0.752 19174
710 1 4 . 1 1 46 46 PHE CA C 46 59.155 59.155 61.015 -1.860 19174
711 1 4 . 1 1 46 46 PHE CB C 46 39.311 39.311 38.639 0.672 19174
712 1 4 . 1 1 46 46 PHE H H 46 7.673 7.673 7.979 -0.306 19174
713 1 4 . 1 1 47 47 TRP N N 47 118.484 118.484 120.849 -2.365 19174
714 1 4 . 1 1 47 47 TRP CA C 47 58.837 58.837 60.414 -1.577 19174
715 1 4 . 1 1 47 47 TRP CB C 47 29.833 29.833 29.485 0.348 19174
716 1 4 . 1 1 47 47 TRP H H 47 7.614 7.614 8.856 -1.242 19174
717 1 4 . 1 1 48 48 ASN N N 48 114.629 114.629 116.786 -2.157 19174
718 1 4 . 1 1 48 48 ASN CA C 48 54.124 54.124 55.255 -1.131 19174
719 1 4 . 1 1 48 48 ASN CB C 48 38.887 38.887 38.326 0.561 19174
720 1 4 . 1 1 48 48 ASN H H 48 7.811 7.811 7.977 -0.166 19174
721 1 4 . 1 1 49 49 ASP N N 49 118.029 118.029 116.967 1.062 19174
722 1 4 . 1 1 49 49 ASP CA C 49 54.310 54.310 55.197 -0.887 19174
723 1 4 . 1 1 49 49 ASP CB C 49 40.793 40.793 41.105 -0.312 19174
724 1 4 . 1 1 49 49 ASP H H 49 7.775 7.775 7.428 0.347 19174
725 1 5 . 1 1 2 2 ALA N N 2 127.400 127.400 123.512 3.888 19174
726 1 5 . 1 1 2 2 ALA CA C 2 52.536 52.536 51.562 0.974 19174
727 1 5 . 1 1 2 2 ALA CB C 2 19.031 19.031 21.136 -2.105 19174
728 1 5 . 1 1 2 2 ALA H H 2 8.593 8.593 8.017 0.576 19174
729 1 5 . 1 1 3 3 GLU N N 3 120.977 120.977 120.680 0.297 19174
730 1 5 . 1 1 3 3 GLU CA C 3 56.295 56.295 57.307 -1.012 19174
731 1 5 . 1 1 3 3 GLU CB C 3 29.939 29.939 30.188 -0.249 19174
732 1 5 . 1 1 3 3 GLU H H 3 8.301 8.301 8.647 -0.346 19174
733 1 5 . 1 1 4 4 ALA N N 4 125.568 125.568 126.117 -0.549 19174
734 1 5 . 1 1 4 4 ALA CA C 4 52.509 52.509 54.183 -1.674 19174
735 1 5 . 1 1 4 4 ALA CB C 4 19.084 19.084 17.363 1.721 19174
736 1 5 . 1 1 4 4 ALA H H 4 8.229 8.229 8.692 -0.463 19174
737 1 5 . 1 1 5 5 HIS N N 5 117.815 117.815 117.896 -0.081 19174
738 1 5 . 1 1 5 5 HIS CA C 5 55.157 55.157 57.577 -2.420 19174
739 1 5 . 1 1 5 5 HIS CB C 5 28.827 28.827 29.868 -1.041 19174
740 1 5 . 1 1 5 5 HIS H H 5 8.363 8.363 7.955 0.408 19174
741 1 5 . 1 1 6 6 GLN N N 6 121.556 121.556 118.696 2.860 19174
742 1 5 . 1 1 6 6 GLN CA C 6 55.739 55.739 57.610 -1.871 19174
743 1 5 . 1 1 6 6 GLN CB C 6 29.409 29.409 29.575 -0.166 19174
744 1 5 . 1 1 6 6 GLN H H 6 8.289 8.289 8.096 0.193 19174
745 1 5 . 1 1 7 7 ALA N N 7 126.411 126.411 120.104 6.307 19174
746 1 5 . 1 1 7 7 ALA CA C 7 52.404 52.404 51.303 1.101 19174
747 1 5 . 1 1 7 7 ALA CB C 7 18.978 18.978 21.439 -2.462 19174
748 1 5 . 1 1 7 7 ALA H H 7 8.311 8.311 7.469 0.842 19174
749 1 5 . 1 1 8 8 VAL N N 8 119.771 119.771 116.999 2.772 19174
750 1 5 . 1 1 8 8 VAL CA C 8 62.491 62.491 60.754 1.737 19174
751 1 5 . 1 1 8 8 VAL CB C 8 32.586 32.586 32.779 -0.193 19174
752 1 5 . 1 1 8 8 VAL H H 8 8.018 8.018 8.370 -0.352 19174
753 1 5 . 1 1 9 9 GLY N N 9 112.108 112.108 114.571 -2.463 19174
754 1 5 . 1 1 9 9 GLY CA C 9 45.044 45.044 46.188 -1.144 19174
755 1 5 . 1 1 9 9 GLY H H 9 8.243 8.243 8.937 -0.694 19174
756 1 5 . 1 1 10 10 PHE N N 10 120.842 120.842 118.472 2.370 19174
757 1 5 . 1 1 10 10 PHE CA C 10 57.725 57.725 57.982 -0.257 19174
758 1 5 . 1 1 10 10 PHE CB C 10 39.628 39.628 39.348 0.280 19174
759 1 5 . 1 1 10 10 PHE H H 10 7.983 7.983 7.855 0.128 19174
760 1 5 . 1 1 11 11 ARG N N 11 125.277 125.277 121.338 3.939 19174
761 1 5 . 1 1 11 11 ARG CA C 11 53.410 53.410 53.523 -0.113 19174
762 1 5 . 1 1 11 11 ARG CB C 11 30.574 30.574 30.342 0.232 19174
763 1 5 . 1 1 11 11 ARG H H 11 8.016 8.016 7.781 0.235 19174
764 1 5 . 1 1 13 13 SER N N 13 115.938 115.938 114.755 1.183 19174
765 1 5 . 1 1 13 13 SER CA C 13 58.043 58.043 59.908 -1.865 19174
766 1 5 . 1 1 13 13 SER CB C 13 63.774 63.774 63.394 0.380 19174
767 1 5 . 1 1 13 13 SER H H 13 8.197 8.197 8.330 -0.133 19174
768 1 5 . 1 1 14 14 LEU N N 14 124.186 124.186 121.643 2.543 19174
769 1 5 . 1 1 14 14 LEU CA C 14 55.422 55.422 54.261 1.161 19174
770 1 5 . 1 1 14 14 LEU CB C 14 42.329 42.329 42.767 -0.438 19174
771 1 5 . 1 1 14 14 LEU H H 14 8.256 8.256 7.597 0.659 19174
772 1 5 . 1 1 15 15 THR N N 15 112.858 112.858 116.687 -3.829 19174
773 1 5 . 1 1 15 15 THR CA C 15 61.379 61.379 64.181 -2.802 19174
774 1 5 . 1 1 15 15 THR CB C 15 69.810 69.810 69.395 0.415 19174
775 1 5 . 1 1 15 15 THR H H 15 7.913 7.913 8.498 -0.585 19174
776 1 5 . 1 1 16 16 SER N N 16 117.578 117.578 113.910 3.668 19174
777 1 5 . 1 1 16 16 SER CA C 16 58.678 58.678 56.876 1.802 19174
778 1 5 . 1 1 16 16 SER CB C 16 63.668 63.668 65.287 -1.619 19174
779 1 5 . 1 1 16 16 SER H H 16 8.154 8.154 7.425 0.729 19174
780 1 5 . 1 1 17 17 ASP N N 17 122.030 122.030 119.361 2.669 19174
781 1 5 . 1 1 17 17 ASP CA C 17 54.680 54.680 54.784 -0.104 19174
782 1 5 . 1 1 17 17 ASP CB C 17 40.899 40.899 41.099 -0.201 19174
783 1 5 . 1 1 17 17 ASP H H 17 8.263 8.263 8.601 -0.338 19174
784 1 5 . 1 1 18 18 GLY N N 18 108.815 108.815 105.916 2.899 19174
785 1 5 . 1 1 18 18 GLY CA C 18 45.758 45.758 44.441 1.317 19174
786 1 5 . 1 1 18 18 GLY H H 18 8.239 8.239 7.529 0.710 19174
787 1 5 . 1 1 19 19 ALA N N 19 123.128 123.128 122.224 0.904 19174
788 1 5 . 1 1 19 19 ALA CA C 19 53.164 53.164 52.016 1.149 19174
789 1 5 . 1 1 19 19 ALA CB C 19 19.084 19.084 19.901 -0.817 19174
790 1 5 . 1 1 19 19 ALA H H 19 8.001 8.001 8.618 -0.617 19174
791 1 5 . 1 1 20 20 GLU N N 20 117.663 117.663 122.096 -4.433 19174
792 1 5 . 1 1 20 20 GLU CA C 20 57.275 57.275 59.415 -2.140 19174
793 1 5 . 1 1 20 20 GLU CB C 20 29.250 29.250 29.441 -0.191 19174
794 1 5 . 1 1 20 20 GLU H H 20 8.231 8.231 8.852 -0.621 19174
795 1 5 . 1 1 21 21 VAL N N 21 119.044 119.044 117.474 1.570 19174
796 1 5 . 1 1 21 21 VAL CA C 21 62.755 62.755 65.404 -2.649 19174
797 1 5 . 1 1 21 21 VAL CB C 21 32.268 32.268 31.708 0.560 19174
798 1 5 . 1 1 21 21 VAL H H 21 7.767 7.767 7.814 -0.047 19174
799 1 5 . 1 1 22 22 GLU N N 22 121.765 121.765 117.853 3.912 19174
800 1 5 . 1 1 22 22 GLU CA C 22 56.613 56.613 58.258 -1.645 19174
801 1 5 . 1 1 22 22 GLU CB C 22 29.833 29.833 29.933 -0.100 19174
802 1 5 . 1 1 22 22 GLU H H 22 7.969 7.969 8.103 -0.134 19174
803 1 5 . 1 1 23 23 LEU N N 23 120.996 120.996 120.085 0.911 19174
804 1 5 . 1 1 23 23 LEU CA C 23 54.310 54.310 53.695 0.615 19174
805 1 5 . 1 1 23 23 LEU CB C 23 42.223 42.223 43.023 -0.800 19174
806 1 5 . 1 1 23 23 LEU H H 23 7.917 7.917 7.833 0.084 19174
807 1 5 . 1 1 24 24 SER N N 24 114.702 114.702 120.528 -5.826 19174
808 1 5 . 1 1 24 24 SER CA C 24 57.593 57.593 59.559 -1.966 19174
809 1 5 . 1 1 24 24 SER CB C 24 64.515 64.515 62.211 2.304 19174
810 1 5 . 1 1 24 24 SER H H 24 7.564 7.564 9.146 -1.582 19174
811 1 5 . 1 1 25 25 ALA N N 25 125.059 125.059 124.770 0.289 19174
812 1 5 . 1 1 25 25 ALA CA C 25 55.898 55.898 56.616 -0.718 19174
813 1 5 . 1 1 25 25 ALA CB C 25 16.330 16.330 16.541 -0.211 19174
814 1 5 . 1 1 25 25 ALA H H 25 8.630 8.630 8.537 0.093 19174
815 1 5 . 1 1 27 27 VAL N N 27 118.016 118.016 117.600 0.416 19174
816 1 5 . 1 1 27 27 VAL CA C 27 65.826 65.826 65.633 0.193 19174
817 1 5 . 1 1 27 27 VAL CB C 27 31.686 31.686 31.288 0.398 19174
818 1 5 . 1 1 27 27 VAL H H 27 7.294 7.294 7.472 -0.178 19174
819 1 5 . 1 1 28 28 LEU N N 28 119.933 119.933 120.129 -0.196 19174
820 1 5 . 1 1 28 28 LEU CA C 28 57.990 57.990 58.304 -0.314 19174
821 1 5 . 1 1 28 28 LEU CB C 28 41.429 41.429 41.290 0.139 19174
822 1 5 . 1 1 28 28 LEU H H 28 7.939 7.939 7.883 0.056 19174
823 1 5 . 1 1 29 29 GLN N N 29 117.644 117.644 118.494 -0.850 19174
824 1 5 . 1 1 29 29 GLN CA C 29 59.367 59.367 59.546 -0.179 19174
825 1 5 . 1 1 29 29 GLN CB C 29 28.297 28.297 28.452 -0.155 19174
826 1 5 . 1 1 29 29 GLN H H 29 8.179 8.179 8.812 -0.633 19174
827 1 5 . 1 1 30 30 GLU N N 30 118.389 118.389 120.472 -2.083 19174
828 1 5 . 1 1 30 30 GLU CA C 30 59.128 59.128 59.322 -0.194 19174
829 1 5 . 1 1 30 30 GLU CB C 30 29.038 29.038 29.519 -0.481 19174
830 1 5 . 1 1 30 30 GLU H H 30 7.752 7.752 7.848 -0.096 19174
831 1 5 . 1 1 31 31 ILE N N 31 120.796 120.796 121.332 -0.536 19174
832 1 5 . 1 1 31 31 ILE CA C 31 65.509 65.509 65.371 0.138 19174
833 1 5 . 1 1 31 31 ILE CB C 31 37.775 37.775 38.130 -0.355 19174
834 1 5 . 1 1 31 31 ILE H H 31 8.131 8.131 8.015 0.116 19174
835 1 5 . 1 1 32 32 TYR N N 32 120.550 120.550 120.671 -0.121 19174
836 1 5 . 1 1 32 32 TYR CA C 32 61.405 61.405 62.256 -0.851 19174
837 1 5 . 1 1 32 32 TYR CB C 32 38.358 38.358 38.425 -0.067 19174
838 1 5 . 1 1 32 32 TYR H H 32 8.214 8.214 8.230 -0.016 19174
839 1 5 . 1 1 33 33 LEU N N 33 117.578 117.578 118.093 -0.515 19174
840 1 5 . 1 1 33 33 LEU CA C 33 57.513 57.513 57.653 -0.140 19174
841 1 5 . 1 1 33 33 LEU CB C 33 41.657 41.657 41.603 0.054 19174
842 1 5 . 1 1 33 33 LEU H H 33 8.347 8.347 8.391 -0.044 19174
843 1 5 . 1 1 34 34 SER N N 34 114.635 114.635 115.146 -0.511 19174
844 1 5 . 1 1 34 34 SER CA C 34 61.405 61.405 61.271 0.134 19174
845 1 5 . 1 1 34 34 SER CB C 34 63.403 63.403 62.244 1.159 19174
846 1 5 . 1 1 34 34 SER H H 34 7.986 7.986 8.407 -0.421 19174
847 1 5 . 1 1 35 35 GLY N N 35 110.749 110.749 110.234 0.515 19174
848 1 5 . 1 1 35 35 GLY CA C 35 46.897 46.897 46.312 0.585 19174
849 1 5 . 1 1 35 35 GLY H H 35 8.302 8.302 8.113 0.189 19174
850 1 5 . 1 1 36 36 LEU N N 36 121.632 121.632 122.004 -0.372 19174
851 1 5 . 1 1 36 36 LEU CA C 36 57.619 57.619 56.982 0.637 19174
852 1 5 . 1 1 36 36 LEU CB C 36 41.799 41.799 41.367 0.431 19174
853 1 5 . 1 1 36 36 LEU H H 36 8.194 8.194 7.439 0.755 19174
854 1 5 . 1 1 37 37 ARG N N 37 118.274 118.274 117.717 0.557 19174
855 1 5 . 1 1 37 37 ARG CA C 37 59.049 59.049 59.558 -0.509 19174
856 1 5 . 1 1 37 37 ARG CB C 37 30.044 30.044 29.827 0.217 19174
857 1 5 . 1 1 37 37 ARG H H 37 7.934 7.934 7.496 0.438 19174
858 1 5 . 1 1 38 38 SER N N 38 114.239 114.239 115.006 -0.767 19174
859 1 5 . 1 1 38 38 SER CA C 38 60.531 60.531 61.368 -0.837 19174
860 1 5 . 1 1 38 38 SER CB C 38 63.509 63.509 63.376 0.133 19174
861 1 5 . 1 1 38 38 SER H H 38 7.913 7.913 7.679 0.234 19174
862 1 5 . 1 1 39 39 TRP N N 39 123.095 123.095 122.568 0.527 19174
863 1 5 . 1 1 39 39 TRP CA C 39 59.870 59.870 58.519 1.351 19174
864 1 5 . 1 1 39 39 TRP CB C 39 28.721 28.721 28.356 0.365 19174
865 1 5 . 1 1 39 39 TRP H H 39 8.108 8.108 8.892 -0.784 19174
866 1 5 . 1 1 40 40 LYS N N 40 119.629 119.629 119.688 -0.059 19174
867 1 5 . 1 1 40 40 LYS CA C 40 59.525 59.525 60.388 -0.862 19174
868 1 5 . 1 1 40 40 LYS CB C 40 32.109 32.109 32.183 -0.074 19174
869 1 5 . 1 1 40 40 LYS H H 40 7.938 7.938 7.849 0.089 19174
870 1 5 . 1 1 41 41 ARG N N 41 117.834 117.834 116.877 0.957 19174
871 1 5 . 1 1 41 41 ARG CA C 41 57.857 57.857 59.284 -1.427 19174
872 1 5 . 1 1 41 41 ARG CB C 41 30.203 30.203 29.876 0.327 19174
873 1 5 . 1 1 41 41 ARG H H 41 7.863 7.863 7.919 -0.056 19174
874 1 5 . 1 1 42 42 HIS N N 42 115.774 115.774 116.959 -1.185 19174
875 1 5 . 1 1 42 42 HIS CA C 42 57.487 57.487 58.370 -0.883 19174
876 1 5 . 1 1 42 42 HIS CB C 42 30.786 30.786 30.536 0.250 19174
877 1 5 . 1 1 42 42 HIS H H 42 7.919 7.919 7.722 0.197 19174
878 1 5 . 1 1 43 43 LEU N N 43 120.243 120.243 121.111 -0.868 19174
879 1 5 . 1 1 43 43 LEU CA C 43 56.745 56.745 56.050 0.695 19174
880 1 5 . 1 1 43 43 LEU CB C 43 42.276 42.276 41.986 0.290 19174
881 1 5 . 1 1 43 43 LEU H H 43 8.162 8.162 8.771 -0.609 19174
882 1 5 . 1 1 44 44 SER N N 44 114.616 114.616 116.183 -1.567 19174
883 1 5 . 1 1 44 44 SER CA C 44 60.987 60.987 62.200 -1.213 19174
884 1 5 . 1 1 44 44 SER CB C 44 62.768 62.768 62.615 0.153 19174
885 1 5 . 1 1 44 44 SER H H 44 8.033 8.033 8.678 -0.645 19174
886 1 5 . 1 1 45 45 ARG N N 45 120.757 120.757 122.534 -1.777 19174
887 1 5 . 1 1 45 45 ARG CA C 45 57.513 57.513 59.075 -1.562 19174
888 1 5 . 1 1 45 45 ARG CB C 45 29.462 29.462 30.184 -0.722 19174
889 1 5 . 1 1 45 45 ARG H H 45 7.763 7.763 8.087 -0.324 19174
890 1 5 . 1 1 46 46 PHE N N 46 118.237 118.237 120.099 -1.862 19174
891 1 5 . 1 1 46 46 PHE CA C 46 59.155 59.155 61.082 -1.927 19174
892 1 5 . 1 1 46 46 PHE CB C 46 39.311 39.311 39.195 0.116 19174
893 1 5 . 1 1 46 46 PHE H H 46 7.673 7.673 7.875 -0.202 19174
894 1 5 . 1 1 47 47 TRP N N 47 118.484 118.484 121.941 -3.457 19174
895 1 5 . 1 1 47 47 TRP CA C 47 58.837 58.837 59.709 -0.872 19174
896 1 5 . 1 1 47 47 TRP CB C 47 29.833 29.833 29.724 0.109 19174
897 1 5 . 1 1 47 47 TRP H H 47 7.614 7.614 8.690 -1.076 19174
898 1 5 . 1 1 48 48 ASN N N 48 114.629 114.629 118.521 -3.892 19174
899 1 5 . 1 1 48 48 ASN CA C 48 54.124 54.124 55.322 -1.198 19174
900 1 5 . 1 1 48 48 ASN CB C 48 38.887 38.887 39.040 -0.153 19174
901 1 5 . 1 1 48 48 ASN H H 48 7.811 7.811 8.392 -0.581 19174
902 1 5 . 1 1 49 49 ASP N N 49 118.029 118.029 119.415 -1.386 19174
903 1 5 . 1 1 49 49 ASP CA C 49 54.310 54.310 53.006 1.304 19174
904 1 5 . 1 1 49 49 ASP CB C 49 40.793 40.793 40.667 0.126 19174
905 1 5 . 1 1 49 49 ASP H H 49 7.775 7.775 7.736 0.039 19174
906 1 6 . 1 1 2 2 ALA N N 2 127.400 127.400 126.893 0.507 19174
907 1 6 . 1 1 2 2 ALA CA C 2 52.536 52.536 54.326 -1.790 19174
908 1 6 . 1 1 2 2 ALA CB C 2 19.031 19.031 19.100 -0.069 19174
909 1 6 . 1 1 2 2 ALA H H 2 8.593 8.593 8.627 -0.034 19174
910 1 6 . 1 1 3 3 GLU N N 3 120.977 120.977 118.210 2.767 19174
911 1 6 . 1 1 3 3 GLU CA C 3 56.295 56.295 57.892 -1.597 19174
912 1 6 . 1 1 3 3 GLU CB C 3 29.939 29.939 29.454 0.485 19174
913 1 6 . 1 1 3 3 GLU H H 3 8.301 8.301 8.288 0.013 19174
914 1 6 . 1 1 4 4 ALA N N 4 125.568 125.568 122.124 3.444 19174
915 1 6 . 1 1 4 4 ALA CA C 4 52.509 52.509 53.593 -1.084 19174
916 1 6 . 1 1 4 4 ALA CB C 4 19.084 19.084 19.046 0.038 19174
917 1 6 . 1 1 4 4 ALA H H 4 8.229 8.229 7.711 0.518 19174
918 1 6 . 1 1 5 5 HIS N N 5 117.815 117.815 119.101 -1.286 19174
919 1 6 . 1 1 5 5 HIS CA C 5 55.157 55.157 56.480 -1.323 19174
920 1 6 . 1 1 5 5 HIS CB C 5 28.827 28.827 29.999 -1.172 19174
921 1 6 . 1 1 5 5 HIS H H 5 8.363 8.363 7.638 0.725 19174
922 1 6 . 1 1 6 6 GLN N N 6 121.556 121.556 122.930 -1.374 19174
923 1 6 . 1 1 6 6 GLN CA C 6 55.739 55.739 54.492 1.247 19174
924 1 6 . 1 1 6 6 GLN CB C 6 29.409 29.409 32.033 -2.624 19174
925 1 6 . 1 1 6 6 GLN H H 6 8.289 8.289 8.056 0.233 19174
926 1 6 . 1 1 7 7 ALA N N 7 126.411 126.411 123.998 2.413 19174
927 1 6 . 1 1 7 7 ALA CA C 7 52.404 52.404 52.172 0.232 19174
928 1 6 . 1 1 7 7 ALA CB C 7 18.978 18.978 19.280 -0.302 19174
929 1 6 . 1 1 7 7 ALA H H 7 8.311 8.311 8.378 -0.067 19174
930 1 6 . 1 1 8 8 VAL N N 8 119.771 119.771 122.280 -2.509 19174
931 1 6 . 1 1 8 8 VAL CA C 8 62.491 62.491 63.285 -0.794 19174
932 1 6 . 1 1 8 8 VAL CB C 8 32.586 32.586 32.105 0.481 19174
933 1 6 . 1 1 8 8 VAL H H 8 8.018 8.018 8.254 -0.236 19174
934 1 6 . 1 1 9 9 GLY N N 9 112.108 112.108 105.528 6.580 19174
935 1 6 . 1 1 9 9 GLY CA C 9 45.044 45.044 44.083 0.961 19174
936 1 6 . 1 1 9 9 GLY H H 9 8.243 8.243 7.726 0.517 19174
937 1 6 . 1 1 10 10 PHE N N 10 120.842 120.842 121.233 -0.391 19174
938 1 6 . 1 1 10 10 PHE CA C 10 57.725 57.725 60.010 -2.284 19174
939 1 6 . 1 1 10 10 PHE CB C 10 39.628 39.628 39.373 0.255 19174
940 1 6 . 1 1 10 10 PHE H H 10 7.983 7.983 8.494 -0.511 19174
941 1 6 . 1 1 11 11 ARG N N 11 125.277 125.277 119.142 6.135 19174
942 1 6 . 1 1 11 11 ARG CA C 11 53.410 53.410 54.008 -0.598 19174
943 1 6 . 1 1 11 11 ARG CB C 11 30.574 30.574 30.527 0.047 19174
944 1 6 . 1 1 11 11 ARG H H 11 8.016 8.016 7.911 0.105 19174
945 1 6 . 1 1 13 13 SER N N 13 115.938 115.938 112.518 3.420 19174
946 1 6 . 1 1 13 13 SER CA C 13 58.043 58.043 59.888 -1.845 19174
947 1 6 . 1 1 13 13 SER CB C 13 63.774 63.774 63.020 0.753 19174
948 1 6 . 1 1 13 13 SER H H 13 8.197 8.197 8.339 -0.142 19174
949 1 6 . 1 1 14 14 LEU N N 14 124.186 124.186 121.564 2.622 19174
950 1 6 . 1 1 14 14 LEU CA C 14 55.422 55.422 54.868 0.554 19174
951 1 6 . 1 1 14 14 LEU CB C 14 42.329 42.329 42.719 -0.390 19174
952 1 6 . 1 1 14 14 LEU H H 14 8.256 8.256 8.332 -0.076 19174
953 1 6 . 1 1 15 15 THR N N 15 112.858 112.858 116.073 -3.215 19174
954 1 6 . 1 1 15 15 THR CA C 15 61.379 61.379 61.555 -0.176 19174
955 1 6 . 1 1 15 15 THR CB C 15 69.810 69.810 69.498 0.312 19174
956 1 6 . 1 1 15 15 THR H H 15 7.913 7.913 8.356 -0.443 19174
957 1 6 . 1 1 16 16 SER N N 16 117.578 117.578 118.509 -0.931 19174
958 1 6 . 1 1 16 16 SER CA C 16 58.678 58.678 58.385 0.293 19174
959 1 6 . 1 1 16 16 SER CB C 16 63.668 63.668 63.941 -0.273 19174
960 1 6 . 1 1 16 16 SER H H 16 8.154 8.154 7.623 0.531 19174
961 1 6 . 1 1 17 17 ASP N N 17 122.030 122.030 123.281 -1.251 19174
962 1 6 . 1 1 17 17 ASP CA C 17 54.680 54.680 54.978 -0.298 19174
963 1 6 . 1 1 17 17 ASP CB C 17 40.899 40.899 40.975 -0.076 19174
964 1 6 . 1 1 17 17 ASP H H 17 8.263 8.263 8.443 -0.180 19174
965 1 6 . 1 1 18 18 GLY N N 18 108.815 108.815 108.060 0.755 19174
966 1 6 . 1 1 18 18 GLY CA C 18 45.758 45.758 45.197 0.561 19174
967 1 6 . 1 1 18 18 GLY H H 18 8.239 8.239 8.127 0.112 19174
968 1 6 . 1 1 19 19 ALA N N 19 123.128 123.128 122.820 0.308 19174
969 1 6 . 1 1 19 19 ALA CA C 19 53.164 53.164 51.300 1.865 19174
970 1 6 . 1 1 19 19 ALA CB C 19 19.084 19.084 20.988 -1.904 19174
971 1 6 . 1 1 19 19 ALA H H 19 8.001 8.001 7.932 0.069 19174
972 1 6 . 1 1 20 20 GLU N N 20 117.663 117.663 121.681 -4.018 19174
973 1 6 . 1 1 20 20 GLU CA C 20 57.275 57.275 56.035 1.240 19174
974 1 6 . 1 1 20 20 GLU CB C 20 29.250 29.250 30.308 -1.058 19174
975 1 6 . 1 1 20 20 GLU H H 20 8.231 8.231 8.416 -0.185 19174
976 1 6 . 1 1 21 21 VAL N N 21 119.044 119.044 120.050 -1.006 19174
977 1 6 . 1 1 21 21 VAL CA C 21 62.755 62.755 64.658 -1.903 19174
978 1 6 . 1 1 21 21 VAL CB C 21 32.268 32.268 31.995 0.273 19174
979 1 6 . 1 1 21 21 VAL H H 21 7.767 7.767 8.575 -0.808 19174
980 1 6 . 1 1 22 22 GLU N N 22 121.765 121.765 117.849 3.916 19174
981 1 6 . 1 1 22 22 GLU CA C 22 56.613 56.613 58.432 -1.819 19174
982 1 6 . 1 1 22 22 GLU CB C 22 29.833 29.833 29.507 0.326 19174
983 1 6 . 1 1 22 22 GLU H H 22 7.969 7.969 8.159 -0.190 19174
984 1 6 . 1 1 23 23 LEU N N 23 120.996 120.996 118.376 2.620 19174
985 1 6 . 1 1 23 23 LEU CA C 23 54.310 54.310 56.397 -2.087 19174
986 1 6 . 1 1 23 23 LEU CB C 23 42.223 42.223 42.305 -0.082 19174
987 1 6 . 1 1 23 23 LEU H H 23 7.917 7.917 7.451 0.466 19174
988 1 6 . 1 1 24 24 SER N N 24 114.702 114.702 114.917 -0.215 19174
989 1 6 . 1 1 24 24 SER CA C 24 57.593 57.593 58.782 -1.189 19174
990 1 6 . 1 1 24 24 SER CB C 24 64.515 64.515 62.386 2.129 19174
991 1 6 . 1 1 24 24 SER H H 24 7.564 7.564 7.480 0.084 19174
992 1 6 . 1 1 25 25 ALA N N 25 125.059 125.059 131.395 -6.336 19174
993 1 6 . 1 1 25 25 ALA CA C 25 55.898 55.898 55.604 0.294 19174
994 1 6 . 1 1 25 25 ALA CB C 25 16.330 16.330 16.959 -0.629 19174
995 1 6 . 1 1 25 25 ALA H H 25 8.630 8.630 8.248 0.382 19174
996 1 6 . 1 1 27 27 VAL N N 27 118.016 118.016 116.994 1.022 19174
997 1 6 . 1 1 27 27 VAL CA C 27 65.826 65.826 65.785 0.040 19174
998 1 6 . 1 1 27 27 VAL CB C 27 31.686 31.686 31.609 0.077 19174
999 1 6 . 1 1 27 27 VAL H H 27 7.294 7.294 7.512 -0.218 19174
1000 1 6 . 1 1 28 28 LEU N N 28 119.933 119.933 119.592 0.341 19174
1001 1 6 . 1 1 28 28 LEU CA C 28 57.990 57.990 58.084 -0.094 19174
1002 1 6 . 1 1 28 28 LEU CB C 28 41.429 41.429 41.355 0.074 19174
1003 1 6 . 1 1 28 28 LEU H H 28 7.939 7.939 7.533 0.406 19174
1004 1 6 . 1 1 29 29 GLN N N 29 117.644 117.644 118.138 -0.494 19174
1005 1 6 . 1 1 29 29 GLN CA C 29 59.367 59.367 59.373 -0.007 19174
1006 1 6 . 1 1 29 29 GLN CB C 29 28.297 28.297 28.429 -0.132 19174
1007 1 6 . 1 1 29 29 GLN H H 29 8.179 8.179 7.788 0.391 19174
1008 1 6 . 1 1 30 30 GLU N N 30 118.389 118.389 120.979 -2.590 19174
1009 1 6 . 1 1 30 30 GLU CA C 30 59.128 59.128 59.411 -0.283 19174
1010 1 6 . 1 1 30 30 GLU CB C 30 29.038 29.038 29.620 -0.582 19174
1011 1 6 . 1 1 30 30 GLU H H 30 7.752 7.752 8.191 -0.439 19174
1012 1 6 . 1 1 31 31 ILE N N 31 120.796 120.796 120.669 0.127 19174
1013 1 6 . 1 1 31 31 ILE CA C 31 65.509 65.509 65.336 0.173 19174
1014 1 6 . 1 1 31 31 ILE CB C 31 37.775 37.775 38.050 -0.275 19174
1015 1 6 . 1 1 31 31 ILE H H 31 8.131 8.131 8.364 -0.233 19174
1016 1 6 . 1 1 32 32 TYR N N 32 120.550 120.550 120.910 -0.360 19174
1017 1 6 . 1 1 32 32 TYR CA C 32 61.405 61.405 62.036 -0.631 19174
1018 1 6 . 1 1 32 32 TYR CB C 32 38.358 38.358 38.471 -0.113 19174
1019 1 6 . 1 1 32 32 TYR H H 32 8.214 8.214 8.303 -0.089 19174
1020 1 6 . 1 1 33 33 LEU N N 33 117.578 117.578 119.538 -1.960 19174
1021 1 6 . 1 1 33 33 LEU CA C 33 57.513 57.513 57.260 0.253 19174
1022 1 6 . 1 1 33 33 LEU CB C 33 41.657 41.657 41.718 -0.061 19174
1023 1 6 . 1 1 33 33 LEU H H 33 8.347 8.347 8.331 0.016 19174
1024 1 6 . 1 1 34 34 SER N N 34 114.635 114.635 114.484 0.151 19174
1025 1 6 . 1 1 34 34 SER CA C 34 61.405 61.405 61.241 0.164 19174
1026 1 6 . 1 1 34 34 SER CB C 34 63.403 63.403 62.780 0.623 19174
1027 1 6 . 1 1 34 34 SER H H 34 7.986 7.986 8.369 -0.383 19174
1028 1 6 . 1 1 35 35 GLY N N 35 110.749 110.749 110.450 0.299 19174
1029 1 6 . 1 1 35 35 GLY CA C 35 46.897 46.897 46.386 0.511 19174
1030 1 6 . 1 1 35 35 GLY H H 35 8.302 8.302 8.101 0.201 19174
1031 1 6 . 1 1 36 36 LEU N N 36 121.632 121.632 122.001 -0.369 19174
1032 1 6 . 1 1 36 36 LEU CA C 36 57.619 57.619 56.920 0.698 19174
1033 1 6 . 1 1 36 36 LEU CB C 36 41.799 41.799 41.380 0.419 19174
1034 1 6 . 1 1 36 36 LEU H H 36 8.194 8.194 7.279 0.915 19174
1035 1 6 . 1 1 37 37 ARG N N 37 118.274 118.274 118.110 0.164 19174
1036 1 6 . 1 1 37 37 ARG CA C 37 59.049 59.049 59.687 -0.638 19174
1037 1 6 . 1 1 37 37 ARG CB C 37 30.044 30.044 29.953 0.091 19174
1038 1 6 . 1 1 37 37 ARG H H 37 7.934 7.934 7.479 0.455 19174
1039 1 6 . 1 1 38 38 SER N N 38 114.239 114.239 115.941 -1.702 19174
1040 1 6 . 1 1 38 38 SER CA C 38 60.531 60.531 61.214 -0.683 19174
1041 1 6 . 1 1 38 38 SER CB C 38 63.509 63.509 63.221 0.288 19174
1042 1 6 . 1 1 38 38 SER H H 38 7.913 7.913 7.628 0.285 19174
1043 1 6 . 1 1 39 39 TRP N N 39 123.095 123.095 122.594 0.501 19174
1044 1 6 . 1 1 39 39 TRP CA C 39 59.870 59.870 58.490 1.380 19174
1045 1 6 . 1 1 39 39 TRP CB C 39 28.721 28.721 28.329 0.392 19174
1046 1 6 . 1 1 39 39 TRP H H 39 8.108 8.108 8.723 -0.615 19174
1047 1 6 . 1 1 40 40 LYS N N 40 119.629 119.629 118.857 0.772 19174
1048 1 6 . 1 1 40 40 LYS CA C 40 59.525 59.525 59.825 -0.300 19174
1049 1 6 . 1 1 40 40 LYS CB C 40 32.109 32.109 31.938 0.171 19174
1050 1 6 . 1 1 40 40 LYS H H 40 7.938 7.938 7.905 0.033 19174
1051 1 6 . 1 1 41 41 ARG N N 41 117.834 117.834 117.437 0.397 19174
1052 1 6 . 1 1 41 41 ARG CA C 41 57.857 57.857 58.916 -1.059 19174
1053 1 6 . 1 1 41 41 ARG CB C 41 30.203 30.203 30.137 0.066 19174
1054 1 6 . 1 1 41 41 ARG H H 41 7.863 7.863 7.618 0.245 19174
1055 1 6 . 1 1 42 42 HIS N N 42 115.774 115.774 117.406 -1.632 19174
1056 1 6 . 1 1 42 42 HIS CA C 42 57.487 57.487 59.232 -1.745 19174
1057 1 6 . 1 1 42 42 HIS CB C 42 30.786 30.786 30.032 0.754 19174
1058 1 6 . 1 1 42 42 HIS H H 42 7.919 7.919 7.715 0.204 19174
1059 1 6 . 1 1 43 43 LEU N N 43 120.243 120.243 119.679 0.564 19174
1060 1 6 . 1 1 43 43 LEU CA C 43 56.745 56.745 55.668 1.077 19174
1061 1 6 . 1 1 43 43 LEU CB C 43 42.276 42.276 41.344 0.932 19174
1062 1 6 . 1 1 43 43 LEU H H 43 8.162 8.162 8.906 -0.744 19174
1063 1 6 . 1 1 44 44 SER N N 44 114.616 114.616 116.679 -2.063 19174
1064 1 6 . 1 1 44 44 SER CA C 44 60.987 60.987 62.546 -1.559 19174
1065 1 6 . 1 1 44 44 SER CB C 44 62.768 62.768 62.656 0.112 19174
1066 1 6 . 1 1 44 44 SER H H 44 8.033 8.033 8.207 -0.174 19174
1067 1 6 . 1 1 45 45 ARG N N 45 120.757 120.757 121.249 -0.492 19174
1068 1 6 . 1 1 45 45 ARG CA C 45 57.513 57.513 59.345 -1.832 19174
1069 1 6 . 1 1 45 45 ARG CB C 45 29.462 29.462 29.966 -0.504 19174
1070 1 6 . 1 1 45 45 ARG H H 45 7.763 7.763 8.180 -0.417 19174
1071 1 6 . 1 1 46 46 PHE N N 46 118.237 118.237 119.693 -1.456 19174
1072 1 6 . 1 1 46 46 PHE CA C 46 59.155 59.155 60.710 -1.555 19174
1073 1 6 . 1 1 46 46 PHE CB C 46 39.311 39.311 38.891 0.420 19174
1074 1 6 . 1 1 46 46 PHE H H 46 7.673 7.673 8.167 -0.494 19174
1075 1 6 . 1 1 47 47 TRP N N 47 118.484 118.484 120.350 -1.866 19174
1076 1 6 . 1 1 47 47 TRP CA C 47 58.837 58.837 59.521 -0.684 19174
1077 1 6 . 1 1 47 47 TRP CB C 47 29.833 29.833 29.723 0.110 19174
1078 1 6 . 1 1 47 47 TRP H H 47 7.614 7.614 8.573 -0.959 19174
1079 1 6 . 1 1 48 48 ASN N N 48 114.629 114.629 116.482 -1.853 19174
1080 1 6 . 1 1 48 48 ASN CA C 48 54.124 54.124 55.038 -0.914 19174
1081 1 6 . 1 1 48 48 ASN CB C 48 38.887 38.887 38.418 0.469 19174
1082 1 6 . 1 1 48 48 ASN H H 48 7.811 7.811 8.001 -0.190 19174
1083 1 6 . 1 1 49 49 ASP N N 49 118.029 118.029 119.746 -1.717 19174
1084 1 6 . 1 1 49 49 ASP CA C 49 54.310 54.310 53.040 1.270 19174
1085 1 6 . 1 1 49 49 ASP CB C 49 40.793 40.793 40.444 0.349 19174
1086 1 6 . 1 1 49 49 ASP H H 49 7.775 7.775 7.310 0.465 19174
1087 1 7 . 1 1 2 2 ALA N N 2 127.400 127.400 122.317 5.083 19174
1088 1 7 . 1 1 2 2 ALA CA C 2 52.536 52.536 54.314 -1.778 19174
1089 1 7 . 1 1 2 2 ALA CB C 2 19.031 19.031 18.976 0.055 19174
1090 1 7 . 1 1 2 2 ALA H H 2 8.593 8.593 8.176 0.417 19174
1091 1 7 . 1 1 3 3 GLU N N 3 120.977 120.977 118.521 2.456 19174
1092 1 7 . 1 1 3 3 GLU CA C 3 56.295 56.295 56.700 -0.405 19174
1093 1 7 . 1 1 3 3 GLU CB C 3 29.939 29.939 29.676 0.263 19174
1094 1 7 . 1 1 3 3 GLU H H 3 8.301 8.301 8.393 -0.092 19174
1095 1 7 . 1 1 4 4 ALA N N 4 125.568 125.568 122.325 3.243 19174
1096 1 7 . 1 1 4 4 ALA CA C 4 52.509 52.509 52.217 0.292 19174
1097 1 7 . 1 1 4 4 ALA CB C 4 19.084 19.084 19.449 -0.365 19174
1098 1 7 . 1 1 4 4 ALA H H 4 8.229 8.229 7.563 0.666 19174
1099 1 7 . 1 1 5 5 HIS N N 5 117.815 117.815 119.837 -2.022 19174
1100 1 7 . 1 1 5 5 HIS CA C 5 55.157 55.157 58.555 -3.398 19174
1101 1 7 . 1 1 5 5 HIS CB C 5 28.827 28.827 30.100 -1.273 19174
1102 1 7 . 1 1 5 5 HIS H H 5 8.363 8.363 8.360 0.003 19174
1103 1 7 . 1 1 6 6 GLN N N 6 121.556 121.556 117.442 4.114 19174
1104 1 7 . 1 1 6 6 GLN CA C 6 55.739 55.739 57.687 -1.948 19174
1105 1 7 . 1 1 6 6 GLN CB C 6 29.409 29.409 27.741 1.668 19174
1106 1 7 . 1 1 6 6 GLN H H 6 8.289 8.289 8.482 -0.193 19174
1107 1 7 . 1 1 7 7 ALA N N 7 126.411 126.411 123.512 2.899 19174
1108 1 7 . 1 1 7 7 ALA CA C 7 52.404 52.404 53.399 -0.995 19174
1109 1 7 . 1 1 7 7 ALA CB C 7 18.978 18.978 19.223 -0.245 19174
1110 1 7 . 1 1 7 7 ALA H H 7 8.311 8.311 8.534 -0.223 19174
1111 1 7 . 1 1 8 8 VAL N N 8 119.771 119.771 119.099 0.672 19174
1112 1 7 . 1 1 8 8 VAL CA C 8 62.491 62.491 61.875 0.616 19174
1113 1 7 . 1 1 8 8 VAL CB C 8 32.586 32.586 33.361 -0.775 19174
1114 1 7 . 1 1 8 8 VAL H H 8 8.018 8.018 7.644 0.374 19174
1115 1 7 . 1 1 9 9 GLY N N 9 112.108 112.108 113.971 -1.863 19174
1116 1 7 . 1 1 9 9 GLY CA C 9 45.044 45.044 45.695 -0.651 19174
1117 1 7 . 1 1 9 9 GLY H H 9 8.243 8.243 8.263 -0.020 19174
1118 1 7 . 1 1 10 10 PHE N N 10 120.842 120.842 116.306 4.536 19174
1119 1 7 . 1 1 10 10 PHE CA C 10 57.725 57.725 55.992 1.734 19174
1120 1 7 . 1 1 10 10 PHE CB C 10 39.628 39.628 42.425 -2.797 19174
1121 1 7 . 1 1 10 10 PHE H H 10 7.983 7.983 7.337 0.646 19174
1122 1 7 . 1 1 11 11 ARG N N 11 125.277 125.277 122.752 2.525 19174
1123 1 7 . 1 1 11 11 ARG CA C 11 53.410 53.410 54.923 -1.513 19174
1124 1 7 . 1 1 11 11 ARG CB C 11 30.574 30.574 31.030 -0.456 19174
1125 1 7 . 1 1 11 11 ARG H H 11 8.016 8.016 8.628 -0.612 19174
1126 1 7 . 1 1 13 13 SER N N 13 115.938 115.938 114.171 1.767 19174
1127 1 7 . 1 1 13 13 SER CA C 13 58.043 58.043 58.736 -0.693 19174
1128 1 7 . 1 1 13 13 SER CB C 13 63.774 63.774 63.996 -0.222 19174
1129 1 7 . 1 1 13 13 SER H H 13 8.197 8.197 7.914 0.283 19174
1130 1 7 . 1 1 14 14 LEU N N 14 124.186 124.186 123.895 0.291 19174
1131 1 7 . 1 1 14 14 LEU CA C 14 55.422 55.422 54.011 1.411 19174
1132 1 7 . 1 1 14 14 LEU CB C 14 42.329 42.329 42.220 0.109 19174
1133 1 7 . 1 1 14 14 LEU H H 14 8.256 8.256 8.450 -0.194 19174
1134 1 7 . 1 1 15 15 THR N N 15 112.858 112.858 115.828 -2.970 19174
1135 1 7 . 1 1 15 15 THR CA C 15 61.379 61.379 61.846 -0.467 19174
1136 1 7 . 1 1 15 15 THR CB C 15 69.810 69.810 69.784 0.026 19174
1137 1 7 . 1 1 15 15 THR H H 15 7.913 7.913 8.125 -0.212 19174
1138 1 7 . 1 1 16 16 SER N N 16 117.578 117.578 114.331 3.247 19174
1139 1 7 . 1 1 16 16 SER CA C 16 58.678 58.678 59.632 -0.954 19174
1140 1 7 . 1 1 16 16 SER CB C 16 63.668 63.668 62.531 1.137 19174
1141 1 7 . 1 1 16 16 SER H H 16 8.154 8.154 8.725 -0.571 19174
1142 1 7 . 1 1 17 17 ASP N N 17 122.030 122.030 122.334 -0.304 19174
1143 1 7 . 1 1 17 17 ASP CA C 17 54.680 54.680 53.858 0.823 19174
1144 1 7 . 1 1 17 17 ASP CB C 17 40.899 40.899 40.931 -0.032 19174
1145 1 7 . 1 1 17 17 ASP H H 17 8.263 8.263 8.364 -0.101 19174
1146 1 7 . 1 1 18 18 GLY N N 18 108.815 108.815 108.227 0.588 19174
1147 1 7 . 1 1 18 18 GLY CA C 18 45.758 45.758 44.292 1.466 19174
1148 1 7 . 1 1 18 18 GLY H H 18 8.239 8.239 7.593 0.646 19174
1149 1 7 . 1 1 19 19 ALA N N 19 123.128 123.128 122.260 0.868 19174
1150 1 7 . 1 1 19 19 ALA CA C 19 53.164 53.164 52.512 0.652 19174
1151 1 7 . 1 1 19 19 ALA CB C 19 19.084 19.084 19.503 -0.419 19174
1152 1 7 . 1 1 19 19 ALA H H 19 8.001 8.001 8.069 -0.068 19174
1153 1 7 . 1 1 20 20 GLU N N 20 117.663 117.663 118.460 -0.797 19174
1154 1 7 . 1 1 20 20 GLU CA C 20 57.275 57.275 56.975 0.300 19174
1155 1 7 . 1 1 20 20 GLU CB C 20 29.250 29.250 28.078 1.172 19174
1156 1 7 . 1 1 20 20 GLU H H 20 8.231 8.231 8.783 -0.552 19174
1157 1 7 . 1 1 21 21 VAL N N 21 119.044 119.044 117.507 1.537 19174
1158 1 7 . 1 1 21 21 VAL CA C 21 62.755 62.755 65.041 -2.286 19174
1159 1 7 . 1 1 21 21 VAL CB C 21 32.268 32.268 31.970 0.298 19174
1160 1 7 . 1 1 21 21 VAL H H 21 7.767 7.767 8.042 -0.275 19174
1161 1 7 . 1 1 22 22 GLU N N 22 121.765 121.765 118.004 3.761 19174
1162 1 7 . 1 1 22 22 GLU CA C 22 56.613 56.613 58.085 -1.472 19174
1163 1 7 . 1 1 22 22 GLU CB C 22 29.833 29.833 29.583 0.250 19174
1164 1 7 . 1 1 22 22 GLU H H 22 7.969 7.969 8.290 -0.321 19174
1165 1 7 . 1 1 23 23 LEU N N 23 120.996 120.996 119.892 1.104 19174
1166 1 7 . 1 1 23 23 LEU CA C 23 54.310 54.310 53.575 0.735 19174
1167 1 7 . 1 1 23 23 LEU CB C 23 42.223 42.223 43.629 -1.406 19174
1168 1 7 . 1 1 23 23 LEU H H 23 7.917 7.917 7.151 0.766 19174
1169 1 7 . 1 1 24 24 SER N N 24 114.702 114.702 123.526 -8.824 19174
1170 1 7 . 1 1 24 24 SER CA C 24 57.593 57.593 59.082 -1.489 19174
1171 1 7 . 1 1 24 24 SER CB C 24 64.515 64.515 61.879 2.636 19174
1172 1 7 . 1 1 24 24 SER H H 24 7.564 7.564 9.103 -1.539 19174
1173 1 7 . 1 1 25 25 ALA N N 25 125.059 125.059 125.422 -0.363 19174
1174 1 7 . 1 1 25 25 ALA CA C 25 55.898 55.898 56.375 -0.477 19174
1175 1 7 . 1 1 25 25 ALA CB C 25 16.330 16.330 16.424 -0.094 19174
1176 1 7 . 1 1 25 25 ALA H H 25 8.630 8.630 8.744 -0.114 19174
1177 1 7 . 1 1 27 27 VAL N N 27 118.016 118.016 117.717 0.299 19174
1178 1 7 . 1 1 27 27 VAL CA C 27 65.826 65.826 65.835 -0.009 19174
1179 1 7 . 1 1 27 27 VAL CB C 27 31.686 31.686 31.355 0.331 19174
1180 1 7 . 1 1 27 27 VAL H H 27 7.294 7.294 7.407 -0.113 19174
1181 1 7 . 1 1 28 28 LEU N N 28 119.933 119.933 120.339 -0.406 19174
1182 1 7 . 1 1 28 28 LEU CA C 28 57.990 57.990 58.282 -0.291 19174
1183 1 7 . 1 1 28 28 LEU CB C 28 41.429 41.429 41.206 0.223 19174
1184 1 7 . 1 1 28 28 LEU H H 28 7.939 7.939 8.041 -0.102 19174
1185 1 7 . 1 1 29 29 GLN N N 29 117.644 117.644 118.034 -0.390 19174
1186 1 7 . 1 1 29 29 GLN CA C 29 59.367 59.367 58.897 0.471 19174
1187 1 7 . 1 1 29 29 GLN CB C 29 28.297 28.297 27.982 0.315 19174
1188 1 7 . 1 1 29 29 GLN H H 29 8.179 8.179 8.781 -0.602 19174
1189 1 7 . 1 1 30 30 GLU N N 30 118.389 118.389 120.731 -2.342 19174
1190 1 7 . 1 1 30 30 GLU CA C 30 59.128 59.128 59.297 -0.169 19174
1191 1 7 . 1 1 30 30 GLU CB C 30 29.038 29.038 29.526 -0.489 19174
1192 1 7 . 1 1 30 30 GLU H H 30 7.752 7.752 7.914 -0.162 19174
1193 1 7 . 1 1 31 31 ILE N N 31 120.796 120.796 120.745 0.051 19174
1194 1 7 . 1 1 31 31 ILE CA C 31 65.509 65.509 65.350 0.159 19174
1195 1 7 . 1 1 31 31 ILE CB C 31 37.775 37.775 37.909 -0.134 19174
1196 1 7 . 1 1 31 31 ILE H H 31 8.131 8.131 8.165 -0.034 19174
1197 1 7 . 1 1 32 32 TYR N N 32 120.550 120.550 120.741 -0.191 19174
1198 1 7 . 1 1 32 32 TYR CA C 32 61.405 61.405 62.177 -0.772 19174
1199 1 7 . 1 1 32 32 TYR CB C 32 38.358 38.358 38.425 -0.067 19174
1200 1 7 . 1 1 32 32 TYR H H 32 8.214 8.214 8.306 -0.092 19174
1201 1 7 . 1 1 33 33 LEU N N 33 117.578 117.578 118.503 -0.925 19174
1202 1 7 . 1 1 33 33 LEU CA C 33 57.513 57.513 57.876 -0.363 19174
1203 1 7 . 1 1 33 33 LEU CB C 33 41.657 41.657 41.539 0.117 19174
1204 1 7 . 1 1 33 33 LEU H H 33 8.347 8.347 8.488 -0.141 19174
1205 1 7 . 1 1 34 34 SER N N 34 114.635 114.635 115.018 -0.383 19174
1206 1 7 . 1 1 34 34 SER CA C 34 61.405 61.405 61.908 -0.503 19174
1207 1 7 . 1 1 34 34 SER CB C 34 63.403 63.403 62.849 0.554 19174
1208 1 7 . 1 1 34 34 SER H H 34 7.986 7.986 8.380 -0.394 19174
1209 1 7 . 1 1 35 35 GLY N N 35 110.749 110.749 109.960 0.789 19174
1210 1 7 . 1 1 35 35 GLY CA C 35 46.897 46.897 46.550 0.347 19174
1211 1 7 . 1 1 35 35 GLY H H 35 8.302 8.302 8.076 0.226 19174
1212 1 7 . 1 1 36 36 LEU N N 36 121.632 121.632 122.025 -0.393 19174
1213 1 7 . 1 1 36 36 LEU CA C 36 57.619 57.619 56.923 0.696 19174
1214 1 7 . 1 1 36 36 LEU CB C 36 41.799 41.799 41.398 0.401 19174
1215 1 7 . 1 1 36 36 LEU H H 36 8.194 8.194 7.284 0.910 19174
1216 1 7 . 1 1 37 37 ARG N N 37 118.274 118.274 117.675 0.599 19174
1217 1 7 . 1 1 37 37 ARG CA C 37 59.049 59.049 59.541 -0.492 19174
1218 1 7 . 1 1 37 37 ARG CB C 37 30.044 30.044 29.833 0.211 19174
1219 1 7 . 1 1 37 37 ARG H H 37 7.934 7.934 7.481 0.453 19174
1220 1 7 . 1 1 38 38 SER N N 38 114.239 114.239 115.035 -0.796 19174
1221 1 7 . 1 1 38 38 SER CA C 38 60.531 60.531 60.873 -0.342 19174
1222 1 7 . 1 1 38 38 SER CB C 38 63.509 63.509 63.306 0.203 19174
1223 1 7 . 1 1 38 38 SER H H 38 7.913 7.913 7.603 0.310 19174
1224 1 7 . 1 1 39 39 TRP N N 39 123.095 123.095 122.217 0.878 19174
1225 1 7 . 1 1 39 39 TRP CA C 39 59.870 59.870 58.639 1.231 19174
1226 1 7 . 1 1 39 39 TRP CB C 39 28.721 28.721 28.566 0.155 19174
1227 1 7 . 1 1 39 39 TRP H H 39 8.108 8.108 8.699 -0.591 19174
1228 1 7 . 1 1 40 40 LYS N N 40 119.629 119.629 118.934 0.695 19174
1229 1 7 . 1 1 40 40 LYS CA C 40 59.525 59.525 59.679 -0.154 19174
1230 1 7 . 1 1 40 40 LYS CB C 40 32.109 32.109 31.917 0.192 19174
1231 1 7 . 1 1 40 40 LYS H H 40 7.938 7.938 7.877 0.061 19174
1232 1 7 . 1 1 41 41 ARG N N 41 117.834 117.834 118.461 -0.627 19174
1233 1 7 . 1 1 41 41 ARG CA C 41 57.857 57.857 58.999 -1.142 19174
1234 1 7 . 1 1 41 41 ARG CB C 41 30.203 30.203 29.963 0.240 19174
1235 1 7 . 1 1 41 41 ARG H H 41 7.863 7.863 7.650 0.213 19174
1236 1 7 . 1 1 42 42 HIS N N 42 115.774 115.774 116.234 -0.460 19174
1237 1 7 . 1 1 42 42 HIS CA C 42 57.487 57.487 58.721 -1.234 19174
1238 1 7 . 1 1 42 42 HIS CB C 42 30.786 30.786 30.274 0.512 19174
1239 1 7 . 1 1 42 42 HIS H H 42 7.919 7.919 7.508 0.411 19174
1240 1 7 . 1 1 43 43 LEU N N 43 120.243 120.243 120.503 -0.260 19174
1241 1 7 . 1 1 43 43 LEU CA C 43 56.745 56.745 55.165 1.580 19174
1242 1 7 . 1 1 43 43 LEU CB C 43 42.276 42.276 42.122 0.154 19174
1243 1 7 . 1 1 43 43 LEU H H 43 8.162 8.162 8.757 -0.595 19174
1244 1 7 . 1 1 44 44 SER N N 44 114.616 114.616 116.464 -1.848 19174
1245 1 7 . 1 1 44 44 SER CA C 44 60.987 60.987 62.565 -1.578 19174
1246 1 7 . 1 1 44 44 SER CB C 44 62.768 62.768 62.763 0.005 19174
1247 1 7 . 1 1 44 44 SER H H 44 8.033 8.033 8.174 -0.141 19174
1248 1 7 . 1 1 45 45 ARG N N 45 120.757 120.757 120.335 0.422 19174
1249 1 7 . 1 1 45 45 ARG CA C 45 57.513 57.513 59.366 -1.853 19174
1250 1 7 . 1 1 45 45 ARG CB C 45 29.462 29.462 29.750 -0.288 19174
1251 1 7 . 1 1 45 45 ARG H H 45 7.763 7.763 8.111 -0.348 19174
1252 1 7 . 1 1 46 46 PHE N N 46 118.237 118.237 118.344 -0.107 19174
1253 1 7 . 1 1 46 46 PHE CA C 46 59.155 59.155 61.017 -1.862 19174
1254 1 7 . 1 1 46 46 PHE CB C 46 39.311 39.311 38.695 0.616 19174
1255 1 7 . 1 1 46 46 PHE H H 46 7.673 7.673 8.121 -0.448 19174
1256 1 7 . 1 1 47 47 TRP N N 47 118.484 118.484 122.022 -3.538 19174
1257 1 7 . 1 1 47 47 TRP CA C 47 58.837 58.837 60.733 -1.896 19174
1258 1 7 . 1 1 47 47 TRP CB C 47 29.833 29.833 29.696 0.137 19174
1259 1 7 . 1 1 47 47 TRP H H 47 7.614 7.614 8.943 -1.329 19174
1260 1 7 . 1 1 48 48 ASN N N 48 114.629 114.629 118.245 -3.616 19174
1261 1 7 . 1 1 48 48 ASN CA C 48 54.124 54.124 55.588 -1.464 19174
1262 1 7 . 1 1 48 48 ASN CB C 48 38.887 38.887 38.367 0.520 19174
1263 1 7 . 1 1 48 48 ASN H H 48 7.811 7.811 8.460 -0.649 19174
1264 1 7 . 1 1 49 49 ASP N N 49 118.029 118.029 119.181 -1.152 19174
1265 1 7 . 1 1 49 49 ASP CA C 49 54.310 54.310 55.910 -1.600 19174
1266 1 7 . 1 1 49 49 ASP CB C 49 40.793 40.793 40.816 -0.022 19174
1267 1 7 . 1 1 49 49 ASP H H 49 7.775 7.775 7.745 0.030 19174
1268 1 8 . 1 1 2 2 ALA N N 2 127.400 127.400 125.763 1.637 19174
1269 1 8 . 1 1 2 2 ALA CA C 2 52.536 52.536 51.693 0.843 19174
1270 1 8 . 1 1 2 2 ALA CB C 2 19.031 19.031 19.916 -0.885 19174
1271 1 8 . 1 1 2 2 ALA H H 2 8.593 8.593 8.347 0.246 19174
1272 1 8 . 1 1 3 3 GLU N N 3 120.977 120.977 120.342 0.635 19174
1273 1 8 . 1 1 3 3 GLU CA C 3 56.295 56.295 57.441 -1.146 19174
1274 1 8 . 1 1 3 3 GLU CB C 3 29.939 29.939 30.024 -0.085 19174
1275 1 8 . 1 1 3 3 GLU H H 3 8.301 8.301 8.537 -0.236 19174
1276 1 8 . 1 1 4 4 ALA N N 4 125.568 125.568 119.922 5.646 19174
1277 1 8 . 1 1 4 4 ALA CA C 4 52.509 52.509 51.351 1.158 19174
1278 1 8 . 1 1 4 4 ALA CB C 4 19.084 19.084 20.430 -1.346 19174
1279 1 8 . 1 1 4 4 ALA H H 4 8.229 8.229 7.383 0.846 19174
1280 1 8 . 1 1 5 5 HIS N N 5 117.815 117.815 118.895 -1.080 19174
1281 1 8 . 1 1 5 5 HIS CA C 5 55.157 55.157 59.626 -4.469 19174
1282 1 8 . 1 1 5 5 HIS CB C 5 28.827 28.827 30.348 -1.520 19174
1283 1 8 . 1 1 5 5 HIS H H 5 8.363 8.363 8.978 -0.615 19174
1284 1 8 . 1 1 6 6 GLN N N 6 121.556 121.556 117.794 3.762 19174
1285 1 8 . 1 1 6 6 GLN CA C 6 55.739 55.739 58.115 -2.377 19174
1286 1 8 . 1 1 6 6 GLN CB C 6 29.409 29.409 28.349 1.060 19174
1287 1 8 . 1 1 6 6 GLN H H 6 8.289 8.289 8.260 0.029 19174
1288 1 8 . 1 1 7 7 ALA N N 7 126.411 126.411 120.738 5.673 19174
1289 1 8 . 1 1 7 7 ALA CA C 7 52.404 52.404 53.205 -0.801 19174
1290 1 8 . 1 1 7 7 ALA CB C 7 18.978 18.978 19.080 -0.102 19174
1291 1 8 . 1 1 7 7 ALA H H 7 8.311 8.311 7.891 0.420 19174
1292 1 8 . 1 1 8 8 VAL N N 8 119.771 119.771 117.193 2.578 19174
1293 1 8 . 1 1 8 8 VAL CA C 8 62.491 62.491 61.410 1.081 19174
1294 1 8 . 1 1 8 8 VAL CB C 8 32.586 32.586 34.600 -2.014 19174
1295 1 8 . 1 1 8 8 VAL H H 8 8.018 8.018 7.360 0.658 19174
1296 1 8 . 1 1 9 9 GLY N N 9 112.108 112.108 112.816 -0.708 19174
1297 1 8 . 1 1 9 9 GLY CA C 9 45.044 45.044 44.865 0.178 19174
1298 1 8 . 1 1 9 9 GLY H H 9 8.243 8.243 7.790 0.453 19174
1299 1 8 . 1 1 10 10 PHE N N 10 120.842 120.842 120.156 0.686 19174
1300 1 8 . 1 1 10 10 PHE CA C 10 57.725 57.725 58.518 -0.793 19174
1301 1 8 . 1 1 10 10 PHE CB C 10 39.628 39.628 39.928 -0.300 19174
1302 1 8 . 1 1 10 10 PHE H H 10 7.983 7.983 8.422 -0.439 19174
1303 1 8 . 1 1 11 11 ARG N N 11 125.277 125.277 123.423 1.854 19174
1304 1 8 . 1 1 11 11 ARG CA C 11 53.410 53.410 54.552 -1.142 19174
1305 1 8 . 1 1 11 11 ARG CB C 11 30.574 30.574 30.607 -0.033 19174
1306 1 8 . 1 1 11 11 ARG H H 11 8.016 8.016 8.553 -0.537 19174
1307 1 8 . 1 1 13 13 SER N N 13 115.938 115.938 115.288 0.650 19174
1308 1 8 . 1 1 13 13 SER CA C 13 58.043 58.043 60.295 -2.252 19174
1309 1 8 . 1 1 13 13 SER CB C 13 63.774 63.774 63.337 0.437 19174
1310 1 8 . 1 1 13 13 SER H H 13 8.197 8.197 8.519 -0.322 19174
1311 1 8 . 1 1 14 14 LEU N N 14 124.186 124.186 120.185 4.001 19174
1312 1 8 . 1 1 14 14 LEU CA C 14 55.422 55.422 57.047 -1.625 19174
1313 1 8 . 1 1 14 14 LEU CB C 14 42.329 42.329 41.694 0.635 19174
1314 1 8 . 1 1 14 14 LEU H H 14 8.256 8.256 7.820 0.436 19174
1315 1 8 . 1 1 15 15 THR N N 15 112.858 112.858 113.762 -0.904 19174
1316 1 8 . 1 1 15 15 THR CA C 15 61.379 61.379 64.734 -3.355 19174
1317 1 8 . 1 1 15 15 THR CB C 15 69.810 69.810 68.933 0.877 19174
1318 1 8 . 1 1 15 15 THR H H 15 7.913 7.913 7.890 0.023 19174
1319 1 8 . 1 1 16 16 SER N N 16 117.578 117.578 116.304 1.274 19174
1320 1 8 . 1 1 16 16 SER CA C 16 58.678 58.678 57.284 1.394 19174
1321 1 8 . 1 1 16 16 SER CB C 16 63.668 63.668 64.808 -1.140 19174
1322 1 8 . 1 1 16 16 SER H H 16 8.154 8.154 7.693 0.461 19174
1323 1 8 . 1 1 17 17 ASP N N 17 122.030 122.030 118.499 3.531 19174
1324 1 8 . 1 1 17 17 ASP CA C 17 54.680 54.680 53.728 0.952 19174
1325 1 8 . 1 1 17 17 ASP CB C 17 40.899 40.899 40.612 0.287 19174
1326 1 8 . 1 1 17 17 ASP H H 17 8.263 8.263 8.421 -0.158 19174
1327 1 8 . 1 1 18 18 GLY N N 18 108.815 108.815 106.369 2.446 19174
1328 1 8 . 1 1 18 18 GLY CA C 18 45.758 45.758 44.655 1.103 19174
1329 1 8 . 1 1 18 18 GLY H H 18 8.239 8.239 8.224 0.015 19174
1330 1 8 . 1 1 19 19 ALA N N 19 123.128 123.128 123.333 -0.205 19174
1331 1 8 . 1 1 19 19 ALA CA C 19 53.164 53.164 52.394 0.770 19174
1332 1 8 . 1 1 19 19 ALA CB C 19 19.084 19.084 19.631 -0.547 19174
1333 1 8 . 1 1 19 19 ALA H H 19 8.001 8.001 8.209 -0.208 19174
1334 1 8 . 1 1 20 20 GLU N N 20 117.663 117.663 123.623 -5.960 19174
1335 1 8 . 1 1 20 20 GLU CA C 20 57.275 57.275 55.822 1.453 19174
1336 1 8 . 1 1 20 20 GLU CB C 20 29.250 29.250 31.309 -2.059 19174
1337 1 8 . 1 1 20 20 GLU H H 20 8.231 8.231 8.421 -0.190 19174
1338 1 8 . 1 1 21 21 VAL N N 21 119.044 119.044 124.075 -5.031 19174
1339 1 8 . 1 1 21 21 VAL CA C 21 62.755 62.755 61.902 0.853 19174
1340 1 8 . 1 1 21 21 VAL CB C 21 32.268 32.268 33.793 -1.525 19174
1341 1 8 . 1 1 21 21 VAL H H 21 7.767 7.767 8.560 -0.793 19174
1342 1 8 . 1 1 22 22 GLU N N 22 121.765 121.765 126.327 -4.562 19174
1343 1 8 . 1 1 22 22 GLU CA C 22 56.613 56.613 57.532 -0.920 19174
1344 1 8 . 1 1 22 22 GLU CB C 22 29.833 29.833 29.867 -0.034 19174
1345 1 8 . 1 1 22 22 GLU H H 22 7.969 7.969 8.581 -0.612 19174
1346 1 8 . 1 1 23 23 LEU N N 23 120.996 120.996 121.524 -0.528 19174
1347 1 8 . 1 1 23 23 LEU CA C 23 54.310 54.310 54.750 -0.440 19174
1348 1 8 . 1 1 23 23 LEU CB C 23 42.223 42.223 42.717 -0.494 19174
1349 1 8 . 1 1 23 23 LEU H H 23 7.917 7.917 7.688 0.229 19174
1350 1 8 . 1 1 24 24 SER N N 24 114.702 114.702 115.251 -0.549 19174
1351 1 8 . 1 1 24 24 SER CA C 24 57.593 57.593 56.800 0.793 19174
1352 1 8 . 1 1 24 24 SER CB C 24 64.515 64.515 65.793 -1.278 19174
1353 1 8 . 1 1 24 24 SER H H 24 7.564 7.564 8.008 -0.444 19174
1354 1 8 . 1 1 25 25 ALA N N 25 125.059 125.059 124.126 0.933 19174
1355 1 8 . 1 1 25 25 ALA CA C 25 55.898 55.898 56.822 -0.924 19174
1356 1 8 . 1 1 25 25 ALA CB C 25 16.330 16.330 16.338 -0.008 19174
1357 1 8 . 1 1 25 25 ALA H H 25 8.630 8.630 8.821 -0.191 19174
1358 1 8 . 1 1 27 27 VAL N N 27 118.016 118.016 117.645 0.371 19174
1359 1 8 . 1 1 27 27 VAL CA C 27 65.826 65.826 66.333 -0.507 19174
1360 1 8 . 1 1 27 27 VAL CB C 27 31.686 31.686 31.797 -0.111 19174
1361 1 8 . 1 1 27 27 VAL H H 27 7.294 7.294 7.405 -0.111 19174
1362 1 8 . 1 1 28 28 LEU N N 28 119.933 119.933 120.107 -0.174 19174
1363 1 8 . 1 1 28 28 LEU CA C 28 57.990 57.990 58.213 -0.223 19174
1364 1 8 . 1 1 28 28 LEU CB C 28 41.429 41.429 41.343 0.086 19174
1365 1 8 . 1 1 28 28 LEU H H 28 7.939 7.939 8.368 -0.429 19174
1366 1 8 . 1 1 29 29 GLN N N 29 117.644 117.644 119.149 -1.505 19174
1367 1 8 . 1 1 29 29 GLN CA C 29 59.367 59.367 59.444 -0.077 19174
1368 1 8 . 1 1 29 29 GLN CB C 29 28.297 28.297 28.560 -0.263 19174
1369 1 8 . 1 1 29 29 GLN H H 29 8.179 8.179 8.726 -0.547 19174
1370 1 8 . 1 1 30 30 GLU N N 30 118.389 118.389 119.834 -1.445 19174
1371 1 8 . 1 1 30 30 GLU CA C 30 59.128 59.128 58.964 0.164 19174
1372 1 8 . 1 1 30 30 GLU CB C 30 29.038 29.038 29.468 -0.430 19174
1373 1 8 . 1 1 30 30 GLU H H 30 7.752 7.752 7.678 0.074 19174
1374 1 8 . 1 1 31 31 ILE N N 31 120.796 120.796 120.946 -0.150 19174
1375 1 8 . 1 1 31 31 ILE CA C 31 65.509 65.509 65.421 0.088 19174
1376 1 8 . 1 1 31 31 ILE CB C 31 37.775 37.775 37.877 -0.102 19174
1377 1 8 . 1 1 31 31 ILE H H 31 8.131 8.131 8.223 -0.092 19174
1378 1 8 . 1 1 32 32 TYR N N 32 120.550 120.550 120.768 -0.218 19174
1379 1 8 . 1 1 32 32 TYR CA C 32 61.405 61.405 62.049 -0.644 19174
1380 1 8 . 1 1 32 32 TYR CB C 32 38.358 38.358 38.461 -0.103 19174
1381 1 8 . 1 1 32 32 TYR H H 32 8.214 8.214 8.294 -0.080 19174
1382 1 8 . 1 1 33 33 LEU N N 33 117.578 117.578 119.525 -1.947 19174
1383 1 8 . 1 1 33 33 LEU CA C 33 57.513 57.513 57.568 -0.055 19174
1384 1 8 . 1 1 33 33 LEU CB C 33 41.657 41.657 41.712 -0.055 19174
1385 1 8 . 1 1 33 33 LEU H H 33 8.347 8.347 8.246 0.101 19174
1386 1 8 . 1 1 34 34 SER N N 34 114.635 114.635 114.364 0.271 19174
1387 1 8 . 1 1 34 34 SER CA C 34 61.405 61.405 62.424 -1.019 19174
1388 1 8 . 1 1 34 34 SER CB C 34 63.403 63.403 62.772 0.631 19174
1389 1 8 . 1 1 34 34 SER H H 34 7.986 7.986 8.521 -0.535 19174
1390 1 8 . 1 1 35 35 GLY N N 35 110.749 110.749 109.838 0.911 19174
1391 1 8 . 1 1 35 35 GLY CA C 35 46.897 46.897 46.586 0.311 19174
1392 1 8 . 1 1 35 35 GLY H H 35 8.302 8.302 8.192 0.110 19174
1393 1 8 . 1 1 36 36 LEU N N 36 121.632 121.632 121.957 -0.325 19174
1394 1 8 . 1 1 36 36 LEU CA C 36 57.619 57.619 57.187 0.432 19174
1395 1 8 . 1 1 36 36 LEU CB C 36 41.799 41.799 41.183 0.616 19174
1396 1 8 . 1 1 36 36 LEU H H 36 8.194 8.194 7.130 1.064 19174
1397 1 8 . 1 1 37 37 ARG N N 37 118.274 118.274 119.323 -1.049 19174
1398 1 8 . 1 1 37 37 ARG CA C 37 59.049 59.049 59.673 -0.624 19174
1399 1 8 . 1 1 37 37 ARG CB C 37 30.044 30.044 30.219 -0.175 19174
1400 1 8 . 1 1 37 37 ARG H H 37 7.934 7.934 7.544 0.390 19174
1401 1 8 . 1 1 38 38 SER N N 38 114.239 114.239 115.430 -1.191 19174
1402 1 8 . 1 1 38 38 SER CA C 38 60.531 60.531 61.034 -0.503 19174
1403 1 8 . 1 1 38 38 SER CB C 38 63.509 63.509 62.478 1.031 19174
1404 1 8 . 1 1 38 38 SER H H 38 7.913 7.913 7.791 0.122 19174
1405 1 8 . 1 1 39 39 TRP N N 39 123.095 123.095 124.188 -1.093 19174
1406 1 8 . 1 1 39 39 TRP CA C 39 59.870 59.870 57.930 1.940 19174
1407 1 8 . 1 1 39 39 TRP CB C 39 28.721 28.721 28.110 0.611 19174
1408 1 8 . 1 1 39 39 TRP H H 39 8.108 8.108 8.581 -0.473 19174
1409 1 8 . 1 1 40 40 LYS N N 40 119.629 119.629 119.937 -0.308 19174
1410 1 8 . 1 1 40 40 LYS CA C 40 59.525 59.525 59.827 -0.302 19174
1411 1 8 . 1 1 40 40 LYS CB C 40 32.109 32.109 32.160 -0.051 19174
1412 1 8 . 1 1 40 40 LYS H H 40 7.938 7.938 7.954 -0.016 19174
1413 1 8 . 1 1 41 41 ARG N N 41 117.834 117.834 117.656 0.178 19174
1414 1 8 . 1 1 41 41 ARG CA C 41 57.857 57.857 58.970 -1.113 19174
1415 1 8 . 1 1 41 41 ARG CB C 41 30.203 30.203 30.061 0.142 19174
1416 1 8 . 1 1 41 41 ARG H H 41 7.863 7.863 7.697 0.166 19174
1417 1 8 . 1 1 42 42 HIS N N 42 115.774 115.774 116.589 -0.815 19174
1418 1 8 . 1 1 42 42 HIS CA C 42 57.487 57.487 59.316 -1.829 19174
1419 1 8 . 1 1 42 42 HIS CB C 42 30.786 30.786 30.068 0.718 19174
1420 1 8 . 1 1 42 42 HIS H H 42 7.919 7.919 7.700 0.219 19174
1421 1 8 . 1 1 43 43 LEU N N 43 120.243 120.243 119.987 0.256 19174
1422 1 8 . 1 1 43 43 LEU CA C 43 56.745 56.745 55.977 0.768 19174
1423 1 8 . 1 1 43 43 LEU CB C 43 42.276 42.276 41.615 0.661 19174
1424 1 8 . 1 1 43 43 LEU H H 43 8.162 8.162 8.996 -0.834 19174
1425 1 8 . 1 1 44 44 SER N N 44 114.616 114.616 116.784 -2.168 19174
1426 1 8 . 1 1 44 44 SER CA C 44 60.987 60.987 62.145 -1.158 19174
1427 1 8 . 1 1 44 44 SER CB C 44 62.768 62.768 61.937 0.831 19174
1428 1 8 . 1 1 44 44 SER H H 44 8.033 8.033 8.280 -0.247 19174
1429 1 8 . 1 1 45 45 ARG N N 45 120.757 120.757 122.241 -1.484 19174
1430 1 8 . 1 1 45 45 ARG CA C 45 57.513 57.513 59.382 -1.869 19174
1431 1 8 . 1 1 45 45 ARG CB C 45 29.462 29.462 29.922 -0.460 19174
1432 1 8 . 1 1 45 45 ARG H H 45 7.763 7.763 8.059 -0.296 19174
1433 1 8 . 1 1 46 46 PHE N N 46 118.237 118.237 119.449 -1.212 19174
1434 1 8 . 1 1 46 46 PHE CA C 46 59.155 59.155 61.052 -1.897 19174
1435 1 8 . 1 1 46 46 PHE CB C 46 39.311 39.311 38.784 0.527 19174
1436 1 8 . 1 1 46 46 PHE H H 46 7.673 7.673 8.297 -0.624 19174
1437 1 8 . 1 1 47 47 TRP N N 47 118.484 118.484 121.736 -3.252 19174
1438 1 8 . 1 1 47 47 TRP CA C 47 58.837 58.837 60.374 -1.537 19174
1439 1 8 . 1 1 47 47 TRP CB C 47 29.833 29.833 29.644 0.189 19174
1440 1 8 . 1 1 47 47 TRP H H 47 7.614 7.614 9.130 -1.516 19174
1441 1 8 . 1 1 48 48 ASN N N 48 114.629 114.629 116.594 -1.965 19174
1442 1 8 . 1 1 48 48 ASN CA C 48 54.124 54.124 55.597 -1.473 19174
1443 1 8 . 1 1 48 48 ASN CB C 48 38.887 38.887 38.051 0.836 19174
1444 1 8 . 1 1 48 48 ASN H H 48 7.811 7.811 8.544 -0.733 19174
1445 1 8 . 1 1 49 49 ASP N N 49 118.029 118.029 118.681 -0.652 19174
1446 1 8 . 1 1 49 49 ASP CA C 49 54.310 54.310 56.123 -1.813 19174
1447 1 8 . 1 1 49 49 ASP CB C 49 40.793 40.793 41.833 -1.040 19174
1448 1 8 . 1 1 49 49 ASP H H 49 7.775 7.775 7.741 0.034 19174
1449 1 9 . 1 1 2 2 ALA N N 2 127.400 127.400 124.368 3.032 19174
1450 1 9 . 1 1 2 2 ALA CA C 2 52.536 52.536 53.170 -0.634 19174
1451 1 9 . 1 1 2 2 ALA CB C 2 19.031 19.031 19.097 -0.066 19174
1452 1 9 . 1 1 2 2 ALA H H 2 8.593 8.593 8.572 0.021 19174
1453 1 9 . 1 1 3 3 GLU N N 3 120.977 120.977 118.210 2.767 19174
1454 1 9 . 1 1 3 3 GLU CA C 3 56.295 56.295 56.276 0.018 19174
1455 1 9 . 1 1 3 3 GLU CB C 3 29.939 29.939 29.015 0.924 19174
1456 1 9 . 1 1 3 3 GLU H H 3 8.301 8.301 8.177 0.124 19174
1457 1 9 . 1 1 4 4 ALA N N 4 125.568 125.568 126.892 -1.324 19174
1458 1 9 . 1 1 4 4 ALA CA C 4 52.509 52.509 51.329 1.180 19174
1459 1 9 . 1 1 4 4 ALA CB C 4 19.084 19.084 21.075 -1.991 19174
1460 1 9 . 1 1 4 4 ALA H H 4 8.229 8.229 7.754 0.475 19174
1461 1 9 . 1 1 5 5 HIS N N 5 117.815 117.815 118.683 -0.868 19174
1462 1 9 . 1 1 5 5 HIS CA C 5 55.157 55.157 56.051 -0.894 19174
1463 1 9 . 1 1 5 5 HIS CB C 5 28.827 28.827 31.358 -2.531 19174
1464 1 9 . 1 1 5 5 HIS H H 5 8.363 8.363 8.486 -0.123 19174
1465 1 9 . 1 1 6 6 GLN N N 6 121.556 121.556 123.288 -1.732 19174
1466 1 9 . 1 1 6 6 GLN CA C 6 55.739 55.739 57.150 -1.411 19174
1467 1 9 . 1 1 6 6 GLN CB C 6 29.409 29.409 29.326 0.083 19174
1468 1 9 . 1 1 6 6 GLN H H 6 8.289 8.289 8.960 -0.671 19174
1469 1 9 . 1 1 7 7 ALA N N 7 126.411 126.411 120.771 5.640 19174
1470 1 9 . 1 1 7 7 ALA CA C 7 52.404 52.404 51.741 0.663 19174
1471 1 9 . 1 1 7 7 ALA CB C 7 18.978 18.978 21.126 -2.148 19174
1472 1 9 . 1 1 7 7 ALA H H 7 8.311 8.311 7.796 0.515 19174
1473 1 9 . 1 1 8 8 VAL N N 8 119.771 119.771 117.570 2.201 19174
1474 1 9 . 1 1 8 8 VAL CA C 8 62.491 62.491 61.127 1.364 19174
1475 1 9 . 1 1 8 8 VAL CB C 8 32.586 32.586 33.877 -1.291 19174
1476 1 9 . 1 1 8 8 VAL H H 8 8.018 8.018 9.033 -1.015 19174
1477 1 9 . 1 1 9 9 GLY N N 9 112.108 112.108 109.908 2.200 19174
1478 1 9 . 1 1 9 9 GLY CA C 9 45.044 45.044 44.965 0.079 19174
1479 1 9 . 1 1 9 9 GLY H H 9 8.243 8.243 8.053 0.191 19174
1480 1 9 . 1 1 10 10 PHE N N 10 120.842 120.842 121.002 -0.160 19174
1481 1 9 . 1 1 10 10 PHE CA C 10 57.725 57.725 57.746 -0.021 19174
1482 1 9 . 1 1 10 10 PHE CB C 10 39.628 39.628 40.384 -0.756 19174
1483 1 9 . 1 1 10 10 PHE H H 10 7.983 7.983 8.316 -0.333 19174
1484 1 9 . 1 1 11 11 ARG N N 11 125.277 125.277 126.460 -1.183 19174
1485 1 9 . 1 1 11 11 ARG CA C 11 53.410 53.410 55.042 -1.632 19174
1486 1 9 . 1 1 11 11 ARG CB C 11 30.574 30.574 31.252 -0.678 19174
1487 1 9 . 1 1 11 11 ARG H H 11 8.016 8.016 8.671 -0.655 19174
1488 1 9 . 1 1 13 13 SER N N 13 115.938 115.938 117.333 -1.395 19174
1489 1 9 . 1 1 13 13 SER CA C 13 58.043 58.043 57.699 0.344 19174
1490 1 9 . 1 1 13 13 SER CB C 13 63.774 63.774 65.282 -1.508 19174
1491 1 9 . 1 1 13 13 SER H H 13 8.197 8.197 8.412 -0.215 19174
1492 1 9 . 1 1 14 14 LEU N N 14 124.186 124.186 123.694 0.492 19174
1493 1 9 . 1 1 14 14 LEU CA C 14 55.422 55.422 57.434 -2.012 19174
1494 1 9 . 1 1 14 14 LEU CB C 14 42.329 42.329 40.462 1.867 19174
1495 1 9 . 1 1 14 14 LEU H H 14 8.256 8.256 8.858 -0.602 19174
1496 1 9 . 1 1 15 15 THR N N 15 112.858 112.858 109.448 3.410 19174
1497 1 9 . 1 1 15 15 THR CA C 15 61.379 61.379 64.123 -2.744 19174
1498 1 9 . 1 1 15 15 THR CB C 15 69.810 69.810 67.712 2.098 19174
1499 1 9 . 1 1 15 15 THR H H 15 7.913 7.913 8.267 -0.354 19174
1500 1 9 . 1 1 16 16 SER N N 16 117.578 117.578 118.098 -0.520 19174
1501 1 9 . 1 1 16 16 SER CA C 16 58.678 58.678 58.308 0.370 19174
1502 1 9 . 1 1 16 16 SER CB C 16 63.668 63.668 63.835 -0.167 19174
1503 1 9 . 1 1 16 16 SER H H 16 8.154 8.154 8.402 -0.248 19174
1504 1 9 . 1 1 17 17 ASP N N 17 122.030 122.030 120.748 1.282 19174
1505 1 9 . 1 1 17 17 ASP CA C 17 54.680 54.680 53.916 0.764 19174
1506 1 9 . 1 1 17 17 ASP CB C 17 40.899 40.899 40.696 0.203 19174
1507 1 9 . 1 1 17 17 ASP H H 17 8.263 8.263 8.548 -0.285 19174
1508 1 9 . 1 1 18 18 GLY N N 18 108.815 108.815 107.704 1.111 19174
1509 1 9 . 1 1 18 18 GLY CA C 18 45.758 45.758 44.660 1.098 19174
1510 1 9 . 1 1 18 18 GLY H H 18 8.239 8.239 7.638 0.601 19174
1511 1 9 . 1 1 19 19 ALA N N 19 123.128 123.128 121.670 1.458 19174
1512 1 9 . 1 1 19 19 ALA CA C 19 53.164 53.164 51.521 1.643 19174
1513 1 9 . 1 1 19 19 ALA CB C 19 19.084 19.084 20.797 -1.713 19174
1514 1 9 . 1 1 19 19 ALA H H 19 8.001 8.001 8.299 -0.298 19174
1515 1 9 . 1 1 20 20 GLU N N 20 117.663 117.663 122.294 -4.631 19174
1516 1 9 . 1 1 20 20 GLU CA C 20 57.275 57.275 57.599 -0.324 19174
1517 1 9 . 1 1 20 20 GLU CB C 20 29.250 29.250 30.152 -0.902 19174
1518 1 9 . 1 1 20 20 GLU H H 20 8.231 8.231 8.788 -0.557 19174
1519 1 9 . 1 1 21 21 VAL N N 21 119.044 119.044 119.903 -0.859 19174
1520 1 9 . 1 1 21 21 VAL CA C 21 62.755 62.755 61.684 1.071 19174
1521 1 9 . 1 1 21 21 VAL CB C 21 32.268 32.268 33.277 -1.009 19174
1522 1 9 . 1 1 21 21 VAL H H 21 7.767 7.767 7.620 0.147 19174
1523 1 9 . 1 1 22 22 GLU N N 22 121.765 121.765 124.454 -2.689 19174
1524 1 9 . 1 1 22 22 GLU CA C 22 56.613 56.613 56.629 -0.016 19174
1525 1 9 . 1 1 22 22 GLU CB C 22 29.833 29.833 30.028 -0.195 19174
1526 1 9 . 1 1 22 22 GLU H H 22 7.969 7.969 8.714 -0.745 19174
1527 1 9 . 1 1 23 23 LEU N N 23 120.996 120.996 121.072 -0.076 19174
1528 1 9 . 1 1 23 23 LEU CA C 23 54.310 54.310 56.669 -2.358 19174
1529 1 9 . 1 1 23 23 LEU CB C 23 42.223 42.223 42.163 0.060 19174
1530 1 9 . 1 1 23 23 LEU H H 23 7.917 7.917 7.984 -0.067 19174
1531 1 9 . 1 1 24 24 SER N N 24 114.702 114.702 106.229 8.473 19174
1532 1 9 . 1 1 24 24 SER CA C 24 57.593 57.593 58.388 -0.795 19174
1533 1 9 . 1 1 24 24 SER CB C 24 64.515 64.515 61.252 3.263 19174
1534 1 9 . 1 1 24 24 SER H H 24 7.564 7.564 7.795 -0.231 19174
1535 1 9 . 1 1 25 25 ALA N N 25 125.059 125.059 126.160 -1.101 19174
1536 1 9 . 1 1 25 25 ALA CA C 25 55.898 55.898 56.559 -0.661 19174
1537 1 9 . 1 1 25 25 ALA CB C 25 16.330 16.330 16.816 -0.486 19174
1538 1 9 . 1 1 25 25 ALA H H 25 8.630 8.630 8.910 -0.280 19174
1539 1 9 . 1 1 27 27 VAL N N 27 118.016 118.016 115.049 2.967 19174
1540 1 9 . 1 1 27 27 VAL CA C 27 65.826 65.826 65.361 0.465 19174
1541 1 9 . 1 1 27 27 VAL CB C 27 31.686 31.686 31.259 0.427 19174
1542 1 9 . 1 1 27 27 VAL H H 27 7.294 7.294 7.276 0.018 19174
1543 1 9 . 1 1 28 28 LEU N N 28 119.933 119.933 121.108 -1.175 19174
1544 1 9 . 1 1 28 28 LEU CA C 28 57.990 57.990 58.056 -0.066 19174
1545 1 9 . 1 1 28 28 LEU CB C 28 41.429 41.429 41.199 0.230 19174
1546 1 9 . 1 1 28 28 LEU H H 28 7.939 7.939 8.350 -0.411 19174
1547 1 9 . 1 1 29 29 GLN N N 29 117.644 117.644 118.329 -0.685 19174
1548 1 9 . 1 1 29 29 GLN CA C 29 59.367 59.367 59.389 -0.022 19174
1549 1 9 . 1 1 29 29 GLN CB C 29 28.297 28.297 28.529 -0.232 19174
1550 1 9 . 1 1 29 29 GLN H H 29 8.179 8.179 8.793 -0.614 19174
1551 1 9 . 1 1 30 30 GLU N N 30 118.389 118.389 119.774 -1.385 19174
1552 1 9 . 1 1 30 30 GLU CA C 30 59.128 59.128 58.934 0.194 19174
1553 1 9 . 1 1 30 30 GLU CB C 30 29.038 29.038 29.261 -0.223 19174
1554 1 9 . 1 1 30 30 GLU H H 30 7.752 7.752 7.691 0.061 19174
1555 1 9 . 1 1 31 31 ILE N N 31 120.796 120.796 121.246 -0.450 19174
1556 1 9 . 1 1 31 31 ILE CA C 31 65.509 65.509 65.329 0.180 19174
1557 1 9 . 1 1 31 31 ILE CB C 31 37.775 37.775 37.903 -0.128 19174
1558 1 9 . 1 1 31 31 ILE H H 31 8.131 8.131 7.700 0.431 19174
1559 1 9 . 1 1 32 32 TYR N N 32 120.550 120.550 118.716 1.834 19174
1560 1 9 . 1 1 32 32 TYR CA C 32 61.405 61.405 62.216 -0.811 19174
1561 1 9 . 1 1 32 32 TYR CB C 32 38.358 38.358 37.842 0.516 19174
1562 1 9 . 1 1 32 32 TYR H H 32 8.214 8.214 7.893 0.321 19174
1563 1 9 . 1 1 33 33 LEU N N 33 117.578 117.578 120.006 -2.428 19174
1564 1 9 . 1 1 33 33 LEU CA C 33 57.513 57.513 57.614 -0.101 19174
1565 1 9 . 1 1 33 33 LEU CB C 33 41.657 41.657 41.709 -0.052 19174
1566 1 9 . 1 1 33 33 LEU H H 33 8.347 8.347 8.054 0.293 19174
1567 1 9 . 1 1 34 34 SER N N 34 114.635 114.635 115.041 -0.406 19174
1568 1 9 . 1 1 34 34 SER CA C 34 61.405 61.405 61.595 -0.190 19174
1569 1 9 . 1 1 34 34 SER CB C 34 63.403 63.403 62.275 1.128 19174
1570 1 9 . 1 1 34 34 SER H H 34 7.986 7.986 8.464 -0.478 19174
1571 1 9 . 1 1 35 35 GLY N N 35 110.749 110.749 110.760 -0.011 19174
1572 1 9 . 1 1 35 35 GLY CA C 35 46.897 46.897 46.942 -0.045 19174
1573 1 9 . 1 1 35 35 GLY H H 35 8.302 8.302 8.401 -0.099 19174
1574 1 9 . 1 1 36 36 LEU N N 36 121.632 121.632 122.742 -1.110 19174
1575 1 9 . 1 1 36 36 LEU CA C 36 57.619 57.619 57.438 0.181 19174
1576 1 9 . 1 1 36 36 LEU CB C 36 41.799 41.799 41.867 -0.068 19174
1577 1 9 . 1 1 36 36 LEU H H 36 8.194 8.194 8.031 0.163 19174
1578 1 9 . 1 1 37 37 ARG N N 37 118.274 118.274 118.136 0.138 19174
1579 1 9 . 1 1 37 37 ARG CA C 37 59.049 59.049 59.884 -0.835 19174
1580 1 9 . 1 1 37 37 ARG CB C 37 30.044 30.044 30.139 -0.095 19174
1581 1 9 . 1 1 37 37 ARG H H 37 7.934 7.934 7.842 0.092 19174
1582 1 9 . 1 1 38 38 SER N N 38 114.239 114.239 114.675 -0.436 19174
1583 1 9 . 1 1 38 38 SER CA C 38 60.531 60.531 60.748 -0.217 19174
1584 1 9 . 1 1 38 38 SER CB C 38 63.509 63.509 63.318 0.191 19174
1585 1 9 . 1 1 38 38 SER H H 38 7.913 7.913 7.944 -0.031 19174
1586 1 9 . 1 1 39 39 TRP N N 39 123.095 123.095 125.601 -2.506 19174
1587 1 9 . 1 1 39 39 TRP CA C 39 59.870 59.870 60.384 -0.514 19174
1588 1 9 . 1 1 39 39 TRP CB C 39 28.721 28.721 29.684 -0.963 19174
1589 1 9 . 1 1 39 39 TRP H H 39 8.108 8.108 8.554 -0.446 19174
1590 1 9 . 1 1 40 40 LYS N N 40 119.629 119.629 118.785 0.844 19174
1591 1 9 . 1 1 40 40 LYS CA C 40 59.525 59.525 59.359 0.166 19174
1592 1 9 . 1 1 40 40 LYS CB C 40 32.109 32.109 32.185 -0.076 19174
1593 1 9 . 1 1 40 40 LYS H H 40 7.938 7.938 7.860 0.078 19174
1594 1 9 . 1 1 41 41 ARG N N 41 117.834 117.834 116.566 1.268 19174
1595 1 9 . 1 1 41 41 ARG CA C 41 57.857 57.857 59.005 -1.148 19174
1596 1 9 . 1 1 41 41 ARG CB C 41 30.203 30.203 30.074 0.129 19174
1597 1 9 . 1 1 41 41 ARG H H 41 7.863 7.863 7.525 0.338 19174
1598 1 9 . 1 1 42 42 HIS N N 42 115.774 115.774 117.861 -2.087 19174
1599 1 9 . 1 1 42 42 HIS CA C 42 57.487 57.487 58.439 -0.952 19174
1600 1 9 . 1 1 42 42 HIS CB C 42 30.786 30.786 29.305 1.480 19174
1601 1 9 . 1 1 42 42 HIS H H 42 7.919 7.919 7.504 0.415 19174
1602 1 9 . 1 1 43 43 LEU N N 43 120.243 120.243 119.551 0.692 19174
1603 1 9 . 1 1 43 43 LEU CA C 43 56.745 56.745 54.456 2.289 19174
1604 1 9 . 1 1 43 43 LEU CB C 43 42.276 42.276 41.569 0.707 19174
1605 1 9 . 1 1 43 43 LEU H H 43 8.162 8.162 7.690 0.472 19174
1606 1 9 . 1 1 44 44 SER N N 44 114.616 114.616 115.884 -1.268 19174
1607 1 9 . 1 1 44 44 SER CA C 44 60.987 60.987 61.914 -0.927 19174
1608 1 9 . 1 1 44 44 SER CB C 44 62.768 62.768 62.740 0.028 19174
1609 1 9 . 1 1 44 44 SER H H 44 8.033 8.033 7.610 0.423 19174
1610 1 9 . 1 1 45 45 ARG N N 45 120.757 120.757 120.678 0.079 19174
1611 1 9 . 1 1 45 45 ARG CA C 45 57.513 57.513 59.037 -1.524 19174
1612 1 9 . 1 1 45 45 ARG CB C 45 29.462 29.462 29.904 -0.442 19174
1613 1 9 . 1 1 45 45 ARG H H 45 7.763 7.763 8.069 -0.306 19174
1614 1 9 . 1 1 46 46 PHE N N 46 118.237 118.237 117.907 0.330 19174
1615 1 9 . 1 1 46 46 PHE CA C 46 59.155 59.155 61.107 -1.952 19174
1616 1 9 . 1 1 46 46 PHE CB C 46 39.311 39.311 38.646 0.665 19174
1617 1 9 . 1 1 46 46 PHE H H 46 7.673 7.673 7.922 -0.249 19174
1618 1 9 . 1 1 47 47 TRP N N 47 118.484 118.484 122.026 -3.542 19174
1619 1 9 . 1 1 47 47 TRP CA C 47 58.837 58.837 60.726 -1.889 19174
1620 1 9 . 1 1 47 47 TRP CB C 47 29.833 29.833 29.708 0.125 19174
1621 1 9 . 1 1 47 47 TRP H H 47 7.614 7.614 8.938 -1.324 19174
1622 1 9 . 1 1 48 48 ASN N N 48 114.629 114.629 118.071 -3.442 19174
1623 1 9 . 1 1 48 48 ASN CA C 48 54.124 54.124 55.445 -1.321 19174
1624 1 9 . 1 1 48 48 ASN CB C 48 38.887 38.887 38.293 0.594 19174
1625 1 9 . 1 1 48 48 ASN H H 48 7.811 7.811 8.160 -0.349 19174
1626 1 9 . 1 1 49 49 ASP N N 49 118.029 118.029 118.925 -0.896 19174
1627 1 9 . 1 1 49 49 ASP CA C 49 54.310 54.310 55.444 -1.134 19174
1628 1 9 . 1 1 49 49 ASP CB C 49 40.793 40.793 41.166 -0.373 19174
1629 1 9 . 1 1 49 49 ASP H H 49 7.775 7.775 7.698 0.077 19174
1630 1 10 . 1 1 2 2 ALA N N 2 127.400 127.400 124.305 3.095 19174
1631 1 10 . 1 1 2 2 ALA CA C 2 52.536 52.536 51.840 0.696 19174
1632 1 10 . 1 1 2 2 ALA CB C 2 19.031 19.031 19.599 -0.568 19174
1633 1 10 . 1 1 2 2 ALA H H 2 8.593 8.593 8.051 0.542 19174
1634 1 10 . 1 1 3 3 GLU N N 3 120.977 120.977 121.957 -0.980 19174
1635 1 10 . 1 1 3 3 GLU CA C 3 56.295 56.295 56.276 0.019 19174
1636 1 10 . 1 1 3 3 GLU CB C 3 29.939 29.939 30.336 -0.397 19174
1637 1 10 . 1 1 3 3 GLU H H 3 8.301 8.301 8.396 -0.095 19174
1638 1 10 . 1 1 4 4 ALA N N 4 125.568 125.568 126.639 -1.071 19174
1639 1 10 . 1 1 4 4 ALA CA C 4 52.509 52.509 53.867 -1.359 19174
1640 1 10 . 1 1 4 4 ALA CB C 4 19.084 19.084 19.107 -0.023 19174
1641 1 10 . 1 1 4 4 ALA H H 4 8.229 8.229 8.478 -0.249 19174
1642 1 10 . 1 1 5 5 HIS N N 5 117.815 117.815 116.782 1.033 19174
1643 1 10 . 1 1 5 5 HIS CA C 5 55.157 55.157 55.363 -0.206 19174
1644 1 10 . 1 1 5 5 HIS CB C 5 28.827 28.827 31.098 -2.271 19174
1645 1 10 . 1 1 5 5 HIS H H 5 8.363 8.363 7.997 0.366 19174
1646 1 10 . 1 1 6 6 GLN N N 6 121.556 121.556 121.954 -0.398 19174
1647 1 10 . 1 1 6 6 GLN CA C 6 55.739 55.739 54.852 0.887 19174
1648 1 10 . 1 1 6 6 GLN CB C 6 29.409 29.409 30.515 -1.106 19174
1649 1 10 . 1 1 6 6 GLN H H 6 8.289 8.289 8.638 -0.349 19174
1650 1 10 . 1 1 7 7 ALA N N 7 126.411 126.411 128.599 -2.188 19174
1651 1 10 . 1 1 7 7 ALA CA C 7 52.404 52.404 53.561 -1.157 19174
1652 1 10 . 1 1 7 7 ALA CB C 7 18.978 18.978 19.262 -0.284 19174
1653 1 10 . 1 1 7 7 ALA H H 7 8.311 8.311 8.579 -0.268 19174
1654 1 10 . 1 1 8 8 VAL N N 8 119.771 119.771 119.082 0.689 19174
1655 1 10 . 1 1 8 8 VAL CA C 8 62.491 62.491 62.129 0.362 19174
1656 1 10 . 1 1 8 8 VAL CB C 8 32.586 32.586 32.978 -0.392 19174
1657 1 10 . 1 1 8 8 VAL H H 8 8.018 8.018 7.586 0.432 19174
1658 1 10 . 1 1 9 9 GLY N N 9 112.108 112.108 112.792 -0.684 19174
1659 1 10 . 1 1 9 9 GLY CA C 9 45.044 45.044 45.326 -0.282 19174
1660 1 10 . 1 1 9 9 GLY H H 9 8.243 8.243 8.224 0.019 19174
1661 1 10 . 1 1 10 10 PHE N N 10 120.842 120.842 120.928 -0.086 19174
1662 1 10 . 1 1 10 10 PHE CA C 10 57.725 57.725 57.477 0.247 19174
1663 1 10 . 1 1 10 10 PHE CB C 10 39.628 39.628 40.061 -0.433 19174
1664 1 10 . 1 1 10 10 PHE H H 10 7.983 7.983 8.637 -0.654 19174
1665 1 10 . 1 1 11 11 ARG N N 11 125.277 125.277 127.325 -2.048 19174
1666 1 10 . 1 1 11 11 ARG CA C 11 53.410 53.410 55.186 -1.776 19174
1667 1 10 . 1 1 11 11 ARG CB C 11 30.574 30.574 29.166 1.408 19174
1668 1 10 . 1 1 11 11 ARG H H 11 8.016 8.016 7.968 0.048 19174
1669 1 10 . 1 1 13 13 SER N N 13 115.938 115.938 117.825 -1.887 19174
1670 1 10 . 1 1 13 13 SER CA C 13 58.043 58.043 57.816 0.228 19174
1671 1 10 . 1 1 13 13 SER CB C 13 63.774 63.774 64.191 -0.417 19174
1672 1 10 . 1 1 13 13 SER H H 13 8.197 8.197 8.383 -0.186 19174
1673 1 10 . 1 1 14 14 LEU N N 14 124.186 124.186 119.891 4.295 19174
1674 1 10 . 1 1 14 14 LEU CA C 14 55.422 55.422 56.448 -1.026 19174
1675 1 10 . 1 1 14 14 LEU CB C 14 42.329 42.329 41.249 1.080 19174
1676 1 10 . 1 1 14 14 LEU H H 14 8.256 8.256 8.525 -0.269 19174
1677 1 10 . 1 1 15 15 THR N N 15 112.858 112.858 111.816 1.042 19174
1678 1 10 . 1 1 15 15 THR CA C 15 61.379 61.379 60.520 0.859 19174
1679 1 10 . 1 1 15 15 THR CB C 15 69.810 69.810 69.993 -0.183 19174
1680 1 10 . 1 1 15 15 THR H H 15 7.913 7.913 7.720 0.193 19174
1681 1 10 . 1 1 16 16 SER N N 16 117.578 117.578 115.842 1.736 19174
1682 1 10 . 1 1 16 16 SER CA C 16 58.678 58.678 57.940 0.738 19174
1683 1 10 . 1 1 16 16 SER CB C 16 63.668 63.668 64.325 -0.657 19174
1684 1 10 . 1 1 16 16 SER H H 16 8.154 8.154 8.329 -0.175 19174
1685 1 10 . 1 1 17 17 ASP N N 17 122.030 122.030 121.842 0.188 19174
1686 1 10 . 1 1 17 17 ASP CA C 17 54.680 54.680 55.288 -0.608 19174
1687 1 10 . 1 1 17 17 ASP CB C 17 40.899 40.899 40.992 -0.093 19174
1688 1 10 . 1 1 17 17 ASP H H 17 8.263 8.263 8.438 -0.175 19174
1689 1 10 . 1 1 18 18 GLY N N 18 108.815 108.815 109.872 -1.057 19174
1690 1 10 . 1 1 18 18 GLY CA C 18 45.758 45.758 45.563 0.195 19174
1691 1 10 . 1 1 18 18 GLY H H 18 8.239 8.239 8.549 -0.310 19174
1692 1 10 . 1 1 19 19 ALA N N 19 123.128 123.128 122.597 0.531 19174
1693 1 10 . 1 1 19 19 ALA CA C 19 53.164 53.164 54.188 -1.024 19174
1694 1 10 . 1 1 19 19 ALA CB C 19 19.084 19.084 18.787 0.297 19174
1695 1 10 . 1 1 19 19 ALA H H 19 8.001 8.001 7.560 0.441 19174
1696 1 10 . 1 1 20 20 GLU N N 20 117.663 117.663 118.162 -0.499 19174
1697 1 10 . 1 1 20 20 GLU CA C 20 57.275 57.275 58.638 -1.363 19174
1698 1 10 . 1 1 20 20 GLU CB C 20 29.250 29.250 29.207 0.043 19174
1699 1 10 . 1 1 20 20 GLU H H 20 8.231 8.231 8.171 0.060 19174
1700 1 10 . 1 1 21 21 VAL N N 21 119.044 119.044 119.782 -0.738 19174
1701 1 10 . 1 1 21 21 VAL CA C 21 62.755 62.755 64.822 -2.067 19174
1702 1 10 . 1 1 21 21 VAL CB C 21 32.268 32.268 31.609 0.659 19174
1703 1 10 . 1 1 21 21 VAL H H 21 7.767 7.767 7.595 0.172 19174
1704 1 10 . 1 1 22 22 GLU N N 22 121.765 121.765 118.603 3.162 19174
1705 1 10 . 1 1 22 22 GLU CA C 22 56.613 56.613 58.377 -1.764 19174
1706 1 10 . 1 1 22 22 GLU CB C 22 29.833 29.833 30.069 -0.236 19174
1707 1 10 . 1 1 22 22 GLU H H 22 7.969 7.969 7.569 0.400 19174
1708 1 10 . 1 1 23 23 LEU N N 23 120.996 120.996 121.052 -0.056 19174
1709 1 10 . 1 1 23 23 LEU CA C 23 54.310 54.310 54.047 0.263 19174
1710 1 10 . 1 1 23 23 LEU CB C 23 42.223 42.223 43.541 -1.317 19174
1711 1 10 . 1 1 23 23 LEU H H 23 7.917 7.917 7.535 0.382 19174
1712 1 10 . 1 1 24 24 SER N N 24 114.702 114.702 117.783 -3.081 19174
1713 1 10 . 1 1 24 24 SER CA C 24 57.593 57.593 57.005 0.588 19174
1714 1 10 . 1 1 24 24 SER CB C 24 64.515 64.515 65.841 -1.326 19174
1715 1 10 . 1 1 24 24 SER H H 24 7.564 7.564 8.056 -0.492 19174
1716 1 10 . 1 1 25 25 ALA N N 25 125.059 125.059 124.099 0.960 19174
1717 1 10 . 1 1 25 25 ALA CA C 25 55.898 55.898 56.706 -0.808 19174
1718 1 10 . 1 1 25 25 ALA CB C 25 16.330 16.330 16.342 -0.012 19174
1719 1 10 . 1 1 25 25 ALA H H 25 8.630 8.630 8.854 -0.224 19174
1720 1 10 . 1 1 27 27 VAL N N 27 118.016 118.016 117.795 0.221 19174
1721 1 10 . 1 1 27 27 VAL CA C 27 65.826 65.826 66.085 -0.259 19174
1722 1 10 . 1 1 27 27 VAL CB C 27 31.686 31.686 31.426 0.260 19174
1723 1 10 . 1 1 27 27 VAL H H 27 7.294 7.294 7.400 -0.106 19174
1724 1 10 . 1 1 28 28 LEU N N 28 119.933 119.933 120.128 -0.195 19174
1725 1 10 . 1 1 28 28 LEU CA C 28 57.990 57.990 58.292 -0.302 19174
1726 1 10 . 1 1 28 28 LEU CB C 28 41.429 41.429 41.268 0.161 19174
1727 1 10 . 1 1 28 28 LEU H H 28 7.939 7.939 8.309 -0.370 19174
1728 1 10 . 1 1 29 29 GLN N N 29 117.644 117.644 118.528 -0.884 19174
1729 1 10 . 1 1 29 29 GLN CA C 29 59.367 59.367 59.556 -0.189 19174
1730 1 10 . 1 1 29 29 GLN CB C 29 28.297 28.297 28.497 -0.200 19174
1731 1 10 . 1 1 29 29 GLN H H 29 8.179 8.179 8.813 -0.634 19174
1732 1 10 . 1 1 30 30 GLU N N 30 118.389 118.389 120.409 -2.020 19174
1733 1 10 . 1 1 30 30 GLU CA C 30 59.128 59.128 59.304 -0.176 19174
1734 1 10 . 1 1 30 30 GLU CB C 30 29.038 29.038 29.555 -0.517 19174
1735 1 10 . 1 1 30 30 GLU H H 30 7.752 7.752 7.806 -0.054 19174
1736 1 10 . 1 1 31 31 ILE N N 31 120.796 120.796 121.314 -0.518 19174
1737 1 10 . 1 1 31 31 ILE CA C 31 65.509 65.509 65.379 0.130 19174
1738 1 10 . 1 1 31 31 ILE CB C 31 37.775 37.775 38.126 -0.351 19174
1739 1 10 . 1 1 31 31 ILE H H 31 8.131 8.131 8.027 0.104 19174
1740 1 10 . 1 1 32 32 TYR N N 32 120.550 120.550 120.715 -0.165 19174
1741 1 10 . 1 1 32 32 TYR CA C 32 61.405 61.405 62.298 -0.893 19174
1742 1 10 . 1 1 32 32 TYR CB C 32 38.358 38.358 38.502 -0.144 19174
1743 1 10 . 1 1 32 32 TYR H H 32 8.214 8.214 8.156 0.058 19174
1744 1 10 . 1 1 33 33 LEU N N 33 117.578 117.578 118.219 -0.641 19174
1745 1 10 . 1 1 33 33 LEU CA C 33 57.513 57.513 57.828 -0.315 19174
1746 1 10 . 1 1 33 33 LEU CB C 33 41.657 41.657 41.655 0.002 19174
1747 1 10 . 1 1 33 33 LEU H H 33 8.347 8.347 8.335 0.012 19174
1748 1 10 . 1 1 34 34 SER N N 34 114.635 114.635 114.643 -0.008 19174
1749 1 10 . 1 1 34 34 SER CA C 34 61.405 61.405 61.570 -0.165 19174
1750 1 10 . 1 1 34 34 SER CB C 34 63.403 63.403 62.536 0.867 19174
1751 1 10 . 1 1 34 34 SER H H 34 7.986 7.986 8.543 -0.557 19174
1752 1 10 . 1 1 35 35 GLY N N 35 110.749 110.749 110.253 0.496 19174
1753 1 10 . 1 1 35 35 GLY CA C 35 46.897 46.897 46.766 0.131 19174
1754 1 10 . 1 1 35 35 GLY H H 35 8.302 8.302 8.251 0.051 19174
1755 1 10 . 1 1 36 36 LEU N N 36 121.632 121.632 122.632 -1.000 19174
1756 1 10 . 1 1 36 36 LEU CA C 36 57.619 57.619 57.229 0.390 19174
1757 1 10 . 1 1 36 36 LEU CB C 36 41.799 41.799 41.581 0.218 19174
1758 1 10 . 1 1 36 36 LEU H H 36 8.194 8.194 7.596 0.598 19174
1759 1 10 . 1 1 37 37 ARG N N 37 118.274 118.274 118.563 -0.289 19174
1760 1 10 . 1 1 37 37 ARG CA C 37 59.049 59.049 59.637 -0.588 19174
1761 1 10 . 1 1 37 37 ARG CB C 37 30.044 30.044 29.944 0.100 19174
1762 1 10 . 1 1 37 37 ARG H H 37 7.934 7.934 7.674 0.260 19174
1763 1 10 . 1 1 38 38 SER N N 38 114.239 114.239 115.164 -0.925 19174
1764 1 10 . 1 1 38 38 SER CA C 38 60.531 60.531 60.679 -0.148 19174
1765 1 10 . 1 1 38 38 SER CB C 38 63.509 63.509 62.821 0.688 19174
1766 1 10 . 1 1 38 38 SER H H 38 7.913 7.913 7.595 0.318 19174
1767 1 10 . 1 1 39 39 TRP N N 39 123.095 123.095 124.444 -1.349 19174
1768 1 10 . 1 1 39 39 TRP CA C 39 59.870 59.870 60.727 -0.858 19174
1769 1 10 . 1 1 39 39 TRP CB C 39 28.721 28.721 29.412 -0.691 19174
1770 1 10 . 1 1 39 39 TRP H H 39 8.108 8.108 8.588 -0.480 19174
1771 1 10 . 1 1 40 40 LYS N N 40 119.629 119.629 118.648 0.981 19174
1772 1 10 . 1 1 40 40 LYS CA C 40 59.525 59.525 59.169 0.356 19174
1773 1 10 . 1 1 40 40 LYS CB C 40 32.109 32.109 32.165 -0.056 19174
1774 1 10 . 1 1 40 40 LYS H H 40 7.938 7.938 7.961 -0.023 19174
1775 1 10 . 1 1 41 41 ARG N N 41 117.834 117.834 118.105 -0.271 19174
1776 1 10 . 1 1 41 41 ARG CA C 41 57.857 57.857 59.151 -1.294 19174
1777 1 10 . 1 1 41 41 ARG CB C 41 30.203 30.203 30.006 0.196 19174
1778 1 10 . 1 1 41 41 ARG H H 41 7.863 7.863 7.474 0.389 19174
1779 1 10 . 1 1 42 42 HIS N N 42 115.774 115.774 118.015 -2.241 19174
1780 1 10 . 1 1 42 42 HIS CA C 42 57.487 57.487 57.623 -0.136 19174
1781 1 10 . 1 1 42 42 HIS CB C 42 30.786 30.786 29.678 1.107 19174
1782 1 10 . 1 1 42 42 HIS H H 42 7.919 7.919 7.484 0.435 19174
1783 1 10 . 1 1 43 43 LEU N N 43 120.243 120.243 118.840 1.403 19174
1784 1 10 . 1 1 43 43 LEU CA C 43 56.745 56.745 54.373 2.372 19174
1785 1 10 . 1 1 43 43 LEU CB C 43 42.276 42.276 41.703 0.573 19174
1786 1 10 . 1 1 43 43 LEU H H 43 8.162 8.162 7.515 0.647 19174
1787 1 10 . 1 1 44 44 SER N N 44 114.616 114.616 115.766 -1.150 19174
1788 1 10 . 1 1 44 44 SER CA C 44 60.987 60.987 62.312 -1.325 19174
1789 1 10 . 1 1 44 44 SER CB C 44 62.768 62.768 62.946 -0.178 19174
1790 1 10 . 1 1 44 44 SER H H 44 8.033 8.033 8.075 -0.042 19174
1791 1 10 . 1 1 45 45 ARG N N 45 120.757 120.757 120.625 0.132 19174
1792 1 10 . 1 1 45 45 ARG CA C 45 57.513 57.513 59.093 -1.580 19174
1793 1 10 . 1 1 45 45 ARG CB C 45 29.462 29.462 30.029 -0.567 19174
1794 1 10 . 1 1 45 45 ARG H H 45 7.763 7.763 8.106 -0.343 19174
1795 1 10 . 1 1 46 46 PHE N N 46 118.237 118.237 119.819 -1.582 19174
1796 1 10 . 1 1 46 46 PHE CA C 46 59.155 59.155 60.603 -1.448 19174
1797 1 10 . 1 1 46 46 PHE CB C 46 39.311 39.311 38.919 0.392 19174
1798 1 10 . 1 1 46 46 PHE H H 46 7.673 7.673 7.998 -0.325 19174
1799 1 10 . 1 1 47 47 TRP N N 47 118.484 118.484 119.851 -1.367 19174
1800 1 10 . 1 1 47 47 TRP CA C 47 58.837 58.837 59.208 -0.370 19174
1801 1 10 . 1 1 47 47 TRP CB C 47 29.833 29.833 30.011 -0.177 19174
1802 1 10 . 1 1 47 47 TRP H H 47 7.614 7.614 8.386 -0.772 19174
1803 1 10 . 1 1 48 48 ASN N N 48 114.629 114.629 116.250 -1.621 19174
1804 1 10 . 1 1 48 48 ASN CA C 48 54.124 54.124 55.094 -0.970 19174
1805 1 10 . 1 1 48 48 ASN CB C 48 38.887 38.887 38.549 0.338 19174
1806 1 10 . 1 1 48 48 ASN H H 48 7.811 7.811 8.034 -0.223 19174
1807 1 10 . 1 1 49 49 ASP N N 49 118.029 118.029 119.738 -1.709 19174
1808 1 10 . 1 1 49 49 ASP CA C 49 54.310 54.310 52.741 1.569 19174
1809 1 10 . 1 1 49 49 ASP CB C 49 40.793 40.793 40.730 0.063 19174
1810 1 10 . 1 1 49 49 ASP H H 49 7.775 7.775 7.409 0.366 19174
1811 1 11 . 1 1 2 2 ALA N N 2 127.400 127.400 123.979 3.421 19174
1812 1 11 . 1 1 2 2 ALA CA C 2 52.536 52.536 51.618 0.918 19174
1813 1 11 . 1 1 2 2 ALA CB C 2 19.031 19.031 20.987 -1.956 19174
1814 1 11 . 1 1 2 2 ALA H H 2 8.593 8.593 8.503 0.090 19174
1815 1 11 . 1 1 3 3 GLU N N 3 120.977 120.977 120.967 0.010 19174
1816 1 11 . 1 1 3 3 GLU CA C 3 56.295 56.295 56.303 -0.008 19174
1817 1 11 . 1 1 3 3 GLU CB C 3 29.939 29.939 30.381 -0.442 19174
1818 1 11 . 1 1 3 3 GLU H H 3 8.301 8.301 8.573 -0.272 19174
1819 1 11 . 1 1 4 4 ALA N N 4 125.568 125.568 128.186 -2.618 19174
1820 1 11 . 1 1 4 4 ALA CA C 4 52.509 52.509 51.247 1.262 19174
1821 1 11 . 1 1 4 4 ALA CB C 4 19.084 19.084 21.707 -2.623 19174
1822 1 11 . 1 1 4 4 ALA H H 4 8.229 8.229 8.427 -0.198 19174
1823 1 11 . 1 1 5 5 HIS N N 5 117.815 117.815 121.372 -3.557 19174
1824 1 11 . 1 1 5 5 HIS CA C 5 55.157 55.157 60.459 -5.302 19174
1825 1 11 . 1 1 5 5 HIS CB C 5 28.827 28.827 30.056 -1.229 19174
1826 1 11 . 1 1 5 5 HIS H H 5 8.363 8.363 8.776 -0.413 19174
1827 1 11 . 1 1 6 6 GLN N N 6 121.556 121.556 119.424 2.132 19174
1828 1 11 . 1 1 6 6 GLN CA C 6 55.739 55.739 58.259 -2.520 19174
1829 1 11 . 1 1 6 6 GLN CB C 6 29.409 29.409 28.419 0.990 19174
1830 1 11 . 1 1 6 6 GLN H H 6 8.289 8.289 8.714 -0.425 19174
1831 1 11 . 1 1 7 7 ALA N N 7 126.411 126.411 120.981 5.430 19174
1832 1 11 . 1 1 7 7 ALA CA C 7 52.404 52.404 54.492 -2.088 19174
1833 1 11 . 1 1 7 7 ALA CB C 7 18.978 18.978 18.199 0.779 19174
1834 1 11 . 1 1 7 7 ALA H H 7 8.311 8.311 7.901 0.410 19174
1835 1 11 . 1 1 8 8 VAL N N 8 119.771 119.771 116.922 2.849 19174
1836 1 11 . 1 1 8 8 VAL CA C 8 62.491 62.491 63.737 -1.246 19174
1837 1 11 . 1 1 8 8 VAL CB C 8 32.586 32.586 32.010 0.576 19174
1838 1 11 . 1 1 8 8 VAL H H 8 8.018 8.018 7.769 0.249 19174
1839 1 11 . 1 1 9 9 GLY N N 9 112.108 112.108 106.450 5.658 19174
1840 1 11 . 1 1 9 9 GLY CA C 9 45.044 45.044 44.323 0.721 19174
1841 1 11 . 1 1 9 9 GLY H H 9 8.243 8.243 7.619 0.625 19174
1842 1 11 . 1 1 10 10 PHE N N 10 120.842 120.842 119.235 1.607 19174
1843 1 11 . 1 1 10 10 PHE CA C 10 57.725 57.725 57.617 0.108 19174
1844 1 11 . 1 1 10 10 PHE CB C 10 39.628 39.628 40.628 -1.000 19174
1845 1 11 . 1 1 10 10 PHE H H 10 7.983 7.983 8.508 -0.525 19174
1846 1 11 . 1 1 11 11 ARG N N 11 125.277 125.277 124.614 0.663 19174
1847 1 11 . 1 1 11 11 ARG CA C 11 53.410 53.410 54.839 -1.429 19174
1848 1 11 . 1 1 11 11 ARG CB C 11 30.574 30.574 30.782 -0.208 19174
1849 1 11 . 1 1 11 11 ARG H H 11 8.016 8.016 8.572 -0.556 19174
1850 1 11 . 1 1 13 13 SER N N 13 115.938 115.938 115.318 0.620 19174
1851 1 11 . 1 1 13 13 SER CA C 13 58.043 58.043 59.097 -1.054 19174
1852 1 11 . 1 1 13 13 SER CB C 13 63.774 63.774 63.406 0.368 19174
1853 1 11 . 1 1 13 13 SER H H 13 8.197 8.197 8.310 -0.113 19174
1854 1 11 . 1 1 14 14 LEU N N 14 124.186 124.186 123.580 0.606 19174
1855 1 11 . 1 1 14 14 LEU CA C 14 55.422 55.422 55.066 0.356 19174
1856 1 11 . 1 1 14 14 LEU CB C 14 42.329 42.329 41.939 0.390 19174
1857 1 11 . 1 1 14 14 LEU H H 14 8.256 8.256 7.500 0.756 19174
1858 1 11 . 1 1 15 15 THR N N 15 112.858 112.858 113.394 -0.536 19174
1859 1 11 . 1 1 15 15 THR CA C 15 61.379 61.379 62.327 -0.948 19174
1860 1 11 . 1 1 15 15 THR CB C 15 69.810 69.810 69.487 0.323 19174
1861 1 11 . 1 1 15 15 THR H H 15 7.913 7.913 8.239 -0.326 19174
1862 1 11 . 1 1 16 16 SER N N 16 117.578 117.578 116.535 1.043 19174
1863 1 11 . 1 1 16 16 SER CA C 16 58.678 58.678 57.996 0.682 19174
1864 1 11 . 1 1 16 16 SER CB C 16 63.668 63.668 63.822 -0.154 19174
1865 1 11 . 1 1 16 16 SER H H 16 8.154 8.154 8.231 -0.077 19174
1866 1 11 . 1 1 17 17 ASP N N 17 122.030 122.030 118.942 3.088 19174
1867 1 11 . 1 1 17 17 ASP CA C 17 54.680 54.680 53.777 0.903 19174
1868 1 11 . 1 1 17 17 ASP CB C 17 40.899 40.899 40.824 0.075 19174
1869 1 11 . 1 1 17 17 ASP H H 17 8.263 8.263 8.556 -0.293 19174
1870 1 11 . 1 1 18 18 GLY N N 18 108.815 108.815 107.030 1.785 19174
1871 1 11 . 1 1 18 18 GLY CA C 18 45.758 45.758 44.695 1.063 19174
1872 1 11 . 1 1 18 18 GLY H H 18 8.239 8.239 8.176 0.063 19174
1873 1 11 . 1 1 19 19 ALA N N 19 123.128 123.128 123.325 -0.197 19174
1874 1 11 . 1 1 19 19 ALA CA C 19 53.164 53.164 52.578 0.586 19174
1875 1 11 . 1 1 19 19 ALA CB C 19 19.084 19.084 19.661 -0.577 19174
1876 1 11 . 1 1 19 19 ALA H H 19 8.001 8.001 8.128 -0.127 19174
1877 1 11 . 1 1 20 20 GLU N N 20 117.663 117.663 122.314 -4.651 19174
1878 1 11 . 1 1 20 20 GLU CA C 20 57.275 57.275 55.379 1.896 19174
1879 1 11 . 1 1 20 20 GLU CB C 20 29.250 29.250 31.950 -2.700 19174
1880 1 11 . 1 1 20 20 GLU H H 20 8.231 8.231 8.508 -0.277 19174
1881 1 11 . 1 1 21 21 VAL N N 21 119.044 119.044 126.695 -7.651 19174
1882 1 11 . 1 1 21 21 VAL CA C 21 62.755 62.755 65.088 -2.333 19174
1883 1 11 . 1 1 21 21 VAL CB C 21 32.268 32.268 32.291 -0.023 19174
1884 1 11 . 1 1 21 21 VAL H H 21 7.767 7.767 8.769 -1.002 19174
1885 1 11 . 1 1 22 22 GLU N N 22 121.765 121.765 118.130 3.635 19174
1886 1 11 . 1 1 22 22 GLU CA C 22 56.613 56.613 58.506 -1.893 19174
1887 1 11 . 1 1 22 22 GLU CB C 22 29.833 29.833 29.511 0.322 19174
1888 1 11 . 1 1 22 22 GLU H H 22 7.969 7.969 8.156 -0.187 19174
1889 1 11 . 1 1 23 23 LEU N N 23 120.996 120.996 118.101 2.895 19174
1890 1 11 . 1 1 23 23 LEU CA C 23 54.310 54.310 56.204 -1.894 19174
1891 1 11 . 1 1 23 23 LEU CB C 23 42.223 42.223 42.277 -0.054 19174
1892 1 11 . 1 1 23 23 LEU H H 23 7.917 7.917 7.806 0.111 19174
1893 1 11 . 1 1 24 24 SER N N 24 114.702 114.702 115.125 -0.423 19174
1894 1 11 . 1 1 24 24 SER CA C 24 57.593 57.593 58.883 -1.290 19174
1895 1 11 . 1 1 24 24 SER CB C 24 64.515 64.515 62.234 2.281 19174
1896 1 11 . 1 1 24 24 SER H H 24 7.564 7.564 7.727 -0.163 19174
1897 1 11 . 1 1 25 25 ALA N N 25 125.059 125.059 131.246 -6.187 19174
1898 1 11 . 1 1 25 25 ALA CA C 25 55.898 55.898 55.638 0.260 19174
1899 1 11 . 1 1 25 25 ALA CB C 25 16.330 16.330 17.066 -0.736 19174
1900 1 11 . 1 1 25 25 ALA H H 25 8.630 8.630 8.223 0.407 19174
1901 1 11 . 1 1 27 27 VAL N N 27 118.016 118.016 116.871 1.145 19174
1902 1 11 . 1 1 27 27 VAL CA C 27 65.826 65.826 65.854 -0.028 19174
1903 1 11 . 1 1 27 27 VAL CB C 27 31.686 31.686 31.672 0.014 19174
1904 1 11 . 1 1 27 27 VAL H H 27 7.294 7.294 7.507 -0.213 19174
1905 1 11 . 1 1 28 28 LEU N N 28 119.933 119.933 119.557 0.376 19174
1906 1 11 . 1 1 28 28 LEU CA C 28 57.990 57.990 57.935 0.055 19174
1907 1 11 . 1 1 28 28 LEU CB C 28 41.429 41.429 41.227 0.202 19174
1908 1 11 . 1 1 28 28 LEU H H 28 7.939 7.939 7.424 0.515 19174
1909 1 11 . 1 1 29 29 GLN N N 29 117.644 117.644 117.364 0.280 19174
1910 1 11 . 1 1 29 29 GLN CA C 29 59.367 59.367 58.628 0.739 19174
1911 1 11 . 1 1 29 29 GLN CB C 29 28.297 28.297 28.046 0.251 19174
1912 1 11 . 1 1 29 29 GLN H H 29 8.179 8.179 7.734 0.445 19174
1913 1 11 . 1 1 30 30 GLU N N 30 118.389 118.389 120.814 -2.425 19174
1914 1 11 . 1 1 30 30 GLU CA C 30 59.128 59.128 59.302 -0.174 19174
1915 1 11 . 1 1 30 30 GLU CB C 30 29.038 29.038 29.616 -0.578 19174
1916 1 11 . 1 1 30 30 GLU H H 30 7.752 7.752 8.198 -0.446 19174
1917 1 11 . 1 1 31 31 ILE N N 31 120.796 120.796 120.486 0.310 19174
1918 1 11 . 1 1 31 31 ILE CA C 31 65.509 65.509 65.508 0.001 19174
1919 1 11 . 1 1 31 31 ILE CB C 31 37.775 37.775 37.998 -0.223 19174
1920 1 11 . 1 1 31 31 ILE H H 31 8.131 8.131 7.977 0.154 19174
1921 1 11 . 1 1 32 32 TYR N N 32 120.550 120.550 119.071 1.479 19174
1922 1 11 . 1 1 32 32 TYR CA C 32 61.405 61.405 61.800 -0.395 19174
1923 1 11 . 1 1 32 32 TYR CB C 32 38.358 38.358 37.903 0.455 19174
1924 1 11 . 1 1 32 32 TYR H H 32 8.214 8.214 8.057 0.157 19174
1925 1 11 . 1 1 33 33 LEU N N 33 117.578 117.578 119.016 -1.438 19174
1926 1 11 . 1 1 33 33 LEU CA C 33 57.513 57.513 58.127 -0.614 19174
1927 1 11 . 1 1 33 33 LEU CB C 33 41.657 41.657 40.765 0.892 19174
1928 1 11 . 1 1 33 33 LEU H H 33 8.347 8.347 7.961 0.386 19174
1929 1 11 . 1 1 34 34 SER N N 34 114.635 114.635 115.293 -0.658 19174
1930 1 11 . 1 1 34 34 SER CA C 34 61.405 61.405 61.814 -0.409 19174
1931 1 11 . 1 1 34 34 SER CB C 34 63.403 63.403 62.592 0.811 19174
1932 1 11 . 1 1 34 34 SER H H 34 7.986 7.986 8.479 -0.493 19174
1933 1 11 . 1 1 35 35 GLY N N 35 110.749 110.749 109.883 0.866 19174
1934 1 11 . 1 1 35 35 GLY CA C 35 46.897 46.897 46.894 0.003 19174
1935 1 11 . 1 1 35 35 GLY H H 35 8.302 8.302 8.430 -0.128 19174
1936 1 11 . 1 1 36 36 LEU N N 36 121.632 121.632 122.849 -1.217 19174
1937 1 11 . 1 1 36 36 LEU CA C 36 57.619 57.619 57.542 0.077 19174
1938 1 11 . 1 1 36 36 LEU CB C 36 41.799 41.799 41.874 -0.076 19174
1939 1 11 . 1 1 36 36 LEU H H 36 8.194 8.194 8.027 0.167 19174
1940 1 11 . 1 1 37 37 ARG N N 37 118.274 118.274 118.442 -0.168 19174
1941 1 11 . 1 1 37 37 ARG CA C 37 59.049 59.049 59.924 -0.875 19174
1942 1 11 . 1 1 37 37 ARG CB C 37 30.044 30.044 30.069 -0.025 19174
1943 1 11 . 1 1 37 37 ARG H H 37 7.934 7.934 7.846 0.088 19174
1944 1 11 . 1 1 38 38 SER N N 38 114.239 114.239 116.273 -2.034 19174
1945 1 11 . 1 1 38 38 SER CA C 38 60.531 60.531 61.016 -0.485 19174
1946 1 11 . 1 1 38 38 SER CB C 38 63.509 63.509 63.256 0.253 19174
1947 1 11 . 1 1 38 38 SER H H 38 7.913 7.913 7.834 0.079 19174
1948 1 11 . 1 1 39 39 TRP N N 39 123.095 123.095 124.756 -1.661 19174
1949 1 11 . 1 1 39 39 TRP CA C 39 59.870 59.870 61.020 -1.151 19174
1950 1 11 . 1 1 39 39 TRP CB C 39 28.721 28.721 29.209 -0.488 19174
1951 1 11 . 1 1 39 39 TRP H H 39 8.108 8.108 8.905 -0.797 19174
1952 1 11 . 1 1 40 40 LYS N N 40 119.629 119.629 118.599 1.030 19174
1953 1 11 . 1 1 40 40 LYS CA C 40 59.525 59.525 60.212 -0.687 19174
1954 1 11 . 1 1 40 40 LYS CB C 40 32.109 32.109 31.863 0.246 19174
1955 1 11 . 1 1 40 40 LYS H H 40 7.938 7.938 7.813 0.125 19174
1956 1 11 . 1 1 41 41 ARG N N 41 117.834 117.834 117.701 0.133 19174
1957 1 11 . 1 1 41 41 ARG CA C 41 57.857 57.857 59.035 -1.178 19174
1958 1 11 . 1 1 41 41 ARG CB C 41 30.203 30.203 29.921 0.282 19174
1959 1 11 . 1 1 41 41 ARG H H 41 7.863 7.863 7.906 -0.043 19174
1960 1 11 . 1 1 42 42 HIS N N 42 115.774 115.774 117.398 -1.624 19174
1961 1 11 . 1 1 42 42 HIS CA C 42 57.487 57.487 59.076 -1.589 19174
1962 1 11 . 1 1 42 42 HIS CB C 42 30.786 30.786 30.213 0.573 19174
1963 1 11 . 1 1 42 42 HIS H H 42 7.919 7.919 7.636 0.283 19174
1964 1 11 . 1 1 43 43 LEU N N 43 120.243 120.243 120.170 0.073 19174
1965 1 11 . 1 1 43 43 LEU CA C 43 56.745 56.745 55.108 1.637 19174
1966 1 11 . 1 1 43 43 LEU CB C 43 42.276 42.276 41.316 0.959 19174
1967 1 11 . 1 1 43 43 LEU H H 43 8.162 8.162 8.456 -0.294 19174
1968 1 11 . 1 1 44 44 SER N N 44 114.616 114.616 116.388 -1.772 19174
1969 1 11 . 1 1 44 44 SER CA C 44 60.987 60.987 62.200 -1.213 19174
1970 1 11 . 1 1 44 44 SER CB C 44 62.768 62.768 62.788 -0.020 19174
1971 1 11 . 1 1 44 44 SER H H 44 8.033 8.033 8.157 -0.124 19174
1972 1 11 . 1 1 45 45 ARG N N 45 120.757 120.757 121.521 -0.764 19174
1973 1 11 . 1 1 45 45 ARG CA C 45 57.513 57.513 59.230 -1.717 19174
1974 1 11 . 1 1 45 45 ARG CB C 45 29.462 29.462 29.743 -0.281 19174
1975 1 11 . 1 1 45 45 ARG H H 45 7.763 7.763 8.323 -0.560 19174
1976 1 11 . 1 1 46 46 PHE N N 46 118.237 118.237 116.381 1.856 19174
1977 1 11 . 1 1 46 46 PHE CA C 46 59.155 59.155 60.930 -1.775 19174
1978 1 11 . 1 1 46 46 PHE CB C 46 39.311 39.311 38.833 0.478 19174
1979 1 11 . 1 1 46 46 PHE H H 46 7.673 7.673 8.147 -0.474 19174
1980 1 11 . 1 1 47 47 TRP N N 47 118.484 118.484 120.295 -1.811 19174
1981 1 11 . 1 1 47 47 TRP CA C 47 58.837 58.837 59.477 -0.640 19174
1982 1 11 . 1 1 47 47 TRP CB C 47 29.833 29.833 29.967 -0.134 19174
1983 1 11 . 1 1 47 47 TRP H H 47 7.614 7.614 8.311 -0.697 19174
1984 1 11 . 1 1 48 48 ASN N N 48 114.629 114.629 117.737 -3.108 19174
1985 1 11 . 1 1 48 48 ASN CA C 48 54.124 54.124 54.704 -0.580 19174
1986 1 11 . 1 1 48 48 ASN CB C 48 38.887 38.887 38.806 0.081 19174
1987 1 11 . 1 1 48 48 ASN H H 48 7.811 7.811 8.128 -0.317 19174
1988 1 11 . 1 1 49 49 ASP N N 49 118.029 118.029 120.733 -2.704 19174
1989 1 11 . 1 1 49 49 ASP CA C 49 54.310 54.310 55.774 -1.464 19174
1990 1 11 . 1 1 49 49 ASP CB C 49 40.793 40.793 41.199 -0.406 19174
1991 1 11 . 1 1 49 49 ASP H H 49 7.775 7.775 7.814 -0.039 19174
1992 1 12 . 1 1 2 2 ALA N N 2 127.400 127.400 121.728 5.672 19174
1993 1 12 . 1 1 2 2 ALA CA C 2 52.536 52.536 54.587 -2.051 19174
1994 1 12 . 1 1 2 2 ALA CB C 2 19.031 19.031 18.528 0.503 19174
1995 1 12 . 1 1 2 2 ALA H H 2 8.593 8.593 8.186 0.407 19174
1996 1 12 . 1 1 3 3 GLU N N 3 120.977 120.977 119.301 1.676 19174
1997 1 12 . 1 1 3 3 GLU CA C 3 56.295 56.295 57.657 -1.362 19174
1998 1 12 . 1 1 3 3 GLU CB C 3 29.939 29.939 29.912 0.027 19174
1999 1 12 . 1 1 3 3 GLU H H 3 8.301 8.301 8.436 -0.135 19174
2000 1 12 . 1 1 4 4 ALA N N 4 125.568 125.568 118.894 6.674 19174
2001 1 12 . 1 1 4 4 ALA CA C 4 52.509 52.509 51.308 1.201 19174
2002 1 12 . 1 1 4 4 ALA CB C 4 19.084 19.084 20.375 -1.291 19174
2003 1 12 . 1 1 4 4 ALA H H 4 8.229 8.229 7.355 0.874 19174
2004 1 12 . 1 1 5 5 HIS N N 5 117.815 117.815 118.522 -0.707 19174
2005 1 12 . 1 1 5 5 HIS CA C 5 55.157 55.157 59.283 -4.126 19174
2006 1 12 . 1 1 5 5 HIS CB C 5 28.827 28.827 30.202 -1.375 19174
2007 1 12 . 1 1 5 5 HIS H H 5 8.363 8.363 8.671 -0.308 19174
2008 1 12 . 1 1 6 6 GLN N N 6 121.556 121.556 118.797 2.759 19174
2009 1 12 . 1 1 6 6 GLN CA C 6 55.739 55.739 56.565 -0.826 19174
2010 1 12 . 1 1 6 6 GLN CB C 6 29.409 29.409 28.834 0.575 19174
2011 1 12 . 1 1 6 6 GLN H H 6 8.289 8.289 8.343 -0.054 19174
2012 1 12 . 1 1 7 7 ALA N N 7 126.411 126.411 120.277 6.134 19174
2013 1 12 . 1 1 7 7 ALA CA C 7 52.404 52.404 52.394 0.010 19174
2014 1 12 . 1 1 7 7 ALA CB C 7 18.978 18.978 18.774 0.204 19174
2015 1 12 . 1 1 7 7 ALA H H 7 8.311 8.311 8.124 0.187 19174
2016 1 12 . 1 1 8 8 VAL N N 8 119.771 119.771 122.214 -2.443 19174
2017 1 12 . 1 1 8 8 VAL CA C 8 62.491 62.491 61.886 0.605 19174
2018 1 12 . 1 1 8 8 VAL CB C 8 32.586 32.586 33.404 -0.818 19174
2019 1 12 . 1 1 8 8 VAL H H 8 8.018 8.018 8.232 -0.214 19174
2020 1 12 . 1 1 9 9 GLY N N 9 112.108 112.108 114.266 -2.158 19174
2021 1 12 . 1 1 9 9 GLY CA C 9 45.044 45.044 45.417 -0.374 19174
2022 1 12 . 1 1 9 9 GLY H H 9 8.243 8.243 8.558 -0.315 19174
2023 1 12 . 1 1 10 10 PHE N N 10 120.842 120.842 118.964 1.878 19174
2024 1 12 . 1 1 10 10 PHE CA C 10 57.725 57.725 57.212 0.513 19174
2025 1 12 . 1 1 10 10 PHE CB C 10 39.628 39.628 41.263 -1.635 19174
2026 1 12 . 1 1 10 10 PHE H H 10 7.983 7.983 7.650 0.333 19174
2027 1 12 . 1 1 11 11 ARG N N 11 125.277 125.277 120.720 4.557 19174
2028 1 12 . 1 1 11 11 ARG CA C 11 53.410 53.410 54.622 -1.212 19174
2029 1 12 . 1 1 11 11 ARG CB C 11 30.574 30.574 33.399 -2.825 19174
2030 1 12 . 1 1 11 11 ARG H H 11 8.016 8.016 8.463 -0.447 19174
2031 1 12 . 1 1 13 13 SER N N 13 115.938 115.938 112.595 3.343 19174
2032 1 12 . 1 1 13 13 SER CA C 13 58.043 58.043 61.327 -3.284 19174
2033 1 12 . 1 1 13 13 SER CB C 13 63.774 63.774 62.569 1.205 19174
2034 1 12 . 1 1 13 13 SER H H 13 8.197 8.197 8.487 -0.290 19174
2035 1 12 . 1 1 14 14 LEU N N 14 124.186 124.186 122.434 1.752 19174
2036 1 12 . 1 1 14 14 LEU CA C 14 55.422 55.422 57.427 -2.005 19174
2037 1 12 . 1 1 14 14 LEU CB C 14 42.329 42.329 41.257 1.072 19174
2038 1 12 . 1 1 14 14 LEU H H 14 8.256 8.256 7.431 0.825 19174
2039 1 12 . 1 1 15 15 THR N N 15 112.858 112.858 110.090 2.768 19174
2040 1 12 . 1 1 15 15 THR CA C 15 61.379 61.379 64.781 -3.402 19174
2041 1 12 . 1 1 15 15 THR CB C 15 69.810 69.810 68.622 1.188 19174
2042 1 12 . 1 1 15 15 THR H H 15 7.913 7.913 7.811 0.102 19174
2043 1 12 . 1 1 16 16 SER N N 16 117.578 117.578 116.067 1.511 19174
2044 1 12 . 1 1 16 16 SER CA C 16 58.678 58.678 59.664 -0.986 19174
2045 1 12 . 1 1 16 16 SER CB C 16 63.668 63.668 63.671 -0.003 19174
2046 1 12 . 1 1 16 16 SER H H 16 8.154 8.154 7.597 0.557 19174
2047 1 12 . 1 1 17 17 ASP N N 17 122.030 122.030 119.921 2.109 19174
2048 1 12 . 1 1 17 17 ASP CA C 17 54.680 54.680 55.125 -0.445 19174
2049 1 12 . 1 1 17 17 ASP CB C 17 40.899 40.899 38.854 2.045 19174
2050 1 12 . 1 1 17 17 ASP H H 17 8.263 8.263 7.676 0.587 19174
2051 1 12 . 1 1 18 18 GLY N N 18 108.815 108.815 103.724 5.091 19174
2052 1 12 . 1 1 18 18 GLY CA C 18 45.758 45.758 45.379 0.379 19174
2053 1 12 . 1 1 18 18 GLY H H 18 8.239 8.239 8.375 -0.136 19174
2054 1 12 . 1 1 19 19 ALA N N 19 123.128 123.128 122.414 0.714 19174
2055 1 12 . 1 1 19 19 ALA CA C 19 53.164 53.164 53.385 -0.221 19174
2056 1 12 . 1 1 19 19 ALA CB C 19 19.084 19.084 19.076 0.008 19174
2057 1 12 . 1 1 19 19 ALA H H 19 8.001 8.001 7.886 0.115 19174
2058 1 12 . 1 1 20 20 GLU N N 20 117.663 117.663 118.780 -1.117 19174
2059 1 12 . 1 1 20 20 GLU CA C 20 57.275 57.275 56.422 0.853 19174
2060 1 12 . 1 1 20 20 GLU CB C 20 29.250 29.250 30.229 -0.979 19174
2061 1 12 . 1 1 20 20 GLU H H 20 8.231 8.231 8.047 0.184 19174
2062 1 12 . 1 1 21 21 VAL N N 21 119.044 119.044 125.083 -6.039 19174
2063 1 12 . 1 1 21 21 VAL CA C 21 62.755 62.755 61.356 1.399 19174
2064 1 12 . 1 1 21 21 VAL CB C 21 32.268 32.268 33.779 -1.511 19174
2065 1 12 . 1 1 21 21 VAL H H 21 7.767 7.767 8.272 -0.505 19174
2066 1 12 . 1 1 22 22 GLU N N 22 121.765 121.765 124.762 -2.997 19174
2067 1 12 . 1 1 22 22 GLU CA C 22 56.613 56.613 57.733 -1.120 19174
2068 1 12 . 1 1 22 22 GLU CB C 22 29.833 29.833 29.945 -0.112 19174
2069 1 12 . 1 1 22 22 GLU H H 22 7.969 7.969 8.595 -0.626 19174
2070 1 12 . 1 1 23 23 LEU N N 23 120.996 120.996 120.394 0.602 19174
2071 1 12 . 1 1 23 23 LEU CA C 23 54.310 54.310 54.706 -0.396 19174
2072 1 12 . 1 1 23 23 LEU CB C 23 42.223 42.223 42.918 -0.695 19174
2073 1 12 . 1 1 23 23 LEU H H 23 7.917 7.917 7.556 0.361 19174
2074 1 12 . 1 1 24 24 SER N N 24 114.702 114.702 120.608 -5.906 19174
2075 1 12 . 1 1 24 24 SER CA C 24 57.593 57.593 58.852 -1.259 19174
2076 1 12 . 1 1 24 24 SER CB C 24 64.515 64.515 63.060 1.455 19174
2077 1 12 . 1 1 24 24 SER H H 24 7.564 7.564 8.969 -1.405 19174
2078 1 12 . 1 1 25 25 ALA N N 25 125.059 125.059 126.465 -1.406 19174
2079 1 12 . 1 1 25 25 ALA CA C 25 55.898 55.898 56.313 -0.415 19174
2080 1 12 . 1 1 25 25 ALA CB C 25 16.330 16.330 16.907 -0.577 19174
2081 1 12 . 1 1 25 25 ALA H H 25 8.630 8.630 8.881 -0.251 19174
2082 1 12 . 1 1 27 27 VAL N N 27 118.016 118.016 117.672 0.344 19174
2083 1 12 . 1 1 27 27 VAL CA C 27 65.826 65.826 65.897 -0.071 19174
2084 1 12 . 1 1 27 27 VAL CB C 27 31.686 31.686 31.543 0.143 19174
2085 1 12 . 1 1 27 27 VAL H H 27 7.294 7.294 7.323 -0.029 19174
2086 1 12 . 1 1 28 28 LEU N N 28 119.933 119.933 120.098 -0.165 19174
2087 1 12 . 1 1 28 28 LEU CA C 28 57.990 57.990 58.356 -0.366 19174
2088 1 12 . 1 1 28 28 LEU CB C 28 41.429 41.429 41.303 0.126 19174
2089 1 12 . 1 1 28 28 LEU H H 28 7.939 7.939 8.381 -0.442 19174
2090 1 12 . 1 1 29 29 GLN N N 29 117.644 117.644 119.074 -1.430 19174
2091 1 12 . 1 1 29 29 GLN CA C 29 59.367 59.367 59.490 -0.123 19174
2092 1 12 . 1 1 29 29 GLN CB C 29 28.297 28.297 28.541 -0.243 19174
2093 1 12 . 1 1 29 29 GLN H H 29 8.179 8.179 8.720 -0.541 19174
2094 1 12 . 1 1 30 30 GLU N N 30 118.389 118.389 120.483 -2.094 19174
2095 1 12 . 1 1 30 30 GLU CA C 30 59.128 59.128 59.364 -0.236 19174
2096 1 12 . 1 1 30 30 GLU CB C 30 29.038 29.038 29.571 -0.533 19174
2097 1 12 . 1 1 30 30 GLU H H 30 7.752 7.752 7.788 -0.036 19174
2098 1 12 . 1 1 31 31 ILE N N 31 120.796 120.796 120.611 0.185 19174
2099 1 12 . 1 1 31 31 ILE CA C 31 65.509 65.509 65.273 0.236 19174
2100 1 12 . 1 1 31 31 ILE CB C 31 37.775 37.775 38.081 -0.306 19174
2101 1 12 . 1 1 31 31 ILE H H 31 8.131 8.131 8.183 -0.052 19174
2102 1 12 . 1 1 32 32 TYR N N 32 120.550 120.550 120.785 -0.235 19174
2103 1 12 . 1 1 32 32 TYR CA C 32 61.405 61.405 61.881 -0.476 19174
2104 1 12 . 1 1 32 32 TYR CB C 32 38.358 38.358 38.527 -0.169 19174
2105 1 12 . 1 1 32 32 TYR H H 32 8.214 8.214 8.187 0.027 19174
2106 1 12 . 1 1 33 33 LEU N N 33 117.578 117.578 119.153 -1.575 19174
2107 1 12 . 1 1 33 33 LEU CA C 33 57.513 57.513 57.218 0.295 19174
2108 1 12 . 1 1 33 33 LEU CB C 33 41.657 41.657 41.660 -0.002 19174
2109 1 12 . 1 1 33 33 LEU H H 33 8.347 8.347 8.154 0.193 19174
2110 1 12 . 1 1 34 34 SER N N 34 114.635 114.635 114.473 0.162 19174
2111 1 12 . 1 1 34 34 SER CA C 34 61.405 61.405 61.455 -0.050 19174
2112 1 12 . 1 1 34 34 SER CB C 34 63.403 63.403 62.498 0.905 19174
2113 1 12 . 1 1 34 34 SER H H 34 7.986 7.986 8.249 -0.263 19174
2114 1 12 . 1 1 35 35 GLY N N 35 110.749 110.749 109.478 1.271 19174
2115 1 12 . 1 1 35 35 GLY CA C 35 46.897 46.897 46.339 0.558 19174
2116 1 12 . 1 1 35 35 GLY H H 35 8.302 8.302 7.857 0.445 19174
2117 1 12 . 1 1 36 36 LEU N N 36 121.632 121.632 121.932 -0.300 19174
2118 1 12 . 1 1 36 36 LEU CA C 36 57.619 57.619 57.320 0.299 19174
2119 1 12 . 1 1 36 36 LEU CB C 36 41.799 41.799 41.315 0.484 19174
2120 1 12 . 1 1 36 36 LEU H H 36 8.194 8.194 6.596 1.598 19174
2121 1 12 . 1 1 37 37 ARG N N 37 118.274 118.274 118.954 -0.680 19174
2122 1 12 . 1 1 37 37 ARG CA C 37 59.049 59.049 59.607 -0.558 19174
2123 1 12 . 1 1 37 37 ARG CB C 37 30.044 30.044 30.163 -0.119 19174
2124 1 12 . 1 1 37 37 ARG H H 37 7.934 7.934 7.355 0.579 19174
2125 1 12 . 1 1 38 38 SER N N 38 114.239 114.239 115.127 -0.888 19174
2126 1 12 . 1 1 38 38 SER CA C 38 60.531 60.531 61.245 -0.714 19174
2127 1 12 . 1 1 38 38 SER CB C 38 63.509 63.509 62.961 0.548 19174
2128 1 12 . 1 1 38 38 SER H H 38 7.913 7.913 7.712 0.201 19174
2129 1 12 . 1 1 39 39 TRP N N 39 123.095 123.095 123.667 -0.572 19174
2130 1 12 . 1 1 39 39 TRP CA C 39 59.870 59.870 57.259 2.611 19174
2131 1 12 . 1 1 39 39 TRP CB C 39 28.721 28.721 28.244 0.477 19174
2132 1 12 . 1 1 39 39 TRP H H 39 8.108 8.108 8.442 -0.334 19174
2133 1 12 . 1 1 40 40 LYS N N 40 119.629 119.629 119.882 -0.253 19174
2134 1 12 . 1 1 40 40 LYS CA C 40 59.525 59.525 59.781 -0.256 19174
2135 1 12 . 1 1 40 40 LYS CB C 40 32.109 32.109 32.171 -0.062 19174
2136 1 12 . 1 1 40 40 LYS H H 40 7.938 7.938 7.949 -0.011 19174
2137 1 12 . 1 1 41 41 ARG N N 41 117.834 117.834 116.991 0.843 19174
2138 1 12 . 1 1 41 41 ARG CA C 41 57.857 57.857 59.091 -1.234 19174
2139 1 12 . 1 1 41 41 ARG CB C 41 30.203 30.203 30.140 0.063 19174
2140 1 12 . 1 1 41 41 ARG H H 41 7.863 7.863 7.691 0.172 19174
2141 1 12 . 1 1 42 42 HIS N N 42 115.774 115.774 117.324 -1.550 19174
2142 1 12 . 1 1 42 42 HIS CA C 42 57.487 57.487 59.148 -1.661 19174
2143 1 12 . 1 1 42 42 HIS CB C 42 30.786 30.786 30.005 0.781 19174
2144 1 12 . 1 1 42 42 HIS H H 42 7.919 7.919 7.648 0.271 19174
2145 1 12 . 1 1 43 43 LEU N N 43 120.243 120.243 120.351 -0.108 19174
2146 1 12 . 1 1 43 43 LEU CA C 43 56.745 56.745 55.385 1.360 19174
2147 1 12 . 1 1 43 43 LEU CB C 43 42.276 42.276 42.089 0.187 19174
2148 1 12 . 1 1 43 43 LEU H H 43 8.162 8.162 8.803 -0.641 19174
2149 1 12 . 1 1 44 44 SER N N 44 114.616 114.616 116.609 -1.993 19174
2150 1 12 . 1 1 44 44 SER CA C 44 60.987 60.987 62.279 -1.292 19174
2151 1 12 . 1 1 44 44 SER CB C 44 62.768 62.768 62.658 0.110 19174
2152 1 12 . 1 1 44 44 SER H H 44 8.033 8.033 8.167 -0.134 19174
2153 1 12 . 1 1 45 45 ARG N N 45 120.757 120.757 120.489 0.268 19174
2154 1 12 . 1 1 45 45 ARG CA C 45 57.513 57.513 59.149 -1.636 19174
2155 1 12 . 1 1 45 45 ARG CB C 45 29.462 29.462 29.820 -0.358 19174
2156 1 12 . 1 1 45 45 ARG H H 45 7.763 7.763 8.064 -0.301 19174
2157 1 12 . 1 1 46 46 PHE N N 46 118.237 118.237 117.093 1.144 19174
2158 1 12 . 1 1 46 46 PHE CA C 46 59.155 59.155 60.914 -1.759 19174
2159 1 12 . 1 1 46 46 PHE CB C 46 39.311 39.311 38.810 0.501 19174
2160 1 12 . 1 1 46 46 PHE H H 46 7.673 7.673 8.015 -0.342 19174
2161 1 12 . 1 1 47 47 TRP N N 47 118.484 118.484 119.918 -1.434 19174
2162 1 12 . 1 1 47 47 TRP CA C 47 58.837 58.837 58.996 -0.159 19174
2163 1 12 . 1 1 47 47 TRP CB C 47 29.833 29.833 30.239 -0.406 19174
2164 1 12 . 1 1 47 47 TRP H H 47 7.614 7.614 8.517 -0.903 19174
2165 1 12 . 1 1 48 48 ASN N N 48 114.629 114.629 117.267 -2.638 19174
2166 1 12 . 1 1 48 48 ASN CA C 48 54.124 54.124 54.844 -0.720 19174
2167 1 12 . 1 1 48 48 ASN CB C 48 38.887 38.887 38.722 0.165 19174
2168 1 12 . 1 1 48 48 ASN H H 48 7.811 7.811 7.909 -0.098 19174
2169 1 12 . 1 1 49 49 ASP N N 49 118.029 118.029 120.098 -2.069 19174
2170 1 12 . 1 1 49 49 ASP CA C 49 54.310 54.310 52.606 1.704 19174
2171 1 12 . 1 1 49 49 ASP CB C 49 40.793 40.793 40.405 0.388 19174
2172 1 12 . 1 1 49 49 ASP H H 49 7.775 7.775 7.399 0.376 19174
2173 1 13 . 1 1 2 2 ALA N N 2 127.400 127.400 126.399 1.001 19174
2174 1 13 . 1 1 2 2 ALA CA C 2 52.536 52.536 52.453 0.083 19174
2175 1 13 . 1 1 2 2 ALA CB C 2 19.031 19.031 19.329 -0.298 19174
2176 1 13 . 1 1 2 2 ALA H H 2 8.593 8.593 7.896 0.697 19174
2177 1 13 . 1 1 3 3 GLU N N 3 120.977 120.977 119.628 1.349 19174
2178 1 13 . 1 1 3 3 GLU CA C 3 56.295 56.295 56.011 0.284 19174
2179 1 13 . 1 1 3 3 GLU CB C 3 29.939 29.939 31.382 -1.443 19174
2180 1 13 . 1 1 3 3 GLU H H 3 8.301 8.301 8.426 -0.125 19174
2181 1 13 . 1 1 4 4 ALA N N 4 125.568 125.568 124.108 1.460 19174
2182 1 13 . 1 1 4 4 ALA CA C 4 52.509 52.509 52.288 0.222 19174
2183 1 13 . 1 1 4 4 ALA CB C 4 19.084 19.084 18.282 0.802 19174
2184 1 13 . 1 1 4 4 ALA H H 4 8.229 8.229 8.398 -0.169 19174
2185 1 13 . 1 1 5 5 HIS N N 5 117.815 117.815 120.511 -2.696 19174
2186 1 13 . 1 1 5 5 HIS CA C 5 55.157 55.157 57.445 -2.288 19174
2187 1 13 . 1 1 5 5 HIS CB C 5 28.827 28.827 30.133 -1.306 19174
2188 1 13 . 1 1 5 5 HIS H H 5 8.363 8.363 8.456 -0.093 19174
2189 1 13 . 1 1 6 6 GLN N N 6 121.556 121.556 119.534 2.022 19174
2190 1 13 . 1 1 6 6 GLN CA C 6 55.739 55.739 55.967 -0.228 19174
2191 1 13 . 1 1 6 6 GLN CB C 6 29.409 29.409 29.308 0.101 19174
2192 1 13 . 1 1 6 6 GLN H H 6 8.289 8.289 8.075 0.214 19174
2193 1 13 . 1 1 7 7 ALA N N 7 126.411 126.411 126.967 -0.556 19174
2194 1 13 . 1 1 7 7 ALA CA C 7 52.404 52.404 51.626 0.778 19174
2195 1 13 . 1 1 7 7 ALA CB C 7 18.978 18.978 20.728 -1.750 19174
2196 1 13 . 1 1 7 7 ALA H H 7 8.311 8.311 8.375 -0.064 19174
2197 1 13 . 1 1 8 8 VAL N N 8 119.771 119.771 121.912 -2.141 19174
2198 1 13 . 1 1 8 8 VAL CA C 8 62.491 62.491 61.968 0.523 19174
2199 1 13 . 1 1 8 8 VAL CB C 8 32.586 32.586 34.253 -1.667 19174
2200 1 13 . 1 1 8 8 VAL H H 8 8.018 8.018 8.300 -0.282 19174
2201 1 13 . 1 1 9 9 GLY N N 9 112.108 112.108 114.127 -2.019 19174
2202 1 13 . 1 1 9 9 GLY CA C 9 45.044 45.044 45.755 -0.711 19174
2203 1 13 . 1 1 9 9 GLY H H 9 8.243 8.243 8.506 -0.263 19174
2204 1 13 . 1 1 10 10 PHE N N 10 120.842 120.842 119.915 0.927 19174
2205 1 13 . 1 1 10 10 PHE CA C 10 57.725 57.725 56.705 1.020 19174
2206 1 13 . 1 1 10 10 PHE CB C 10 39.628 39.628 41.578 -1.950 19174
2207 1 13 . 1 1 10 10 PHE H H 10 7.983 7.983 7.618 0.365 19174
2208 1 13 . 1 1 11 11 ARG N N 11 125.277 125.277 123.990 1.287 19174
2209 1 13 . 1 1 11 11 ARG CA C 11 53.410 53.410 55.213 -1.803 19174
2210 1 13 . 1 1 11 11 ARG CB C 11 30.574 30.574 29.227 1.347 19174
2211 1 13 . 1 1 11 11 ARG H H 11 8.016 8.016 8.560 -0.544 19174
2212 1 13 . 1 1 13 13 SER N N 13 115.938 115.938 117.209 -1.271 19174
2213 1 13 . 1 1 13 13 SER CA C 13 58.043 58.043 58.077 -0.034 19174
2214 1 13 . 1 1 13 13 SER CB C 13 63.774 63.774 63.985 -0.211 19174
2215 1 13 . 1 1 13 13 SER H H 13 8.197 8.197 8.194 0.003 19174
2216 1 13 . 1 1 14 14 LEU N N 14 124.186 124.186 122.747 1.439 19174
2217 1 13 . 1 1 14 14 LEU CA C 14 55.422 55.422 54.723 0.699 19174
2218 1 13 . 1 1 14 14 LEU CB C 14 42.329 42.329 42.652 -0.323 19174
2219 1 13 . 1 1 14 14 LEU H H 14 8.256 8.256 8.300 -0.044 19174
2220 1 13 . 1 1 15 15 THR N N 15 112.858 112.858 113.907 -1.049 19174
2221 1 13 . 1 1 15 15 THR CA C 15 61.379 61.379 60.888 0.491 19174
2222 1 13 . 1 1 15 15 THR CB C 15 69.810 69.810 69.478 0.332 19174
2223 1 13 . 1 1 15 15 THR H H 15 7.913 7.913 8.356 -0.443 19174
2224 1 13 . 1 1 16 16 SER N N 16 117.578 117.578 119.060 -1.482 19174
2225 1 13 . 1 1 16 16 SER CA C 16 58.678 58.678 57.479 1.199 19174
2226 1 13 . 1 1 16 16 SER CB C 16 63.668 63.668 63.862 -0.194 19174
2227 1 13 . 1 1 16 16 SER H H 16 8.154 8.154 7.731 0.423 19174
2228 1 13 . 1 1 17 17 ASP N N 17 122.030 122.030 120.707 1.323 19174
2229 1 13 . 1 1 17 17 ASP CA C 17 54.680 54.680 54.177 0.503 19174
2230 1 13 . 1 1 17 17 ASP CB C 17 40.899 40.899 40.872 0.027 19174
2231 1 13 . 1 1 17 17 ASP H H 17 8.263 8.263 8.459 -0.196 19174
2232 1 13 . 1 1 18 18 GLY N N 18 108.815 108.815 107.703 1.112 19174
2233 1 13 . 1 1 18 18 GLY CA C 18 45.758 45.758 44.692 1.066 19174
2234 1 13 . 1 1 18 18 GLY H H 18 8.239 8.239 8.700 -0.461 19174
2235 1 13 . 1 1 19 19 ALA N N 19 123.128 123.128 123.846 -0.718 19174
2236 1 13 . 1 1 19 19 ALA CA C 19 53.164 53.164 53.014 0.150 19174
2237 1 13 . 1 1 19 19 ALA CB C 19 19.084 19.084 19.586 -0.502 19174
2238 1 13 . 1 1 19 19 ALA H H 19 8.001 8.001 7.545 0.456 19174
2239 1 13 . 1 1 20 20 GLU N N 20 117.663 117.663 122.537 -4.874 19174
2240 1 13 . 1 1 20 20 GLU CA C 20 57.275 57.275 56.611 0.664 19174
2241 1 13 . 1 1 20 20 GLU CB C 20 29.250 29.250 30.008 -0.758 19174
2242 1 13 . 1 1 20 20 GLU H H 20 8.231 8.231 8.345 -0.114 19174
2243 1 13 . 1 1 21 21 VAL N N 21 119.044 119.044 125.661 -6.617 19174
2244 1 13 . 1 1 21 21 VAL CA C 21 62.755 62.755 61.166 1.589 19174
2245 1 13 . 1 1 21 21 VAL CB C 21 32.268 32.268 33.877 -1.609 19174
2246 1 13 . 1 1 21 21 VAL H H 21 7.767 7.767 8.202 -0.435 19174
2247 1 13 . 1 1 22 22 GLU N N 22 121.765 121.765 125.973 -4.208 19174
2248 1 13 . 1 1 22 22 GLU CA C 22 56.613 56.613 58.607 -1.994 19174
2249 1 13 . 1 1 22 22 GLU CB C 22 29.833 29.833 30.132 -0.299 19174
2250 1 13 . 1 1 22 22 GLU H H 22 7.969 7.969 8.680 -0.711 19174
2251 1 13 . 1 1 23 23 LEU N N 23 120.996 120.996 119.752 1.244 19174
2252 1 13 . 1 1 23 23 LEU CA C 23 54.310 54.310 56.574 -2.264 19174
2253 1 13 . 1 1 23 23 LEU CB C 23 42.223 42.223 41.818 0.405 19174
2254 1 13 . 1 1 23 23 LEU H H 23 7.917 7.917 7.838 0.079 19174
2255 1 13 . 1 1 24 24 SER N N 24 114.702 114.702 114.875 -0.173 19174
2256 1 13 . 1 1 24 24 SER CA C 24 57.593 57.593 58.545 -0.952 19174
2257 1 13 . 1 1 24 24 SER CB C 24 64.515 64.515 62.016 2.499 19174
2258 1 13 . 1 1 24 24 SER H H 24 7.564 7.564 8.062 -0.498 19174
2259 1 13 . 1 1 25 25 ALA N N 25 125.059 125.059 131.260 -6.201 19174
2260 1 13 . 1 1 25 25 ALA CA C 25 55.898 55.898 55.704 0.194 19174
2261 1 13 . 1 1 25 25 ALA CB C 25 16.330 16.330 17.018 -0.688 19174
2262 1 13 . 1 1 25 25 ALA H H 25 8.630 8.630 8.244 0.386 19174
2263 1 13 . 1 1 27 27 VAL N N 27 118.016 118.016 117.060 0.956 19174
2264 1 13 . 1 1 27 27 VAL CA C 27 65.826 65.826 65.949 -0.123 19174
2265 1 13 . 1 1 27 27 VAL CB C 27 31.686 31.686 31.437 0.249 19174
2266 1 13 . 1 1 27 27 VAL H H 27 7.294 7.294 7.493 -0.199 19174
2267 1 13 . 1 1 28 28 LEU N N 28 119.933 119.933 119.298 0.635 19174
2268 1 13 . 1 1 28 28 LEU CA C 28 57.990 57.990 58.217 -0.227 19174
2269 1 13 . 1 1 28 28 LEU CB C 28 41.429 41.429 41.110 0.319 19174
2270 1 13 . 1 1 28 28 LEU H H 28 7.939 7.939 7.552 0.387 19174
2271 1 13 . 1 1 29 29 GLN N N 29 117.644 117.644 118.463 -0.819 19174
2272 1 13 . 1 1 29 29 GLN CA C 29 59.367 59.367 59.450 -0.083 19174
2273 1 13 . 1 1 29 29 GLN CB C 29 28.297 28.297 28.442 -0.144 19174
2274 1 13 . 1 1 29 29 GLN H H 29 8.179 8.179 7.809 0.370 19174
2275 1 13 . 1 1 30 30 GLU N N 30 118.389 118.389 120.705 -2.316 19174
2276 1 13 . 1 1 30 30 GLU CA C 30 59.128 59.128 59.434 -0.306 19174
2277 1 13 . 1 1 30 30 GLU CB C 30 29.038 29.038 29.572 -0.534 19174
2278 1 13 . 1 1 30 30 GLU H H 30 7.752 7.752 8.145 -0.393 19174
2279 1 13 . 1 1 31 31 ILE N N 31 120.796 120.796 121.274 -0.478 19174
2280 1 13 . 1 1 31 31 ILE CA C 31 65.509 65.509 65.447 0.062 19174
2281 1 13 . 1 1 31 31 ILE CB C 31 37.775 37.775 38.152 -0.377 19174
2282 1 13 . 1 1 31 31 ILE H H 31 8.131 8.131 8.428 -0.297 19174
2283 1 13 . 1 1 32 32 TYR N N 32 120.550 120.550 120.764 -0.214 19174
2284 1 13 . 1 1 32 32 TYR CA C 32 61.405 61.405 62.318 -0.913 19174
2285 1 13 . 1 1 32 32 TYR CB C 32 38.358 38.358 38.568 -0.209 19174
2286 1 13 . 1 1 32 32 TYR H H 32 8.214 8.214 8.251 -0.037 19174
2287 1 13 . 1 1 33 33 LEU N N 33 117.578 117.578 118.061 -0.483 19174
2288 1 13 . 1 1 33 33 LEU CA C 33 57.513 57.513 57.834 -0.321 19174
2289 1 13 . 1 1 33 33 LEU CB C 33 41.657 41.657 41.720 -0.063 19174
2290 1 13 . 1 1 33 33 LEU H H 33 8.347 8.347 8.530 -0.183 19174
2291 1 13 . 1 1 34 34 SER N N 34 114.635 114.635 114.518 0.117 19174
2292 1 13 . 1 1 34 34 SER CA C 34 61.405 61.405 61.450 -0.045 19174
2293 1 13 . 1 1 34 34 SER CB C 34 63.403 63.403 62.587 0.816 19174
2294 1 13 . 1 1 34 34 SER H H 34 7.986 7.986 8.543 -0.557 19174
2295 1 13 . 1 1 35 35 GLY N N 35 110.749 110.749 110.352 0.397 19174
2296 1 13 . 1 1 35 35 GLY CA C 35 46.897 46.897 46.744 0.153 19174
2297 1 13 . 1 1 35 35 GLY H H 35 8.302 8.302 8.274 0.028 19174
2298 1 13 . 1 1 36 36 LEU N N 36 121.632 121.632 122.261 -0.629 19174
2299 1 13 . 1 1 36 36 LEU CA C 36 57.619 57.619 57.826 -0.207 19174
2300 1 13 . 1 1 36 36 LEU CB C 36 41.799 41.799 41.485 0.314 19174
2301 1 13 . 1 1 36 36 LEU H H 36 8.194 8.194 7.454 0.740 19174
2302 1 13 . 1 1 37 37 ARG N N 37 118.274 118.274 118.703 -0.429 19174
2303 1 13 . 1 1 37 37 ARG CA C 37 59.049 59.049 59.634 -0.585 19174
2304 1 13 . 1 1 37 37 ARG CB C 37 30.044 30.044 30.005 0.040 19174
2305 1 13 . 1 1 37 37 ARG H H 37 7.934 7.934 7.538 0.396 19174
2306 1 13 . 1 1 38 38 SER N N 38 114.239 114.239 116.466 -2.227 19174
2307 1 13 . 1 1 38 38 SER CA C 38 60.531 60.531 62.026 -1.495 19174
2308 1 13 . 1 1 38 38 SER CB C 38 63.509 63.509 62.830 0.679 19174
2309 1 13 . 1 1 38 38 SER H H 38 7.913 7.913 7.570 0.343 19174
2310 1 13 . 1 1 39 39 TRP N N 39 123.095 123.095 123.024 0.071 19174
2311 1 13 . 1 1 39 39 TRP CA C 39 59.870 59.870 59.757 0.113 19174
2312 1 13 . 1 1 39 39 TRP CB C 39 28.721 28.721 29.432 -0.711 19174
2313 1 13 . 1 1 39 39 TRP H H 39 8.108 8.108 8.539 -0.431 19174
2314 1 13 . 1 1 40 40 LYS N N 40 119.629 119.629 119.605 0.024 19174
2315 1 13 . 1 1 40 40 LYS CA C 40 59.525 59.525 60.136 -0.611 19174
2316 1 13 . 1 1 40 40 LYS CB C 40 32.109 32.109 32.153 -0.044 19174
2317 1 13 . 1 1 40 40 LYS H H 40 7.938 7.938 8.002 -0.064 19174
2318 1 13 . 1 1 41 41 ARG N N 41 117.834 117.834 117.371 0.463 19174
2319 1 13 . 1 1 41 41 ARG CA C 41 57.857 57.857 58.953 -1.096 19174
2320 1 13 . 1 1 41 41 ARG CB C 41 30.203 30.203 29.744 0.459 19174
2321 1 13 . 1 1 41 41 ARG H H 41 7.863 7.863 7.767 0.096 19174
2322 1 13 . 1 1 42 42 HIS N N 42 115.774 115.774 116.612 -0.838 19174
2323 1 13 . 1 1 42 42 HIS CA C 42 57.487 57.487 59.367 -1.879 19174
2324 1 13 . 1 1 42 42 HIS CB C 42 30.786 30.786 30.208 0.578 19174
2325 1 13 . 1 1 42 42 HIS H H 42 7.919 7.919 7.801 0.118 19174
2326 1 13 . 1 1 43 43 LEU N N 43 120.243 120.243 120.355 -0.112 19174
2327 1 13 . 1 1 43 43 LEU CA C 43 56.745 56.745 55.496 1.249 19174
2328 1 13 . 1 1 43 43 LEU CB C 43 42.276 42.276 41.938 0.339 19174
2329 1 13 . 1 1 43 43 LEU H H 43 8.162 8.162 8.923 -0.761 19174
2330 1 13 . 1 1 44 44 SER N N 44 114.616 114.616 116.268 -1.652 19174
2331 1 13 . 1 1 44 44 SER CA C 44 60.987 60.987 62.615 -1.628 19174
2332 1 13 . 1 1 44 44 SER CB C 44 62.768 62.768 62.606 0.162 19174
2333 1 13 . 1 1 44 44 SER H H 44 8.033 8.033 8.119 -0.086 19174
2334 1 13 . 1 1 45 45 ARG N N 45 120.757 120.757 120.824 -0.067 19174
2335 1 13 . 1 1 45 45 ARG CA C 45 57.513 57.513 59.501 -1.988 19174
2336 1 13 . 1 1 45 45 ARG CB C 45 29.462 29.462 29.939 -0.477 19174
2337 1 13 . 1 1 45 45 ARG H H 45 7.763 7.763 8.087 -0.324 19174
2338 1 13 . 1 1 46 46 PHE N N 46 118.237 118.237 117.374 0.863 19174
2339 1 13 . 1 1 46 46 PHE CA C 46 59.155 59.155 60.439 -1.284 19174
2340 1 13 . 1 1 46 46 PHE CB C 46 39.311 39.311 38.543 0.768 19174
2341 1 13 . 1 1 46 46 PHE H H 46 7.673 7.673 7.743 -0.070 19174
2342 1 13 . 1 1 47 47 TRP N N 47 118.484 118.484 121.296 -2.812 19174
2343 1 13 . 1 1 47 47 TRP CA C 47 58.837 58.837 62.041 -3.204 19174
2344 1 13 . 1 1 47 47 TRP CB C 47 29.833 29.833 29.651 0.182 19174
2345 1 13 . 1 1 47 47 TRP H H 47 7.614 7.614 8.320 -0.706 19174
2346 1 13 . 1 1 48 48 ASN N N 48 114.629 114.629 116.074 -1.445 19174
2347 1 13 . 1 1 48 48 ASN CA C 48 54.124 54.124 55.022 -0.898 19174
2348 1 13 . 1 1 48 48 ASN CB C 48 38.887 38.887 38.670 0.217 19174
2349 1 13 . 1 1 48 48 ASN H H 48 7.811 7.811 8.170 -0.359 19174
2350 1 13 . 1 1 49 49 ASP N N 49 118.029 118.029 120.201 -2.172 19174
2351 1 13 . 1 1 49 49 ASP CA C 49 54.310 54.310 54.814 -0.504 19174
2352 1 13 . 1 1 49 49 ASP CB C 49 40.793 40.793 41.351 -0.558 19174
2353 1 13 . 1 1 49 49 ASP H H 49 7.775 7.775 7.506 0.269 19174
2354 1 14 . 1 1 2 2 ALA N N 2 127.400 127.400 122.920 4.480 19174
2355 1 14 . 1 1 2 2 ALA CA C 2 52.536 52.536 53.032 -0.496 19174
2356 1 14 . 1 1 2 2 ALA CB C 2 19.031 19.031 19.055 -0.024 19174
2357 1 14 . 1 1 2 2 ALA H H 2 8.593 8.593 8.182 0.411 19174
2358 1 14 . 1 1 3 3 GLU N N 3 120.977 120.977 118.652 2.325 19174
2359 1 14 . 1 1 3 3 GLU CA C 3 56.295 56.295 55.099 1.196 19174
2360 1 14 . 1 1 3 3 GLU CB C 3 29.939 29.939 31.505 -1.565 19174
2361 1 14 . 1 1 3 3 GLU H H 3 8.301 8.301 7.896 0.405 19174
2362 1 14 . 1 1 4 4 ALA N N 4 125.568 125.568 128.166 -2.598 19174
2363 1 14 . 1 1 4 4 ALA CA C 4 52.509 52.509 52.112 0.397 19174
2364 1 14 . 1 1 4 4 ALA CB C 4 19.084 19.084 19.422 -0.338 19174
2365 1 14 . 1 1 4 4 ALA H H 4 8.229 8.229 8.181 0.048 19174
2366 1 14 . 1 1 5 5 HIS N N 5 117.815 117.815 119.197 -1.382 19174
2367 1 14 . 1 1 5 5 HIS CA C 5 55.157 55.157 55.609 -0.452 19174
2368 1 14 . 1 1 5 5 HIS CB C 5 28.827 28.827 31.221 -2.394 19174
2369 1 14 . 1 1 5 5 HIS H H 5 8.363 8.363 8.317 0.046 19174
2370 1 14 . 1 1 6 6 GLN N N 6 121.556 121.556 123.002 -1.446 19174
2371 1 14 . 1 1 6 6 GLN CA C 6 55.739 55.739 55.580 0.160 19174
2372 1 14 . 1 1 6 6 GLN CB C 6 29.409 29.409 29.505 -0.096 19174
2373 1 14 . 1 1 6 6 GLN H H 6 8.289 8.289 8.693 -0.404 19174
2374 1 14 . 1 1 7 7 ALA N N 7 126.411 126.411 127.401 -0.990 19174
2375 1 14 . 1 1 7 7 ALA CA C 7 52.404 52.404 51.934 0.469 19174
2376 1 14 . 1 1 7 7 ALA CB C 7 18.978 18.978 19.489 -0.511 19174
2377 1 14 . 1 1 7 7 ALA H H 7 8.311 8.311 8.447 -0.136 19174
2378 1 14 . 1 1 8 8 VAL N N 8 119.771 119.771 117.581 2.190 19174
2379 1 14 . 1 1 8 8 VAL CA C 8 62.491 62.491 61.728 0.763 19174
2380 1 14 . 1 1 8 8 VAL CB C 8 32.586 32.586 32.832 -0.246 19174
2381 1 14 . 1 1 8 8 VAL H H 8 8.018 8.018 8.219 -0.201 19174
2382 1 14 . 1 1 9 9 GLY N N 9 112.108 112.108 113.421 -1.313 19174
2383 1 14 . 1 1 9 9 GLY CA C 9 45.044 45.044 45.171 -0.127 19174
2384 1 14 . 1 1 9 9 GLY H H 9 8.243 8.243 8.088 0.155 19174
2385 1 14 . 1 1 10 10 PHE N N 10 120.842 120.842 120.964 -0.122 19174
2386 1 14 . 1 1 10 10 PHE CA C 10 57.725 57.725 57.157 0.568 19174
2387 1 14 . 1 1 10 10 PHE CB C 10 39.628 39.628 39.549 0.079 19174
2388 1 14 . 1 1 10 10 PHE H H 10 7.983 7.983 8.168 -0.185 19174
2389 1 14 . 1 1 11 11 ARG N N 11 125.277 125.277 127.329 -2.052 19174
2390 1 14 . 1 1 11 11 ARG CA C 11 53.410 53.410 54.559 -1.149 19174
2391 1 14 . 1 1 11 11 ARG CB C 11 30.574 30.574 30.147 0.427 19174
2392 1 14 . 1 1 11 11 ARG H H 11 8.016 8.016 7.986 0.030 19174
2393 1 14 . 1 1 13 13 SER N N 13 115.938 115.938 116.851 -0.913 19174
2394 1 14 . 1 1 13 13 SER CA C 13 58.043 58.043 58.000 0.043 19174
2395 1 14 . 1 1 13 13 SER CB C 13 63.774 63.774 63.711 0.063 19174
2396 1 14 . 1 1 13 13 SER H H 13 8.197 8.197 8.258 -0.061 19174
2397 1 14 . 1 1 14 14 LEU N N 14 124.186 124.186 125.284 -1.098 19174
2398 1 14 . 1 1 14 14 LEU CA C 14 55.422 55.422 54.831 0.591 19174
2399 1 14 . 1 1 14 14 LEU CB C 14 42.329 42.329 42.644 -0.315 19174
2400 1 14 . 1 1 14 14 LEU H H 14 8.256 8.256 8.390 -0.134 19174
2401 1 14 . 1 1 15 15 THR N N 15 112.858 112.858 114.409 -1.551 19174
2402 1 14 . 1 1 15 15 THR CA C 15 61.379 61.379 64.571 -3.192 19174
2403 1 14 . 1 1 15 15 THR CB C 15 69.810 69.810 68.960 0.850 19174
2404 1 14 . 1 1 15 15 THR H H 15 7.913 7.913 8.506 -0.593 19174
2405 1 14 . 1 1 16 16 SER N N 16 117.578 117.578 114.804 2.774 19174
2406 1 14 . 1 1 16 16 SER CA C 16 58.678 58.678 59.582 -0.904 19174
2407 1 14 . 1 1 16 16 SER CB C 16 63.668 63.668 62.894 0.774 19174
2408 1 14 . 1 1 16 16 SER H H 16 8.154 8.154 7.964 0.190 19174
2409 1 14 . 1 1 17 17 ASP N N 17 122.030 122.030 122.047 -0.017 19174
2410 1 14 . 1 1 17 17 ASP CA C 17 54.680 54.680 54.268 0.412 19174
2411 1 14 . 1 1 17 17 ASP CB C 17 40.899 40.899 40.271 0.628 19174
2412 1 14 . 1 1 17 17 ASP H H 17 8.263 8.263 7.368 0.895 19174
2413 1 14 . 1 1 18 18 GLY N N 18 108.815 108.815 112.928 -4.113 19174
2414 1 14 . 1 1 18 18 GLY CA C 18 45.758 45.758 45.414 0.344 19174
2415 1 14 . 1 1 18 18 GLY H H 18 8.239 8.239 8.348 -0.109 19174
2416 1 14 . 1 1 19 19 ALA N N 19 123.128 123.128 123.538 -0.410 19174
2417 1 14 . 1 1 19 19 ALA CA C 19 53.164 53.164 53.329 -0.165 19174
2418 1 14 . 1 1 19 19 ALA CB C 19 19.084 19.084 19.216 -0.132 19174
2419 1 14 . 1 1 19 19 ALA H H 19 8.001 8.001 7.854 0.147 19174
2420 1 14 . 1 1 20 20 GLU N N 20 117.663 117.663 118.007 -0.344 19174
2421 1 14 . 1 1 20 20 GLU CA C 20 57.275 57.275 55.807 1.468 19174
2422 1 14 . 1 1 20 20 GLU CB C 20 29.250 29.250 31.057 -1.807 19174
2423 1 14 . 1 1 20 20 GLU H H 20 8.231 8.231 8.471 -0.240 19174
2424 1 14 . 1 1 21 21 VAL N N 21 119.044 119.044 121.568 -2.524 19174
2425 1 14 . 1 1 21 21 VAL CA C 21 62.755 62.755 61.465 1.290 19174
2426 1 14 . 1 1 21 21 VAL CB C 21 32.268 32.268 33.887 -1.619 19174
2427 1 14 . 1 1 21 21 VAL H H 21 7.767 7.767 8.313 -0.546 19174
2428 1 14 . 1 1 22 22 GLU N N 22 121.765 121.765 125.577 -3.812 19174
2429 1 14 . 1 1 22 22 GLU CA C 22 56.613 56.613 56.241 0.372 19174
2430 1 14 . 1 1 22 22 GLU CB C 22 29.833 29.833 30.044 -0.211 19174
2431 1 14 . 1 1 22 22 GLU H H 22 7.969 7.969 8.510 -0.541 19174
2432 1 14 . 1 1 23 23 LEU N N 23 120.996 120.996 122.157 -1.161 19174
2433 1 14 . 1 1 23 23 LEU CA C 23 54.310 54.310 54.897 -0.587 19174
2434 1 14 . 1 1 23 23 LEU CB C 23 42.223 42.223 42.787 -0.564 19174
2435 1 14 . 1 1 23 23 LEU H H 23 7.917 7.917 7.697 0.220 19174
2436 1 14 . 1 1 24 24 SER N N 24 114.702 114.702 115.034 -0.332 19174
2437 1 14 . 1 1 24 24 SER CA C 24 57.593 57.593 58.403 -0.810 19174
2438 1 14 . 1 1 24 24 SER CB C 24 64.515 64.515 62.321 2.194 19174
2439 1 14 . 1 1 24 24 SER H H 24 7.564 7.564 8.883 -1.319 19174
2440 1 14 . 1 1 25 25 ALA N N 25 125.059 125.059 126.611 -1.552 19174
2441 1 14 . 1 1 25 25 ALA CA C 25 55.898 55.898 56.045 -0.147 19174
2442 1 14 . 1 1 25 25 ALA CB C 25 16.330 16.330 16.808 -0.478 19174
2443 1 14 . 1 1 25 25 ALA H H 25 8.630 8.630 8.965 -0.335 19174
2444 1 14 . 1 1 27 27 VAL N N 27 118.016 118.016 117.901 0.115 19174
2445 1 14 . 1 1 27 27 VAL CA C 27 65.826 65.826 65.881 -0.055 19174
2446 1 14 . 1 1 27 27 VAL CB C 27 31.686 31.686 31.504 0.182 19174
2447 1 14 . 1 1 27 27 VAL H H 27 7.294 7.294 7.333 -0.039 19174
2448 1 14 . 1 1 28 28 LEU N N 28 119.933 119.933 120.159 -0.226 19174
2449 1 14 . 1 1 28 28 LEU CA C 28 57.990 57.990 58.299 -0.309 19174
2450 1 14 . 1 1 28 28 LEU CB C 28 41.429 41.429 41.324 0.105 19174
2451 1 14 . 1 1 28 28 LEU H H 28 7.939 7.939 8.406 -0.467 19174
2452 1 14 . 1 1 29 29 GLN N N 29 117.644 117.644 118.217 -0.573 19174
2453 1 14 . 1 1 29 29 GLN CA C 29 59.367 59.367 59.262 0.105 19174
2454 1 14 . 1 1 29 29 GLN CB C 29 28.297 28.297 28.516 -0.219 19174
2455 1 14 . 1 1 29 29 GLN H H 29 8.179 8.179 8.686 -0.507 19174
2456 1 14 . 1 1 30 30 GLU N N 30 118.389 118.389 119.554 -1.165 19174
2457 1 14 . 1 1 30 30 GLU CA C 30 59.128 59.128 59.061 0.067 19174
2458 1 14 . 1 1 30 30 GLU CB C 30 29.038 29.038 29.376 -0.338 19174
2459 1 14 . 1 1 30 30 GLU H H 30 7.752 7.752 7.767 -0.015 19174
2460 1 14 . 1 1 31 31 ILE N N 31 120.796 120.796 117.626 3.170 19174
2461 1 14 . 1 1 31 31 ILE CA C 31 65.509 65.509 65.093 0.416 19174
2462 1 14 . 1 1 31 31 ILE CB C 31 37.775 37.775 37.447 0.328 19174
2463 1 14 . 1 1 31 31 ILE H H 31 8.131 8.131 7.758 0.373 19174
2464 1 14 . 1 1 32 32 TYR N N 32 120.550 120.550 121.991 -1.441 19174
2465 1 14 . 1 1 32 32 TYR CA C 32 61.405 61.405 61.977 -0.572 19174
2466 1 14 . 1 1 32 32 TYR CB C 32 38.358 38.358 38.461 -0.103 19174
2467 1 14 . 1 1 32 32 TYR H H 32 8.214 8.214 7.920 0.294 19174
2468 1 14 . 1 1 33 33 LEU N N 33 117.578 117.578 119.427 -1.849 19174
2469 1 14 . 1 1 33 33 LEU CA C 33 57.513 57.513 57.420 0.092 19174
2470 1 14 . 1 1 33 33 LEU CB C 33 41.657 41.657 41.514 0.143 19174
2471 1 14 . 1 1 33 33 LEU H H 33 8.347 8.347 8.170 0.177 19174
2472 1 14 . 1 1 34 34 SER N N 34 114.635 114.635 114.324 0.311 19174
2473 1 14 . 1 1 34 34 SER CA C 34 61.405 61.405 62.059 -0.654 19174
2474 1 14 . 1 1 34 34 SER CB C 34 63.403 63.403 62.799 0.604 19174
2475 1 14 . 1 1 34 34 SER H H 34 7.986 7.986 8.248 -0.262 19174
2476 1 14 . 1 1 35 35 GLY N N 35 110.749 110.749 109.856 0.893 19174
2477 1 14 . 1 1 35 35 GLY CA C 35 46.897 46.897 46.684 0.213 19174
2478 1 14 . 1 1 35 35 GLY H H 35 8.302 8.302 8.328 -0.026 19174
2479 1 14 . 1 1 36 36 LEU N N 36 121.632 121.632 122.488 -0.856 19174
2480 1 14 . 1 1 36 36 LEU CA C 36 57.619 57.619 56.871 0.748 19174
2481 1 14 . 1 1 36 36 LEU CB C 36 41.799 41.799 41.349 0.451 19174
2482 1 14 . 1 1 36 36 LEU H H 36 8.194 8.194 7.328 0.866 19174
2483 1 14 . 1 1 37 37 ARG N N 37 118.274 118.274 118.683 -0.409 19174
2484 1 14 . 1 1 37 37 ARG CA C 37 59.049 59.049 59.589 -0.540 19174
2485 1 14 . 1 1 37 37 ARG CB C 37 30.044 30.044 30.058 -0.014 19174
2486 1 14 . 1 1 37 37 ARG H H 37 7.934 7.934 7.484 0.450 19174
2487 1 14 . 1 1 38 38 SER N N 38 114.239 114.239 115.653 -1.414 19174
2488 1 14 . 1 1 38 38 SER CA C 38 60.531 60.531 61.725 -1.194 19174
2489 1 14 . 1 1 38 38 SER CB C 38 63.509 63.509 62.755 0.754 19174
2490 1 14 . 1 1 38 38 SER H H 38 7.913 7.913 7.726 0.187 19174
2491 1 14 . 1 1 39 39 TRP N N 39 123.095 123.095 122.869 0.226 19174
2492 1 14 . 1 1 39 39 TRP CA C 39 59.870 59.870 58.257 1.613 19174
2493 1 14 . 1 1 39 39 TRP CB C 39 28.721 28.721 28.320 0.401 19174
2494 1 14 . 1 1 39 39 TRP H H 39 8.108 8.108 8.785 -0.677 19174
2495 1 14 . 1 1 40 40 LYS N N 40 119.629 119.629 119.908 -0.279 19174
2496 1 14 . 1 1 40 40 LYS CA C 40 59.525 59.525 59.762 -0.237 19174
2497 1 14 . 1 1 40 40 LYS CB C 40 32.109 32.109 32.145 -0.036 19174
2498 1 14 . 1 1 40 40 LYS H H 40 7.938 7.938 7.923 0.015 19174
2499 1 14 . 1 1 41 41 ARG N N 41 117.834 117.834 117.782 0.052 19174
2500 1 14 . 1 1 41 41 ARG CA C 41 57.857 57.857 58.956 -1.099 19174
2501 1 14 . 1 1 41 41 ARG CB C 41 30.203 30.203 29.917 0.286 19174
2502 1 14 . 1 1 41 41 ARG H H 41 7.863 7.863 7.630 0.233 19174
2503 1 14 . 1 1 42 42 HIS N N 42 115.774 115.774 116.110 -0.336 19174
2504 1 14 . 1 1 42 42 HIS CA C 42 57.487 57.487 58.702 -1.215 19174
2505 1 14 . 1 1 42 42 HIS CB C 42 30.786 30.786 30.316 0.470 19174
2506 1 14 . 1 1 42 42 HIS H H 42 7.919 7.919 7.519 0.400 19174
2507 1 14 . 1 1 43 43 LEU N N 43 120.243 120.243 120.673 -0.430 19174
2508 1 14 . 1 1 43 43 LEU CA C 43 56.745 56.745 54.858 1.887 19174
2509 1 14 . 1 1 43 43 LEU CB C 43 42.276 42.276 41.873 0.403 19174
2510 1 14 . 1 1 43 43 LEU H H 43 8.162 8.162 8.723 -0.561 19174
2511 1 14 . 1 1 44 44 SER N N 44 114.616 114.616 116.436 -1.820 19174
2512 1 14 . 1 1 44 44 SER CA C 44 60.987 60.987 61.857 -0.870 19174
2513 1 14 . 1 1 44 44 SER CB C 44 62.768 62.768 62.542 0.226 19174
2514 1 14 . 1 1 44 44 SER H H 44 8.033 8.033 8.278 -0.245 19174
2515 1 14 . 1 1 45 45 ARG N N 45 120.757 120.757 121.630 -0.873 19174
2516 1 14 . 1 1 45 45 ARG CA C 45 57.513 57.513 58.924 -1.411 19174
2517 1 14 . 1 1 45 45 ARG CB C 45 29.462 29.462 29.938 -0.476 19174
2518 1 14 . 1 1 45 45 ARG H H 45 7.763 7.763 8.026 -0.263 19174
2519 1 14 . 1 1 46 46 PHE N N 46 118.237 118.237 116.816 1.421 19174
2520 1 14 . 1 1 46 46 PHE CA C 46 59.155 59.155 60.587 -1.432 19174
2521 1 14 . 1 1 46 46 PHE CB C 46 39.311 39.311 38.631 0.680 19174
2522 1 14 . 1 1 46 46 PHE H H 46 7.673 7.673 7.918 -0.245 19174
2523 1 14 . 1 1 47 47 TRP N N 47 118.484 118.484 121.136 -2.652 19174
2524 1 14 . 1 1 47 47 TRP CA C 47 58.837 58.837 61.690 -2.853 19174
2525 1 14 . 1 1 47 47 TRP CB C 47 29.833 29.833 29.606 0.227 19174
2526 1 14 . 1 1 47 47 TRP H H 47 7.614 7.614 8.723 -1.109 19174
2527 1 14 . 1 1 48 48 ASN N N 48 114.629 114.629 115.745 -1.116 19174
2528 1 14 . 1 1 48 48 ASN CA C 48 54.124 54.124 55.203 -1.079 19174
2529 1 14 . 1 1 48 48 ASN CB C 48 38.887 38.887 38.676 0.211 19174
2530 1 14 . 1 1 48 48 ASN H H 48 7.811 7.811 8.278 -0.467 19174
2531 1 14 . 1 1 49 49 ASP N N 49 118.029 118.029 119.659 -1.630 19174
2532 1 14 . 1 1 49 49 ASP CA C 49 54.310 54.310 52.965 1.345 19174
2533 1 14 . 1 1 49 49 ASP CB C 49 40.793 40.793 40.929 -0.136 19174
2534 1 14 . 1 1 49 49 ASP H H 49 7.775 7.775 7.479 0.296 19174
2535 1 15 . 1 1 2 2 ALA N N 2 127.400 127.400 126.405 0.995 19174
2536 1 15 . 1 1 2 2 ALA CA C 2 52.536 52.536 52.334 0.202 19174
2537 1 15 . 1 1 2 2 ALA CB C 2 19.031 19.031 19.625 -0.594 19174
2538 1 15 . 1 1 2 2 ALA H H 2 8.593 8.593 8.350 0.243 19174
2539 1 15 . 1 1 3 3 GLU N N 3 120.977 120.977 121.426 -0.449 19174
2540 1 15 . 1 1 3 3 GLU CA C 3 56.295 56.295 55.816 0.479 19174
2541 1 15 . 1 1 3 3 GLU CB C 3 29.939 29.939 30.773 -0.834 19174
2542 1 15 . 1 1 3 3 GLU H H 3 8.301 8.301 8.611 -0.310 19174
2543 1 15 . 1 1 4 4 ALA N N 4 125.568 125.568 128.123 -2.555 19174
2544 1 15 . 1 1 4 4 ALA CA C 4 52.509 52.509 53.735 -1.226 19174
2545 1 15 . 1 1 4 4 ALA CB C 4 19.084 19.084 19.120 -0.036 19174
2546 1 15 . 1 1 4 4 ALA H H 4 8.229 8.229 8.692 -0.463 19174
2547 1 15 . 1 1 5 5 HIS N N 5 117.815 117.815 117.390 0.425 19174
2548 1 15 . 1 1 5 5 HIS CA C 5 55.157 55.157 55.435 -0.278 19174
2549 1 15 . 1 1 5 5 HIS CB C 5 28.827 28.827 30.504 -1.677 19174
2550 1 15 . 1 1 5 5 HIS H H 5 8.363 8.363 8.130 0.233 19174
2551 1 15 . 1 1 6 6 GLN N N 6 121.556 121.556 123.684 -2.128 19174
2552 1 15 . 1 1 6 6 GLN CA C 6 55.739 55.739 54.825 0.914 19174
2553 1 15 . 1 1 6 6 GLN CB C 6 29.409 29.409 30.860 -1.451 19174
2554 1 15 . 1 1 6 6 GLN H H 6 8.289 8.289 8.601 -0.312 19174
2555 1 15 . 1 1 7 7 ALA N N 7 126.411 126.411 127.535 -1.124 19174
2556 1 15 . 1 1 7 7 ALA CA C 7 52.404 52.404 51.737 0.666 19174
2557 1 15 . 1 1 7 7 ALA CB C 7 18.978 18.978 19.722 -0.744 19174
2558 1 15 . 1 1 7 7 ALA H H 7 8.311 8.311 8.392 -0.081 19174
2559 1 15 . 1 1 8 8 VAL N N 8 119.771 119.771 118.875 0.896 19174
2560 1 15 . 1 1 8 8 VAL CA C 8 62.491 62.491 63.945 -1.454 19174
2561 1 15 . 1 1 8 8 VAL CB C 8 32.586 32.586 31.574 1.012 19174
2562 1 15 . 1 1 8 8 VAL H H 8 8.018 8.018 7.856 0.162 19174
2563 1 15 . 1 1 9 9 GLY N N 9 112.108 112.108 106.327 5.781 19174
2564 1 15 . 1 1 9 9 GLY CA C 9 45.044 45.044 46.566 -1.522 19174
2565 1 15 . 1 1 9 9 GLY H H 9 8.243 8.243 8.183 0.060 19174
2566 1 15 . 1 1 10 10 PHE N N 10 120.842 120.842 116.011 4.831 19174
2567 1 15 . 1 1 10 10 PHE CA C 10 57.725 57.725 59.241 -1.516 19174
2568 1 15 . 1 1 10 10 PHE CB C 10 39.628 39.628 37.815 1.813 19174
2569 1 15 . 1 1 10 10 PHE H H 10 7.983 7.983 7.364 0.619 19174
2570 1 15 . 1 1 11 11 ARG N N 11 125.277 125.277 118.385 6.892 19174
2571 1 15 . 1 1 11 11 ARG CA C 11 53.410 53.410 54.354 -0.944 19174
2572 1 15 . 1 1 11 11 ARG CB C 11 30.574 30.574 30.658 -0.084 19174
2573 1 15 . 1 1 11 11 ARG H H 11 8.016 8.016 7.735 0.281 19174
2574 1 15 . 1 1 13 13 SER N N 13 115.938 115.938 114.937 1.001 19174
2575 1 15 . 1 1 13 13 SER CA C 13 58.043 58.043 58.702 -0.659 19174
2576 1 15 . 1 1 13 13 SER CB C 13 63.774 63.774 63.490 0.284 19174
2577 1 15 . 1 1 13 13 SER H H 13 8.197 8.197 8.311 -0.114 19174
2578 1 15 . 1 1 14 14 LEU N N 14 124.186 124.186 123.270 0.916 19174
2579 1 15 . 1 1 14 14 LEU CA C 14 55.422 55.422 54.653 0.769 19174
2580 1 15 . 1 1 14 14 LEU CB C 14 42.329 42.329 42.734 -0.405 19174
2581 1 15 . 1 1 14 14 LEU H H 14 8.256 8.256 7.601 0.655 19174
2582 1 15 . 1 1 15 15 THR N N 15 112.858 112.858 114.223 -1.365 19174
2583 1 15 . 1 1 15 15 THR CA C 15 61.379 61.379 60.014 1.365 19174
2584 1 15 . 1 1 15 15 THR CB C 15 69.810 69.810 71.525 -1.714 19174
2585 1 15 . 1 1 15 15 THR H H 15 7.913 7.913 8.030 -0.117 19174
2586 1 15 . 1 1 16 16 SER N N 16 117.578 117.578 115.443 2.135 19174
2587 1 15 . 1 1 16 16 SER CA C 16 58.678 58.678 60.128 -1.450 19174
2588 1 15 . 1 1 16 16 SER CB C 16 63.668 63.668 63.078 0.590 19174
2589 1 15 . 1 1 16 16 SER H H 16 8.154 8.154 8.627 -0.473 19174
2590 1 15 . 1 1 17 17 ASP N N 17 122.030 122.030 119.699 2.331 19174
2591 1 15 . 1 1 17 17 ASP CA C 17 54.680 54.680 54.983 -0.303 19174
2592 1 15 . 1 1 17 17 ASP CB C 17 40.899 40.899 40.952 -0.053 19174
2593 1 15 . 1 1 17 17 ASP H H 17 8.263 8.263 7.940 0.323 19174
2594 1 15 . 1 1 18 18 GLY N N 18 108.815 108.815 110.219 -1.404 19174
2595 1 15 . 1 1 18 18 GLY CA C 18 45.758 45.758 45.830 -0.072 19174
2596 1 15 . 1 1 18 18 GLY H H 18 8.239 8.239 8.492 -0.253 19174
2597 1 15 . 1 1 19 19 ALA N N 19 123.128 123.128 122.000 1.128 19174
2598 1 15 . 1 1 19 19 ALA CA C 19 53.164 53.164 54.070 -0.906 19174
2599 1 15 . 1 1 19 19 ALA CB C 19 19.084 19.084 18.578 0.506 19174
2600 1 15 . 1 1 19 19 ALA H H 19 8.001 8.001 7.525 0.476 19174
2601 1 15 . 1 1 20 20 GLU N N 20 117.663 117.663 116.877 0.786 19174
2602 1 15 . 1 1 20 20 GLU CA C 20 57.275 57.275 57.682 -0.407 19174
2603 1 15 . 1 1 20 20 GLU CB C 20 29.250 29.250 29.935 -0.685 19174
2604 1 15 . 1 1 20 20 GLU H H 20 8.231 8.231 8.621 -0.390 19174
2605 1 15 . 1 1 21 21 VAL N N 21 119.044 119.044 113.254 5.790 19174
2606 1 15 . 1 1 21 21 VAL CA C 21 62.755 62.755 59.974 2.781 19174
2607 1 15 . 1 1 21 21 VAL CB C 21 32.268 32.268 34.203 -1.935 19174
2608 1 15 . 1 1 21 21 VAL H H 21 7.767 7.767 7.447 0.320 19174
2609 1 15 . 1 1 22 22 GLU N N 22 121.765 121.765 123.107 -1.342 19174
2610 1 15 . 1 1 22 22 GLU CA C 22 56.613 56.613 58.350 -1.737 19174
2611 1 15 . 1 1 22 22 GLU CB C 22 29.833 29.833 29.721 0.112 19174
2612 1 15 . 1 1 22 22 GLU H H 22 7.969 7.969 8.721 -0.752 19174
2613 1 15 . 1 1 23 23 LEU N N 23 120.996 120.996 118.473 2.523 19174
2614 1 15 . 1 1 23 23 LEU CA C 23 54.310 54.310 55.278 -0.968 19174
2615 1 15 . 1 1 23 23 LEU CB C 23 42.223 42.223 42.936 -0.713 19174
2616 1 15 . 1 1 23 23 LEU H H 23 7.917 7.917 7.605 0.312 19174
2617 1 15 . 1 1 24 24 SER N N 24 114.702 114.702 108.964 5.738 19174
2618 1 15 . 1 1 24 24 SER CA C 24 57.593 57.593 58.043 -0.450 19174
2619 1 15 . 1 1 24 24 SER CB C 24 64.515 64.515 63.052 1.463 19174
2620 1 15 . 1 1 24 24 SER H H 24 7.564 7.564 7.946 -0.382 19174
2621 1 15 . 1 1 25 25 ALA N N 25 125.059 125.059 126.086 -1.027 19174
2622 1 15 . 1 1 25 25 ALA CA C 25 55.898 55.898 55.945 -0.047 19174
2623 1 15 . 1 1 25 25 ALA CB C 25 16.330 16.330 16.631 -0.301 19174
2624 1 15 . 1 1 25 25 ALA H H 25 8.630 8.630 8.614 0.016 19174
2625 1 15 . 1 1 27 27 VAL N N 27 118.016 118.016 117.539 0.477 19174
2626 1 15 . 1 1 27 27 VAL CA C 27 65.826 65.826 66.237 -0.411 19174
2627 1 15 . 1 1 27 27 VAL CB C 27 31.686 31.686 31.751 -0.065 19174
2628 1 15 . 1 1 27 27 VAL H H 27 7.294 7.294 7.278 0.016 19174
2629 1 15 . 1 1 28 28 LEU N N 28 119.933 119.933 120.138 -0.205 19174
2630 1 15 . 1 1 28 28 LEU CA C 28 57.990 57.990 58.240 -0.250 19174
2631 1 15 . 1 1 28 28 LEU CB C 28 41.429 41.429 41.383 0.046 19174
2632 1 15 . 1 1 28 28 LEU H H 28 7.939 7.939 8.456 -0.517 19174
2633 1 15 . 1 1 29 29 GLN N N 29 117.644 117.644 119.353 -1.709 19174
2634 1 15 . 1 1 29 29 GLN CA C 29 59.367 59.367 59.575 -0.208 19174
2635 1 15 . 1 1 29 29 GLN CB C 29 28.297 28.297 28.570 -0.273 19174
2636 1 15 . 1 1 29 29 GLN H H 29 8.179 8.179 8.815 -0.636 19174
2637 1 15 . 1 1 30 30 GLU N N 30 118.389 118.389 120.283 -1.894 19174
2638 1 15 . 1 1 30 30 GLU CA C 30 59.128 59.128 59.354 -0.226 19174
2639 1 15 . 1 1 30 30 GLU CB C 30 29.038 29.038 29.585 -0.547 19174
2640 1 15 . 1 1 30 30 GLU H H 30 7.752 7.752 7.813 -0.061 19174
2641 1 15 . 1 1 31 31 ILE N N 31 120.796 120.796 120.810 -0.014 19174
2642 1 15 . 1 1 31 31 ILE CA C 31 65.509 65.509 65.388 0.121 19174
2643 1 15 . 1 1 31 31 ILE CB C 31 37.775 37.775 37.901 -0.126 19174
2644 1 15 . 1 1 31 31 ILE H H 31 8.131 8.131 8.216 -0.085 19174
2645 1 15 . 1 1 32 32 TYR N N 32 120.550 120.550 120.982 -0.432 19174
2646 1 15 . 1 1 32 32 TYR CA C 32 61.405 61.405 62.114 -0.709 19174
2647 1 15 . 1 1 32 32 TYR CB C 32 38.358 38.358 38.481 -0.123 19174
2648 1 15 . 1 1 32 32 TYR H H 32 8.214 8.214 8.339 -0.125 19174
2649 1 15 . 1 1 33 33 LEU N N 33 117.578 117.578 119.287 -1.709 19174
2650 1 15 . 1 1 33 33 LEU CA C 33 57.513 57.513 57.419 0.094 19174
2651 1 15 . 1 1 33 33 LEU CB C 33 41.657 41.657 41.507 0.151 19174
2652 1 15 . 1 1 33 33 LEU H H 33 8.347 8.347 8.365 -0.018 19174
2653 1 15 . 1 1 34 34 SER N N 34 114.635 114.635 114.268 0.367 19174
2654 1 15 . 1 1 34 34 SER CA C 34 61.405 61.405 62.077 -0.672 19174
2655 1 15 . 1 1 34 34 SER CB C 34 63.403 63.403 62.818 0.585 19174
2656 1 15 . 1 1 34 34 SER H H 34 7.986 7.986 8.421 -0.435 19174
2657 1 15 . 1 1 35 35 GLY N N 35 110.749 110.749 109.168 1.581 19174
2658 1 15 . 1 1 35 35 GLY CA C 35 46.897 46.897 46.521 0.376 19174
2659 1 15 . 1 1 35 35 GLY H H 35 8.302 8.302 8.208 0.094 19174
2660 1 15 . 1 1 36 36 LEU N N 36 121.632 121.632 122.369 -0.737 19174
2661 1 15 . 1 1 36 36 LEU CA C 36 57.619 57.619 56.816 0.803 19174
2662 1 15 . 1 1 36 36 LEU CB C 36 41.799 41.799 41.316 0.483 19174
2663 1 15 . 1 1 36 36 LEU H H 36 8.194 8.194 7.300 0.894 19174
2664 1 15 . 1 1 37 37 ARG N N 37 118.274 118.274 118.553 -0.279 19174
2665 1 15 . 1 1 37 37 ARG CA C 37 59.049 59.049 59.584 -0.535 19174
2666 1 15 . 1 1 37 37 ARG CB C 37 30.044 30.044 30.113 -0.070 19174
2667 1 15 . 1 1 37 37 ARG H H 37 7.934 7.934 7.556 0.378 19174
2668 1 15 . 1 1 38 38 SER N N 38 114.239 114.239 115.129 -0.890 19174
2669 1 15 . 1 1 38 38 SER CA C 38 60.531 60.531 61.259 -0.728 19174
2670 1 15 . 1 1 38 38 SER CB C 38 63.509 63.509 62.719 0.790 19174
2671 1 15 . 1 1 38 38 SER H H 38 7.913 7.913 7.731 0.182 19174
2672 1 15 . 1 1 39 39 TRP N N 39 123.095 123.095 123.749 -0.654 19174
2673 1 15 . 1 1 39 39 TRP CA C 39 59.870 59.870 58.269 1.601 19174
2674 1 15 . 1 1 39 39 TRP CB C 39 28.721 28.721 28.000 0.722 19174
2675 1 15 . 1 1 39 39 TRP H H 39 8.108 8.108 8.490 -0.382 19174
2676 1 15 . 1 1 40 40 LYS N N 40 119.629 119.629 119.022 0.607 19174
2677 1 15 . 1 1 40 40 LYS CA C 40 59.525 59.525 59.761 -0.236 19174
2678 1 15 . 1 1 40 40 LYS CB C 40 32.109 32.109 31.915 0.194 19174
2679 1 15 . 1 1 40 40 LYS H H 40 7.938 7.938 7.858 0.080 19174
2680 1 15 . 1 1 41 41 ARG N N 41 117.834 117.834 118.296 -0.462 19174
2681 1 15 . 1 1 41 41 ARG CA C 41 57.857 57.857 59.221 -1.364 19174
2682 1 15 . 1 1 41 41 ARG CB C 41 30.203 30.203 30.124 0.079 19174
2683 1 15 . 1 1 41 41 ARG H H 41 7.863 7.863 7.769 0.094 19174
2684 1 15 . 1 1 42 42 HIS N N 42 115.774 115.774 118.135 -2.361 19174
2685 1 15 . 1 1 42 42 HIS CA C 42 57.487 57.487 59.992 -2.505 19174
2686 1 15 . 1 1 42 42 HIS CB C 42 30.786 30.786 29.799 0.987 19174
2687 1 15 . 1 1 42 42 HIS H H 42 7.919 7.919 7.647 0.272 19174
2688 1 15 . 1 1 43 43 LEU N N 43 120.243 120.243 119.139 1.104 19174
2689 1 15 . 1 1 43 43 LEU CA C 43 56.745 56.745 56.001 0.744 19174
2690 1 15 . 1 1 43 43 LEU CB C 43 42.276 42.276 41.041 1.235 19174
2691 1 15 . 1 1 43 43 LEU H H 43 8.162 8.162 8.937 -0.775 19174
2692 1 15 . 1 1 44 44 SER N N 44 114.616 114.616 116.960 -2.344 19174
2693 1 15 . 1 1 44 44 SER CA C 44 60.987 60.987 62.351 -1.364 19174
2694 1 15 . 1 1 44 44 SER CB C 44 62.768 62.768 62.290 0.478 19174
2695 1 15 . 1 1 44 44 SER H H 44 8.033 8.033 8.350 -0.317 19174
2696 1 15 . 1 1 45 45 ARG N N 45 120.757 120.757 121.335 -0.578 19174
2697 1 15 . 1 1 45 45 ARG CA C 45 57.513 57.513 59.042 -1.529 19174
2698 1 15 . 1 1 45 45 ARG CB C 45 29.462 29.462 29.846 -0.384 19174
2699 1 15 . 1 1 45 45 ARG H H 45 7.763 7.763 7.918 -0.155 19174
2700 1 15 . 1 1 46 46 PHE N N 46 118.237 118.237 118.249 -0.012 19174
2701 1 15 . 1 1 46 46 PHE CA C 46 59.155 59.155 61.266 -2.111 19174
2702 1 15 . 1 1 46 46 PHE CB C 46 39.311 39.311 38.757 0.554 19174
2703 1 15 . 1 1 46 46 PHE H H 46 7.673 7.673 8.012 -0.339 19174
2704 1 15 . 1 1 47 47 TRP N N 47 118.484 118.484 122.162 -3.678 19174
2705 1 15 . 1 1 47 47 TRP CA C 47 58.837 58.837 59.916 -1.079 19174
2706 1 15 . 1 1 47 47 TRP CB C 47 29.833 29.833 29.804 0.029 19174
2707 1 15 . 1 1 47 47 TRP H H 47 7.614 7.614 9.050 -1.436 19174
2708 1 15 . 1 1 48 48 ASN N N 48 114.629 114.629 118.401 -3.772 19174
2709 1 15 . 1 1 48 48 ASN CA C 48 54.124 54.124 55.614 -1.490 19174
2710 1 15 . 1 1 48 48 ASN CB C 48 38.887 38.887 38.160 0.727 19174
2711 1 15 . 1 1 48 48 ASN H H 48 7.811 7.811 8.250 -0.439 19174
2712 1 15 . 1 1 49 49 ASP N N 49 118.029 118.029 119.192 -1.163 19174
2713 1 15 . 1 1 49 49 ASP CA C 49 54.310 54.310 55.841 -1.531 19174
2714 1 15 . 1 1 49 49 ASP CB C 49 40.793 40.793 41.427 -0.634 19174
2715 1 15 . 1 1 49 49 ASP H H 49 7.775 7.775 7.623 0.152 19174
2716 1 16 . 1 1 2 2 ALA N N 2 127.400 127.400 124.828 2.572 19174
2717 1 16 . 1 1 2 2 ALA CA C 2 52.536 52.536 51.890 0.646 19174
2718 1 16 . 1 1 2 2 ALA CB C 2 19.031 19.031 19.676 -0.645 19174
2719 1 16 . 1 1 2 2 ALA H H 2 8.593 8.593 8.389 0.204 19174
2720 1 16 . 1 1 3 3 GLU N N 3 120.977 120.977 120.010 0.967 19174
2721 1 16 . 1 1 3 3 GLU CA C 3 56.295 56.295 58.228 -1.933 19174
2722 1 16 . 1 1 3 3 GLU CB C 3 29.939 29.939 29.916 0.023 19174
2723 1 16 . 1 1 3 3 GLU H H 3 8.301 8.301 8.987 -0.686 19174
2724 1 16 . 1 1 4 4 ALA N N 4 125.568 125.568 118.428 7.140 19174
2725 1 16 . 1 1 4 4 ALA CA C 4 52.509 52.509 51.957 0.552 19174
2726 1 16 . 1 1 4 4 ALA CB C 4 19.084 19.084 18.486 0.598 19174
2727 1 16 . 1 1 4 4 ALA H H 4 8.229 8.229 7.885 0.344 19174
2728 1 16 . 1 1 5 5 HIS N N 5 117.815 117.815 118.241 -0.426 19174
2729 1 16 . 1 1 5 5 HIS CA C 5 55.157 55.157 57.607 -2.450 19174
2730 1 16 . 1 1 5 5 HIS CB C 5 28.827 28.827 29.763 -0.936 19174
2731 1 16 . 1 1 5 5 HIS H H 5 8.363 8.363 8.183 0.180 19174
2732 1 16 . 1 1 6 6 GLN N N 6 121.556 121.556 118.890 2.666 19174
2733 1 16 . 1 1 6 6 GLN CA C 6 55.739 55.739 55.514 0.225 19174
2734 1 16 . 1 1 6 6 GLN CB C 6 29.409 29.409 28.372 1.036 19174
2735 1 16 . 1 1 6 6 GLN H H 6 8.289 8.289 8.194 0.095 19174
2736 1 16 . 1 1 7 7 ALA N N 7 126.411 126.411 128.242 -1.831 19174
2737 1 16 . 1 1 7 7 ALA CA C 7 52.404 52.404 52.384 0.020 19174
2738 1 16 . 1 1 7 7 ALA CB C 7 18.978 18.978 19.652 -0.674 19174
2739 1 16 . 1 1 7 7 ALA H H 7 8.311 8.311 8.464 -0.153 19174
2740 1 16 . 1 1 8 8 VAL N N 8 119.771 119.771 117.908 1.863 19174
2741 1 16 . 1 1 8 8 VAL CA C 8 62.491 62.491 60.976 1.515 19174
2742 1 16 . 1 1 8 8 VAL CB C 8 32.586 32.586 33.937 -1.351 19174
2743 1 16 . 1 1 8 8 VAL H H 8 8.018 8.018 8.207 -0.189 19174
2744 1 16 . 1 1 9 9 GLY N N 9 112.108 112.108 109.214 2.894 19174
2745 1 16 . 1 1 9 9 GLY CA C 9 45.044 45.044 44.844 0.200 19174
2746 1 16 . 1 1 9 9 GLY H H 9 8.243 8.243 8.064 0.179 19174
2747 1 16 . 1 1 10 10 PHE N N 10 120.842 120.842 119.620 1.222 19174
2748 1 16 . 1 1 10 10 PHE CA C 10 57.725 57.725 57.723 0.002 19174
2749 1 16 . 1 1 10 10 PHE CB C 10 39.628 39.628 39.817 -0.189 19174
2750 1 16 . 1 1 10 10 PHE H H 10 7.983 7.983 8.153 -0.170 19174
2751 1 16 . 1 1 11 11 ARG N N 11 125.277 125.277 120.443 4.834 19174
2752 1 16 . 1 1 11 11 ARG CA C 11 53.410 53.410 55.988 -2.578 19174
2753 1 16 . 1 1 11 11 ARG CB C 11 30.574 30.574 28.716 1.858 19174
2754 1 16 . 1 1 11 11 ARG H H 11 8.016 8.016 8.805 -0.789 19174
2755 1 16 . 1 1 13 13 SER N N 13 115.938 115.938 112.243 3.695 19174
2756 1 16 . 1 1 13 13 SER CA C 13 58.043 58.043 60.645 -2.602 19174
2757 1 16 . 1 1 13 13 SER CB C 13 63.774 63.774 62.848 0.926 19174
2758 1 16 . 1 1 13 13 SER H H 13 8.197 8.197 8.173 0.024 19174
2759 1 16 . 1 1 14 14 LEU N N 14 124.186 124.186 121.821 2.365 19174
2760 1 16 . 1 1 14 14 LEU CA C 14 55.422 55.422 56.846 -1.424 19174
2761 1 16 . 1 1 14 14 LEU CB C 14 42.329 42.329 42.884 -0.555 19174
2762 1 16 . 1 1 14 14 LEU H H 14 8.256 8.256 7.423 0.833 19174
2763 1 16 . 1 1 15 15 THR N N 15 112.858 112.858 114.917 -2.059 19174
2764 1 16 . 1 1 15 15 THR CA C 15 61.379 61.379 61.419 -0.040 19174
2765 1 16 . 1 1 15 15 THR CB C 15 69.810 69.810 70.552 -0.742 19174
2766 1 16 . 1 1 15 15 THR H H 15 7.913 7.913 7.622 0.291 19174
2767 1 16 . 1 1 16 16 SER N N 16 117.578 117.578 121.347 -3.769 19174
2768 1 16 . 1 1 16 16 SER CA C 16 58.678 58.678 58.059 0.619 19174
2769 1 16 . 1 1 16 16 SER CB C 16 63.668 63.668 64.127 -0.459 19174
2770 1 16 . 1 1 16 16 SER H H 16 8.154 8.154 8.569 -0.415 19174
2771 1 16 . 1 1 17 17 ASP N N 17 122.030 122.030 122.526 -0.496 19174
2772 1 16 . 1 1 17 17 ASP CA C 17 54.680 54.680 55.302 -0.622 19174
2773 1 16 . 1 1 17 17 ASP CB C 17 40.899 40.899 40.831 0.067 19174
2774 1 16 . 1 1 17 17 ASP H H 17 8.263 8.263 8.693 -0.430 19174
2775 1 16 . 1 1 18 18 GLY N N 18 108.815 108.815 107.889 0.926 19174
2776 1 16 . 1 1 18 18 GLY CA C 18 45.758 45.758 45.072 0.687 19174
2777 1 16 . 1 1 18 18 GLY H H 18 8.239 8.239 7.938 0.301 19174
2778 1 16 . 1 1 19 19 ALA N N 19 123.128 123.128 122.959 0.169 19174
2779 1 16 . 1 1 19 19 ALA CA C 19 53.164 53.164 52.687 0.478 19174
2780 1 16 . 1 1 19 19 ALA CB C 19 19.084 19.084 19.154 -0.070 19174
2781 1 16 . 1 1 19 19 ALA H H 19 8.001 8.001 7.834 0.167 19174
2782 1 16 . 1 1 20 20 GLU N N 20 117.663 117.663 117.731 -0.068 19174
2783 1 16 . 1 1 20 20 GLU CA C 20 57.275 57.275 56.437 0.838 19174
2784 1 16 . 1 1 20 20 GLU CB C 20 29.250 29.250 29.336 -0.086 19174
2785 1 16 . 1 1 20 20 GLU H H 20 8.231 8.231 8.309 -0.078 19174
2786 1 16 . 1 1 21 21 VAL N N 21 119.044 119.044 124.259 -5.215 19174
2787 1 16 . 1 1 21 21 VAL CA C 21 62.755 62.755 64.756 -2.001 19174
2788 1 16 . 1 1 21 21 VAL CB C 21 32.268 32.268 31.735 0.533 19174
2789 1 16 . 1 1 21 21 VAL H H 21 7.767 7.767 8.256 -0.489 19174
2790 1 16 . 1 1 22 22 GLU N N 22 121.765 121.765 119.458 2.307 19174
2791 1 16 . 1 1 22 22 GLU CA C 22 56.613 56.613 56.788 -0.174 19174
2792 1 16 . 1 1 22 22 GLU CB C 22 29.833 29.833 29.729 0.104 19174
2793 1 16 . 1 1 22 22 GLU H H 22 7.969 7.969 8.123 -0.154 19174
2794 1 16 . 1 1 23 23 LEU N N 23 120.996 120.996 120.134 0.862 19174
2795 1 16 . 1 1 23 23 LEU CA C 23 54.310 54.310 54.970 -0.660 19174
2796 1 16 . 1 1 23 23 LEU CB C 23 42.223 42.223 41.300 0.923 19174
2797 1 16 . 1 1 23 23 LEU H H 23 7.917 7.917 7.820 0.097 19174
2798 1 16 . 1 1 24 24 SER N N 24 114.702 114.702 118.485 -3.783 19174
2799 1 16 . 1 1 24 24 SER CA C 24 57.593 57.593 58.684 -1.091 19174
2800 1 16 . 1 1 24 24 SER CB C 24 64.515 64.515 64.239 0.276 19174
2801 1 16 . 1 1 24 24 SER H H 24 7.564 7.564 8.030 -0.466 19174
2802 1 16 . 1 1 25 25 ALA N N 25 125.059 125.059 130.516 -5.457 19174
2803 1 16 . 1 1 25 25 ALA CA C 25 55.898 55.898 55.144 0.754 19174
2804 1 16 . 1 1 25 25 ALA CB C 25 16.330 16.330 17.117 -0.787 19174
2805 1 16 . 1 1 25 25 ALA H H 25 8.630 8.630 8.897 -0.267 19174
2806 1 16 . 1 1 27 27 VAL N N 27 118.016 118.016 117.200 0.816 19174
2807 1 16 . 1 1 27 27 VAL CA C 27 65.826 65.826 66.740 -0.914 19174
2808 1 16 . 1 1 27 27 VAL CB C 27 31.686 31.686 31.389 0.297 19174
2809 1 16 . 1 1 27 27 VAL H H 27 7.294 7.294 7.488 -0.194 19174
2810 1 16 . 1 1 28 28 LEU N N 28 119.933 119.933 119.671 0.262 19174
2811 1 16 . 1 1 28 28 LEU CA C 28 57.990 57.990 57.989 0.001 19174
2812 1 16 . 1 1 28 28 LEU CB C 28 41.429 41.429 41.446 -0.017 19174
2813 1 16 . 1 1 28 28 LEU H H 28 7.939 7.939 7.572 0.367 19174
2814 1 16 . 1 1 29 29 GLN N N 29 117.644 117.644 118.314 -0.670 19174
2815 1 16 . 1 1 29 29 GLN CA C 29 59.367 59.367 59.260 0.107 19174
2816 1 16 . 1 1 29 29 GLN CB C 29 28.297 28.297 28.473 -0.176 19174
2817 1 16 . 1 1 29 29 GLN H H 29 8.179 8.179 7.722 0.457 19174
2818 1 16 . 1 1 30 30 GLU N N 30 118.389 118.389 120.883 -2.494 19174
2819 1 16 . 1 1 30 30 GLU CA C 30 59.128 59.128 58.970 0.158 19174
2820 1 16 . 1 1 30 30 GLU CB C 30 29.038 29.038 29.222 -0.184 19174
2821 1 16 . 1 1 30 30 GLU H H 30 7.752 7.752 8.182 -0.430 19174
2822 1 16 . 1 1 31 31 ILE N N 31 120.796 120.796 120.841 -0.045 19174
2823 1 16 . 1 1 31 31 ILE CA C 31 65.509 65.509 65.492 0.017 19174
2824 1 16 . 1 1 31 31 ILE CB C 31 37.775 37.775 37.926 -0.151 19174
2825 1 16 . 1 1 31 31 ILE H H 31 8.131 8.131 8.092 0.039 19174
2826 1 16 . 1 1 32 32 TYR N N 32 120.550 120.550 120.985 -0.435 19174
2827 1 16 . 1 1 32 32 TYR CA C 32 61.405 61.405 62.194 -0.789 19174
2828 1 16 . 1 1 32 32 TYR CB C 32 38.358 38.358 38.544 -0.186 19174
2829 1 16 . 1 1 32 32 TYR H H 32 8.214 8.214 8.261 -0.047 19174
2830 1 16 . 1 1 33 33 LEU N N 33 117.578 117.578 119.385 -1.807 19174
2831 1 16 . 1 1 33 33 LEU CA C 33 57.513 57.513 57.540 -0.027 19174
2832 1 16 . 1 1 33 33 LEU CB C 33 41.657 41.657 41.735 -0.078 19174
2833 1 16 . 1 1 33 33 LEU H H 33 8.347 8.347 8.348 -0.001 19174
2834 1 16 . 1 1 34 34 SER N N 34 114.635 114.635 115.466 -0.831 19174
2835 1 16 . 1 1 34 34 SER CA C 34 61.405 61.405 62.264 -0.859 19174
2836 1 16 . 1 1 34 34 SER CB C 34 63.403 63.403 62.969 0.434 19174
2837 1 16 . 1 1 34 34 SER H H 34 7.986 7.986 8.450 -0.464 19174
2838 1 16 . 1 1 35 35 GLY N N 35 110.749 110.749 109.929 0.820 19174
2839 1 16 . 1 1 35 35 GLY CA C 35 46.897 46.897 46.884 0.013 19174
2840 1 16 . 1 1 35 35 GLY H H 35 8.302 8.302 8.350 -0.048 19174
2841 1 16 . 1 1 36 36 LEU N N 36 121.632 121.632 122.675 -1.043 19174
2842 1 16 . 1 1 36 36 LEU CA C 36 57.619 57.619 57.330 0.289 19174
2843 1 16 . 1 1 36 36 LEU CB C 36 41.799 41.799 41.645 0.154 19174
2844 1 16 . 1 1 36 36 LEU H H 36 8.194 8.194 7.789 0.405 19174
2845 1 16 . 1 1 37 37 ARG N N 37 118.274 118.274 118.000 0.274 19174
2846 1 16 . 1 1 37 37 ARG CA C 37 59.049 59.049 59.593 -0.544 19174
2847 1 16 . 1 1 37 37 ARG CB C 37 30.044 30.044 29.872 0.172 19174
2848 1 16 . 1 1 37 37 ARG H H 37 7.934 7.934 7.687 0.247 19174
2849 1 16 . 1 1 38 38 SER N N 38 114.239 114.239 114.779 -0.540 19174
2850 1 16 . 1 1 38 38 SER CA C 38 60.531 60.531 61.052 -0.521 19174
2851 1 16 . 1 1 38 38 SER CB C 38 63.509 63.509 63.323 0.186 19174
2852 1 16 . 1 1 38 38 SER H H 38 7.913 7.913 7.718 0.195 19174
2853 1 16 . 1 1 39 39 TRP N N 39 123.095 123.095 124.689 -1.594 19174
2854 1 16 . 1 1 39 39 TRP CA C 39 59.870 59.870 60.167 -0.298 19174
2855 1 16 . 1 1 39 39 TRP CB C 39 28.721 28.721 29.548 -0.827 19174
2856 1 16 . 1 1 39 39 TRP H H 39 8.108 8.108 8.724 -0.616 19174
2857 1 16 . 1 1 40 40 LYS N N 40 119.629 119.629 118.472 1.157 19174
2858 1 16 . 1 1 40 40 LYS CA C 40 59.525 59.525 59.076 0.449 19174
2859 1 16 . 1 1 40 40 LYS CB C 40 32.109 32.109 32.095 0.014 19174
2860 1 16 . 1 1 40 40 LYS H H 40 7.938 7.938 7.908 0.030 19174
2861 1 16 . 1 1 41 41 ARG N N 41 117.834 117.834 119.498 -1.664 19174
2862 1 16 . 1 1 41 41 ARG CA C 41 57.857 57.857 59.267 -1.410 19174
2863 1 16 . 1 1 41 41 ARG CB C 41 30.203 30.203 29.701 0.502 19174
2864 1 16 . 1 1 41 41 ARG H H 41 7.863 7.863 7.473 0.390 19174
2865 1 16 . 1 1 42 42 HIS N N 42 115.774 115.774 115.582 0.192 19174
2866 1 16 . 1 1 42 42 HIS CA C 42 57.487 57.487 58.385 -0.898 19174
2867 1 16 . 1 1 42 42 HIS CB C 42 30.786 30.786 29.114 1.671 19174
2868 1 16 . 1 1 42 42 HIS H H 42 7.919 7.919 7.422 0.497 19174
2869 1 16 . 1 1 43 43 LEU N N 43 120.243 120.243 118.346 1.897 19174
2870 1 16 . 1 1 43 43 LEU CA C 43 56.745 56.745 54.964 1.781 19174
2871 1 16 . 1 1 43 43 LEU CB C 43 42.276 42.276 41.574 0.702 19174
2872 1 16 . 1 1 43 43 LEU H H 43 8.162 8.162 7.313 0.849 19174
2873 1 16 . 1 1 44 44 SER N N 44 114.616 114.616 116.101 -1.485 19174
2874 1 16 . 1 1 44 44 SER CA C 44 60.987 60.987 62.271 -1.284 19174
2875 1 16 . 1 1 44 44 SER CB C 44 62.768 62.768 62.918 -0.150 19174
2876 1 16 . 1 1 44 44 SER H H 44 8.033 8.033 8.280 -0.247 19174
2877 1 16 . 1 1 45 45 ARG N N 45 120.757 120.757 120.465 0.292 19174
2878 1 16 . 1 1 45 45 ARG CA C 45 57.513 57.513 59.063 -1.550 19174
2879 1 16 . 1 1 45 45 ARG CB C 45 29.462 29.462 29.856 -0.394 19174
2880 1 16 . 1 1 45 45 ARG H H 45 7.763 7.763 8.182 -0.419 19174
2881 1 16 . 1 1 46 46 PHE N N 46 118.237 118.237 116.899 1.338 19174
2882 1 16 . 1 1 46 46 PHE CA C 46 59.155 59.155 60.666 -1.511 19174
2883 1 16 . 1 1 46 46 PHE CB C 46 39.311 39.311 38.690 0.621 19174
2884 1 16 . 1 1 46 46 PHE H H 46 7.673 7.673 7.942 -0.269 19174
2885 1 16 . 1 1 47 47 TRP N N 47 118.484 118.484 122.028 -3.544 19174
2886 1 16 . 1 1 47 47 TRP CA C 47 58.837 58.837 60.577 -1.740 19174
2887 1 16 . 1 1 47 47 TRP CB C 47 29.833 29.833 29.502 0.331 19174
2888 1 16 . 1 1 47 47 TRP H H 47 7.614 7.614 8.864 -1.250 19174
2889 1 16 . 1 1 48 48 ASN N N 48 114.629 114.629 116.187 -1.558 19174
2890 1 16 . 1 1 48 48 ASN CA C 48 54.124 54.124 55.149 -1.025 19174
2891 1 16 . 1 1 48 48 ASN CB C 48 38.887 38.887 38.590 0.297 19174
2892 1 16 . 1 1 48 48 ASN H H 48 7.811 7.811 8.278 -0.467 19174
2893 1 16 . 1 1 49 49 ASP N N 49 118.029 118.029 119.520 -1.491 19174
2894 1 16 . 1 1 49 49 ASP CA C 49 54.310 54.310 53.304 1.006 19174
2895 1 16 . 1 1 49 49 ASP CB C 49 40.793 40.793 40.632 0.161 19174
2896 1 16 . 1 1 49 49 ASP H H 49 7.775 7.775 7.400 0.375 19174
2897 1 17 . 1 1 2 2 ALA N N 2 127.400 127.400 124.842 2.558 19174
2898 1 17 . 1 1 2 2 ALA CA C 2 52.536 52.536 51.865 0.671 19174
2899 1 17 . 1 1 2 2 ALA CB C 2 19.031 19.031 19.562 -0.531 19174
2900 1 17 . 1 1 2 2 ALA H H 2 8.593 8.593 8.037 0.556 19174
2901 1 17 . 1 1 3 3 GLU N N 3 120.977 120.977 121.105 -0.128 19174
2902 1 17 . 1 1 3 3 GLU CA C 3 56.295 56.295 57.390 -1.095 19174
2903 1 17 . 1 1 3 3 GLU CB C 3 29.939 29.939 30.027 -0.088 19174
2904 1 17 . 1 1 3 3 GLU H H 3 8.301 8.301 8.615 -0.314 19174
2905 1 17 . 1 1 4 4 ALA N N 4 125.568 125.568 120.944 4.624 19174
2906 1 17 . 1 1 4 4 ALA CA C 4 52.509 52.509 51.493 1.016 19174
2907 1 17 . 1 1 4 4 ALA CB C 4 19.084 19.084 20.086 -1.002 19174
2908 1 17 . 1 1 4 4 ALA H H 4 8.229 8.229 7.631 0.598 19174
2909 1 17 . 1 1 5 5 HIS N N 5 117.815 117.815 119.280 -1.465 19174
2910 1 17 . 1 1 5 5 HIS CA C 5 55.157 55.157 58.047 -2.890 19174
2911 1 17 . 1 1 5 5 HIS CB C 5 28.827 28.827 30.149 -1.322 19174
2912 1 17 . 1 1 5 5 HIS H H 5 8.363 8.363 8.733 -0.370 19174
2913 1 17 . 1 1 6 6 GLN N N 6 121.556 121.556 119.317 2.239 19174
2914 1 17 . 1 1 6 6 GLN CA C 6 55.739 55.739 54.794 0.945 19174
2915 1 17 . 1 1 6 6 GLN CB C 6 29.409 29.409 29.707 -0.298 19174
2916 1 17 . 1 1 6 6 GLN H H 6 8.289 8.289 8.299 -0.010 19174
2917 1 17 . 1 1 7 7 ALA N N 7 126.411 126.411 127.741 -1.330 19174
2918 1 17 . 1 1 7 7 ALA CA C 7 52.404 52.404 52.979 -0.575 19174
2919 1 17 . 1 1 7 7 ALA CB C 7 18.978 18.978 19.116 -0.138 19174
2920 1 17 . 1 1 7 7 ALA H H 7 8.311 8.311 8.684 -0.373 19174
2921 1 17 . 1 1 8 8 VAL N N 8 119.771 119.771 119.620 0.151 19174
2922 1 17 . 1 1 8 8 VAL CA C 8 62.491 62.491 64.435 -1.944 19174
2923 1 17 . 1 1 8 8 VAL CB C 8 32.586 32.586 31.652 0.933 19174
2924 1 17 . 1 1 8 8 VAL H H 8 8.018 8.018 7.797 0.221 19174
2925 1 17 . 1 1 9 9 GLY N N 9 112.108 112.108 106.598 5.510 19174
2926 1 17 . 1 1 9 9 GLY CA C 9 45.044 45.044 44.450 0.594 19174
2927 1 17 . 1 1 9 9 GLY H H 9 8.243 8.243 7.824 0.419 19174
2928 1 17 . 1 1 10 10 PHE N N 10 120.842 120.842 119.845 0.997 19174
2929 1 17 . 1 1 10 10 PHE CA C 10 57.725 57.725 57.840 -0.115 19174
2930 1 17 . 1 1 10 10 PHE CB C 10 39.628 39.628 41.014 -1.385 19174
2931 1 17 . 1 1 10 10 PHE H H 10 7.983 7.983 8.394 -0.411 19174
2932 1 17 . 1 1 11 11 ARG N N 11 125.277 125.277 123.387 1.890 19174
2933 1 17 . 1 1 11 11 ARG CA C 11 53.410 53.410 53.723 -0.313 19174
2934 1 17 . 1 1 11 11 ARG CB C 11 30.574 30.574 32.678 -2.104 19174
2935 1 17 . 1 1 11 11 ARG H H 11 8.016 8.016 8.447 -0.431 19174
2936 1 17 . 1 1 13 13 SER N N 13 115.938 115.938 112.465 3.473 19174
2937 1 17 . 1 1 13 13 SER CA C 13 58.043 58.043 61.002 -2.959 19174
2938 1 17 . 1 1 13 13 SER CB C 13 63.774 63.774 63.006 0.768 19174
2939 1 17 . 1 1 13 13 SER H H 13 8.197 8.197 8.079 0.118 19174
2940 1 17 . 1 1 14 14 LEU N N 14 124.186 124.186 120.164 4.022 19174
2941 1 17 . 1 1 14 14 LEU CA C 14 55.422 55.422 56.438 -1.016 19174
2942 1 17 . 1 1 14 14 LEU CB C 14 42.329 42.329 42.526 -0.197 19174
2943 1 17 . 1 1 14 14 LEU H H 14 8.256 8.256 7.502 0.754 19174
2944 1 17 . 1 1 15 15 THR N N 15 112.858 112.858 112.016 0.842 19174
2945 1 17 . 1 1 15 15 THR CA C 15 61.379 61.379 61.242 0.137 19174
2946 1 17 . 1 1 15 15 THR CB C 15 69.810 69.810 70.060 -0.250 19174
2947 1 17 . 1 1 15 15 THR H H 15 7.913 7.913 7.515 0.398 19174
2948 1 17 . 1 1 16 16 SER N N 16 117.578 117.578 115.715 1.863 19174
2949 1 17 . 1 1 16 16 SER CA C 16 58.678 58.678 58.880 -0.202 19174
2950 1 17 . 1 1 16 16 SER CB C 16 63.668 63.668 63.755 -0.087 19174
2951 1 17 . 1 1 16 16 SER H H 16 8.154 8.154 8.293 -0.139 19174
2952 1 17 . 1 1 17 17 ASP N N 17 122.030 122.030 127.255 -5.225 19174
2953 1 17 . 1 1 17 17 ASP CA C 17 54.680 54.680 53.559 1.121 19174
2954 1 17 . 1 1 17 17 ASP CB C 17 40.899 40.899 41.334 -0.435 19174
2955 1 17 . 1 1 17 17 ASP H H 17 8.263 8.263 8.404 -0.141 19174
2956 1 17 . 1 1 18 18 GLY N N 18 108.815 108.815 109.880 -1.065 19174
2957 1 17 . 1 1 18 18 GLY CA C 18 45.758 45.758 45.146 0.612 19174
2958 1 17 . 1 1 18 18 GLY H H 18 8.239 8.239 8.335 -0.096 19174
2959 1 17 . 1 1 19 19 ALA N N 19 123.128 123.128 123.700 -0.572 19174
2960 1 17 . 1 1 19 19 ALA CA C 19 53.164 53.164 51.545 1.619 19174
2961 1 17 . 1 1 19 19 ALA CB C 19 19.084 19.084 21.304 -2.220 19174
2962 1 17 . 1 1 19 19 ALA H H 19 8.001 8.001 7.665 0.336 19174
2963 1 17 . 1 1 20 20 GLU N N 20 117.663 117.663 122.319 -4.656 19174
2964 1 17 . 1 1 20 20 GLU CA C 20 57.275 57.275 59.108 -1.833 19174
2965 1 17 . 1 1 20 20 GLU CB C 20 29.250 29.250 29.848 -0.598 19174
2966 1 17 . 1 1 20 20 GLU H H 20 8.231 8.231 8.798 -0.567 19174
2967 1 17 . 1 1 21 21 VAL N N 21 119.044 119.044 119.158 -0.114 19174
2968 1 17 . 1 1 21 21 VAL CA C 21 62.755 62.755 65.056 -2.301 19174
2969 1 17 . 1 1 21 21 VAL CB C 21 32.268 32.268 31.575 0.693 19174
2970 1 17 . 1 1 21 21 VAL H H 21 7.767 7.767 7.935 -0.168 19174
2971 1 17 . 1 1 22 22 GLU N N 22 121.765 121.765 118.174 3.591 19174
2972 1 17 . 1 1 22 22 GLU CA C 22 56.613 56.613 58.775 -2.162 19174
2973 1 17 . 1 1 22 22 GLU CB C 22 29.833 29.833 29.671 0.163 19174
2974 1 17 . 1 1 22 22 GLU H H 22 7.969 7.969 8.051 -0.082 19174
2975 1 17 . 1 1 23 23 LEU N N 23 120.996 120.996 118.870 2.126 19174
2976 1 17 . 1 1 23 23 LEU CA C 23 54.310 54.310 57.275 -2.965 19174
2977 1 17 . 1 1 23 23 LEU CB C 23 42.223 42.223 42.183 0.040 19174
2978 1 17 . 1 1 23 23 LEU H H 23 7.917 7.917 7.935 -0.018 19174
2979 1 17 . 1 1 24 24 SER N N 24 114.702 114.702 112.755 1.947 19174
2980 1 17 . 1 1 24 24 SER CA C 24 57.593 57.593 59.367 -1.774 19174
2981 1 17 . 1 1 24 24 SER CB C 24 64.515 64.515 63.146 1.369 19174
2982 1 17 . 1 1 24 24 SER H H 24 7.564 7.564 7.876 -0.312 19174
2983 1 17 . 1 1 25 25 ALA N N 25 125.059 125.059 125.445 -0.386 19174
2984 1 17 . 1 1 25 25 ALA CA C 25 55.898 55.898 56.514 -0.616 19174
2985 1 17 . 1 1 25 25 ALA CB C 25 16.330 16.330 16.341 -0.011 19174
2986 1 17 . 1 1 25 25 ALA H H 25 8.630 8.630 7.699 0.931 19174
2987 1 17 . 1 1 27 27 VAL N N 27 118.016 118.016 117.276 0.740 19174
2988 1 17 . 1 1 27 27 VAL CA C 27 65.826 65.826 66.233 -0.407 19174
2989 1 17 . 1 1 27 27 VAL CB C 27 31.686 31.686 31.362 0.324 19174
2990 1 17 . 1 1 27 27 VAL H H 27 7.294 7.294 7.472 -0.178 19174
2991 1 17 . 1 1 28 28 LEU N N 28 119.933 119.933 120.211 -0.278 19174
2992 1 17 . 1 1 28 28 LEU CA C 28 57.990 57.990 58.300 -0.310 19174
2993 1 17 . 1 1 28 28 LEU CB C 28 41.429 41.429 41.376 0.053 19174
2994 1 17 . 1 1 28 28 LEU H H 28 7.939 7.939 7.974 -0.035 19174
2995 1 17 . 1 1 29 29 GLN N N 29 117.644 117.644 118.503 -0.859 19174
2996 1 17 . 1 1 29 29 GLN CA C 29 59.367 59.367 59.519 -0.152 19174
2997 1 17 . 1 1 29 29 GLN CB C 29 28.297 28.297 28.529 -0.232 19174
2998 1 17 . 1 1 29 29 GLN H H 29 8.179 8.179 8.718 -0.539 19174
2999 1 17 . 1 1 30 30 GLU N N 30 118.389 118.389 120.389 -2.000 19174
3000 1 17 . 1 1 30 30 GLU CA C 30 59.128 59.128 59.576 -0.448 19174
3001 1 17 . 1 1 30 30 GLU CB C 30 29.038 29.038 29.711 -0.673 19174
3002 1 17 . 1 1 30 30 GLU H H 30 7.752 7.752 7.900 -0.148 19174
3003 1 17 . 1 1 31 31 ILE N N 31 120.796 120.796 121.114 -0.318 19174
3004 1 17 . 1 1 31 31 ILE CA C 31 65.509 65.509 64.594 0.915 19174
3005 1 17 . 1 1 31 31 ILE CB C 31 37.775 37.775 38.316 -0.541 19174
3006 1 17 . 1 1 31 31 ILE H H 31 8.131 8.131 8.070 0.061 19174
3007 1 17 . 1 1 32 32 TYR N N 32 120.550 120.550 120.806 -0.256 19174
3008 1 17 . 1 1 32 32 TYR CA C 32 61.405 61.405 62.023 -0.618 19174
3009 1 17 . 1 1 32 32 TYR CB C 32 38.358 38.358 38.444 -0.086 19174
3010 1 17 . 1 1 32 32 TYR H H 32 8.214 8.214 8.221 -0.007 19174
3011 1 17 . 1 1 33 33 LEU N N 33 117.578 117.578 118.469 -0.891 19174
3012 1 17 . 1 1 33 33 LEU CA C 33 57.513 57.513 58.131 -0.618 19174
3013 1 17 . 1 1 33 33 LEU CB C 33 41.657 41.657 40.853 0.804 19174
3014 1 17 . 1 1 33 33 LEU H H 33 8.347 8.347 8.248 0.099 19174
3015 1 17 . 1 1 34 34 SER N N 34 114.635 114.635 115.287 -0.652 19174
3016 1 17 . 1 1 34 34 SER CA C 34 61.405 61.405 61.985 -0.580 19174
3017 1 17 . 1 1 34 34 SER CB C 34 63.403 63.403 62.945 0.458 19174
3018 1 17 . 1 1 34 34 SER H H 34 7.986 7.986 8.380 -0.394 19174
3019 1 17 . 1 1 35 35 GLY N N 35 110.749 110.749 110.172 0.577 19174
3020 1 17 . 1 1 35 35 GLY CA C 35 46.897 46.897 46.895 0.002 19174
3021 1 17 . 1 1 35 35 GLY H H 35 8.302 8.302 8.483 -0.181 19174
3022 1 17 . 1 1 36 36 LEU N N 36 121.632 121.632 123.035 -1.403 19174
3023 1 17 . 1 1 36 36 LEU CA C 36 57.619 57.619 57.182 0.437 19174
3024 1 17 . 1 1 36 36 LEU CB C 36 41.799 41.799 41.559 0.240 19174
3025 1 17 . 1 1 36 36 LEU H H 36 8.194 8.194 7.605 0.589 19174
3026 1 17 . 1 1 37 37 ARG N N 37 118.274 118.274 118.840 -0.566 19174
3027 1 17 . 1 1 37 37 ARG CA C 37 59.049 59.049 59.756 -0.707 19174
3028 1 17 . 1 1 37 37 ARG CB C 37 30.044 30.044 30.150 -0.106 19174
3029 1 17 . 1 1 37 37 ARG H H 37 7.934 7.934 7.778 0.156 19174
3030 1 17 . 1 1 38 38 SER N N 38 114.239 114.239 115.470 -1.231 19174
3031 1 17 . 1 1 38 38 SER CA C 38 60.531 60.531 62.035 -1.504 19174
3032 1 17 . 1 1 38 38 SER CB C 38 63.509 63.509 62.997 0.512 19174
3033 1 17 . 1 1 38 38 SER H H 38 7.913 7.913 7.838 0.075 19174
3034 1 17 . 1 1 39 39 TRP N N 39 123.095 123.095 124.501 -1.406 19174
3035 1 17 . 1 1 39 39 TRP CA C 39 59.870 59.870 60.416 -0.546 19174
3036 1 17 . 1 1 39 39 TRP CB C 39 28.721 28.721 29.729 -1.008 19174
3037 1 17 . 1 1 39 39 TRP H H 39 8.108 8.108 8.806 -0.698 19174
3038 1 17 . 1 1 40 40 LYS N N 40 119.629 119.629 119.030 0.599 19174
3039 1 17 . 1 1 40 40 LYS CA C 40 59.525 59.525 59.811 -0.286 19174
3040 1 17 . 1 1 40 40 LYS CB C 40 32.109 32.109 32.095 0.014 19174
3041 1 17 . 1 1 40 40 LYS H H 40 7.938 7.938 7.824 0.114 19174
3042 1 17 . 1 1 41 41 ARG N N 41 117.834 117.834 117.070 0.764 19174
3043 1 17 . 1 1 41 41 ARG CA C 41 57.857 57.857 59.128 -1.271 19174
3044 1 17 . 1 1 41 41 ARG CB C 41 30.203 30.203 29.955 0.248 19174
3045 1 17 . 1 1 41 41 ARG H H 41 7.863 7.863 7.562 0.301 19174
3046 1 17 . 1 1 42 42 HIS N N 42 115.774 115.774 119.550 -3.776 19174
3047 1 17 . 1 1 42 42 HIS CA C 42 57.487 57.487 59.446 -1.959 19174
3048 1 17 . 1 1 42 42 HIS CB C 42 30.786 30.786 29.629 1.157 19174
3049 1 17 . 1 1 42 42 HIS H H 42 7.919 7.919 7.606 0.313 19174
3050 1 17 . 1 1 43 43 LEU N N 43 120.243 120.243 119.437 0.806 19174
3051 1 17 . 1 1 43 43 LEU CA C 43 56.745 56.745 55.092 1.653 19174
3052 1 17 . 1 1 43 43 LEU CB C 43 42.276 42.276 41.440 0.836 19174
3053 1 17 . 1 1 43 43 LEU H H 43 8.162 8.162 8.265 -0.103 19174
3054 1 17 . 1 1 44 44 SER N N 44 114.616 114.616 116.384 -1.768 19174
3055 1 17 . 1 1 44 44 SER CA C 44 60.987 60.987 62.879 -1.892 19174
3056 1 17 . 1 1 44 44 SER CB C 44 62.768 62.768 62.528 0.240 19174
3057 1 17 . 1 1 44 44 SER H H 44 8.033 8.033 7.905 0.128 19174
3058 1 17 . 1 1 45 45 ARG N N 45 120.757 120.757 120.930 -0.173 19174
3059 1 17 . 1 1 45 45 ARG CA C 45 57.513 57.513 59.234 -1.721 19174
3060 1 17 . 1 1 45 45 ARG CB C 45 29.462 29.462 29.995 -0.533 19174
3061 1 17 . 1 1 45 45 ARG H H 45 7.763 7.763 8.021 -0.258 19174
3062 1 17 . 1 1 46 46 PHE N N 46 118.237 118.237 117.579 0.658 19174
3063 1 17 . 1 1 46 46 PHE CA C 46 59.155 59.155 60.985 -1.830 19174
3064 1 17 . 1 1 46 46 PHE CB C 46 39.311 39.311 38.674 0.637 19174
3065 1 17 . 1 1 46 46 PHE H H 46 7.673 7.673 7.939 -0.266 19174
3066 1 17 . 1 1 47 47 TRP N N 47 118.484 118.484 120.802 -2.318 19174
3067 1 17 . 1 1 47 47 TRP CA C 47 58.837 58.837 60.897 -2.060 19174
3068 1 17 . 1 1 47 47 TRP CB C 47 29.833 29.833 29.767 0.066 19174
3069 1 17 . 1 1 47 47 TRP H H 47 7.614 7.614 8.688 -1.074 19174
3070 1 17 . 1 1 48 48 ASN N N 48 114.629 114.629 116.581 -1.952 19174
3071 1 17 . 1 1 48 48 ASN CA C 48 54.124 54.124 55.401 -1.277 19174
3072 1 17 . 1 1 48 48 ASN CB C 48 38.887 38.887 38.971 -0.084 19174
3073 1 17 . 1 1 48 48 ASN H H 48 7.811 7.811 8.229 -0.418 19174
3074 1 17 . 1 1 49 49 ASP N N 49 118.029 118.029 118.994 -0.965 19174
3075 1 17 . 1 1 49 49 ASP CA C 49 54.310 54.310 53.491 0.819 19174
3076 1 17 . 1 1 49 49 ASP CB C 49 40.793 40.793 41.061 -0.268 19174
3077 1 17 . 1 1 49 49 ASP H H 49 7.775 7.775 7.580 0.195 19174
3078 1 18 . 1 1 2 2 ALA N N 2 127.400 127.400 124.592 2.808 19174
3079 1 18 . 1 1 2 2 ALA CA C 2 52.536 52.536 52.761 -0.225 19174
3080 1 18 . 1 1 2 2 ALA CB C 2 19.031 19.031 18.689 0.342 19174
3081 1 18 . 1 1 2 2 ALA H H 2 8.593 8.593 7.847 0.746 19174
3082 1 18 . 1 1 3 3 GLU N N 3 120.977 120.977 117.242 3.735 19174
3083 1 18 . 1 1 3 3 GLU CA C 3 56.295 56.295 56.752 -0.457 19174
3084 1 18 . 1 1 3 3 GLU CB C 3 29.939 29.939 28.166 1.773 19174
3085 1 18 . 1 1 3 3 GLU H H 3 8.301 8.301 8.788 -0.487 19174
3086 1 18 . 1 1 4 4 ALA N N 4 125.568 125.568 120.023 5.545 19174
3087 1 18 . 1 1 4 4 ALA CA C 4 52.509 52.509 51.475 1.034 19174
3088 1 18 . 1 1 4 4 ALA CB C 4 19.084 19.084 20.989 -1.905 19174
3089 1 18 . 1 1 4 4 ALA H H 4 8.229 8.229 7.327 0.902 19174
3090 1 18 . 1 1 5 5 HIS N N 5 117.815 117.815 119.113 -1.298 19174
3091 1 18 . 1 1 5 5 HIS CA C 5 55.157 55.157 55.878 -0.721 19174
3092 1 18 . 1 1 5 5 HIS CB C 5 28.827 28.827 31.561 -2.734 19174
3093 1 18 . 1 1 5 5 HIS H H 5 8.363 8.363 8.580 -0.217 19174
3094 1 18 . 1 1 6 6 GLN N N 6 121.556 121.556 121.898 -0.342 19174
3095 1 18 . 1 1 6 6 GLN CA C 6 55.739 55.739 57.024 -1.285 19174
3096 1 18 . 1 1 6 6 GLN CB C 6 29.409 29.409 29.361 0.048 19174
3097 1 18 . 1 1 6 6 GLN H H 6 8.289 8.289 8.815 -0.526 19174
3098 1 18 . 1 1 7 7 ALA N N 7 126.411 126.411 120.239 6.172 19174
3099 1 18 . 1 1 7 7 ALA CA C 7 52.404 52.404 51.431 0.973 19174
3100 1 18 . 1 1 7 7 ALA CB C 7 18.978 18.978 20.674 -1.696 19174
3101 1 18 . 1 1 7 7 ALA H H 7 8.311 8.311 7.550 0.761 19174
3102 1 18 . 1 1 8 8 VAL N N 8 119.771 119.771 120.888 -1.117 19174
3103 1 18 . 1 1 8 8 VAL CA C 8 62.491 62.491 63.411 -0.920 19174
3104 1 18 . 1 1 8 8 VAL CB C 8 32.586 32.586 31.931 0.655 19174
3105 1 18 . 1 1 8 8 VAL H H 8 8.018 8.018 8.475 -0.457 19174
3106 1 18 . 1 1 9 9 GLY N N 9 112.108 112.108 106.046 6.062 19174
3107 1 18 . 1 1 9 9 GLY CA C 9 45.044 45.044 44.620 0.424 19174
3108 1 18 . 1 1 9 9 GLY H H 9 8.243 8.243 7.812 0.431 19174
3109 1 18 . 1 1 10 10 PHE N N 10 120.842 120.842 120.409 0.433 19174
3110 1 18 . 1 1 10 10 PHE CA C 10 57.725 57.725 59.087 -1.362 19174
3111 1 18 . 1 1 10 10 PHE CB C 10 39.628 39.628 39.291 0.337 19174
3112 1 18 . 1 1 10 10 PHE H H 10 7.983 7.983 8.256 -0.273 19174
3113 1 18 . 1 1 11 11 ARG N N 11 125.277 125.277 120.808 4.469 19174
3114 1 18 . 1 1 11 11 ARG CA C 11 53.410 53.410 55.551 -2.141 19174
3115 1 18 . 1 1 11 11 ARG CB C 11 30.574 30.574 29.242 1.332 19174
3116 1 18 . 1 1 11 11 ARG H H 11 8.016 8.016 8.066 -0.050 19174
3117 1 18 . 1 1 13 13 SER N N 13 115.938 115.938 116.553 -0.615 19174
3118 1 18 . 1 1 13 13 SER CA C 13 58.043 58.043 57.706 0.337 19174
3119 1 18 . 1 1 13 13 SER CB C 13 63.774 63.774 65.398 -1.624 19174
3120 1 18 . 1 1 13 13 SER H H 13 8.197 8.197 8.377 -0.180 19174
3121 1 18 . 1 1 14 14 LEU N N 14 124.186 124.186 123.965 0.221 19174
3122 1 18 . 1 1 14 14 LEU CA C 14 55.422 55.422 54.428 0.994 19174
3123 1 18 . 1 1 14 14 LEU CB C 14 42.329 42.329 42.893 -0.564 19174
3124 1 18 . 1 1 14 14 LEU H H 14 8.256 8.256 8.267 -0.011 19174
3125 1 18 . 1 1 15 15 THR N N 15 112.858 112.858 115.996 -3.138 19174
3126 1 18 . 1 1 15 15 THR CA C 15 61.379 61.379 61.942 -0.563 19174
3127 1 18 . 1 1 15 15 THR CB C 15 69.810 69.810 69.903 -0.093 19174
3128 1 18 . 1 1 15 15 THR H H 15 7.913 7.913 8.514 -0.601 19174
3129 1 18 . 1 1 16 16 SER N N 16 117.578 117.578 119.111 -1.533 19174
3130 1 18 . 1 1 16 16 SER CA C 16 58.678 58.678 59.776 -1.098 19174
3131 1 18 . 1 1 16 16 SER CB C 16 63.668 63.668 63.291 0.377 19174
3132 1 18 . 1 1 16 16 SER H H 16 8.154 8.154 8.554 -0.400 19174
3133 1 18 . 1 1 17 17 ASP N N 17 122.030 122.030 122.885 -0.855 19174
3134 1 18 . 1 1 17 17 ASP CA C 17 54.680 54.680 53.622 1.058 19174
3135 1 18 . 1 1 17 17 ASP CB C 17 40.899 40.899 41.055 -0.156 19174
3136 1 18 . 1 1 17 17 ASP H H 17 8.263 8.263 7.945 0.318 19174
3137 1 18 . 1 1 18 18 GLY N N 18 108.815 108.815 110.374 -1.559 19174
3138 1 18 . 1 1 18 18 GLY CA C 18 45.758 45.758 44.534 1.224 19174
3139 1 18 . 1 1 18 18 GLY H H 18 8.239 8.239 8.101 0.138 19174
3140 1 18 . 1 1 19 19 ALA N N 19 123.128 123.128 126.927 -3.799 19174
3141 1 18 . 1 1 19 19 ALA CA C 19 53.164 53.164 53.241 -0.077 19174
3142 1 18 . 1 1 19 19 ALA CB C 19 19.084 19.084 19.047 0.037 19174
3143 1 18 . 1 1 19 19 ALA H H 19 8.001 8.001 8.637 -0.636 19174
3144 1 18 . 1 1 20 20 GLU N N 20 117.663 117.663 117.555 0.108 19174
3145 1 18 . 1 1 20 20 GLU CA C 20 57.275 57.275 58.862 -1.587 19174
3146 1 18 . 1 1 20 20 GLU CB C 20 29.250 29.250 29.334 -0.084 19174
3147 1 18 . 1 1 20 20 GLU H H 20 8.231 8.231 8.223 0.008 19174
3148 1 18 . 1 1 21 21 VAL N N 21 119.044 119.044 116.515 2.529 19174
3149 1 18 . 1 1 21 21 VAL CA C 21 62.755 62.755 65.613 -2.858 19174
3150 1 18 . 1 1 21 21 VAL CB C 21 32.268 32.268 31.930 0.338 19174
3151 1 18 . 1 1 21 21 VAL H H 21 7.767 7.767 7.705 0.062 19174
3152 1 18 . 1 1 22 22 GLU N N 22 121.765 121.765 119.549 2.216 19174
3153 1 18 . 1 1 22 22 GLU CA C 22 56.613 56.613 58.571 -1.958 19174
3154 1 18 . 1 1 22 22 GLU CB C 22 29.833 29.833 30.376 -0.543 19174
3155 1 18 . 1 1 22 22 GLU H H 22 7.969 7.969 8.250 -0.281 19174
3156 1 18 . 1 1 23 23 LEU N N 23 120.996 120.996 117.541 3.455 19174
3157 1 18 . 1 1 23 23 LEU CA C 23 54.310 54.310 53.932 0.378 19174
3158 1 18 . 1 1 23 23 LEU CB C 23 42.223 42.223 44.188 -1.965 19174
3159 1 18 . 1 1 23 23 LEU H H 23 7.917 7.917 7.629 0.288 19174
3160 1 18 . 1 1 24 24 SER N N 24 114.702 114.702 112.682 2.020 19174
3161 1 18 . 1 1 24 24 SER CA C 24 57.593 57.593 58.250 -0.657 19174
3162 1 18 . 1 1 24 24 SER CB C 24 64.515 64.515 63.263 1.252 19174
3163 1 18 . 1 1 24 24 SER H H 24 7.564 7.564 8.367 -0.803 19174
3164 1 18 . 1 1 25 25 ALA N N 25 125.059 125.059 125.902 -0.843 19174
3165 1 18 . 1 1 25 25 ALA CA C 25 55.898 55.898 55.940 -0.042 19174
3166 1 18 . 1 1 25 25 ALA CB C 25 16.330 16.330 16.596 -0.266 19174
3167 1 18 . 1 1 25 25 ALA H H 25 8.630 8.630 8.612 0.018 19174
3168 1 18 . 1 1 27 27 VAL N N 27 118.016 118.016 114.151 3.865 19174
3169 1 18 . 1 1 27 27 VAL CA C 27 65.826 65.826 65.604 0.222 19174
3170 1 18 . 1 1 27 27 VAL CB C 27 31.686 31.686 31.596 0.090 19174
3171 1 18 . 1 1 27 27 VAL H H 27 7.294 7.294 7.220 0.074 19174
3172 1 18 . 1 1 28 28 LEU N N 28 119.933 119.933 121.225 -1.292 19174
3173 1 18 . 1 1 28 28 LEU CA C 28 57.990 57.990 58.002 -0.012 19174
3174 1 18 . 1 1 28 28 LEU CB C 28 41.429 41.429 41.212 0.217 19174
3175 1 18 . 1 1 28 28 LEU H H 28 7.939 7.939 7.968 -0.029 19174
3176 1 18 . 1 1 29 29 GLN N N 29 117.644 117.644 118.070 -0.426 19174
3177 1 18 . 1 1 29 29 GLN CA C 29 59.367 59.367 59.471 -0.104 19174
3178 1 18 . 1 1 29 29 GLN CB C 29 28.297 28.297 28.383 -0.086 19174
3179 1 18 . 1 1 29 29 GLN H H 29 8.179 8.179 8.528 -0.349 19174
3180 1 18 . 1 1 30 30 GLU N N 30 118.389 118.389 120.689 -2.300 19174
3181 1 18 . 1 1 30 30 GLU CA C 30 59.128 59.128 59.444 -0.316 19174
3182 1 18 . 1 1 30 30 GLU CB C 30 29.038 29.038 29.581 -0.543 19174
3183 1 18 . 1 1 30 30 GLU H H 30 7.752 7.752 7.634 0.118 19174
3184 1 18 . 1 1 31 31 ILE N N 31 120.796 120.796 120.124 0.672 19174
3185 1 18 . 1 1 31 31 ILE CA C 31 65.509 65.509 63.992 1.517 19174
3186 1 18 . 1 1 31 31 ILE CB C 31 37.775 37.775 36.816 0.959 19174
3187 1 18 . 1 1 31 31 ILE H H 31 8.131 8.131 8.042 0.089 19174
3188 1 18 . 1 1 32 32 TYR N N 32 120.550 120.550 121.486 -0.936 19174
3189 1 18 . 1 1 32 32 TYR CA C 32 61.405 61.405 62.283 -0.878 19174
3190 1 18 . 1 1 32 32 TYR CB C 32 38.358 38.358 38.390 -0.032 19174
3191 1 18 . 1 1 32 32 TYR H H 32 8.214 8.214 8.420 -0.206 19174
3192 1 18 . 1 1 33 33 LEU N N 33 117.578 117.578 119.302 -1.724 19174
3193 1 18 . 1 1 33 33 LEU CA C 33 57.513 57.513 57.422 0.091 19174
3194 1 18 . 1 1 33 33 LEU CB C 33 41.657 41.657 41.691 -0.034 19174
3195 1 18 . 1 1 33 33 LEU H H 33 8.347 8.347 8.263 0.084 19174
3196 1 18 . 1 1 34 34 SER N N 34 114.635 114.635 114.479 0.156 19174
3197 1 18 . 1 1 34 34 SER CA C 34 61.405 61.405 62.273 -0.868 19174
3198 1 18 . 1 1 34 34 SER CB C 34 63.403 63.403 62.645 0.758 19174
3199 1 18 . 1 1 34 34 SER H H 34 7.986 7.986 8.397 -0.411 19174
3200 1 18 . 1 1 35 35 GLY N N 35 110.749 110.749 110.010 0.739 19174
3201 1 18 . 1 1 35 35 GLY CA C 35 46.897 46.897 46.467 0.430 19174
3202 1 18 . 1 1 35 35 GLY H H 35 8.302 8.302 8.036 0.266 19174
3203 1 18 . 1 1 36 36 LEU N N 36 121.632 121.632 121.691 -0.059 19174
3204 1 18 . 1 1 36 36 LEU CA C 36 57.619 57.619 57.533 0.085 19174
3205 1 18 . 1 1 36 36 LEU CB C 36 41.799 41.799 41.145 0.654 19174
3206 1 18 . 1 1 36 36 LEU H H 36 8.194 8.194 6.974 1.220 19174
3207 1 18 . 1 1 37 37 ARG N N 37 118.274 118.274 118.214 0.060 19174
3208 1 18 . 1 1 37 37 ARG CA C 37 59.049 59.049 59.537 -0.488 19174
3209 1 18 . 1 1 37 37 ARG CB C 37 30.044 30.044 30.003 0.041 19174
3210 1 18 . 1 1 37 37 ARG H H 37 7.934 7.934 7.390 0.544 19174
3211 1 18 . 1 1 38 38 SER N N 38 114.239 114.239 115.426 -1.187 19174
3212 1 18 . 1 1 38 38 SER CA C 38 60.531 60.531 60.970 -0.439 19174
3213 1 18 . 1 1 38 38 SER CB C 38 63.509 63.509 62.620 0.889 19174
3214 1 18 . 1 1 38 38 SER H H 38 7.913 7.913 7.674 0.239 19174
3215 1 18 . 1 1 39 39 TRP N N 39 123.095 123.095 123.811 -0.716 19174
3216 1 18 . 1 1 39 39 TRP CA C 39 59.870 59.870 57.745 2.125 19174
3217 1 18 . 1 1 39 39 TRP CB C 39 28.721 28.721 27.869 0.852 19174
3218 1 18 . 1 1 39 39 TRP H H 39 8.108 8.108 8.401 -0.293 19174
3219 1 18 . 1 1 40 40 LYS N N 40 119.629 119.629 120.020 -0.391 19174
3220 1 18 . 1 1 40 40 LYS CA C 40 59.525 59.525 59.783 -0.258 19174
3221 1 18 . 1 1 40 40 LYS CB C 40 32.109 32.109 32.206 -0.097 19174
3222 1 18 . 1 1 40 40 LYS H H 40 7.938 7.938 7.914 0.024 19174
3223 1 18 . 1 1 41 41 ARG N N 41 117.834 117.834 118.042 -0.208 19174
3224 1 18 . 1 1 41 41 ARG CA C 41 57.857 57.857 59.200 -1.343 19174
3225 1 18 . 1 1 41 41 ARG CB C 41 30.203 30.203 30.079 0.124 19174
3226 1 18 . 1 1 41 41 ARG H H 41 7.863 7.863 7.752 0.111 19174
3227 1 18 . 1 1 42 42 HIS N N 42 115.774 115.774 118.988 -3.214 19174
3228 1 18 . 1 1 42 42 HIS CA C 42 57.487 57.487 59.668 -2.181 19174
3229 1 18 . 1 1 42 42 HIS CB C 42 30.786 30.786 29.901 0.885 19174
3230 1 18 . 1 1 42 42 HIS H H 42 7.919 7.919 7.926 -0.007 19174
3231 1 18 . 1 1 43 43 LEU N N 43 120.243 120.243 118.909 1.334 19174
3232 1 18 . 1 1 43 43 LEU CA C 43 56.745 56.745 55.555 1.190 19174
3233 1 18 . 1 1 43 43 LEU CB C 43 42.276 42.276 41.703 0.573 19174
3234 1 18 . 1 1 43 43 LEU H H 43 8.162 8.162 9.002 -0.840 19174
3235 1 18 . 1 1 44 44 SER N N 44 114.616 114.616 116.199 -1.583 19174
3236 1 18 . 1 1 44 44 SER CA C 44 60.987 60.987 62.280 -1.293 19174
3237 1 18 . 1 1 44 44 SER CB C 44 62.768 62.768 63.052 -0.284 19174
3238 1 18 . 1 1 44 44 SER H H 44 8.033 8.033 7.885 0.148 19174
3239 1 18 . 1 1 45 45 ARG N N 45 120.757 120.757 120.791 -0.034 19174
3240 1 18 . 1 1 45 45 ARG CA C 45 57.513 57.513 59.396 -1.883 19174
3241 1 18 . 1 1 45 45 ARG CB C 45 29.462 29.462 29.868 -0.406 19174
3242 1 18 . 1 1 45 45 ARG H H 45 7.763 7.763 8.162 -0.399 19174
3243 1 18 . 1 1 46 46 PHE N N 46 118.237 118.237 116.907 1.330 19174
3244 1 18 . 1 1 46 46 PHE CA C 46 59.155 59.155 60.964 -1.809 19174
3245 1 18 . 1 1 46 46 PHE CB C 46 39.311 39.311 38.836 0.475 19174
3246 1 18 . 1 1 46 46 PHE H H 46 7.673 7.673 8.071 -0.398 19174
3247 1 18 . 1 1 47 47 TRP N N 47 118.484 118.484 119.890 -1.406 19174
3248 1 18 . 1 1 47 47 TRP CA C 47 58.837 58.837 58.987 -0.150 19174
3249 1 18 . 1 1 47 47 TRP CB C 47 29.833 29.833 30.258 -0.425 19174
3250 1 18 . 1 1 47 47 TRP H H 47 7.614 7.614 8.488 -0.874 19174
3251 1 18 . 1 1 48 48 ASN N N 48 114.629 114.629 117.410 -2.781 19174
3252 1 18 . 1 1 48 48 ASN CA C 48 54.124 54.124 54.788 -0.664 19174
3253 1 18 . 1 1 48 48 ASN CB C 48 38.887 38.887 38.696 0.191 19174
3254 1 18 . 1 1 48 48 ASN H H 48 7.811 7.811 8.110 -0.299 19174
3255 1 18 . 1 1 49 49 ASP N N 49 118.029 118.029 120.467 -2.438 19174
3256 1 18 . 1 1 49 49 ASP CA C 49 54.310 54.310 55.108 -0.797 19174
3257 1 18 . 1 1 49 49 ASP CB C 49 40.793 40.793 41.240 -0.447 19174
3258 1 18 . 1 1 49 49 ASP H H 49 7.775 7.775 7.714 0.061 19174
3259 1 19 . 1 1 2 2 ALA N N 2 127.400 127.400 123.524 3.876 19174
3260 1 19 . 1 1 2 2 ALA CA C 2 52.536 52.536 53.645 -1.109 19174
3261 1 19 . 1 1 2 2 ALA CB C 2 19.031 19.031 19.073 -0.042 19174
3262 1 19 . 1 1 2 2 ALA H H 2 8.593 8.593 7.985 0.608 19174
3263 1 19 . 1 1 3 3 GLU N N 3 120.977 120.977 119.763 1.214 19174
3264 1 19 . 1 1 3 3 GLU CA C 3 56.295 56.295 55.903 0.392 19174
3265 1 19 . 1 1 3 3 GLU CB C 3 29.939 29.939 30.838 -0.899 19174
3266 1 19 . 1 1 3 3 GLU H H 3 8.301 8.301 8.165 0.136 19174
3267 1 19 . 1 1 4 4 ALA N N 4 125.568 125.568 127.322 -1.754 19174
3268 1 19 . 1 1 4 4 ALA CA C 4 52.509 52.509 52.008 0.500 19174
3269 1 19 . 1 1 4 4 ALA CB C 4 19.084 19.084 20.179 -1.095 19174
3270 1 19 . 1 1 4 4 ALA H H 4 8.229 8.229 8.282 -0.053 19174
3271 1 19 . 1 1 5 5 HIS N N 5 117.815 117.815 119.930 -2.115 19174
3272 1 19 . 1 1 5 5 HIS CA C 5 55.157 55.157 57.669 -2.512 19174
3273 1 19 . 1 1 5 5 HIS CB C 5 28.827 28.827 29.954 -1.127 19174
3274 1 19 . 1 1 5 5 HIS H H 5 8.363 8.363 8.576 -0.213 19174
3275 1 19 . 1 1 6 6 GLN N N 6 121.556 121.556 118.889 2.667 19174
3276 1 19 . 1 1 6 6 GLN CA C 6 55.739 55.739 55.936 -0.197 19174
3277 1 19 . 1 1 6 6 GLN CB C 6 29.409 29.409 28.536 0.873 19174
3278 1 19 . 1 1 6 6 GLN H H 6 8.289 8.289 8.124 0.165 19174
3279 1 19 . 1 1 7 7 ALA N N 7 126.411 126.411 127.592 -1.181 19174
3280 1 19 . 1 1 7 7 ALA CA C 7 52.404 52.404 51.601 0.803 19174
3281 1 19 . 1 1 7 7 ALA CB C 7 18.978 18.978 20.808 -1.830 19174
3282 1 19 . 1 1 7 7 ALA H H 7 8.311 8.311 8.275 0.036 19174
3283 1 19 . 1 1 8 8 VAL N N 8 119.771 119.771 119.112 0.659 19174
3284 1 19 . 1 1 8 8 VAL CA C 8 62.491 62.491 61.403 1.088 19174
3285 1 19 . 1 1 8 8 VAL CB C 8 32.586 32.586 34.069 -1.482 19174
3286 1 19 . 1 1 8 8 VAL H H 8 8.018 8.018 8.459 -0.441 19174
3287 1 19 . 1 1 9 9 GLY N N 9 112.108 112.108 108.927 3.181 19174
3288 1 19 . 1 1 9 9 GLY CA C 9 45.044 45.044 45.171 -0.127 19174
3289 1 19 . 1 1 9 9 GLY H H 9 8.243 8.243 8.433 -0.190 19174
3290 1 19 . 1 1 10 10 PHE N N 10 120.842 120.842 120.160 0.682 19174
3291 1 19 . 1 1 10 10 PHE CA C 10 57.725 57.725 59.359 -1.634 19174
3292 1 19 . 1 1 10 10 PHE CB C 10 39.628 39.628 39.436 0.192 19174
3293 1 19 . 1 1 10 10 PHE H H 10 7.983 7.983 7.675 0.308 19174
3294 1 19 . 1 1 11 11 ARG N N 11 125.277 125.277 120.168 5.109 19174
3295 1 19 . 1 1 11 11 ARG CA C 11 53.410 53.410 55.737 -2.327 19174
3296 1 19 . 1 1 11 11 ARG CB C 11 30.574 30.574 28.870 1.704 19174
3297 1 19 . 1 1 11 11 ARG H H 11 8.016 8.016 8.264 -0.248 19174
3298 1 19 . 1 1 13 13 SER N N 13 115.938 115.938 117.215 -1.277 19174
3299 1 19 . 1 1 13 13 SER CA C 13 58.043 58.043 57.494 0.549 19174
3300 1 19 . 1 1 13 13 SER CB C 13 63.774 63.774 65.168 -1.394 19174
3301 1 19 . 1 1 13 13 SER H H 13 8.197 8.197 8.321 -0.124 19174
3302 1 19 . 1 1 14 14 LEU N N 14 124.186 124.186 123.743 0.443 19174
3303 1 19 . 1 1 14 14 LEU CA C 14 55.422 55.422 55.812 -0.390 19174
3304 1 19 . 1 1 14 14 LEU CB C 14 42.329 42.329 42.429 -0.100 19174
3305 1 19 . 1 1 14 14 LEU H H 14 8.256 8.256 8.569 -0.313 19174
3306 1 19 . 1 1 15 15 THR N N 15 112.858 112.858 112.678 0.180 19174
3307 1 19 . 1 1 15 15 THR CA C 15 61.379 61.379 61.368 0.011 19174
3308 1 19 . 1 1 15 15 THR CB C 15 69.810 69.810 69.740 0.070 19174
3309 1 19 . 1 1 15 15 THR H H 15 7.913 7.913 7.558 0.355 19174
3310 1 19 . 1 1 16 16 SER N N 16 117.578 117.578 115.885 1.693 19174
3311 1 19 . 1 1 16 16 SER CA C 16 58.678 58.678 58.627 0.051 19174
3312 1 19 . 1 1 16 16 SER CB C 16 63.668 63.668 63.919 -0.251 19174
3313 1 19 . 1 1 16 16 SER H H 16 8.154 8.154 8.415 -0.261 19174
3314 1 19 . 1 1 17 17 ASP N N 17 122.030 122.030 127.211 -5.181 19174
3315 1 19 . 1 1 17 17 ASP CA C 17 54.680 54.680 54.854 -0.174 19174
3316 1 19 . 1 1 17 17 ASP CB C 17 40.899 40.899 40.286 0.613 19174
3317 1 19 . 1 1 17 17 ASP H H 17 8.263 8.263 8.534 -0.271 19174
3318 1 19 . 1 1 18 18 GLY N N 18 108.815 108.815 112.297 -3.482 19174
3319 1 19 . 1 1 18 18 GLY CA C 18 45.758 45.758 44.891 0.867 19174
3320 1 19 . 1 1 18 18 GLY H H 18 8.239 8.239 8.641 -0.402 19174
3321 1 19 . 1 1 19 19 ALA N N 19 123.128 123.128 122.326 0.802 19174
3322 1 19 . 1 1 19 19 ALA CA C 19 53.164 53.164 51.849 1.315 19174
3323 1 19 . 1 1 19 19 ALA CB C 19 19.084 19.084 21.696 -2.612 19174
3324 1 19 . 1 1 19 19 ALA H H 19 8.001 8.001 7.375 0.626 19174
3325 1 19 . 1 1 20 20 GLU N N 20 117.663 117.663 119.991 -2.328 19174
3326 1 19 . 1 1 20 20 GLU CA C 20 57.275 57.275 55.161 2.114 19174
3327 1 19 . 1 1 20 20 GLU CB C 20 29.250 29.250 32.546 -3.296 19174
3328 1 19 . 1 1 20 20 GLU H H 20 8.231 8.231 8.640 -0.409 19174
3329 1 19 . 1 1 21 21 VAL N N 21 119.044 119.044 120.766 -1.722 19174
3330 1 19 . 1 1 21 21 VAL CA C 21 62.755 62.755 64.475 -1.720 19174
3331 1 19 . 1 1 21 21 VAL CB C 21 32.268 32.268 31.966 0.302 19174
3332 1 19 . 1 1 21 21 VAL H H 21 7.767 7.767 8.505 -0.738 19174
3333 1 19 . 1 1 22 22 GLU N N 22 121.765 121.765 119.297 2.468 19174
3334 1 19 . 1 1 22 22 GLU CA C 22 56.613 56.613 57.732 -1.119 19174
3335 1 19 . 1 1 22 22 GLU CB C 22 29.833 29.833 29.503 0.330 19174
3336 1 19 . 1 1 22 22 GLU H H 22 7.969 7.969 8.339 -0.370 19174
3337 1 19 . 1 1 23 23 LEU N N 23 120.996 120.996 119.904 1.092 19174
3338 1 19 . 1 1 23 23 LEU CA C 23 54.310 54.310 54.291 0.019 19174
3339 1 19 . 1 1 23 23 LEU CB C 23 42.223 42.223 42.644 -0.421 19174
3340 1 19 . 1 1 23 23 LEU H H 23 7.917 7.917 7.474 0.443 19174
3341 1 19 . 1 1 24 24 SER N N 24 114.702 114.702 117.107 -2.405 19174
3342 1 19 . 1 1 24 24 SER CA C 24 57.593 57.593 58.300 -0.707 19174
3343 1 19 . 1 1 24 24 SER CB C 24 64.515 64.515 63.073 1.442 19174
3344 1 19 . 1 1 24 24 SER H H 24 7.564 7.564 8.935 -1.371 19174
3345 1 19 . 1 1 25 25 ALA N N 25 125.059 125.059 126.317 -1.258 19174
3346 1 19 . 1 1 25 25 ALA CA C 25 55.898 55.898 56.602 -0.704 19174
3347 1 19 . 1 1 25 25 ALA CB C 25 16.330 16.330 16.833 -0.503 19174
3348 1 19 . 1 1 25 25 ALA H H 25 8.630 8.630 8.930 -0.300 19174
3349 1 19 . 1 1 27 27 VAL N N 27 118.016 118.016 117.091 0.925 19174
3350 1 19 . 1 1 27 27 VAL CA C 27 65.826 65.826 66.252 -0.426 19174
3351 1 19 . 1 1 27 27 VAL CB C 27 31.686 31.686 31.385 0.301 19174
3352 1 19 . 1 1 27 27 VAL H H 27 7.294 7.294 7.334 -0.040 19174
3353 1 19 . 1 1 28 28 LEU N N 28 119.933 119.933 120.620 -0.687 19174
3354 1 19 . 1 1 28 28 LEU CA C 28 57.990 57.990 58.326 -0.336 19174
3355 1 19 . 1 1 28 28 LEU CB C 28 41.429 41.429 41.347 0.082 19174
3356 1 19 . 1 1 28 28 LEU H H 28 7.939 7.939 8.484 -0.545 19174
3357 1 19 . 1 1 29 29 GLN N N 29 117.644 117.644 118.046 -0.402 19174
3358 1 19 . 1 1 29 29 GLN CA C 29 59.367 59.367 58.886 0.481 19174
3359 1 19 . 1 1 29 29 GLN CB C 29 28.297 28.297 28.002 0.295 19174
3360 1 19 . 1 1 29 29 GLN H H 29 8.179 8.179 8.737 -0.558 19174
3361 1 19 . 1 1 30 30 GLU N N 30 118.389 118.389 120.370 -1.981 19174
3362 1 19 . 1 1 30 30 GLU CA C 30 59.128 59.128 59.510 -0.382 19174
3363 1 19 . 1 1 30 30 GLU CB C 30 29.038 29.038 29.582 -0.544 19174
3364 1 19 . 1 1 30 30 GLU H H 30 7.752 7.752 7.779 -0.027 19174
3365 1 19 . 1 1 31 31 ILE N N 31 120.796 120.796 120.684 0.112 19174
3366 1 19 . 1 1 31 31 ILE CA C 31 65.509 65.509 65.364 0.145 19174
3367 1 19 . 1 1 31 31 ILE CB C 31 37.775 37.775 37.913 -0.138 19174
3368 1 19 . 1 1 31 31 ILE H H 31 8.131 8.131 8.090 0.041 19174
3369 1 19 . 1 1 32 32 TYR N N 32 120.550 120.550 120.979 -0.429 19174
3370 1 19 . 1 1 32 32 TYR CA C 32 61.405 61.405 62.330 -0.924 19174
3371 1 19 . 1 1 32 32 TYR CB C 32 38.358 38.358 38.364 -0.005 19174
3372 1 19 . 1 1 32 32 TYR H H 32 8.214 8.214 8.291 -0.077 19174
3373 1 19 . 1 1 33 33 LEU N N 33 117.578 117.578 118.674 -1.096 19174
3374 1 19 . 1 1 33 33 LEU CA C 33 57.513 57.513 58.242 -0.729 19174
3375 1 19 . 1 1 33 33 LEU CB C 33 41.657 41.657 41.496 0.161 19174
3376 1 19 . 1 1 33 33 LEU H H 33 8.347 8.347 8.280 0.067 19174
3377 1 19 . 1 1 34 34 SER N N 34 114.635 114.635 114.962 -0.327 19174
3378 1 19 . 1 1 34 34 SER CA C 34 61.405 61.405 62.246 -0.841 19174
3379 1 19 . 1 1 34 34 SER CB C 34 63.403 63.403 62.827 0.576 19174
3380 1 19 . 1 1 34 34 SER H H 34 7.986 7.986 8.255 -0.269 19174
3381 1 19 . 1 1 35 35 GLY N N 35 110.749 110.749 110.079 0.670 19174
3382 1 19 . 1 1 35 35 GLY CA C 35 46.897 46.897 46.598 0.299 19174
3383 1 19 . 1 1 35 35 GLY H H 35 8.302 8.302 8.366 -0.064 19174
3384 1 19 . 1 1 36 36 LEU N N 36 121.632 121.632 122.062 -0.430 19174
3385 1 19 . 1 1 36 36 LEU CA C 36 57.619 57.619 57.098 0.521 19174
3386 1 19 . 1 1 36 36 LEU CB C 36 41.799 41.799 41.375 0.424 19174
3387 1 19 . 1 1 36 36 LEU H H 36 8.194 8.194 7.398 0.796 19174
3388 1 19 . 1 1 37 37 ARG N N 37 118.274 118.274 117.784 0.490 19174
3389 1 19 . 1 1 37 37 ARG CA C 37 59.049 59.049 58.416 0.633 19174
3390 1 19 . 1 1 37 37 ARG CB C 37 30.044 30.044 29.235 0.809 19174
3391 1 19 . 1 1 37 37 ARG H H 37 7.934 7.934 7.498 0.436 19174
3392 1 19 . 1 1 38 38 SER N N 38 114.239 114.239 115.266 -1.027 19174
3393 1 19 . 1 1 38 38 SER CA C 38 60.531 60.531 60.839 -0.308 19174
3394 1 19 . 1 1 38 38 SER CB C 38 63.509 63.509 63.071 0.438 19174
3395 1 19 . 1 1 38 38 SER H H 38 7.913 7.913 7.740 0.173 19174
3396 1 19 . 1 1 39 39 TRP N N 39 123.095 123.095 123.111 -0.016 19174
3397 1 19 . 1 1 39 39 TRP CA C 39 59.870 59.870 58.520 1.351 19174
3398 1 19 . 1 1 39 39 TRP CB C 39 28.721 28.721 28.347 0.374 19174
3399 1 19 . 1 1 39 39 TRP H H 39 8.108 8.108 8.892 -0.784 19174
3400 1 19 . 1 1 40 40 LYS N N 40 119.629 119.629 119.898 -0.269 19174
3401 1 19 . 1 1 40 40 LYS CA C 40 59.525 59.525 59.782 -0.257 19174
3402 1 19 . 1 1 40 40 LYS CB C 40 32.109 32.109 32.181 -0.071 19174
3403 1 19 . 1 1 40 40 LYS H H 40 7.938 7.938 7.917 0.021 19174
3404 1 19 . 1 1 41 41 ARG N N 41 117.834 117.834 117.701 0.133 19174
3405 1 19 . 1 1 41 41 ARG CA C 41 57.857 57.857 59.035 -1.177 19174
3406 1 19 . 1 1 41 41 ARG CB C 41 30.203 30.203 29.919 0.284 19174
3407 1 19 . 1 1 41 41 ARG H H 41 7.863 7.863 7.650 0.213 19174
3408 1 19 . 1 1 42 42 HIS N N 42 115.774 115.774 116.279 -0.505 19174
3409 1 19 . 1 1 42 42 HIS CA C 42 57.487 57.487 58.817 -1.330 19174
3410 1 19 . 1 1 42 42 HIS CB C 42 30.786 30.786 30.266 0.520 19174
3411 1 19 . 1 1 42 42 HIS H H 42 7.919 7.919 7.531 0.388 19174
3412 1 19 . 1 1 43 43 LEU N N 43 120.243 120.243 119.530 0.713 19174
3413 1 19 . 1 1 43 43 LEU CA C 43 56.745 56.745 55.285 1.460 19174
3414 1 19 . 1 1 43 43 LEU CB C 43 42.276 42.276 41.535 0.741 19174
3415 1 19 . 1 1 43 43 LEU H H 43 8.162 8.162 8.862 -0.700 19174
3416 1 19 . 1 1 44 44 SER N N 44 114.616 114.616 116.786 -2.170 19174
3417 1 19 . 1 1 44 44 SER CA C 44 60.987 60.987 62.409 -1.422 19174
3418 1 19 . 1 1 44 44 SER CB C 44 62.768 62.768 62.865 -0.097 19174
3419 1 19 . 1 1 44 44 SER H H 44 8.033 8.033 8.347 -0.314 19174
3420 1 19 . 1 1 45 45 ARG N N 45 120.757 120.757 121.235 -0.478 19174
3421 1 19 . 1 1 45 45 ARG CA C 45 57.513 57.513 59.357 -1.844 19174
3422 1 19 . 1 1 45 45 ARG CB C 45 29.462 29.462 29.889 -0.427 19174
3423 1 19 . 1 1 45 45 ARG H H 45 7.763 7.763 8.216 -0.453 19174
3424 1 19 . 1 1 46 46 PHE N N 46 118.237 118.237 119.431 -1.194 19174
3425 1 19 . 1 1 46 46 PHE CA C 46 59.155 59.155 60.794 -1.639 19174
3426 1 19 . 1 1 46 46 PHE CB C 46 39.311 39.311 38.966 0.345 19174
3427 1 19 . 1 1 46 46 PHE H H 46 7.673 7.673 8.219 -0.546 19174
3428 1 19 . 1 1 47 47 TRP N N 47 118.484 118.484 120.253 -1.769 19174
3429 1 19 . 1 1 47 47 TRP CA C 47 58.837 58.837 59.367 -0.530 19174
3430 1 19 . 1 1 47 47 TRP CB C 47 29.833 29.833 29.875 -0.042 19174
3431 1 19 . 1 1 47 47 TRP H H 47 7.614 7.614 8.504 -0.890 19174
3432 1 19 . 1 1 48 48 ASN N N 48 114.629 114.629 116.769 -2.140 19174
3433 1 19 . 1 1 48 48 ASN CA C 48 54.124 54.124 55.229 -1.105 19174
3434 1 19 . 1 1 48 48 ASN CB C 48 38.887 38.887 38.543 0.344 19174
3435 1 19 . 1 1 48 48 ASN H H 48 7.811 7.811 8.175 -0.364 19174
3436 1 19 . 1 1 49 49 ASP N N 49 118.029 118.029 119.771 -1.742 19174
3437 1 19 . 1 1 49 49 ASP CA C 49 54.310 54.310 53.640 0.670 19174
3438 1 19 . 1 1 49 49 ASP CB C 49 40.793 40.793 40.547 0.246 19174
3439 1 19 . 1 1 49 49 ASP H H 49 7.775 7.775 7.597 0.178 19174
3440 1 20 . 1 1 2 2 ALA N N 2 127.400 127.400 124.565 2.835 19174
3441 1 20 . 1 1 2 2 ALA CA C 2 52.536 52.536 52.409 0.127 19174
3442 1 20 . 1 1 2 2 ALA CB C 2 19.031 19.031 19.292 -0.261 19174
3443 1 20 . 1 1 2 2 ALA H H 2 8.593 8.593 8.390 0.203 19174
3444 1 20 . 1 1 3 3 GLU N N 3 120.977 120.977 116.707 4.270 19174
3445 1 20 . 1 1 3 3 GLU CA C 3 56.295 56.295 56.785 -0.490 19174
3446 1 20 . 1 1 3 3 GLU CB C 3 29.939 29.939 27.497 2.442 19174
3447 1 20 . 1 1 3 3 GLU H H 3 8.301 8.301 8.584 -0.283 19174
3448 1 20 . 1 1 4 4 ALA N N 4 125.568 125.568 121.546 4.022 19174
3449 1 20 . 1 1 4 4 ALA CA C 4 52.509 52.509 52.624 -0.115 19174
3450 1 20 . 1 1 4 4 ALA CB C 4 19.084 19.084 19.746 -0.662 19174
3451 1 20 . 1 1 4 4 ALA H H 4 8.229 8.229 7.366 0.863 19174
3452 1 20 . 1 1 5 5 HIS N N 5 117.815 117.815 120.572 -2.757 19174
3453 1 20 . 1 1 5 5 HIS CA C 5 55.157 55.157 55.425 -0.267 19174
3454 1 20 . 1 1 5 5 HIS CB C 5 28.827 28.827 30.784 -1.957 19174
3455 1 20 . 1 1 5 5 HIS H H 5 8.363 8.363 8.457 -0.094 19174
3456 1 20 . 1 1 6 6 GLN N N 6 121.556 121.556 122.388 -0.832 19174
3457 1 20 . 1 1 6 6 GLN CA C 6 55.739 55.739 55.088 0.651 19174
3458 1 20 . 1 1 6 6 GLN CB C 6 29.409 29.409 31.017 -1.608 19174
3459 1 20 . 1 1 6 6 GLN H H 6 8.289 8.289 8.777 -0.488 19174
3460 1 20 . 1 1 7 7 ALA N N 7 126.411 126.411 127.139 -0.728 19174
3461 1 20 . 1 1 7 7 ALA CA C 7 52.404 52.404 52.238 0.166 19174
3462 1 20 . 1 1 7 7 ALA CB C 7 18.978 18.978 19.646 -0.668 19174
3463 1 20 . 1 1 7 7 ALA H H 7 8.311 8.311 8.385 -0.074 19174
3464 1 20 . 1 1 8 8 VAL N N 8 119.771 119.771 120.877 -1.106 19174
3465 1 20 . 1 1 8 8 VAL CA C 8 62.491 62.491 62.338 0.153 19174
3466 1 20 . 1 1 8 8 VAL CB C 8 32.586 32.586 33.476 -0.890 19174
3467 1 20 . 1 1 8 8 VAL H H 8 8.018 8.018 8.123 -0.105 19174
3468 1 20 . 1 1 9 9 GLY N N 9 112.108 112.108 114.773 -2.665 19174
3469 1 20 . 1 1 9 9 GLY CA C 9 45.044 45.044 45.523 -0.479 19174
3470 1 20 . 1 1 9 9 GLY H H 9 8.243 8.243 8.649 -0.406 19174
3471 1 20 . 1 1 10 10 PHE N N 10 120.842 120.842 120.899 -0.057 19174
3472 1 20 . 1 1 10 10 PHE CA C 10 57.725 57.725 57.401 0.324 19174
3473 1 20 . 1 1 10 10 PHE CB C 10 39.628 39.628 40.311 -0.683 19174
3474 1 20 . 1 1 10 10 PHE H H 10 7.983 7.983 7.773 0.210 19174
3475 1 20 . 1 1 11 11 ARG N N 11 125.277 125.277 126.626 -1.349 19174
3476 1 20 . 1 1 11 11 ARG CA C 11 53.410 53.410 53.075 0.335 19174
3477 1 20 . 1 1 11 11 ARG CB C 11 30.574 30.574 32.146 -1.572 19174
3478 1 20 . 1 1 11 11 ARG H H 11 8.016 8.016 7.968 0.048 19174
3479 1 20 . 1 1 13 13 SER N N 13 115.938 115.938 116.109 -0.171 19174
3480 1 20 . 1 1 13 13 SER CA C 13 58.043 58.043 60.204 -2.161 19174
3481 1 20 . 1 1 13 13 SER CB C 13 63.774 63.774 63.071 0.703 19174
3482 1 20 . 1 1 13 13 SER H H 13 8.197 8.197 8.561 -0.364 19174
3483 1 20 . 1 1 14 14 LEU N N 14 124.186 124.186 121.586 2.600 19174
3484 1 20 . 1 1 14 14 LEU CA C 14 55.422 55.422 56.767 -1.345 19174
3485 1 20 . 1 1 14 14 LEU CB C 14 42.329 42.329 42.249 0.080 19174
3486 1 20 . 1 1 14 14 LEU H H 14 8.256 8.256 7.861 0.395 19174
3487 1 20 . 1 1 15 15 THR N N 15 112.858 112.858 109.045 3.813 19174
3488 1 20 . 1 1 15 15 THR CA C 15 61.379 61.379 60.985 0.394 19174
3489 1 20 . 1 1 15 15 THR CB C 15 69.810 69.810 71.465 -1.655 19174
3490 1 20 . 1 1 15 15 THR H H 15 7.913 7.913 7.471 0.442 19174
3491 1 20 . 1 1 16 16 SER N N 16 117.578 117.578 115.810 1.768 19174
3492 1 20 . 1 1 16 16 SER CA C 16 58.678 58.678 57.066 1.612 19174
3493 1 20 . 1 1 16 16 SER CB C 16 63.668 63.668 65.425 -1.757 19174
3494 1 20 . 1 1 16 16 SER H H 16 8.154 8.154 7.966 0.188 19174
3495 1 20 . 1 1 17 17 ASP N N 17 122.030 122.030 121.915 0.115 19174
3496 1 20 . 1 1 17 17 ASP CA C 17 54.680 54.680 54.702 -0.022 19174
3497 1 20 . 1 1 17 17 ASP CB C 17 40.899 40.899 41.141 -0.242 19174
3498 1 20 . 1 1 17 17 ASP H H 17 8.263 8.263 8.292 -0.029 19174
3499 1 20 . 1 1 18 18 GLY N N 18 108.815 108.815 107.568 1.247 19174
3500 1 20 . 1 1 18 18 GLY CA C 18 45.758 45.758 44.748 1.010 19174
3501 1 20 . 1 1 18 18 GLY H H 18 8.239 8.239 8.288 -0.049 19174
3502 1 20 . 1 1 19 19 ALA N N 19 123.128 123.128 125.180 -2.052 19174
3503 1 20 . 1 1 19 19 ALA CA C 19 53.164 53.164 52.276 0.888 19174
3504 1 20 . 1 1 19 19 ALA CB C 19 19.084 19.084 19.651 -0.567 19174
3505 1 20 . 1 1 19 19 ALA H H 19 8.001 8.001 8.354 -0.353 19174
3506 1 20 . 1 1 20 20 GLU N N 20 117.663 117.663 122.376 -4.713 19174
3507 1 20 . 1 1 20 20 GLU CA C 20 57.275 57.275 56.184 1.091 19174
3508 1 20 . 1 1 20 20 GLU CB C 20 29.250 29.250 30.878 -1.628 19174
3509 1 20 . 1 1 20 20 GLU H H 20 8.231 8.231 8.753 -0.522 19174
3510 1 20 . 1 1 21 21 VAL N N 21 119.044 119.044 119.792 -0.748 19174
3511 1 20 . 1 1 21 21 VAL CA C 21 62.755 62.755 64.893 -2.138 19174
3512 1 20 . 1 1 21 21 VAL CB C 21 32.268 32.268 31.414 0.854 19174
3513 1 20 . 1 1 21 21 VAL H H 21 7.767 7.767 7.875 -0.108 19174
3514 1 20 . 1 1 22 22 GLU N N 22 121.765 121.765 119.124 2.641 19174
3515 1 20 . 1 1 22 22 GLU CA C 22 56.613 56.613 57.535 -0.922 19174
3516 1 20 . 1 1 22 22 GLU CB C 22 29.833 29.833 29.601 0.232 19174
3517 1 20 . 1 1 22 22 GLU H H 22 7.969 7.969 8.139 -0.170 19174
3518 1 20 . 1 1 23 23 LEU N N 23 120.996 120.996 120.458 0.538 19174
3519 1 20 . 1 1 23 23 LEU CA C 23 54.310 54.310 54.302 0.008 19174
3520 1 20 . 1 1 23 23 LEU CB C 23 42.223 42.223 42.847 -0.624 19174
3521 1 20 . 1 1 23 23 LEU H H 23 7.917 7.917 7.656 0.261 19174
3522 1 20 . 1 1 24 24 SER N N 24 114.702 114.702 115.267 -0.565 19174
3523 1 20 . 1 1 24 24 SER CA C 24 57.593 57.593 58.531 -0.938 19174
3524 1 20 . 1 1 24 24 SER CB C 24 64.515 64.515 63.098 1.417 19174
3525 1 20 . 1 1 24 24 SER H H 24 7.564 7.564 8.877 -1.313 19174
3526 1 20 . 1 1 25 25 ALA N N 25 125.059 125.059 125.574 -0.515 19174
3527 1 20 . 1 1 25 25 ALA CA C 25 55.898 55.898 56.728 -0.830 19174
3528 1 20 . 1 1 25 25 ALA CB C 25 16.330 16.330 16.854 -0.524 19174
3529 1 20 . 1 1 25 25 ALA H H 25 8.630 8.630 8.861 -0.231 19174
3530 1 20 . 1 1 27 27 VAL N N 27 118.016 118.016 118.050 -0.034 19174
3531 1 20 . 1 1 27 27 VAL CA C 27 65.826 65.826 66.138 -0.312 19174
3532 1 20 . 1 1 27 27 VAL CB C 27 31.686 31.686 31.440 0.246 19174
3533 1 20 . 1 1 27 27 VAL H H 27 7.294 7.294 7.528 -0.234 19174
3534 1 20 . 1 1 28 28 LEU N N 28 119.933 119.933 120.401 -0.468 19174
3535 1 20 . 1 1 28 28 LEU CA C 28 57.990 57.990 58.761 -0.771 19174
3536 1 20 . 1 1 28 28 LEU CB C 28 41.429 41.429 41.416 0.014 19174
3537 1 20 . 1 1 28 28 LEU H H 28 7.939 7.939 8.153 -0.214 19174
3538 1 20 . 1 1 29 29 GLN N N 29 117.644 117.644 118.399 -0.755 19174
3539 1 20 . 1 1 29 29 GLN CA C 29 59.367 59.367 59.402 -0.035 19174
3540 1 20 . 1 1 29 29 GLN CB C 29 28.297 28.297 28.411 -0.114 19174
3541 1 20 . 1 1 29 29 GLN H H 29 8.179 8.179 8.505 -0.326 19174
3542 1 20 . 1 1 30 30 GLU N N 30 118.389 118.389 120.761 -2.372 19174
3543 1 20 . 1 1 30 30 GLU CA C 30 59.128 59.128 58.885 0.243 19174
3544 1 20 . 1 1 30 30 GLU CB C 30 29.038 29.038 29.155 -0.117 19174
3545 1 20 . 1 1 30 30 GLU H H 30 7.752 7.752 7.741 0.011 19174
3546 1 20 . 1 1 31 31 ILE N N 31 120.796 120.796 121.264 -0.468 19174
3547 1 20 . 1 1 31 31 ILE CA C 31 65.509 65.509 65.391 0.118 19174
3548 1 20 . 1 1 31 31 ILE CB C 31 37.775 37.775 38.040 -0.265 19174
3549 1 20 . 1 1 31 31 ILE H H 31 8.131 8.131 7.972 0.159 19174
3550 1 20 . 1 1 32 32 TYR N N 32 120.550 120.550 120.638 -0.088 19174
3551 1 20 . 1 1 32 32 TYR CA C 32 61.405 61.405 62.233 -0.828 19174
3552 1 20 . 1 1 32 32 TYR CB C 32 38.358 38.358 38.389 -0.031 19174
3553 1 20 . 1 1 32 32 TYR H H 32 8.214 8.214 8.291 -0.077 19174
3554 1 20 . 1 1 33 33 LEU N N 33 117.578 117.578 118.104 -0.526 19174
3555 1 20 . 1 1 33 33 LEU CA C 33 57.513 57.513 57.804 -0.291 19174
3556 1 20 . 1 1 33 33 LEU CB C 33 41.657 41.657 41.691 -0.034 19174
3557 1 20 . 1 1 33 33 LEU H H 33 8.347 8.347 8.323 0.024 19174
3558 1 20 . 1 1 34 34 SER N N 34 114.635 114.635 114.649 -0.014 19174
3559 1 20 . 1 1 34 34 SER CA C 34 61.405 61.405 61.127 0.279 19174
3560 1 20 . 1 1 34 34 SER CB C 34 63.403 63.403 62.763 0.640 19174
3561 1 20 . 1 1 34 34 SER H H 34 7.986 7.986 8.387 -0.401 19174
3562 1 20 . 1 1 35 35 GLY N N 35 110.749 110.749 110.564 0.185 19174
3563 1 20 . 1 1 35 35 GLY CA C 35 46.897 46.897 46.426 0.471 19174
3564 1 20 . 1 1 35 35 GLY H H 35 8.302 8.302 8.185 0.117 19174
3565 1 20 . 1 1 36 36 LEU N N 36 121.632 121.632 122.452 -0.820 19174
3566 1 20 . 1 1 36 36 LEU CA C 36 57.619 57.619 56.890 0.729 19174
3567 1 20 . 1 1 36 36 LEU CB C 36 41.799 41.799 41.359 0.440 19174
3568 1 20 . 1 1 36 36 LEU H H 36 8.194 8.194 7.225 0.969 19174
3569 1 20 . 1 1 37 37 ARG N N 37 118.274 118.274 118.483 -0.209 19174
3570 1 20 . 1 1 37 37 ARG CA C 37 59.049 59.049 59.373 -0.324 19174
3571 1 20 . 1 1 37 37 ARG CB C 37 30.044 30.044 29.954 0.090 19174
3572 1 20 . 1 1 37 37 ARG H H 37 7.934 7.934 7.403 0.531 19174
3573 1 20 . 1 1 38 38 SER N N 38 114.239 114.239 115.034 -0.795 19174
3574 1 20 . 1 1 38 38 SER CA C 38 60.531 60.531 61.491 -0.960 19174
3575 1 20 . 1 1 38 38 SER CB C 38 63.509 63.509 63.180 0.329 19174
3576 1 20 . 1 1 38 38 SER H H 38 7.913 7.913 7.616 0.297 19174
3577 1 20 . 1 1 39 39 TRP N N 39 123.095 123.095 122.689 0.406 19174
3578 1 20 . 1 1 39 39 TRP CA C 39 59.870 59.870 58.258 1.612 19174
3579 1 20 . 1 1 39 39 TRP CB C 39 28.721 28.721 28.309 0.412 19174
3580 1 20 . 1 1 39 39 TRP H H 39 8.108 8.108 8.770 -0.662 19174
3581 1 20 . 1 1 40 40 LYS N N 40 119.629 119.629 119.808 -0.179 19174
3582 1 20 . 1 1 40 40 LYS CA C 40 59.525 59.525 59.750 -0.225 19174
3583 1 20 . 1 1 40 40 LYS CB C 40 32.109 32.109 32.140 -0.031 19174
3584 1 20 . 1 1 40 40 LYS H H 40 7.938 7.938 7.895 0.043 19174
3585 1 20 . 1 1 41 41 ARG N N 41 117.834 117.834 116.842 0.992 19174
3586 1 20 . 1 1 41 41 ARG CA C 41 57.857 57.857 59.041 -1.184 19174
3587 1 20 . 1 1 41 41 ARG CB C 41 30.203 30.203 30.177 0.025 19174
3588 1 20 . 1 1 41 41 ARG H H 41 7.863 7.863 7.736 0.127 19174
3589 1 20 . 1 1 42 42 HIS N N 42 115.774 115.774 117.183 -1.409 19174
3590 1 20 . 1 1 42 42 HIS CA C 42 57.487 57.487 59.078 -1.591 19174
3591 1 20 . 1 1 42 42 HIS CB C 42 30.786 30.786 30.088 0.698 19174
3592 1 20 . 1 1 42 42 HIS H H 42 7.919 7.919 7.690 0.229 19174
3593 1 20 . 1 1 43 43 LEU N N 43 120.243 120.243 120.446 -0.203 19174
3594 1 20 . 1 1 43 43 LEU CA C 43 56.745 56.745 55.307 1.438 19174
3595 1 20 . 1 1 43 43 LEU CB C 43 42.276 42.276 42.139 0.137 19174
3596 1 20 . 1 1 43 43 LEU H H 43 8.162 8.162 8.854 -0.692 19174
3597 1 20 . 1 1 44 44 SER N N 44 114.616 114.616 116.528 -1.912 19174
3598 1 20 . 1 1 44 44 SER CA C 44 60.987 60.987 62.669 -1.682 19174
3599 1 20 . 1 1 44 44 SER CB C 44 62.768 62.768 62.898 -0.130 19174
3600 1 20 . 1 1 44 44 SER H H 44 8.033 8.033 8.200 -0.167 19174
3601 1 20 . 1 1 45 45 ARG N N 45 120.757 120.757 121.565 -0.808 19174
3602 1 20 . 1 1 45 45 ARG CA C 45 57.513 57.513 59.083 -1.570 19174
3603 1 20 . 1 1 45 45 ARG CB C 45 29.462 29.462 29.831 -0.369 19174
3604 1 20 . 1 1 45 45 ARG H H 45 7.763 7.763 8.045 -0.282 19174
3605 1 20 . 1 1 46 46 PHE N N 46 118.237 118.237 114.494 3.743 19174
3606 1 20 . 1 1 46 46 PHE CA C 46 59.155 59.155 60.475 -1.320 19174
3607 1 20 . 1 1 46 46 PHE CB C 46 39.311 39.311 38.930 0.381 19174
3608 1 20 . 1 1 46 46 PHE H H 46 7.673 7.673 8.010 -0.337 19174
3609 1 20 . 1 1 47 47 TRP N N 47 118.484 118.484 122.650 -4.166 19174
3610 1 20 . 1 1 47 47 TRP CA C 47 58.837 58.837 61.606 -2.769 19174
3611 1 20 . 1 1 47 47 TRP CB C 47 29.833 29.833 29.489 0.344 19174
3612 1 20 . 1 1 47 47 TRP H H 47 7.614 7.614 8.975 -1.361 19174
3613 1 20 . 1 1 48 48 ASN N N 48 114.629 114.629 115.471 -0.842 19174
3614 1 20 . 1 1 48 48 ASN CA C 48 54.124 54.124 52.680 1.444 19174
3615 1 20 . 1 1 48 48 ASN CB C 48 38.887 38.887 39.139 -0.252 19174
3616 1 20 . 1 1 48 48 ASN H H 48 7.811 7.811 8.130 -0.319 19174
3617 1 20 . 1 1 49 49 ASP N N 49 118.029 118.029 120.333 -2.304 19174
3618 1 20 . 1 1 49 49 ASP CA C 49 54.310 54.310 56.163 -1.853 19174
3619 1 20 . 1 1 49 49 ASP CB C 49 40.793 40.793 41.013 -0.220 19174
3620 1 20 . 1 1 49 49 ASP H H 49 7.775 7.775 7.659 0.116 19174
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 46 2.467 -0.249 2.482 19174
2 1 1 "Average Difference" HA 0 0.000 0.000 0.000 19174
3 1 1 "Average Difference" C 0 0.000 0.000 0.000 19174
4 1 1 "Average Difference" CA 46 1.165 0.415 1.100 19174
5 1 1 "Average Difference" CB 43 0.922 0.150 0.920 19174
6 1 1 "Average Difference" HN 46 0.388 0.058 0.388 19174
7 1 2 "Average Difference" N 46 2.356 0.241 2.369 19174
8 1 2 "Average Difference" HA 0 0.000 0.000 0.000 19174
9 1 2 "Average Difference" C 0 0.000 0.000 0.000 19174
10 1 2 "Average Difference" CA 46 1.443 0.529 1.357 19174
11 1 2 "Average Difference" CB 43 0.725 0.032 0.733 19174
12 1 2 "Average Difference" HN 46 0.426 0.090 0.421 19174
13 1 3 "Average Difference" N 46 2.461 -0.410 2.453 19174
14 1 3 "Average Difference" HA 0 0.000 0.000 0.000 19174
15 1 3 "Average Difference" C 0 0.000 0.000 0.000 19174
16 1 3 "Average Difference" CA 46 1.272 0.314 1.247 19174
17 1 3 "Average Difference" CB 43 0.851 0.159 0.845 19174
18 1 3 "Average Difference" HN 46 0.439 0.052 0.441 19174
19 1 4 "Average Difference" N 46 1.713 0.348 1.695 19174
20 1 4 "Average Difference" HA 0 0.000 0.000 0.000 19174
21 1 4 "Average Difference" C 0 0.000 0.000 0.000 19174
22 1 4 "Average Difference" CA 46 0.961 0.378 0.894 19174
23 1 4 "Average Difference" CB 43 0.864 0.098 0.869 19174
24 1 4 "Average Difference" HN 46 0.444 0.107 0.435 19174
25 1 5 "Average Difference" N 46 2.431 -0.147 2.453 19174
26 1 5 "Average Difference" HA 0 0.000 0.000 0.000 19174
27 1 5 "Average Difference" C 0 0.000 0.000 0.000 19174
28 1 5 "Average Difference" CA 46 1.301 0.445 1.236 19174
29 1 5 "Average Difference" CB 43 0.809 0.057 0.817 19174
30 1 5 "Average Difference" HN 46 0.513 0.104 0.507 19174
31 1 6 "Average Difference" N 46 2.395 0.027 2.421 19174
32 1 6 "Average Difference" HA 0 0.000 0.000 0.000 19174
33 1 6 "Average Difference" C 0 0.000 0.000 0.000 19174
34 1 6 "Average Difference" CA 46 1.143 0.390 1.087 19174
35 1 6 "Average Difference" CB 43 0.734 -0.005 0.743 19174
36 1 6 "Average Difference" HN 46 0.409 0.010 0.413 19174
37 1 7 "Average Difference" N 46 2.395 -0.171 2.416 19174
38 1 7 "Average Difference" HA 0 0.000 0.000 0.000 19174
39 1 7 "Average Difference" C 0 0.000 0.000 0.000 19174
40 1 7 "Average Difference" CA 46 1.234 0.473 1.152 19174
41 1 7 "Average Difference" CB 43 0.800 -0.079 0.806 19174
42 1 7 "Average Difference" HN 46 0.494 0.096 0.490 19174
43 1 8 "Average Difference" N 46 2.337 0.069 2.361 19174
44 1 8 "Average Difference" HA 0 0.000 0.000 0.000 19174
45 1 8 "Average Difference" C 0 0.000 0.000 0.000 19174
46 1 8 "Average Difference" CA 46 1.397 0.491 1.322 19174
47 1 8 "Average Difference" CB 43 0.810 0.139 0.807 19174
48 1 8 "Average Difference" HN 46 0.487 0.113 0.479 19174
49 1 9 "Average Difference" N 46 2.335 -0.040 2.360 19174
50 1 9 "Average Difference" HA 0 0.000 0.000 0.000 19174
51 1 9 "Average Difference" C 0 0.000 0.000 0.000 19174
52 1 9 "Average Difference" CA 46 1.112 0.328 1.074 19174
53 1 9 "Average Difference" CB 43 1.091 0.078 1.101 19174
54 1 9 "Average Difference" HN 46 0.439 0.125 0.425 19174
55 1 10 "Average Difference" N 46 1.478 0.277 1.468 19174
56 1 10 "Average Difference" HA 0 0.000 0.000 0.000 19174
57 1 10 "Average Difference" C 0 0.000 0.000 0.000 19174
58 1 10 "Average Difference" CA 46 0.954 0.314 0.911 19174
59 1 10 "Average Difference" CB 43 0.677 0.096 0.678 19174
60 1 10 "Average Difference" HN 46 0.356 0.024 0.359 19174
61 1 11 "Average Difference" N 46 2.621 0.092 2.648 19174
62 1 11 "Average Difference" HA 0 0.000 0.000 0.000 19174
63 1 11 "Average Difference" C 0 0.000 0.000 0.000 19174
64 1 11 "Average Difference" CA 46 1.394 0.559 1.291 19174
65 1 11 "Average Difference" CB 43 0.884 0.054 0.893 19174
66 1 11 "Average Difference" HN 46 0.389 0.097 0.381 19174
67 1 12 "Average Difference" N 46 2.692 -0.233 2.712 19174
68 1 12 "Average Difference" HA 0 0.000 0.000 0.000 19174
69 1 12 "Average Difference" C 0 0.000 0.000 0.000 19174
70 1 12 "Average Difference" CA 46 1.373 0.495 1.295 19174
71 1 12 "Average Difference" CB 43 0.881 0.020 0.891 19174
72 1 12 "Average Difference" HN 46 0.498 0.009 0.503 19174
73 1 13 "Average Difference" N 46 2.066 0.739 1.950 19174
74 1 13 "Average Difference" HA 0 0.000 0.000 0.000 19174
75 1 13 "Average Difference" C 0 0.000 0.000 0.000 19174
76 1 13 "Average Difference" CA 46 1.120 0.361 1.072 19174
77 1 13 "Average Difference" CB 43 0.849 0.127 0.849 19174
78 1 13 "Average Difference" HN 46 0.375 0.077 0.371 19174
79 1 14 "Average Difference" N 46 1.748 0.584 1.666 19174
80 1 14 "Average Difference" HA 0 0.000 0.000 0.000 19174
81 1 14 "Average Difference" C 0 0.000 0.000 0.000 19174
82 1 14 "Average Difference" CA 46 1.036 0.152 1.036 19174
83 1 14 "Average Difference" CB 43 0.761 0.026 0.770 19174
84 1 14 "Average Difference" HN 46 0.440 0.084 0.437 19174
85 1 15 "Average Difference" N 46 2.417 -0.261 2.429 19174
86 1 15 "Average Difference" HA 0 0.000 0.000 0.000 19174
87 1 15 "Average Difference" C 0 0.000 0.000 0.000 19174
88 1 15 "Average Difference" CA 46 1.116 0.434 1.040 19174
89 1 15 "Average Difference" CB 43 0.806 0.014 0.815 19174
90 1 15 "Average Difference" HN 46 0.427 0.076 0.425 19174
91 1 16 "Average Difference" N 46 2.411 0.017 2.437 19174
92 1 16 "Average Difference" HA 0 0.000 0.000 0.000 19174
93 1 16 "Average Difference" C 0 0.000 0.000 0.000 19174
94 1 16 "Average Difference" CA 46 1.116 0.404 1.051 19174
95 1 16 "Average Difference" CB 43 0.643 -0.075 0.646 19174
96 1 16 "Average Difference" HN 46 0.417 0.047 0.419 19174
97 1 17 "Average Difference" N 46 2.179 -0.092 2.201 19174
98 1 17 "Average Difference" HA 0 0.000 0.000 0.000 19174
99 1 17 "Average Difference" C 0 0.000 0.000 0.000 19174
100 1 17 "Average Difference" CA 46 1.372 0.661 1.216 19174
101 1 17 "Average Difference" CB 43 0.762 0.108 0.763 19174
102 1 17 "Average Difference" HN 46 0.390 0.030 0.393 19174
103 1 18 "Average Difference" N 46 2.423 -0.264 2.435 19174
104 1 18 "Average Difference" HA 0 0.000 0.000 0.000 19174
105 1 18 "Average Difference" C 0 0.000 0.000 0.000 19174
106 1 18 "Average Difference" CA 46 1.133 0.377 1.080 19174
107 1 18 "Average Difference" CB 43 0.895 0.018 0.905 19174
108 1 18 "Average Difference" HN 46 0.446 0.052 0.448 19174
109 1 19 "Average Difference" N 46 1.887 0.266 1.889 19174
110 1 19 "Average Difference" HA 0 0.000 0.000 0.000 19174
111 1 19 "Average Difference" C 0 0.000 0.000 0.000 19174
112 1 19 "Average Difference" CA 46 1.057 0.276 1.032 19174
113 1 19 "Average Difference" CB 43 0.949 0.114 0.953 19174
114 1 19 "Average Difference" HN 46 0.447 0.138 0.430 19174
115 1 20 "Average Difference" N 46 1.953 0.162 1.968 19174
116 1 20 "Average Difference" HA 0 0.000 0.000 0.000 19174
117 1 20 "Average Difference" C 0 0.000 0.000 0.000 19174
118 1 20 "Average Difference" CA 46 1.071 0.268 1.048 19174
119 1 20 "Average Difference" CB 43 0.862 0.172 0.855 19174
120 1 20 "Average Difference" HN 46 0.443 0.096 0.438 19174
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 19174
_Entity_delta_chem_shifts.ID 2
_Entity_delta_chem_shifts.Details
;
This saveframe contains the averaged SPARTA chemical shift over all the models used.
;
loop_
_Delta_CS.Atom_chem_shift_ID
_Delta_CS.Entity_delta_chem_shifts_ID
_Delta_CS.Assembly_atom_ID
_Delta_CS.Entity_assembly_ID
_Delta_CS.Entity_ID
_Delta_CS.Comp_index_ID
_Delta_CS.Seq_ID
_Delta_CS.Comp_ID
_Delta_CS.Atom_ID
_Delta_CS.Atom_type
_Delta_CS.Auth_seq_ID
_Delta_CS.Original_CS_value
_Delta_CS.Corrected_CS_value
_Delta_CS.Sparta_CS_value
_Delta_CS.Delta_CS_value
_Delta_CS.Entry_ID
1 1 . 1 1 2 2 ALA N N 2 127.400 127.400 124.362 3.038 19174
2 1 . 1 1 2 2 ALA CA C 2 52.536 52.536 52.795 -0.259 19174
3 1 . 1 1 2 2 ALA CB C 2 19.031 19.031 19.433 -0.402 19174
4 1 . 1 1 2 2 ALA H H 2 8.593 8.593 8.199 0.394 19174
5 1 . 1 1 3 3 GLU N N 3 120.977 120.977 119.410 1.567 19174
6 1 . 1 1 3 3 GLU CA C 3 56.295 56.295 56.713 -0.418 19174
7 1 . 1 1 3 3 GLU CB C 3 29.939 29.939 29.992 -0.053 19174
8 1 . 1 1 3 3 GLU H H 3 8.301 8.301 8.445 -0.144 19174
9 1 . 1 1 4 4 ALA N N 4 125.568 125.568 123.843 1.725 19174
10 1 . 1 1 4 4 ALA CA C 4 52.509 52.509 52.241 0.268 19174
11 1 . 1 1 4 4 ALA CB C 4 19.084 19.084 19.737 -0.653 19174
12 1 . 1 1 4 4 ALA H H 4 8.229 8.229 7.927 0.302 19174
13 1 . 1 1 5 5 HIS N N 5 117.815 117.815 119.163 -1.348 19174
14 1 . 1 1 5 5 HIS CA C 5 55.157 55.157 57.317 -2.160 19174
15 1 . 1 1 5 5 HIS CB C 5 28.827 28.827 30.510 -1.683 19174
16 1 . 1 1 5 5 HIS H H 5 8.363 8.363 8.420 -0.057 19174
17 1 . 1 1 6 6 GLN N N 6 121.556 121.556 120.420 1.136 19174
18 1 . 1 1 6 6 GLN CA C 6 55.739 55.739 56.292 -0.553 19174
19 1 . 1 1 6 6 GLN CB C 6 29.409 29.409 29.446 -0.037 19174
20 1 . 1 1 6 6 GLN H H 6 8.289 8.289 8.448 -0.159 19174
21 1 . 1 1 7 7 ALA N N 7 126.411 126.411 124.259 2.152 19174
22 1 . 1 1 7 7 ALA CA C 7 52.404 52.404 52.581 -0.177 19174
23 1 . 1 1 7 7 ALA CB C 7 18.978 18.978 19.641 -0.663 19174
24 1 . 1 1 7 7 ALA H H 7 8.311 8.311 8.207 0.104 19174
25 1 . 1 1 8 8 VAL N N 8 119.771 119.771 119.100 0.671 19174
26 1 . 1 1 8 8 VAL CA C 8 62.491 62.491 62.374 0.117 19174
27 1 . 1 1 8 8 VAL CB C 8 32.586 32.586 33.049 -0.463 19174
28 1 . 1 1 8 8 VAL H H 8 8.018 8.018 7.995 0.023 19174
29 1 . 1 1 9 9 GLY N N 9 112.108 112.108 110.469 1.639 19174
30 1 . 1 1 9 9 GLY CA C 9 45.044 45.044 45.080 -0.036 19174
31 1 . 1 1 9 9 GLY H H 9 8.243 8.243 8.101 0.142 19174
32 1 . 1 1 10 10 PHE N N 10 120.842 120.842 119.377 1.465 19174
33 1 . 1 1 10 10 PHE CA C 10 57.725 57.725 57.979 -0.254 19174
34 1 . 1 1 10 10 PHE CB C 10 39.628 39.628 40.325 -0.697 19174
35 1 . 1 1 10 10 PHE H H 10 7.983 7.983 8.076 -0.093 19174
36 1 . 1 1 11 11 ARG N N 11 125.277 125.277 122.728 2.550 19174
37 1 . 1 1 11 11 ARG CA C 11 53.410 53.410 54.812 -1.402 19174
38 1 . 1 1 11 11 ARG CB C 11 30.574 30.574 30.405 0.169 19174
39 1 . 1 1 11 11 ARG H H 11 8.016 8.016 8.308 -0.292 19174
40 1 . 1 1 13 13 SER N N 13 115.938 115.938 115.684 0.254 19174
41 1 . 1 1 13 13 SER CA C 13 58.043 58.043 59.119 -1.076 19174
42 1 . 1 1 13 13 SER CB C 13 63.774 63.774 63.735 0.039 19174
43 1 . 1 1 13 13 SER H H 13 8.197 8.197 8.323 -0.126 19174
44 1 . 1 1 14 14 LEU N N 14 124.186 124.186 122.484 1.702 19174
45 1 . 1 1 14 14 LEU CA C 14 55.422 55.422 55.670 -0.248 19174
46 1 . 1 1 14 14 LEU CB C 14 42.329 42.329 42.283 0.046 19174
47 1 . 1 1 14 14 LEU H H 14 8.256 8.256 8.086 0.170 19174
48 1 . 1 1 15 15 THR N N 15 112.858 112.858 113.181 -0.323 19174
49 1 . 1 1 15 15 THR CA C 15 61.379 61.379 62.336 -0.957 19174
50 1 . 1 1 15 15 THR CB C 15 69.810 69.810 69.675 0.135 19174
51 1 . 1 1 15 15 THR H H 15 7.913 7.913 8.022 -0.109 19174
52 1 . 1 1 16 16 SER N N 16 117.578 117.578 116.716 0.862 19174
53 1 . 1 1 16 16 SER CA C 16 58.678 58.678 58.625 0.053 19174
54 1 . 1 1 16 16 SER CB C 16 63.668 63.668 63.893 -0.225 19174
55 1 . 1 1 16 16 SER H H 16 8.154 8.154 8.091 0.063 19174
56 1 . 1 1 17 17 ASP N N 17 122.030 122.030 121.734 0.296 19174
57 1 . 1 1 17 17 ASP CA C 17 54.680 54.680 54.329 0.351 19174
58 1 . 1 1 17 17 ASP CB C 17 40.899 40.899 40.724 0.175 19174
59 1 . 1 1 17 17 ASP H H 17 8.263 8.263 8.283 -0.020 19174
60 1 . 1 1 18 18 GLY N N 18 108.815 108.815 108.715 0.100 19174
61 1 . 1 1 18 18 GLY CA C 18 45.758 45.758 44.981 0.778 19174
62 1 . 1 1 18 18 GLY H H 18 8.239 8.239 8.156 0.083 19174
63 1 . 1 1 19 19 ALA N N 19 123.128 123.128 123.060 0.068 19174
64 1 . 1 1 19 19 ALA CA C 19 53.164 53.164 52.472 0.692 19174
65 1 . 1 1 19 19 ALA CB C 19 19.084 19.084 19.795 -0.711 19174
66 1 . 1 1 19 19 ALA H H 19 8.001 8.001 7.977 0.025 19174
67 1 . 1 1 20 20 GLU N N 20 117.663 117.663 120.353 -2.690 19174
68 1 . 1 1 20 20 GLU CA C 20 57.275 57.275 57.050 0.225 19174
69 1 . 1 1 20 20 GLU CB C 20 29.250 29.250 30.250 -1.000 19174
70 1 . 1 1 20 20 GLU H H 20 8.231 8.231 8.509 -0.278 19174
71 1 . 1 1 21 21 VAL N N 21 119.044 119.044 120.070 -1.027 19174
72 1 . 1 1 21 21 VAL CA C 21 62.755 62.755 63.106 -0.351 19174
73 1 . 1 1 21 21 VAL CB C 21 32.268 32.268 32.861 -0.593 19174
74 1 . 1 1 21 21 VAL H H 21 7.767 7.767 8.021 -0.254 19174
75 1 . 1 1 22 22 GLU N N 22 121.765 121.765 121.511 0.254 19174
76 1 . 1 1 22 22 GLU CA C 22 56.613 56.613 57.710 -1.097 19174
77 1 . 1 1 22 22 GLU CB C 22 29.833 29.833 29.901 -0.068 19174
78 1 . 1 1 22 22 GLU H H 22 7.969 7.969 8.375 -0.406 19174
79 1 . 1 1 23 23 LEU N N 23 120.996 120.996 120.142 0.854 19174
80 1 . 1 1 23 23 LEU CA C 23 54.310 54.310 55.220 -0.910 19174
81 1 . 1 1 23 23 LEU CB C 23 42.223 42.223 42.684 -0.461 19174
82 1 . 1 1 23 23 LEU H H 23 7.917 7.917 7.701 0.216 19174
83 1 . 1 1 24 24 SER N N 24 114.702 114.702 115.137 -0.435 19174
84 1 . 1 1 24 24 SER CA C 24 57.593 57.593 58.482 -0.889 19174
85 1 . 1 1 24 24 SER CB C 24 64.515 64.515 63.048 1.467 19174
86 1 . 1 1 24 24 SER H H 24 7.564 7.564 8.325 -0.761 19174
87 1 . 1 1 25 25 ALA N N 25 125.059 125.059 126.707 -1.648 19174
88 1 . 1 1 25 25 ALA CA C 25 55.898 55.898 56.214 -0.316 19174
89 1 . 1 1 25 25 ALA CB C 25 16.330 16.330 16.742 -0.412 19174
90 1 . 1 1 25 25 ALA H H 25 8.630 8.630 8.628 0.002 19174
91 1 . 1 1 27 27 VAL N N 27 118.016 118.016 117.068 0.948 19174
92 1 . 1 1 27 27 VAL CA C 27 65.826 65.826 65.990 -0.164 19174
93 1 . 1 1 27 27 VAL CB C 27 31.686 31.686 31.473 0.213 19174
94 1 . 1 1 27 27 VAL H H 27 7.294 7.294 7.381 -0.087 19174
95 1 . 1 1 28 28 LEU N N 28 119.933 119.933 120.256 -0.323 19174
96 1 . 1 1 28 28 LEU CA C 28 57.990 57.990 58.232 -0.241 19174
97 1 . 1 1 28 28 LEU CB C 28 41.429 41.429 41.295 0.134 19174
98 1 . 1 1 28 28 LEU H H 28 7.939 7.939 8.130 -0.191 19174
99 1 . 1 1 29 29 GLN N N 29 117.644 117.644 118.528 -0.884 19174
100 1 . 1 1 29 29 GLN CA C 29 59.367 59.367 59.355 0.012 19174
101 1 . 1 1 29 29 GLN CB C 29 28.297 28.297 28.428 -0.131 19174
102 1 . 1 1 29 29 GLN H H 29 8.179 8.179 8.535 -0.356 19174
103 1 . 1 1 30 30 GLU N N 30 118.389 118.389 120.429 -2.040 19174
104 1 . 1 1 30 30 GLU CA C 30 59.128 59.128 59.239 -0.111 19174
105 1 . 1 1 30 30 GLU CB C 30 29.038 29.038 29.492 -0.454 19174
106 1 . 1 1 30 30 GLU H H 30 7.752 7.752 7.864 -0.112 19174
107 1 . 1 1 31 31 ILE N N 31 120.796 120.796 120.733 0.063 19174
108 1 . 1 1 31 31 ILE CA C 31 65.509 65.509 65.265 0.244 19174
109 1 . 1 1 31 31 ILE CB C 31 37.775 37.775 37.931 -0.156 19174
110 1 . 1 1 31 31 ILE H H 31 8.131 8.131 8.112 0.019 19174
111 1 . 1 1 32 32 TYR N N 32 120.550 120.550 120.745 -0.195 19174
112 1 . 1 1 32 32 TYR CA C 32 61.405 61.405 62.141 -0.736 19174
113 1 . 1 1 32 32 TYR CB C 32 38.358 38.358 38.419 -0.061 19174
114 1 . 1 1 32 32 TYR H H 32 8.214 8.214 8.239 -0.025 19174
115 1 . 1 1 33 33 LEU N N 33 117.578 117.578 119.065 -1.487 19174
116 1 . 1 1 33 33 LEU CA C 33 57.513 57.513 57.646 -0.133 19174
117 1 . 1 1 33 33 LEU CB C 33 41.657 41.657 41.560 0.098 19174
118 1 . 1 1 33 33 LEU H H 33 8.347 8.347 8.293 0.054 19174
119 1 . 1 1 34 34 SER N N 34 114.635 114.635 114.754 -0.119 19174
120 1 . 1 1 34 34 SER CA C 34 61.405 61.405 61.806 -0.401 19174
121 1 . 1 1 34 34 SER CB C 34 63.403 63.403 62.685 0.718 19174
122 1 . 1 1 34 34 SER H H 34 7.986 7.986 8.406 -0.420 19174
123 1 . 1 1 35 35 GLY N N 35 110.749 110.749 110.095 0.654 19174
124 1 . 1 1 35 35 GLY CA C 35 46.897 46.897 46.657 0.240 19174
125 1 . 1 1 35 35 GLY H H 35 8.302 8.302 8.256 0.046 19174
126 1 . 1 1 36 36 LEU N N 36 121.632 121.632 122.345 -0.713 19174
127 1 . 1 1 36 36 LEU CA C 36 57.619 57.619 57.207 0.412 19174
128 1 . 1 1 36 36 LEU CB C 36 41.799 41.799 41.460 0.339 19174
129 1 . 1 1 36 36 LEU H H 36 8.194 8.194 7.441 0.753 19174
130 1 . 1 1 37 37 ARG N N 37 118.274 118.274 118.347 -0.073 19174
131 1 . 1 1 37 37 ARG CA C 37 59.049 59.049 59.582 -0.533 19174
132 1 . 1 1 37 37 ARG CB C 37 30.044 30.044 29.989 0.055 19174
133 1 . 1 1 37 37 ARG H H 37 7.934 7.934 7.570 0.364 19174
134 1 . 1 1 38 38 SER N N 38 114.239 114.239 115.300 -1.061 19174
135 1 . 1 1 38 38 SER CA C 38 60.531 60.531 61.183 -0.652 19174
136 1 . 1 1 38 38 SER CB C 38 63.509 63.509 62.998 0.511 19174
137 1 . 1 1 38 38 SER H H 38 7.913 7.913 7.718 0.195 19174
138 1 . 1 1 39 39 TRP N N 39 123.095 123.095 123.805 -0.710 19174
139 1 . 1 1 39 39 TRP CA C 39 59.870 59.870 59.146 0.723 19174
140 1 . 1 1 39 39 TRP CB C 39 28.721 28.721 28.801 -0.080 19174
141 1 . 1 1 39 39 TRP H H 39 8.108 8.108 8.658 -0.550 19174
142 1 . 1 1 40 40 LYS N N 40 119.629 119.629 119.176 0.453 19174
143 1 . 1 1 40 40 LYS CA C 40 59.525 59.525 59.740 -0.215 19174
144 1 . 1 1 40 40 LYS CB C 40 32.109 32.109 32.083 0.026 19174
145 1 . 1 1 40 40 LYS H H 40 7.938 7.938 7.889 0.049 19174
146 1 . 1 1 41 41 ARG N N 41 117.834 117.834 117.770 0.064 19174
147 1 . 1 1 41 41 ARG CA C 41 57.857 57.857 59.083 -1.226 19174
148 1 . 1 1 41 41 ARG CB C 41 30.203 30.203 29.979 0.224 19174
149 1 . 1 1 41 41 ARG H H 41 7.863 7.863 7.664 0.199 19174
150 1 . 1 1 42 42 HIS N N 42 115.774 115.774 117.489 -1.715 19174
151 1 . 1 1 42 42 HIS CA C 42 57.487 57.487 58.984 -1.496 19174
152 1 . 1 1 42 42 HIS CB C 42 30.786 30.786 29.947 0.839 19174
153 1 . 1 1 42 42 HIS H H 42 7.919 7.919 7.630 0.289 19174
154 1 . 1 1 43 43 LEU N N 43 120.243 120.243 119.773 0.470 19174
155 1 . 1 1 43 43 LEU CA C 43 56.745 56.745 55.307 1.438 19174
156 1 . 1 1 43 43 LEU CB C 43 42.276 42.276 41.652 0.624 19174
157 1 . 1 1 43 43 LEU H H 43 8.162 8.162 8.562 -0.400 19174
158 1 . 1 1 44 44 SER N N 44 114.616 114.616 116.488 -1.872 19174
159 1 . 1 1 44 44 SER CA C 44 60.987 60.987 62.396 -1.409 19174
160 1 . 1 1 44 44 SER CB C 44 62.768 62.768 62.647 0.121 19174
161 1 . 1 1 44 44 SER H H 44 8.033 8.033 8.160 -0.127 19174
162 1 . 1 1 45 45 ARG N N 45 120.757 120.757 121.226 -0.469 19174
163 1 . 1 1 45 45 ARG CA C 45 57.513 57.513 59.205 -1.692 19174
164 1 . 1 1 45 45 ARG CB C 45 29.462 29.462 29.910 -0.448 19174
165 1 . 1 1 45 45 ARG H H 45 7.763 7.763 8.088 -0.325 19174
166 1 . 1 1 46 46 PHE N N 46 118.237 118.237 117.879 0.358 19174
167 1 . 1 1 46 46 PHE CA C 46 59.155 59.155 60.867 -1.712 19174
168 1 . 1 1 46 46 PHE CB C 46 39.311 39.311 38.786 0.525 19174
169 1 . 1 1 46 46 PHE H H 46 7.673 7.673 8.022 -0.349 19174
170 1 . 1 1 47 47 TRP N N 47 118.484 118.484 121.079 -2.595 19174
171 1 . 1 1 47 47 TRP CA C 47 58.837 58.837 60.261 -1.424 19174
172 1 . 1 1 47 47 TRP CB C 47 29.833 29.833 29.778 0.055 19174
173 1 . 1 1 47 47 TRP H H 47 7.614 7.614 8.696 -1.082 19174
174 1 . 1 1 48 48 ASN N N 48 114.629 114.629 116.944 -2.315 19174
175 1 . 1 1 48 48 ASN CA C 48 54.124 54.124 55.047 -0.923 19174
176 1 . 1 1 48 48 ASN CB C 48 38.887 38.887 38.634 0.253 19174
177 1 . 1 1 48 48 ASN H H 48 7.811 7.811 8.199 -0.388 19174
178 1 . 1 1 49 49 ASP N N 49 118.029 118.029 119.531 -1.502 19174
179 1 . 1 1 49 49 ASP CA C 49 54.310 54.310 54.237 0.073 19174
180 1 . 1 1 49 49 ASP CB C 49 40.793 40.793 40.915 -0.122 19174
181 1 . 1 1 49 49 ASP H H 49 7.775 7.775 7.569 0.206 19174
stop_
save_