data_18327
save_entry_information
_Entry.Sf_category entry_information
_Entry.NMR_STAR_version 3.0.9.13
_Entry.Entry_ID 18327
_Entry.PDB_ID 2LQS
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 18327
_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 13 13 TYR HA H 13 5.560 5.560 4.705 0.855 18327
2 1 1 . 1 1 13 13 TYR CA C 13 55.860 55.860 57.645 -1.784 18327
3 1 1 . 1 1 13 13 TYR CB C 13 42.440 42.440 41.560 0.880 18327
4 1 1 . 1 1 14 14 GLY N N 14 105.400 105.400 107.149 -1.749 18327
5 1 1 . 1 1 14 14 GLY CA C 14 45.240 45.240 43.554 1.686 18327
6 1 1 . 1 1 14 14 GLY H H 14 8.406 8.406 8.529 -0.123 18327
7 1 1 . 1 1 15 15 VAL N N 15 118.900 118.900 120.210 -1.310 18327
8 1 1 . 1 1 15 15 VAL HA H 15 5.330 5.330 4.769 0.561 18327
9 1 1 . 1 1 15 15 VAL CA C 15 59.210 59.210 60.879 -1.669 18327
10 1 1 . 1 1 15 15 VAL CB C 15 35.740 35.740 36.425 -0.685 18327
11 1 1 . 1 1 15 15 VAL H H 15 8.854 8.854 8.560 0.294 18327
12 1 1 . 1 1 16 16 ALA N N 16 129.400 129.400 127.809 1.591 18327
13 1 1 . 1 1 16 16 ALA HA H 16 5.000 5.000 5.079 -0.079 18327
14 1 1 . 1 1 16 16 ALA CA C 16 52.000 52.000 50.735 1.265 18327
15 1 1 . 1 1 16 16 ALA CB C 16 19.330 19.330 21.061 -1.731 18327
16 1 1 . 1 1 16 16 ALA H H 16 9.112 9.112 9.132 -0.020 18327
17 1 1 . 1 1 17 17 PHE N N 17 123.900 123.900 124.023 -0.123 18327
18 1 1 . 1 1 17 17 PHE HA H 17 4.740 4.740 4.763 -0.023 18327
19 1 1 . 1 1 17 17 PHE CA C 17 56.230 56.230 57.392 -1.162 18327
20 1 1 . 1 1 17 17 PHE CB C 17 40.000 40.000 40.514 -0.514 18327
21 1 1 . 1 1 17 17 PHE H H 17 8.785 8.785 8.310 0.475 18327
22 1 1 . 1 1 18 18 TYR N N 18 118.100 118.100 118.592 -0.492 18327
23 1 1 . 1 1 18 18 TYR HA H 18 4.490 4.490 4.506 -0.016 18327
24 1 1 . 1 1 18 18 TYR CA C 18 55.300 55.300 57.719 -2.419 18327
25 1 1 . 1 1 18 18 TYR CB C 18 42.810 42.810 42.094 0.716 18327
26 1 1 . 1 1 18 18 TYR H H 18 7.288 7.288 7.635 -0.347 18327
27 1 1 . 1 1 19 19 ASN N N 19 116.800 116.800 121.193 -4.393 18327
28 1 1 . 1 1 19 19 ASN HA H 19 4.710 4.710 4.764 -0.054 18327
29 1 1 . 1 1 19 19 ASN CA C 19 52.940 52.940 53.139 -0.199 18327
30 1 1 . 1 1 19 19 ASN CB C 19 39.060 39.060 39.206 -0.146 18327
31 1 1 . 1 1 19 19 ASN H H 19 8.122 8.122 8.454 -0.332 18327
32 1 1 . 1 1 20 20 TYR N N 20 122.000 122.000 124.970 -2.970 18327
33 1 1 . 1 1 20 20 TYR HA H 20 4.710 4.710 4.545 0.165 18327
34 1 1 . 1 1 20 20 TYR CA C 20 57.720 57.720 57.970 -0.250 18327
35 1 1 . 1 1 20 20 TYR CB C 20 42.250 42.250 42.670 -0.421 18327
36 1 1 . 1 1 20 20 TYR H H 20 8.994 8.994 8.634 0.360 18327
37 1 1 . 1 1 21 21 ASP N N 21 128.500 128.500 120.306 8.194 18327
38 1 1 . 1 1 21 21 ASP HA H 21 4.790 4.790 4.813 -0.023 18327
39 1 1 . 1 1 21 21 ASP CA C 21 52.370 52.370 52.180 0.190 18327
40 1 1 . 1 1 21 21 ASP CB C 21 41.130 41.130 43.301 -2.171 18327
41 1 1 . 1 1 21 21 ASP H H 21 7.839 7.839 7.787 0.052 18327
42 1 1 . 1 1 22 22 ALA N N 22 125.200 125.200 121.141 4.059 18327
43 1 1 . 1 1 22 22 ALA HA H 22 4.050 4.050 4.509 -0.459 18327
44 1 1 . 1 1 22 22 ALA CA C 22 52.940 52.940 52.644 0.296 18327
45 1 1 . 1 1 22 22 ALA CB C 22 20.450 20.450 19.646 0.804 18327
46 1 1 . 1 1 22 22 ALA H H 22 8.107 8.107 8.482 -0.375 18327
47 1 1 . 1 1 23 23 ARG N N 23 122.200 122.200 120.548 1.652 18327
48 1 1 . 1 1 23 23 ARG HA H 23 4.350 4.350 4.463 -0.113 18327
49 1 1 . 1 1 23 23 ARG CA C 23 55.490 55.490 55.712 -0.221 18327
50 1 1 . 1 1 23 23 ARG CB C 23 30.700 30.700 31.494 -0.794 18327
51 1 1 . 1 1 23 23 ARG H H 23 8.889 8.889 8.610 0.279 18327
52 1 1 . 1 1 24 24 GLY N N 24 105.200 105.200 107.478 -2.278 18327
53 1 1 . 1 1 24 24 GLY CA C 24 44.500 44.500 44.740 -0.241 18327
54 1 1 . 1 1 24 24 GLY H H 24 7.267 7.267 7.612 -0.345 18327
55 1 1 . 1 1 25 25 ALA N N 25 122.200 122.200 121.375 0.825 18327
56 1 1 . 1 1 25 25 ALA HA H 25 4.160 4.160 4.407 -0.247 18327
57 1 1 . 1 1 25 25 ALA CA C 25 54.440 54.440 53.972 0.468 18327
58 1 1 . 1 1 25 25 ALA CB C 25 18.770 18.770 19.185 -0.415 18327
59 1 1 . 1 1 25 25 ALA H H 25 8.621 8.621 8.432 0.189 18327
60 1 1 . 1 1 26 26 ASP N N 26 114.700 114.700 118.054 -3.354 18327
61 1 1 . 1 1 26 26 ASP HA H 26 4.700 4.700 4.726 -0.026 18327
62 1 1 . 1 1 26 26 ASP CA C 26 53.870 53.870 53.500 0.370 18327
63 1 1 . 1 1 26 26 ASP CB C 26 40.390 40.390 40.808 -0.418 18327
64 1 1 . 1 1 26 26 ASP H H 26 8.949 8.949 8.396 0.553 18327
65 1 1 . 1 1 27 27 GLU N N 27 118.800 118.800 120.453 -1.653 18327
66 1 1 . 1 1 27 27 GLU HA H 27 5.220 5.220 4.596 0.624 18327
67 1 1 . 1 1 27 27 GLU CA C 27 54.930 54.930 55.756 -0.826 18327
68 1 1 . 1 1 27 27 GLU CB C 27 32.880 32.880 31.870 1.010 18327
69 1 1 . 1 1 27 27 GLU H H 27 7.542 7.542 7.521 0.021 18327
70 1 1 . 1 1 28 28 LEU N N 28 121.400 121.400 119.292 2.108 18327
71 1 1 . 1 1 28 28 LEU HA H 28 4.760 4.760 4.761 -0.001 18327
72 1 1 . 1 1 28 28 LEU CA C 28 53.120 53.120 54.132 -1.012 18327
73 1 1 . 1 1 28 28 LEU CB C 28 44.500 44.500 46.169 -1.669 18327
74 1 1 . 1 1 28 28 LEU H H 28 8.897 8.897 8.260 0.637 18327
75 1 1 . 1 1 29 29 SER N N 29 115.700 115.700 117.849 -2.149 18327
76 1 1 . 1 1 29 29 SER HA H 29 5.030 5.030 5.184 -0.154 18327
77 1 1 . 1 1 29 29 SER CA C 29 58.470 58.470 58.703 -0.233 18327
78 1 1 . 1 1 29 29 SER CB C 29 63.690 63.690 64.251 -0.561 18327
79 1 1 . 1 1 29 29 SER H H 29 7.949 7.949 8.370 -0.421 18327
80 1 1 . 1 1 30 30 LEU N N 30 121.300 121.300 120.349 0.951 18327
81 1 1 . 1 1 30 30 LEU HA H 30 4.800 4.800 4.556 0.244 18327
82 1 1 . 1 1 30 30 LEU CA C 30 52.940 52.940 55.482 -2.542 18327
83 1 1 . 1 1 30 30 LEU CB C 30 46.370 46.370 46.145 0.225 18327
84 1 1 . 1 1 30 30 LEU H H 30 9.503 9.503 8.570 0.933 18327
85 1 1 . 1 1 31 31 GLN N N 31 123.100 123.100 120.565 2.535 18327
86 1 1 . 1 1 31 31 GLN HA H 31 5.070 5.070 4.619 0.451 18327
87 1 1 . 1 1 31 31 GLN CA C 31 52.940 52.940 53.906 -0.966 18327
88 1 1 . 1 1 31 31 GLN CB C 31 31.190 31.190 32.043 -0.853 18327
89 1 1 . 1 1 31 31 GLN H H 31 9.152 9.152 8.279 0.873 18327
90 1 1 . 1 1 32 32 ILE N N 32 120.800 120.800 120.379 0.421 18327
91 1 1 . 1 1 32 32 ILE HA H 32 3.030 3.030 3.858 -0.828 18327
92 1 1 . 1 1 32 32 ILE CA C 32 64.250 64.250 61.721 2.529 18327
93 1 1 . 1 1 32 32 ILE CB C 32 37.940 37.940 37.362 0.578 18327
94 1 1 . 1 1 32 32 ILE H H 32 8.019 8.019 8.419 -0.400 18327
95 1 1 . 1 1 33 33 GLY N N 33 115.700 115.700 113.874 1.826 18327
96 1 1 . 1 1 33 33 GLY CA C 33 44.500 44.500 45.050 -0.550 18327
97 1 1 . 1 1 33 33 GLY H H 33 8.777 8.777 8.666 0.111 18327
98 1 1 . 1 1 34 34 ASP N N 34 122.300 122.300 121.364 0.936 18327
99 1 1 . 1 1 34 34 ASP HA H 34 4.640 4.640 4.983 -0.343 18327
100 1 1 . 1 1 34 34 ASP CA C 34 55.860 55.860 53.655 2.205 18327
101 1 1 . 1 1 34 34 ASP CB C 34 41.310 41.310 42.450 -1.140 18327
102 1 1 . 1 1 34 34 ASP H H 34 8.690 8.690 7.573 1.117 18327
103 1 1 . 1 1 35 35 THR N N 35 117.900 117.900 116.281 1.619 18327
104 1 1 . 1 1 35 35 THR HA H 35 5.160 5.160 5.091 0.069 18327
105 1 1 . 1 1 35 35 THR CA C 35 61.450 61.450 61.581 -0.131 18327
106 1 1 . 1 1 35 35 THR CB C 35 69.090 69.090 70.932 -1.842 18327
107 1 1 . 1 1 35 35 THR H H 35 8.389 8.389 8.387 0.002 18327
108 1 1 . 1 1 36 36 VAL N N 36 118.200 118.200 116.761 1.439 18327
109 1 1 . 1 1 36 36 VAL HA H 36 5.100 5.100 4.855 0.245 18327
110 1 1 . 1 1 36 36 VAL CA C 36 57.910 57.910 59.873 -1.963 18327
111 1 1 . 1 1 36 36 VAL CB C 36 34.190 34.190 34.628 -0.438 18327
112 1 1 . 1 1 36 36 VAL H H 36 9.019 9.019 9.003 0.016 18327
113 1 1 . 1 1 37 37 HIS N N 37 122.100 122.100 119.769 2.331 18327
114 1 1 . 1 1 37 37 HIS HA H 37 4.840 4.840 4.567 0.273 18327
115 1 1 . 1 1 37 37 HIS CA C 37 52.560 52.560 54.037 -1.477 18327
116 1 1 . 1 1 37 37 HIS CB C 37 31.260 31.260 32.420 -1.160 18327
117 1 1 . 1 1 37 37 HIS H H 37 8.489 8.489 8.001 0.488 18327
118 1 1 . 1 1 38 38 ILE N N 38 126.400 126.400 124.462 1.938 18327
119 1 1 . 1 1 38 38 ILE HA H 38 3.780 3.780 4.311 -0.531 18327
120 1 1 . 1 1 38 38 ILE CA C 38 61.640 61.640 61.320 0.320 18327
121 1 1 . 1 1 38 38 ILE CB C 38 38.880 38.880 38.942 -0.062 18327
122 1 1 . 1 1 38 38 ILE H H 38 8.636 8.636 8.404 0.232 18327
123 1 1 . 1 1 39 39 LEU N N 39 126.000 126.000 121.915 4.085 18327
124 1 1 . 1 1 39 39 LEU HA H 39 4.400 4.400 4.735 -0.335 18327
125 1 1 . 1 1 39 39 LEU CA C 39 55.490 55.490 55.358 0.132 18327
126 1 1 . 1 1 39 39 LEU CB C 39 43.750 43.750 44.898 -1.148 18327
127 1 1 . 1 1 39 39 LEU H H 39 9.162 9.162 8.579 0.583 18327
128 1 1 . 1 1 40 40 GLU N N 40 115.100 115.100 117.513 -2.413 18327
129 1 1 . 1 1 40 40 GLU HA H 40 7.895 7.895 4.803 3.092 18327
130 1 1 . 1 1 41 41 THR N N 41 116.400 116.400 108.013 8.387 18327
131 1 1 . 1 1 41 41 THR HA H 41 4.270 4.270 4.672 -0.402 18327
132 1 1 . 1 1 41 41 THR CA C 41 60.890 60.890 60.593 0.297 18327
133 1 1 . 1 1 41 41 THR CB C 41 69.650 69.650 71.545 -1.895 18327
134 1 1 . 1 1 41 41 THR H H 41 8.162 8.162 8.340 -0.178 18327
135 1 1 . 1 1 43 43 GLU N N 43 123.300 123.300 121.371 1.929 18327
136 1 1 . 1 1 43 43 GLU HA H 43 4.270 4.270 4.388 -0.118 18327
137 1 1 . 1 1 43 43 GLU CA C 43 57.350 57.350 54.860 2.490 18327
138 1 1 . 1 1 43 43 GLU CB C 43 26.790 26.790 29.454 -2.664 18327
139 1 1 . 1 1 43 43 GLU H H 43 8.108 8.108 8.391 -0.283 18327
140 1 1 . 1 1 44 44 GLY CA C 44 45.440 45.440 45.200 0.240 18327
141 1 1 . 1 1 45 45 TRP N N 45 124.100 124.100 119.364 4.736 18327
142 1 1 . 1 1 45 45 TRP HA H 45 4.690 4.690 4.513 0.177 18327
143 1 1 . 1 1 45 45 TRP H H 45 8.590 8.590 7.214 1.376 18327
144 1 1 . 1 1 46 46 TYR HA H 46 5.600 5.600 4.514 1.086 18327
145 1 1 . 1 1 46 46 TYR CA C 46 54.060 54.060 56.882 -2.822 18327
146 1 1 . 1 1 46 46 TYR CB C 46 42.060 42.060 39.607 2.453 18327
147 1 1 . 1 1 47 47 ARG N N 47 118.100 118.100 122.384 -4.284 18327
148 1 1 . 1 1 47 47 ARG HA H 47 5.070 5.070 4.498 0.572 18327
149 1 1 . 1 1 47 47 ARG CA C 47 54.060 54.060 54.266 -0.206 18327
150 1 1 . 1 1 47 47 ARG CB C 47 33.250 33.250 34.471 -1.221 18327
151 1 1 . 1 1 47 47 ARG H H 47 8.495 8.495 8.928 -0.433 18327
152 1 1 . 1 1 48 48 GLY N N 48 114.000 114.000 112.039 1.961 18327
153 1 1 . 1 1 48 48 GLY CA C 48 46.560 46.560 46.286 0.274 18327
154 1 1 . 1 1 48 48 GLY H H 48 9.183 9.183 8.838 0.345 18327
155 1 1 . 1 1 49 49 TYR N N 49 116.200 116.200 117.182 -0.982 18327
156 1 1 . 1 1 49 49 TYR HA H 49 5.380 5.380 5.096 0.284 18327
157 1 1 . 1 1 49 49 TYR CA C 49 55.110 55.110 56.904 -1.794 18327
158 1 1 . 1 1 49 49 TYR CB C 49 40.750 40.750 39.897 0.853 18327
159 1 1 . 1 1 49 49 TYR H H 49 8.199 8.199 8.314 -0.115 18327
160 1 1 . 1 1 50 50 THR N N 50 112.200 112.200 112.313 -0.113 18327
161 1 1 . 1 1 50 50 THR HA H 50 5.120 5.120 4.127 0.993 18327
162 1 1 . 1 1 50 50 THR CA C 50 59.770 59.770 61.378 -1.608 18327
163 1 1 . 1 1 50 50 THR CB C 50 69.460 69.460 69.893 -0.433 18327
164 1 1 . 1 1 50 50 THR H H 50 9.436 9.436 8.630 0.806 18327
165 1 1 . 1 1 51 51 LEU N N 51 121.300 121.300 119.398 1.902 18327
166 1 1 . 1 1 51 51 LEU HA H 51 4.230 4.230 4.390 -0.160 18327
167 1 1 . 1 1 51 51 LEU CA C 51 56.790 56.790 56.297 0.493 18327
168 1 1 . 1 1 51 51 LEU CB C 51 40.000 40.000 42.174 -2.174 18327
169 1 1 . 1 1 51 51 LEU H H 51 8.313 8.313 8.029 0.284 18327
170 1 1 . 1 1 52 52 ARG N N 52 116.600 116.600 117.881 -1.281 18327
171 1 1 . 1 1 52 52 ARG HA H 52 4.250 4.250 4.147 0.103 18327
172 1 1 . 1 1 52 52 ARG CA C 52 57.350 57.350 57.097 0.253 18327
173 1 1 . 1 1 52 52 ARG CB C 52 30.510 30.510 30.485 0.025 18327
174 1 1 . 1 1 52 52 ARG H H 52 8.053 8.053 8.286 -0.233 18327
175 1 1 . 1 1 53 53 LYS N N 53 122.600 122.600 118.345 4.255 18327
176 1 1 . 1 1 53 53 LYS HA H 53 4.620 4.620 4.505 0.115 18327
177 1 1 . 1 1 53 53 LYS CA C 53 54.620 54.620 55.727 -1.107 18327
178 1 1 . 1 1 53 53 LYS CB C 53 32.310 32.310 33.818 -1.508 18327
179 1 1 . 1 1 53 53 LYS H H 53 7.655 7.655 7.472 0.183 18327
180 1 1 . 1 1 54 54 LYS N N 54 124.900 124.900 124.931 -0.031 18327
181 1 1 . 1 1 54 54 LYS HA H 54 4.090 4.090 4.203 -0.113 18327
182 1 1 . 1 1 54 54 LYS CA C 54 58.470 58.470 58.877 -0.407 18327
183 1 1 . 1 1 54 54 LYS CB C 54 32.130 32.130 32.952 -0.822 18327
184 1 1 . 1 1 54 54 LYS H H 54 8.499 8.499 8.723 -0.224 18327
185 1 1 . 1 1 55 55 SER N N 55 110.100 110.100 112.979 -2.879 18327
186 1 1 . 1 1 55 55 SER HA H 55 4.140 4.140 4.313 -0.173 18327
187 1 1 . 1 1 55 55 SER CA C 55 58.470 58.470 59.791 -1.321 18327
188 1 1 . 1 1 55 55 SER CB C 55 63.310 63.310 63.118 0.192 18327
189 1 1 . 1 1 55 55 SER H H 55 7.862 7.862 7.940 -0.078 18327
190 1 1 . 1 1 56 56 LYS N N 56 124.000 124.000 122.949 1.051 18327
191 1 1 . 1 1 56 56 LYS HA H 56 4.700 4.700 4.442 0.258 18327
192 1 1 . 1 1 56 56 LYS CA C 56 54.810 54.810 54.636 0.174 18327
193 1 1 . 1 1 56 56 LYS CB C 56 33.250 33.250 31.318 1.932 18327
194 1 1 . 1 1 56 56 LYS H H 56 7.481 7.481 8.015 -0.534 18327
195 1 1 . 1 1 57 57 LYS N N 57 125.700 125.700 121.044 4.656 18327
196 1 1 . 1 1 57 57 LYS HA H 57 5.330 5.330 4.324 1.006 18327
197 1 1 . 1 1 57 57 LYS CA C 57 54.620 54.620 56.662 -2.042 18327
198 1 1 . 1 1 57 57 LYS CB C 57 34.240 34.240 33.570 0.670 18327
199 1 1 . 1 1 57 57 LYS H H 57 8.475 8.475 7.588 0.887 18327
200 1 1 . 1 1 58 58 GLY N N 58 109.400 109.400 107.040 2.360 18327
201 1 1 . 1 1 58 58 GLY CA C 58 45.620 45.620 45.443 0.177 18327
202 1 1 . 1 1 58 58 GLY H H 58 9.073 9.073 8.745 0.328 18327
203 1 1 . 1 1 59 59 ILE N N 59 113.900 113.900 119.651 -5.751 18327
204 1 1 . 1 1 59 59 ILE HA H 59 6.000 6.000 4.761 1.239 18327
205 1 1 . 1 1 59 59 ILE CA C 59 59.590 59.590 60.486 -0.896 18327
206 1 1 . 1 1 59 59 ILE CB C 59 41.140 41.140 42.065 -0.925 18327
207 1 1 . 1 1 59 59 ILE H H 59 8.628 8.628 8.367 0.261 18327
208 1 1 . 1 1 60 60 PHE N N 60 116.900 116.900 116.068 0.832 18327
209 1 1 . 1 1 60 60 PHE HA H 60 5.120 5.120 5.166 -0.046 18327
210 1 1 . 1 1 60 60 PHE CA C 60 54.060 54.060 54.909 -0.849 18327
211 1 1 . 1 1 60 60 PHE CB C 60 37.190 37.190 40.663 -3.473 18327
212 1 1 . 1 1 60 60 PHE H H 60 8.724 8.724 8.669 0.055 18327
213 1 1 . 1 1 61 61 PRO HA H 61 3.480 3.480 3.605 -0.125 18327
214 1 1 . 1 1 61 61 PRO CA C 61 62.200 62.200 62.460 -0.260 18327
215 1 1 . 1 1 61 61 PRO CB C 61 31.190 31.190 31.777 -0.587 18327
216 1 1 . 1 1 62 62 ALA N N 62 124.600 124.600 128.609 -4.009 18327
217 1 1 . 1 1 62 62 ALA HA H 62 3.720 3.720 4.072 -0.352 18327
218 1 1 . 1 1 62 62 ALA CA C 62 54.370 54.370 54.827 -0.457 18327
219 1 1 . 1 1 62 62 ALA CB C 62 17.650 17.650 17.689 -0.039 18327
220 1 1 . 1 1 62 62 ALA H H 62 7.898 7.898 8.290 -0.392 18327
221 1 1 . 1 1 63 63 SER N N 63 109.700 109.700 111.957 -2.257 18327
222 1 1 . 1 1 63 63 SER HA H 63 4.200 4.200 4.073 0.127 18327
223 1 1 . 1 1 63 63 SER CA C 63 59.400 59.400 60.086 -0.686 18327
224 1 1 . 1 1 63 63 SER CB C 63 62.380 62.380 62.806 -0.426 18327
225 1 1 . 1 1 63 63 SER H H 63 8.030 8.030 7.985 0.045 18327
226 1 1 . 1 1 64 64 TYR N N 64 120.300 120.300 117.865 2.435 18327
227 1 1 . 1 1 64 64 TYR HA H 64 4.260 4.260 4.739 -0.479 18327
228 1 1 . 1 1 64 64 TYR CA C 64 57.720 57.720 56.908 0.812 18327
229 1 1 . 1 1 64 64 TYR CB C 64 37.560 37.560 37.536 0.024 18327
230 1 1 . 1 1 64 64 TYR H H 64 7.124 7.124 7.114 0.010 18327
231 1 1 . 1 1 65 65 ILE N N 65 118.000 118.000 118.353 -0.353 18327
232 1 1 . 1 1 65 65 ILE HA H 65 4.830 4.830 5.312 -0.482 18327
233 1 1 . 1 1 65 65 ILE CA C 65 56.980 56.980 59.048 -2.068 18327
234 1 1 . 1 1 65 65 ILE CB C 65 39.630 39.630 42.676 -3.046 18327
235 1 1 . 1 1 65 65 ILE H H 65 7.671 7.671 7.665 0.006 18327
236 1 1 . 1 1 66 66 HIS N N 66 124.500 124.500 121.589 2.911 18327
237 1 1 . 1 1 66 66 HIS HA H 66 5.130 5.130 4.824 0.306 18327
238 1 1 . 1 1 66 66 HIS CA C 66 53.060 53.060 55.093 -2.033 18327
239 1 1 . 1 1 66 66 HIS CB C 66 30.510 30.510 33.798 -3.288 18327
240 1 1 . 1 1 66 66 HIS H H 66 9.159 9.159 9.131 0.028 18327
241 1 1 . 1 1 67 67 LEU N N 67 127.400 127.400 125.556 1.844 18327
242 1 1 . 1 1 67 67 LEU HA H 67 4.560 4.560 4.637 -0.077 18327
243 1 1 . 1 1 67 67 LEU CA C 67 55.300 55.300 55.559 -0.259 18327
244 1 1 . 1 1 67 67 LEU CB C 67 42.060 42.060 42.250 -0.190 18327
245 1 1 . 1 1 67 67 LEU H H 67 8.979 8.979 8.430 0.549 18327
246 1 1 . 1 1 68 68 LYS N N 68 121.900 121.900 120.587 1.313 18327
247 1 1 . 1 1 68 68 LYS HA H 68 4.490 4.490 4.539 -0.049 18327
248 1 1 . 1 1 68 68 LYS CA C 68 55.110 55.110 55.385 -0.275 18327
249 1 1 . 1 1 68 68 LYS CB C 68 34.610 34.610 34.011 0.599 18327
250 1 1 . 1 1 68 68 LYS H H 68 8.499 8.499 8.868 -0.369 18327
251 1 1 . 1 1 69 69 GLU N N 69 122.100 122.100 116.482 5.618 18327
252 1 1 . 1 1 69 69 GLU HA H 69 4.290 4.290 3.997 0.293 18327
253 1 1 . 1 1 69 69 GLU CA C 69 56.610 56.610 57.513 -0.903 18327
254 1 1 . 1 1 69 69 GLU CB C 69 30.330 30.330 29.949 0.381 18327
255 1 1 . 1 1 69 69 GLU H H 69 8.569 8.569 8.183 0.386 18327
256 1 1 . 1 1 70 70 ALA N N 70 123.300 123.300 123.695 -0.395 18327
257 1 1 . 1 1 70 70 ALA HA H 70 4.210 4.210 4.674 -0.464 18327
258 1 1 . 1 1 70 70 ALA CA C 70 51.810 51.810 51.396 0.414 18327
259 1 1 . 1 1 70 70 ALA CB C 70 19.700 19.700 19.069 0.631 18327
260 1 1 . 1 1 70 70 ALA H H 70 8.181 8.181 8.317 -0.136 18327
261 1 1 . 1 1 71 71 ILE N N 71 120.000 120.000 122.799 -2.799 18327
262 1 1 . 1 1 71 71 ILE HA H 71 4.070 4.070 4.101 -0.031 18327
263 1 1 . 1 1 71 71 ILE CA C 71 60.330 60.330 61.034 -0.704 18327
264 1 1 . 1 1 71 71 ILE CB C 71 38.690 38.690 38.461 0.229 18327
265 1 1 . 1 1 71 71 ILE H H 71 7.789 7.789 7.372 0.417 18327
266 1 1 . 1 1 72 72 VAL N N 72 124.400 124.400 122.994 1.406 18327
267 1 1 . 1 1 72 72 VAL HA H 72 4.070 4.070 4.240 -0.170 18327
268 1 1 . 1 1 72 72 VAL CA C 72 61.640 61.640 61.801 -0.161 18327
269 1 1 . 1 1 72 72 VAL CB C 72 32.690 32.690 32.568 0.122 18327
270 1 1 . 1 1 72 72 VAL H H 72 8.089 8.089 7.876 0.213 18327
271 1 1 . 1 1 73 73 GLU N N 73 125.940 125.940 122.367 3.573 18327
272 1 1 . 1 1 73 73 GLU HA H 73 4.300 4.300 4.507 -0.207 18327
273 1 1 . 1 1 73 73 GLU CA C 73 56.610 56.610 55.636 0.974 18327
274 1 1 . 1 1 73 73 GLU CB C 73 30.710 30.710 31.459 -0.749 18327
275 1 1 . 1 1 73 73 GLU H H 73 8.464 8.464 8.303 0.161 18327
276 1 2 . 1 1 13 13 TYR HA H 13 5.560 5.560 4.761 0.799 18327
277 1 2 . 1 1 13 13 TYR CA C 13 55.860 55.860 56.423 -0.563 18327
278 1 2 . 1 1 13 13 TYR CB C 13 42.440 42.440 41.127 1.313 18327
279 1 2 . 1 1 14 14 GLY N N 14 105.400 105.400 106.191 -0.791 18327
280 1 2 . 1 1 14 14 GLY CA C 14 45.240 45.240 43.819 1.421 18327
281 1 2 . 1 1 14 14 GLY H H 14 8.406 8.406 8.541 -0.135 18327
282 1 2 . 1 1 15 15 VAL N N 15 118.900 118.900 121.135 -2.235 18327
283 1 2 . 1 1 15 15 VAL HA H 15 5.330 5.330 4.929 0.401 18327
284 1 2 . 1 1 15 15 VAL CA C 15 59.210 59.210 59.116 0.094 18327
285 1 2 . 1 1 15 15 VAL CB C 15 35.740 35.740 35.510 0.230 18327
286 1 2 . 1 1 15 15 VAL H H 15 8.854 8.854 8.781 0.073 18327
287 1 2 . 1 1 16 16 ALA N N 16 129.400 129.400 128.076 1.324 18327
288 1 2 . 1 1 16 16 ALA HA H 16 5.000 5.000 4.836 0.164 18327
289 1 2 . 1 1 16 16 ALA CA C 16 52.000 52.000 50.882 1.118 18327
290 1 2 . 1 1 16 16 ALA CB C 16 19.330 19.330 20.096 -0.766 18327
291 1 2 . 1 1 16 16 ALA H H 16 9.112 9.112 9.052 0.060 18327
292 1 2 . 1 1 17 17 PHE N N 17 123.900 123.900 125.586 -1.686 18327
293 1 2 . 1 1 17 17 PHE HA H 17 4.740 4.740 4.699 0.041 18327
294 1 2 . 1 1 17 17 PHE CA C 17 56.230 56.230 56.984 -0.754 18327
295 1 2 . 1 1 17 17 PHE CB C 17 40.000 40.000 39.790 0.210 18327
296 1 2 . 1 1 17 17 PHE H H 17 8.785 8.785 8.016 0.769 18327
297 1 2 . 1 1 18 18 TYR N N 18 118.100 118.100 118.048 0.052 18327
298 1 2 . 1 1 18 18 TYR HA H 18 4.490 4.490 4.351 0.139 18327
299 1 2 . 1 1 18 18 TYR CA C 18 55.300 55.300 57.809 -2.509 18327
300 1 2 . 1 1 18 18 TYR CB C 18 42.810 42.810 42.401 0.409 18327
301 1 2 . 1 1 18 18 TYR H H 18 7.288 7.288 7.565 -0.277 18327
302 1 2 . 1 1 19 19 ASN N N 19 116.800 116.800 119.509 -2.709 18327
303 1 2 . 1 1 19 19 ASN HA H 19 4.710 4.710 4.726 -0.016 18327
304 1 2 . 1 1 19 19 ASN CA C 19 52.940 52.940 53.234 -0.294 18327
305 1 2 . 1 1 19 19 ASN CB C 19 39.060 39.060 39.345 -0.285 18327
306 1 2 . 1 1 19 19 ASN H H 19 8.122 8.122 8.559 -0.437 18327
307 1 2 . 1 1 20 20 TYR N N 20 122.000 122.000 122.123 -0.123 18327
308 1 2 . 1 1 20 20 TYR HA H 20 4.710 4.710 4.720 -0.010 18327
309 1 2 . 1 1 20 20 TYR CA C 20 57.720 57.720 57.859 -0.139 18327
310 1 2 . 1 1 20 20 TYR CB C 20 42.250 42.250 43.020 -0.770 18327
311 1 2 . 1 1 20 20 TYR H H 20 8.994 8.994 8.428 0.566 18327
312 1 2 . 1 1 21 21 ASP N N 21 128.500 128.500 121.719 6.781 18327
313 1 2 . 1 1 21 21 ASP HA H 21 4.790 4.790 4.924 -0.134 18327
314 1 2 . 1 1 21 21 ASP CA C 21 52.370 52.370 51.876 0.494 18327
315 1 2 . 1 1 21 21 ASP CB C 21 41.130 41.130 43.823 -2.693 18327
316 1 2 . 1 1 21 21 ASP H H 21 7.839 7.839 7.767 0.072 18327
317 1 2 . 1 1 22 22 ALA N N 22 125.200 125.200 124.861 0.339 18327
318 1 2 . 1 1 22 22 ALA HA H 22 4.050 4.050 4.370 -0.320 18327
319 1 2 . 1 1 22 22 ALA CA C 22 52.940 52.940 53.123 -0.183 18327
320 1 2 . 1 1 22 22 ALA CB C 22 20.450 20.450 19.435 1.015 18327
321 1 2 . 1 1 22 22 ALA H H 22 8.107 8.107 8.205 -0.098 18327
322 1 2 . 1 1 23 23 ARG N N 23 122.200 122.200 121.668 0.532 18327
323 1 2 . 1 1 23 23 ARG HA H 23 4.350 4.350 4.162 0.188 18327
324 1 2 . 1 1 23 23 ARG CA C 23 55.490 55.490 57.324 -1.834 18327
325 1 2 . 1 1 23 23 ARG CB C 23 30.700 30.700 30.853 -0.153 18327
326 1 2 . 1 1 23 23 ARG H H 23 8.889 8.889 8.761 0.128 18327
327 1 2 . 1 1 24 24 GLY N N 24 105.200 105.200 104.409 0.791 18327
328 1 2 . 1 1 24 24 GLY CA C 24 44.500 44.500 44.654 -0.154 18327
329 1 2 . 1 1 24 24 GLY H H 24 7.267 7.267 7.605 -0.338 18327
330 1 2 . 1 1 25 25 ALA N N 25 122.200 122.200 121.157 1.043 18327
331 1 2 . 1 1 25 25 ALA HA H 25 4.160 4.160 4.258 -0.098 18327
332 1 2 . 1 1 25 25 ALA CA C 25 54.440 54.440 53.954 0.486 18327
333 1 2 . 1 1 25 25 ALA CB C 25 18.770 18.770 19.155 -0.385 18327
334 1 2 . 1 1 25 25 ALA H H 25 8.621 8.621 8.294 0.327 18327
335 1 2 . 1 1 26 26 ASP N N 26 114.700 114.700 118.575 -3.875 18327
336 1 2 . 1 1 26 26 ASP HA H 26 4.700 4.700 4.708 -0.008 18327
337 1 2 . 1 1 26 26 ASP CA C 26 53.870 53.870 54.176 -0.306 18327
338 1 2 . 1 1 26 26 ASP CB C 26 40.390 40.390 40.825 -0.435 18327
339 1 2 . 1 1 26 26 ASP H H 26 8.949 8.949 8.456 0.493 18327
340 1 2 . 1 1 27 27 GLU N N 27 118.800 118.800 118.333 0.467 18327
341 1 2 . 1 1 27 27 GLU HA H 27 5.220 5.220 4.881 0.339 18327
342 1 2 . 1 1 27 27 GLU CA C 27 54.930 54.930 54.595 0.335 18327
343 1 2 . 1 1 27 27 GLU CB C 27 32.880 32.880 32.484 0.396 18327
344 1 2 . 1 1 27 27 GLU H H 27 7.542 7.542 7.639 -0.097 18327
345 1 2 . 1 1 28 28 LEU N N 28 121.400 121.400 121.040 0.360 18327
346 1 2 . 1 1 28 28 LEU HA H 28 4.760 4.760 4.734 0.026 18327
347 1 2 . 1 1 28 28 LEU CA C 28 53.120 53.120 54.346 -1.226 18327
348 1 2 . 1 1 28 28 LEU CB C 28 44.500 44.500 45.422 -0.922 18327
349 1 2 . 1 1 28 28 LEU H H 28 8.897 8.897 8.244 0.653 18327
350 1 2 . 1 1 29 29 SER N N 29 115.700 115.700 119.392 -3.692 18327
351 1 2 . 1 1 29 29 SER HA H 29 5.030 5.030 4.710 0.320 18327
352 1 2 . 1 1 29 29 SER CA C 29 58.470 58.470 59.227 -0.757 18327
353 1 2 . 1 1 29 29 SER CB C 29 63.690 63.690 63.887 -0.197 18327
354 1 2 . 1 1 29 29 SER H H 29 7.949 7.949 8.514 -0.565 18327
355 1 2 . 1 1 30 30 LEU N N 30 121.300 121.300 120.376 0.924 18327
356 1 2 . 1 1 30 30 LEU HA H 30 4.800 4.800 4.787 0.013 18327
357 1 2 . 1 1 30 30 LEU CA C 30 52.940 52.940 55.014 -2.074 18327
358 1 2 . 1 1 30 30 LEU CB C 30 46.370 46.370 45.514 0.856 18327
359 1 2 . 1 1 30 30 LEU H H 30 9.503 9.503 8.593 0.910 18327
360 1 2 . 1 1 31 31 GLN N N 31 123.100 123.100 121.459 1.641 18327
361 1 2 . 1 1 31 31 GLN HA H 31 5.070 5.070 4.793 0.277 18327
362 1 2 . 1 1 31 31 GLN CA C 31 52.940 52.940 54.544 -1.604 18327
363 1 2 . 1 1 31 31 GLN CB C 31 31.190 31.190 32.554 -1.364 18327
364 1 2 . 1 1 31 31 GLN H H 31 9.152 9.152 8.389 0.763 18327
365 1 2 . 1 1 32 32 ILE N N 32 120.800 120.800 120.689 0.111 18327
366 1 2 . 1 1 32 32 ILE HA H 32 3.030 3.030 4.011 -0.981 18327
367 1 2 . 1 1 32 32 ILE CA C 32 64.250 64.250 61.672 2.578 18327
368 1 2 . 1 1 32 32 ILE CB C 32 37.940 37.940 37.710 0.230 18327
369 1 2 . 1 1 32 32 ILE H H 32 8.019 8.019 8.388 -0.369 18327
370 1 2 . 1 1 33 33 GLY N N 33 115.700 115.700 114.090 1.610 18327
371 1 2 . 1 1 33 33 GLY CA C 33 44.500 44.500 45.061 -0.561 18327
372 1 2 . 1 1 33 33 GLY H H 33 8.777 8.777 8.830 -0.053 18327
373 1 2 . 1 1 34 34 ASP N N 34 122.300 122.300 120.062 2.238 18327
374 1 2 . 1 1 34 34 ASP HA H 34 4.640 4.640 4.947 -0.307 18327
375 1 2 . 1 1 34 34 ASP CA C 34 55.860 55.860 53.316 2.544 18327
376 1 2 . 1 1 34 34 ASP CB C 34 41.310 41.310 42.876 -1.566 18327
377 1 2 . 1 1 34 34 ASP H H 34 8.690 8.690 7.577 1.113 18327
378 1 2 . 1 1 35 35 THR N N 35 117.900 117.900 114.843 3.057 18327
379 1 2 . 1 1 35 35 THR HA H 35 5.160 5.160 5.301 -0.141 18327
380 1 2 . 1 1 35 35 THR CA C 35 61.450 61.450 61.394 0.056 18327
381 1 2 . 1 1 35 35 THR CB C 35 69.090 69.090 70.618 -1.528 18327
382 1 2 . 1 1 35 35 THR H H 35 8.389 8.389 8.249 0.140 18327
383 1 2 . 1 1 36 36 VAL N N 36 118.200 118.200 117.450 0.750 18327
384 1 2 . 1 1 36 36 VAL HA H 36 5.100 5.100 4.262 0.838 18327
385 1 2 . 1 1 36 36 VAL CA C 36 57.910 57.910 60.594 -2.684 18327
386 1 2 . 1 1 36 36 VAL CB C 36 34.190 34.190 34.781 -0.591 18327
387 1 2 . 1 1 36 36 VAL H H 36 9.019 9.019 8.997 0.022 18327
388 1 2 . 1 1 37 37 HIS N N 37 122.100 122.100 118.173 3.927 18327
389 1 2 . 1 1 37 37 HIS HA H 37 4.840 4.840 5.019 -0.179 18327
390 1 2 . 1 1 37 37 HIS CA C 37 52.560 52.560 54.753 -2.193 18327
391 1 2 . 1 1 37 37 HIS CB C 37 31.260 31.260 33.765 -2.505 18327
392 1 2 . 1 1 37 37 HIS H H 37 8.489 8.489 8.531 -0.042 18327
393 1 2 . 1 1 38 38 ILE N N 38 126.400 126.400 124.980 1.420 18327
394 1 2 . 1 1 38 38 ILE HA H 38 3.780 3.780 4.538 -0.758 18327
395 1 2 . 1 1 38 38 ILE CA C 38 61.640 61.640 60.648 0.992 18327
396 1 2 . 1 1 38 38 ILE CB C 38 38.880 38.880 39.640 -0.760 18327
397 1 2 . 1 1 38 38 ILE H H 38 8.636 8.636 8.158 0.478 18327
398 1 2 . 1 1 39 39 LEU N N 39 126.000 126.000 124.835 1.165 18327
399 1 2 . 1 1 39 39 LEU HA H 39 4.400 4.400 4.802 -0.402 18327
400 1 2 . 1 1 39 39 LEU CA C 39 55.490 55.490 55.031 0.459 18327
401 1 2 . 1 1 39 39 LEU CB C 39 43.750 43.750 44.168 -0.418 18327
402 1 2 . 1 1 39 39 LEU H H 39 9.162 9.162 9.050 0.112 18327
403 1 2 . 1 1 40 40 GLU N N 40 115.100 115.100 117.447 -2.347 18327
404 1 2 . 1 1 40 40 GLU HA H 40 7.895 7.895 4.706 3.189 18327
405 1 2 . 1 1 41 41 THR N N 41 116.400 116.400 112.891 3.509 18327
406 1 2 . 1 1 41 41 THR HA H 41 4.270 4.270 4.673 -0.403 18327
407 1 2 . 1 1 41 41 THR CA C 41 60.890 60.890 60.961 -0.071 18327
408 1 2 . 1 1 41 41 THR CB C 41 69.650 69.650 69.742 -0.091 18327
409 1 2 . 1 1 41 41 THR H H 41 8.162 8.162 8.463 -0.301 18327
410 1 2 . 1 1 43 43 GLU N N 43 123.300 123.300 120.284 3.016 18327
411 1 2 . 1 1 43 43 GLU HA H 43 4.270 4.270 4.224 0.046 18327
412 1 2 . 1 1 43 43 GLU CA C 43 57.350 57.350 56.389 0.961 18327
413 1 2 . 1 1 43 43 GLU CB C 43 26.790 26.790 29.856 -3.066 18327
414 1 2 . 1 1 43 43 GLU H H 43 8.108 8.108 8.392 -0.284 18327
415 1 2 . 1 1 44 44 GLY CA C 44 45.440 45.440 44.799 0.641 18327
416 1 2 . 1 1 45 45 TRP N N 45 124.100 124.100 119.784 4.316 18327
417 1 2 . 1 1 45 45 TRP HA H 45 4.690 4.690 4.715 -0.025 18327
418 1 2 . 1 1 45 45 TRP H H 45 8.590 8.590 7.255 1.335 18327
419 1 2 . 1 1 46 46 TYR HA H 46 5.600 5.600 4.639 0.961 18327
420 1 2 . 1 1 46 46 TYR CA C 46 54.060 54.060 57.407 -3.347 18327
421 1 2 . 1 1 46 46 TYR CB C 46 42.060 42.060 41.746 0.314 18327
422 1 2 . 1 1 47 47 ARG N N 47 118.100 118.100 122.345 -4.245 18327
423 1 2 . 1 1 47 47 ARG HA H 47 5.070 5.070 4.698 0.372 18327
424 1 2 . 1 1 47 47 ARG CA C 47 54.060 54.060 54.159 -0.099 18327
425 1 2 . 1 1 47 47 ARG CB C 47 33.250 33.250 34.585 -1.335 18327
426 1 2 . 1 1 47 47 ARG H H 47 8.495 8.495 8.977 -0.482 18327
427 1 2 . 1 1 48 48 GLY N N 48 114.000 114.000 111.853 2.147 18327
428 1 2 . 1 1 48 48 GLY CA C 48 46.560 46.560 46.218 0.343 18327
429 1 2 . 1 1 48 48 GLY H H 48 9.183 9.183 8.795 0.388 18327
430 1 2 . 1 1 49 49 TYR N N 49 116.200 116.200 117.827 -1.627 18327
431 1 2 . 1 1 49 49 TYR HA H 49 5.380 5.380 5.367 0.013 18327
432 1 2 . 1 1 49 49 TYR CA C 49 55.110 55.110 56.430 -1.320 18327
433 1 2 . 1 1 49 49 TYR CB C 49 40.750 40.750 40.090 0.660 18327
434 1 2 . 1 1 49 49 TYR H H 49 8.199 8.199 8.572 -0.373 18327
435 1 2 . 1 1 50 50 THR N N 50 112.200 112.200 111.924 0.276 18327
436 1 2 . 1 1 50 50 THR HA H 50 5.120 5.120 4.159 0.961 18327
437 1 2 . 1 1 50 50 THR CA C 50 59.770 59.770 60.862 -1.092 18327
438 1 2 . 1 1 50 50 THR CB C 50 69.460 69.460 69.457 0.003 18327
439 1 2 . 1 1 50 50 THR H H 50 9.436 9.436 8.556 0.880 18327
440 1 2 . 1 1 51 51 LEU N N 51 121.300 121.300 120.548 0.752 18327
441 1 2 . 1 1 51 51 LEU HA H 51 4.230 4.230 4.209 0.021 18327
442 1 2 . 1 1 51 51 LEU CA C 51 56.790 56.790 54.218 2.572 18327
443 1 2 . 1 1 51 51 LEU CB C 51 40.000 40.000 41.440 -1.440 18327
444 1 2 . 1 1 51 51 LEU H H 51 8.313 8.313 8.118 0.195 18327
445 1 2 . 1 1 52 52 ARG N N 52 116.600 116.600 118.223 -1.623 18327
446 1 2 . 1 1 52 52 ARG HA H 52 4.250 4.250 4.363 -0.113 18327
447 1 2 . 1 1 52 52 ARG CA C 52 57.350 57.350 56.535 0.815 18327
448 1 2 . 1 1 52 52 ARG CB C 52 30.510 30.510 31.181 -0.671 18327
449 1 2 . 1 1 52 52 ARG H H 52 8.053 8.053 8.076 -0.023 18327
450 1 2 . 1 1 53 53 LYS N N 53 122.600 122.600 118.863 3.737 18327
451 1 2 . 1 1 53 53 LYS HA H 53 4.620 4.620 4.526 0.094 18327
452 1 2 . 1 1 53 53 LYS CA C 53 54.620 54.620 55.770 -1.150 18327
453 1 2 . 1 1 53 53 LYS CB C 53 32.310 32.310 34.444 -2.134 18327
454 1 2 . 1 1 53 53 LYS H H 53 7.655 7.655 7.818 -0.163 18327
455 1 2 . 1 1 54 54 LYS N N 54 124.900 124.900 123.282 1.618 18327
456 1 2 . 1 1 54 54 LYS HA H 54 4.090 4.090 4.313 -0.223 18327
457 1 2 . 1 1 54 54 LYS CA C 54 58.470 58.470 58.368 0.102 18327
458 1 2 . 1 1 54 54 LYS CB C 54 32.130 32.130 32.767 -0.637 18327
459 1 2 . 1 1 54 54 LYS H H 54 8.499 8.499 8.739 -0.240 18327
460 1 2 . 1 1 55 55 SER N N 55 110.100 110.100 114.519 -4.419 18327
461 1 2 . 1 1 55 55 SER HA H 55 4.140 4.140 4.325 -0.185 18327
462 1 2 . 1 1 55 55 SER CA C 55 58.470 58.470 59.950 -1.480 18327
463 1 2 . 1 1 55 55 SER CB C 55 63.310 63.310 63.215 0.095 18327
464 1 2 . 1 1 55 55 SER H H 55 7.862 7.862 7.966 -0.104 18327
465 1 2 . 1 1 56 56 LYS N N 56 124.000 124.000 123.898 0.102 18327
466 1 2 . 1 1 56 56 LYS HA H 56 4.700 4.700 4.260 0.440 18327
467 1 2 . 1 1 56 56 LYS CA C 56 54.810 54.810 56.209 -1.399 18327
468 1 2 . 1 1 56 56 LYS CB C 56 33.250 33.250 32.301 0.949 18327
469 1 2 . 1 1 56 56 LYS H H 56 7.481 7.481 8.231 -0.750 18327
470 1 2 . 1 1 57 57 LYS N N 57 125.700 125.700 122.941 2.759 18327
471 1 2 . 1 1 57 57 LYS HA H 57 5.330 5.330 4.694 0.636 18327
472 1 2 . 1 1 57 57 LYS CA C 57 54.620 54.620 55.016 -0.396 18327
473 1 2 . 1 1 57 57 LYS CB C 57 34.240 34.240 36.408 -2.168 18327
474 1 2 . 1 1 57 57 LYS H H 57 8.475 8.475 7.917 0.558 18327
475 1 2 . 1 1 58 58 GLY N N 58 109.400 109.400 107.361 2.039 18327
476 1 2 . 1 1 58 58 GLY CA C 58 45.620 45.620 45.862 -0.242 18327
477 1 2 . 1 1 58 58 GLY H H 58 9.073 9.073 8.784 0.289 18327
478 1 2 . 1 1 59 59 ILE N N 59 113.900 113.900 119.374 -5.474 18327
479 1 2 . 1 1 59 59 ILE HA H 59 6.000 6.000 4.878 1.122 18327
480 1 2 . 1 1 59 59 ILE CA C 59 59.590 59.590 60.347 -0.757 18327
481 1 2 . 1 1 59 59 ILE CB C 59 41.140 41.140 41.948 -0.808 18327
482 1 2 . 1 1 59 59 ILE H H 59 8.628 8.628 8.310 0.318 18327
483 1 2 . 1 1 60 60 PHE N N 60 116.900 116.900 117.077 -0.177 18327
484 1 2 . 1 1 60 60 PHE HA H 60 5.120 5.120 5.088 0.032 18327
485 1 2 . 1 1 60 60 PHE CA C 60 54.060 54.060 55.324 -1.264 18327
486 1 2 . 1 1 60 60 PHE CB C 60 37.190 37.190 40.640 -3.450 18327
487 1 2 . 1 1 60 60 PHE H H 60 8.724 8.724 8.850 -0.126 18327
488 1 2 . 1 1 61 61 PRO HA H 61 3.480 3.480 3.929 -0.449 18327
489 1 2 . 1 1 61 61 PRO CA C 61 62.200 62.200 62.072 0.128 18327
490 1 2 . 1 1 61 61 PRO CB C 61 31.190 31.190 31.417 -0.227 18327
491 1 2 . 1 1 62 62 ALA N N 62 124.600 124.600 128.065 -3.465 18327
492 1 2 . 1 1 62 62 ALA HA H 62 3.720 3.720 4.399 -0.679 18327
493 1 2 . 1 1 62 62 ALA CA C 62 54.370 54.370 55.068 -0.698 18327
494 1 2 . 1 1 62 62 ALA CB C 62 17.650 17.650 18.506 -0.856 18327
495 1 2 . 1 1 62 62 ALA H H 62 7.898 7.898 8.314 -0.416 18327
496 1 2 . 1 1 63 63 SER N N 63 109.700 109.700 112.943 -3.243 18327
497 1 2 . 1 1 63 63 SER HA H 63 4.200 4.200 4.153 0.047 18327
498 1 2 . 1 1 63 63 SER CA C 63 59.400 59.400 60.650 -1.250 18327
499 1 2 . 1 1 63 63 SER CB C 63 62.380 62.380 62.909 -0.529 18327
500 1 2 . 1 1 63 63 SER H H 63 8.030 8.030 7.932 0.098 18327
501 1 2 . 1 1 64 64 TYR N N 64 120.300 120.300 116.842 3.458 18327
502 1 2 . 1 1 64 64 TYR HA H 64 4.260 4.260 4.613 -0.353 18327
503 1 2 . 1 1 64 64 TYR CA C 64 57.720 57.720 55.847 1.873 18327
504 1 2 . 1 1 64 64 TYR CB C 64 37.560 37.560 37.385 0.175 18327
505 1 2 . 1 1 64 64 TYR H H 64 7.124 7.124 7.345 -0.221 18327
506 1 2 . 1 1 65 65 ILE N N 65 118.000 118.000 118.758 -0.758 18327
507 1 2 . 1 1 65 65 ILE HA H 65 4.830 4.830 4.854 -0.024 18327
508 1 2 . 1 1 65 65 ILE CA C 65 56.980 56.980 58.839 -1.859 18327
509 1 2 . 1 1 65 65 ILE CB C 65 39.630 39.630 42.451 -2.821 18327
510 1 2 . 1 1 65 65 ILE H H 65 7.671 7.671 7.664 0.007 18327
511 1 2 . 1 1 66 66 HIS N N 66 124.500 124.500 121.136 3.364 18327
512 1 2 . 1 1 66 66 HIS HA H 66 5.130 5.130 4.980 0.150 18327
513 1 2 . 1 1 66 66 HIS CA C 66 53.060 53.060 54.393 -1.333 18327
514 1 2 . 1 1 66 66 HIS CB C 66 30.510 30.510 32.465 -1.955 18327
515 1 2 . 1 1 66 66 HIS H H 66 9.159 9.159 8.873 0.286 18327
516 1 2 . 1 1 67 67 LEU N N 67 127.400 127.400 127.991 -0.591 18327
517 1 2 . 1 1 67 67 LEU HA H 67 4.560 4.560 4.975 -0.415 18327
518 1 2 . 1 1 67 67 LEU CA C 67 55.300 55.300 54.599 0.701 18327
519 1 2 . 1 1 67 67 LEU CB C 67 42.060 42.060 43.813 -1.754 18327
520 1 2 . 1 1 67 67 LEU H H 67 8.979 8.979 8.865 0.114 18327
521 1 2 . 1 1 68 68 LYS N N 68 121.900 121.900 124.318 -2.418 18327
522 1 2 . 1 1 68 68 LYS HA H 68 4.490 4.490 4.463 0.027 18327
523 1 2 . 1 1 68 68 LYS CA C 68 55.110 55.110 54.925 0.185 18327
524 1 2 . 1 1 68 68 LYS CB C 68 34.610 34.610 34.489 0.121 18327
525 1 2 . 1 1 68 68 LYS H H 68 8.499 8.499 9.057 -0.558 18327
526 1 2 . 1 1 69 69 GLU N N 69 122.100 122.100 124.924 -2.824 18327
527 1 2 . 1 1 69 69 GLU HA H 69 4.290 4.290 4.005 0.285 18327
528 1 2 . 1 1 69 69 GLU CA C 69 56.610 56.610 57.338 -0.728 18327
529 1 2 . 1 1 69 69 GLU CB C 69 30.330 30.330 29.856 0.474 18327
530 1 2 . 1 1 69 69 GLU H H 69 8.569 8.569 8.556 0.013 18327
531 1 2 . 1 1 70 70 ALA N N 70 123.300 123.300 125.851 -2.551 18327
532 1 2 . 1 1 70 70 ALA HA H 70 4.210 4.210 4.296 -0.086 18327
533 1 2 . 1 1 70 70 ALA CA C 70 51.810 51.810 52.591 -0.781 18327
534 1 2 . 1 1 70 70 ALA CB C 70 19.700 19.700 17.876 1.824 18327
535 1 2 . 1 1 70 70 ALA H H 70 8.181 8.181 8.466 -0.285 18327
536 1 2 . 1 1 71 71 ILE N N 71 120.000 120.000 120.487 -0.487 18327
537 1 2 . 1 1 71 71 ILE HA H 71 4.070 4.070 4.243 -0.173 18327
538 1 2 . 1 1 71 71 ILE CA C 71 60.330 60.330 61.054 -0.724 18327
539 1 2 . 1 1 71 71 ILE CB C 71 38.690 38.690 38.801 -0.111 18327
540 1 2 . 1 1 71 71 ILE H H 71 7.789 7.789 8.006 -0.217 18327
541 1 2 . 1 1 72 72 VAL N N 72 124.400 124.400 120.757 3.643 18327
542 1 2 . 1 1 72 72 VAL HA H 72 4.070 4.070 4.293 -0.223 18327
543 1 2 . 1 1 72 72 VAL CA C 72 61.640 61.640 61.709 -0.069 18327
544 1 2 . 1 1 72 72 VAL CB C 72 32.690 32.690 32.798 -0.108 18327
545 1 2 . 1 1 72 72 VAL H H 72 8.089 8.089 8.056 0.033 18327
546 1 2 . 1 1 73 73 GLU N N 73 125.940 125.940 123.157 2.783 18327
547 1 2 . 1 1 73 73 GLU HA H 73 4.300 4.300 4.502 -0.202 18327
548 1 2 . 1 1 73 73 GLU CA C 73 56.610 56.610 55.836 0.774 18327
549 1 2 . 1 1 73 73 GLU CB C 73 30.710 30.710 30.031 0.679 18327
550 1 2 . 1 1 73 73 GLU H H 73 8.464 8.464 8.526 -0.062 18327
551 1 3 . 1 1 13 13 TYR HA H 13 5.560 5.560 4.613 0.947 18327
552 1 3 . 1 1 13 13 TYR CA C 13 55.860 55.860 57.782 -1.921 18327
553 1 3 . 1 1 13 13 TYR CB C 13 42.440 42.440 40.837 1.603 18327
554 1 3 . 1 1 14 14 GLY N N 14 105.400 105.400 106.344 -0.944 18327
555 1 3 . 1 1 14 14 GLY CA C 14 45.240 45.240 43.537 1.703 18327
556 1 3 . 1 1 14 14 GLY H H 14 8.406 8.406 8.562 -0.156 18327
557 1 3 . 1 1 15 15 VAL N N 15 118.900 118.900 121.642 -2.742 18327
558 1 3 . 1 1 15 15 VAL HA H 15 5.330 5.330 4.848 0.482 18327
559 1 3 . 1 1 15 15 VAL CA C 15 59.210 59.210 60.407 -1.198 18327
560 1 3 . 1 1 15 15 VAL CB C 15 35.740 35.740 35.557 0.183 18327
561 1 3 . 1 1 15 15 VAL H H 15 8.854 8.854 8.382 0.472 18327
562 1 3 . 1 1 16 16 ALA N N 16 129.400 129.400 128.280 1.120 18327
563 1 3 . 1 1 16 16 ALA HA H 16 5.000 5.000 4.996 0.004 18327
564 1 3 . 1 1 16 16 ALA CA C 16 52.000 52.000 51.152 0.848 18327
565 1 3 . 1 1 16 16 ALA CB C 16 19.330 19.330 20.605 -1.275 18327
566 1 3 . 1 1 16 16 ALA H H 16 9.112 9.112 9.238 -0.126 18327
567 1 3 . 1 1 17 17 PHE N N 17 123.900 123.900 124.130 -0.230 18327
568 1 3 . 1 1 17 17 PHE HA H 17 4.740 4.740 4.777 -0.037 18327
569 1 3 . 1 1 17 17 PHE CA C 17 56.230 56.230 56.825 -0.595 18327
570 1 3 . 1 1 17 17 PHE CB C 17 40.000 40.000 40.283 -0.283 18327
571 1 3 . 1 1 17 17 PHE H H 17 8.785 8.785 8.227 0.558 18327
572 1 3 . 1 1 18 18 TYR N N 18 118.100 118.100 118.053 0.047 18327
573 1 3 . 1 1 18 18 TYR HA H 18 4.490 4.490 4.449 0.041 18327
574 1 3 . 1 1 18 18 TYR CA C 18 55.300 55.300 57.720 -2.420 18327
575 1 3 . 1 1 18 18 TYR CB C 18 42.810 42.810 42.393 0.417 18327
576 1 3 . 1 1 18 18 TYR H H 18 7.288 7.288 7.681 -0.393 18327
577 1 3 . 1 1 19 19 ASN N N 19 116.800 116.800 119.535 -2.735 18327
578 1 3 . 1 1 19 19 ASN HA H 19 4.710 4.710 4.839 -0.129 18327
579 1 3 . 1 1 19 19 ASN CA C 19 52.940 52.940 53.552 -0.612 18327
580 1 3 . 1 1 19 19 ASN CB C 19 39.060 39.060 39.927 -0.867 18327
581 1 3 . 1 1 19 19 ASN H H 19 8.122 8.122 8.377 -0.255 18327
582 1 3 . 1 1 20 20 TYR N N 20 122.000 122.000 124.161 -2.161 18327
583 1 3 . 1 1 20 20 TYR HA H 20 4.710 4.710 4.581 0.129 18327
584 1 3 . 1 1 20 20 TYR CA C 20 57.720 57.720 58.035 -0.315 18327
585 1 3 . 1 1 20 20 TYR CB C 20 42.250 42.250 43.014 -0.764 18327
586 1 3 . 1 1 20 20 TYR H H 20 8.994 8.994 8.855 0.139 18327
587 1 3 . 1 1 21 21 ASP N N 21 128.500 128.500 122.207 6.293 18327
588 1 3 . 1 1 21 21 ASP HA H 21 4.790 4.790 4.983 -0.193 18327
589 1 3 . 1 1 21 21 ASP CA C 21 52.370 52.370 51.400 0.970 18327
590 1 3 . 1 1 21 21 ASP CB C 21 41.130 41.130 42.929 -1.799 18327
591 1 3 . 1 1 21 21 ASP H H 21 7.839 7.839 7.997 -0.158 18327
592 1 3 . 1 1 22 22 ALA N N 22 125.200 125.200 123.615 1.585 18327
593 1 3 . 1 1 22 22 ALA HA H 22 4.050 4.050 4.615 -0.565 18327
594 1 3 . 1 1 22 22 ALA CA C 22 52.940 52.940 52.861 0.078 18327
595 1 3 . 1 1 22 22 ALA CB C 22 20.450 20.450 19.563 0.887 18327
596 1 3 . 1 1 22 22 ALA H H 22 8.107 8.107 8.501 -0.394 18327
597 1 3 . 1 1 23 23 ARG N N 23 122.200 122.200 119.100 3.100 18327
598 1 3 . 1 1 23 23 ARG HA H 23 4.350 4.350 4.524 -0.174 18327
599 1 3 . 1 1 23 23 ARG CA C 23 55.490 55.490 55.515 -0.025 18327
600 1 3 . 1 1 23 23 ARG CB C 23 30.700 30.700 31.109 -0.409 18327
601 1 3 . 1 1 23 23 ARG H H 23 8.889 8.889 8.580 0.309 18327
602 1 3 . 1 1 24 24 GLY N N 24 105.200 105.200 107.674 -2.474 18327
603 1 3 . 1 1 24 24 GLY CA C 24 44.500 44.500 45.301 -0.801 18327
604 1 3 . 1 1 24 24 GLY H H 24 7.267 7.267 7.684 -0.417 18327
605 1 3 . 1 1 25 25 ALA N N 25 122.200 122.200 122.596 -0.396 18327
606 1 3 . 1 1 25 25 ALA HA H 25 4.160 4.160 4.240 -0.080 18327
607 1 3 . 1 1 25 25 ALA CA C 25 54.440 54.440 54.282 0.158 18327
608 1 3 . 1 1 25 25 ALA CB C 25 18.770 18.770 18.762 0.009 18327
609 1 3 . 1 1 25 25 ALA H H 25 8.621 8.621 8.516 0.105 18327
610 1 3 . 1 1 26 26 ASP N N 26 114.700 114.700 118.188 -3.488 18327
611 1 3 . 1 1 26 26 ASP HA H 26 4.700 4.700 4.736 -0.036 18327
612 1 3 . 1 1 26 26 ASP CA C 26 53.870 53.870 53.731 0.139 18327
613 1 3 . 1 1 26 26 ASP CB C 26 40.390 40.390 40.816 -0.426 18327
614 1 3 . 1 1 26 26 ASP H H 26 8.949 8.949 8.546 0.403 18327
615 1 3 . 1 1 27 27 GLU N N 27 118.800 118.800 118.633 0.167 18327
616 1 3 . 1 1 27 27 GLU HA H 27 5.220 5.220 4.976 0.244 18327
617 1 3 . 1 1 27 27 GLU CA C 27 54.930 54.930 54.754 0.176 18327
618 1 3 . 1 1 27 27 GLU CB C 27 32.880 32.880 32.136 0.744 18327
619 1 3 . 1 1 27 27 GLU H H 27 7.542 7.542 7.538 0.004 18327
620 1 3 . 1 1 28 28 LEU N N 28 121.400 121.400 120.657 0.743 18327
621 1 3 . 1 1 28 28 LEU HA H 28 4.760 4.760 4.828 -0.068 18327
622 1 3 . 1 1 28 28 LEU CA C 28 53.120 53.120 54.411 -1.291 18327
623 1 3 . 1 1 28 28 LEU CB C 28 44.500 44.500 45.505 -1.004 18327
624 1 3 . 1 1 28 28 LEU H H 28 8.897 8.897 8.467 0.430 18327
625 1 3 . 1 1 29 29 SER N N 29 115.700 115.700 118.581 -2.881 18327
626 1 3 . 1 1 29 29 SER HA H 29 5.030 5.030 4.631 0.399 18327
627 1 3 . 1 1 29 29 SER CA C 29 58.470 58.470 58.007 0.463 18327
628 1 3 . 1 1 29 29 SER CB C 29 63.690 63.690 63.960 -0.270 18327
629 1 3 . 1 1 29 29 SER H H 29 7.949 7.949 8.404 -0.455 18327
630 1 3 . 1 1 30 30 LEU N N 30 121.300 121.300 118.961 2.339 18327
631 1 3 . 1 1 30 30 LEU HA H 30 4.800 4.800 4.827 -0.027 18327
632 1 3 . 1 1 30 30 LEU CA C 30 52.940 52.940 55.352 -2.412 18327
633 1 3 . 1 1 30 30 LEU CB C 30 46.370 46.370 45.540 0.830 18327
634 1 3 . 1 1 30 30 LEU H H 30 9.503 9.503 8.697 0.806 18327
635 1 3 . 1 1 31 31 GLN N N 31 123.100 123.100 120.749 2.351 18327
636 1 3 . 1 1 31 31 GLN HA H 31 5.070 5.070 4.631 0.439 18327
637 1 3 . 1 1 31 31 GLN CA C 31 52.940 52.940 53.603 -0.663 18327
638 1 3 . 1 1 31 31 GLN CB C 31 31.190 31.190 32.505 -1.315 18327
639 1 3 . 1 1 31 31 GLN H H 31 9.152 9.152 8.323 0.829 18327
640 1 3 . 1 1 32 32 ILE N N 32 120.800 120.800 120.673 0.127 18327
641 1 3 . 1 1 32 32 ILE HA H 32 3.030 3.030 3.907 -0.877 18327
642 1 3 . 1 1 32 32 ILE CA C 32 64.250 64.250 62.477 1.772 18327
643 1 3 . 1 1 32 32 ILE CB C 32 37.940 37.940 37.435 0.504 18327
644 1 3 . 1 1 32 32 ILE H H 32 8.019 8.019 8.516 -0.497 18327
645 1 3 . 1 1 33 33 GLY N N 33 115.700 115.700 114.363 1.337 18327
646 1 3 . 1 1 33 33 GLY CA C 33 44.500 44.500 44.883 -0.383 18327
647 1 3 . 1 1 33 33 GLY H H 33 8.777 8.777 8.831 -0.054 18327
648 1 3 . 1 1 34 34 ASP N N 34 122.300 122.300 121.275 1.025 18327
649 1 3 . 1 1 34 34 ASP HA H 34 4.640 4.640 4.908 -0.268 18327
650 1 3 . 1 1 34 34 ASP CA C 34 55.860 55.860 53.454 2.406 18327
651 1 3 . 1 1 34 34 ASP CB C 34 41.310 41.310 42.734 -1.424 18327
652 1 3 . 1 1 34 34 ASP H H 34 8.690 8.690 7.750 0.940 18327
653 1 3 . 1 1 35 35 THR N N 35 117.900 117.900 116.298 1.602 18327
654 1 3 . 1 1 35 35 THR HA H 35 5.160 5.160 5.323 -0.163 18327
655 1 3 . 1 1 35 35 THR CA C 35 61.450 61.450 61.618 -0.168 18327
656 1 3 . 1 1 35 35 THR CB C 35 69.090 69.090 70.718 -1.627 18327
657 1 3 . 1 1 35 35 THR H H 35 8.389 8.389 8.394 -0.005 18327
658 1 3 . 1 1 36 36 VAL N N 36 118.200 118.200 117.742 0.458 18327
659 1 3 . 1 1 36 36 VAL HA H 36 5.100 5.100 4.430 0.670 18327
660 1 3 . 1 1 36 36 VAL CA C 36 57.910 57.910 60.168 -2.258 18327
661 1 3 . 1 1 36 36 VAL CB C 36 34.190 34.190 34.382 -0.192 18327
662 1 3 . 1 1 36 36 VAL H H 36 9.019 9.019 9.126 -0.107 18327
663 1 3 . 1 1 37 37 HIS N N 37 122.100 122.100 119.248 2.852 18327
664 1 3 . 1 1 37 37 HIS HA H 37 4.840 4.840 4.994 -0.154 18327
665 1 3 . 1 1 37 37 HIS CA C 37 52.560 52.560 54.270 -1.710 18327
666 1 3 . 1 1 37 37 HIS CB C 37 31.260 31.260 33.574 -2.314 18327
667 1 3 . 1 1 37 37 HIS H H 37 8.489 8.489 8.589 -0.100 18327
668 1 3 . 1 1 38 38 ILE N N 38 126.400 126.400 124.938 1.462 18327
669 1 3 . 1 1 38 38 ILE HA H 38 3.780 3.780 4.122 -0.342 18327
670 1 3 . 1 1 38 38 ILE CA C 38 61.640 61.640 61.135 0.505 18327
671 1 3 . 1 1 38 38 ILE CB C 38 38.880 38.880 38.276 0.604 18327
672 1 3 . 1 1 38 38 ILE H H 38 8.636 8.636 8.373 0.263 18327
673 1 3 . 1 1 39 39 LEU N N 39 126.000 126.000 125.213 0.787 18327
674 1 3 . 1 1 39 39 LEU HA H 39 4.400 4.400 4.764 -0.364 18327
675 1 3 . 1 1 39 39 LEU CA C 39 55.490 55.490 55.401 0.089 18327
676 1 3 . 1 1 39 39 LEU CB C 39 43.750 43.750 44.188 -0.438 18327
677 1 3 . 1 1 39 39 LEU H H 39 9.162 9.162 8.330 0.832 18327
678 1 3 . 1 1 40 40 GLU N N 40 115.100 115.100 118.075 -2.975 18327
679 1 3 . 1 1 40 40 GLU HA H 40 7.895 7.895 4.798 3.097 18327
680 1 3 . 1 1 41 41 THR N N 41 116.400 116.400 112.109 4.291 18327
681 1 3 . 1 1 41 41 THR HA H 41 4.270 4.270 5.004 -0.734 18327
682 1 3 . 1 1 41 41 THR CA C 41 60.890 60.890 60.973 -0.083 18327
683 1 3 . 1 1 41 41 THR CB C 41 69.650 69.650 71.203 -1.553 18327
684 1 3 . 1 1 41 41 THR H H 41 8.162 8.162 8.588 -0.426 18327
685 1 3 . 1 1 43 43 GLU N N 43 123.300 123.300 121.548 1.752 18327
686 1 3 . 1 1 43 43 GLU HA H 43 4.270 4.270 3.717 0.553 18327
687 1 3 . 1 1 43 43 GLU CA C 43 57.350 57.350 56.993 0.357 18327
688 1 3 . 1 1 43 43 GLU CB C 43 26.790 26.790 28.270 -1.480 18327
689 1 3 . 1 1 43 43 GLU H H 43 8.108 8.108 8.658 -0.550 18327
690 1 3 . 1 1 44 44 GLY CA C 44 45.440 45.440 45.188 0.252 18327
691 1 3 . 1 1 45 45 TRP N N 45 124.100 124.100 118.455 5.645 18327
692 1 3 . 1 1 45 45 TRP HA H 45 4.690 4.690 4.847 -0.157 18327
693 1 3 . 1 1 45 45 TRP H H 45 8.590 8.590 7.358 1.232 18327
694 1 3 . 1 1 46 46 TYR HA H 46 5.600 5.600 4.635 0.965 18327
695 1 3 . 1 1 46 46 TYR CA C 46 54.060 54.060 56.892 -2.832 18327
696 1 3 . 1 1 46 46 TYR CB C 46 42.060 42.060 39.821 2.239 18327
697 1 3 . 1 1 47 47 ARG N N 47 118.100 118.100 124.692 -6.592 18327
698 1 3 . 1 1 47 47 ARG HA H 47 5.070 5.070 4.810 0.260 18327
699 1 3 . 1 1 47 47 ARG CA C 47 54.060 54.060 54.673 -0.613 18327
700 1 3 . 1 1 47 47 ARG CB C 47 33.250 33.250 32.690 0.560 18327
701 1 3 . 1 1 47 47 ARG H H 47 8.495 8.495 8.724 -0.229 18327
702 1 3 . 1 1 48 48 GLY N N 48 114.000 114.000 114.912 -0.912 18327
703 1 3 . 1 1 48 48 GLY CA C 48 46.560 46.560 46.433 0.127 18327
704 1 3 . 1 1 48 48 GLY H H 48 9.183 9.183 9.066 0.117 18327
705 1 3 . 1 1 49 49 TYR N N 49 116.200 116.200 117.065 -0.865 18327
706 1 3 . 1 1 49 49 TYR HA H 49 5.380 5.380 5.060 0.320 18327
707 1 3 . 1 1 49 49 TYR CA C 49 55.110 55.110 57.070 -1.960 18327
708 1 3 . 1 1 49 49 TYR CB C 49 40.750 40.750 39.410 1.340 18327
709 1 3 . 1 1 49 49 TYR H H 49 8.199 8.199 8.500 -0.301 18327
710 1 3 . 1 1 50 50 THR N N 50 112.200 112.200 111.294 0.906 18327
711 1 3 . 1 1 50 50 THR HA H 50 5.120 5.120 4.313 0.807 18327
712 1 3 . 1 1 50 50 THR CA C 50 59.770 59.770 61.102 -1.333 18327
713 1 3 . 1 1 50 50 THR CB C 50 69.460 69.460 69.987 -0.527 18327
714 1 3 . 1 1 50 50 THR H H 50 9.436 9.436 8.470 0.966 18327
715 1 3 . 1 1 51 51 LEU N N 51 121.300 121.300 119.666 1.634 18327
716 1 3 . 1 1 51 51 LEU HA H 51 4.230 4.230 4.285 -0.055 18327
717 1 3 . 1 1 51 51 LEU CA C 51 56.790 56.790 55.269 1.521 18327
718 1 3 . 1 1 51 51 LEU CB C 51 40.000 40.000 41.750 -1.750 18327
719 1 3 . 1 1 51 51 LEU H H 51 8.313 8.313 8.152 0.161 18327
720 1 3 . 1 1 52 52 ARG N N 52 116.600 116.600 117.824 -1.224 18327
721 1 3 . 1 1 52 52 ARG HA H 52 4.250 4.250 4.207 0.043 18327
722 1 3 . 1 1 52 52 ARG CA C 52 57.350 57.350 57.400 -0.050 18327
723 1 3 . 1 1 52 52 ARG CB C 52 30.510 30.510 31.042 -0.532 18327
724 1 3 . 1 1 52 52 ARG H H 52 8.053 8.053 7.939 0.114 18327
725 1 3 . 1 1 53 53 LYS N N 53 122.600 122.600 118.340 4.260 18327
726 1 3 . 1 1 53 53 LYS HA H 53 4.620 4.620 4.525 0.095 18327
727 1 3 . 1 1 53 53 LYS CA C 53 54.620 54.620 55.621 -1.001 18327
728 1 3 . 1 1 53 53 LYS CB C 53 32.310 32.310 33.980 -1.671 18327
729 1 3 . 1 1 53 53 LYS H H 53 7.655 7.655 7.571 0.084 18327
730 1 3 . 1 1 54 54 LYS N N 54 124.900 124.900 125.772 -0.872 18327
731 1 3 . 1 1 54 54 LYS HA H 54 4.090 4.090 4.340 -0.250 18327
732 1 3 . 1 1 54 54 LYS CA C 54 58.470 58.470 58.517 -0.048 18327
733 1 3 . 1 1 54 54 LYS CB C 54 32.130 32.130 32.693 -0.563 18327
734 1 3 . 1 1 54 54 LYS H H 54 8.499 8.499 8.893 -0.394 18327
735 1 3 . 1 1 55 55 SER N N 55 110.100 110.100 113.645 -3.545 18327
736 1 3 . 1 1 55 55 SER HA H 55 4.140 4.140 4.280 -0.140 18327
737 1 3 . 1 1 55 55 SER CA C 55 58.470 58.470 59.663 -1.193 18327
738 1 3 . 1 1 55 55 SER CB C 55 63.310 63.310 63.271 0.039 18327
739 1 3 . 1 1 55 55 SER H H 55 7.862 7.862 8.009 -0.147 18327
740 1 3 . 1 1 56 56 LYS N N 56 124.000 124.000 122.326 1.674 18327
741 1 3 . 1 1 56 56 LYS HA H 56 4.700 4.700 4.447 0.253 18327
742 1 3 . 1 1 56 56 LYS CA C 56 54.810 54.810 55.372 -0.562 18327
743 1 3 . 1 1 56 56 LYS CB C 56 33.250 33.250 32.905 0.345 18327
744 1 3 . 1 1 56 56 LYS H H 56 7.481 7.481 7.953 -0.472 18327
745 1 3 . 1 1 57 57 LYS N N 57 125.700 125.700 121.894 3.806 18327
746 1 3 . 1 1 57 57 LYS HA H 57 5.330 5.330 4.675 0.655 18327
747 1 3 . 1 1 57 57 LYS CA C 57 54.620 54.620 54.880 -0.260 18327
748 1 3 . 1 1 57 57 LYS CB C 57 34.240 34.240 36.519 -2.279 18327
749 1 3 . 1 1 57 57 LYS H H 57 8.475 8.475 8.414 0.061 18327
750 1 3 . 1 1 58 58 GLY N N 58 109.400 109.400 107.140 2.260 18327
751 1 3 . 1 1 58 58 GLY CA C 58 45.620 45.620 45.372 0.248 18327
752 1 3 . 1 1 58 58 GLY H H 58 9.073 9.073 8.461 0.612 18327
753 1 3 . 1 1 59 59 ILE N N 59 113.900 113.900 117.259 -3.359 18327
754 1 3 . 1 1 59 59 ILE HA H 59 6.000 6.000 5.416 0.584 18327
755 1 3 . 1 1 59 59 ILE CA C 59 59.590 59.590 58.698 0.892 18327
756 1 3 . 1 1 59 59 ILE CB C 59 41.140 41.140 42.293 -1.153 18327
757 1 3 . 1 1 59 59 ILE H H 59 8.628 8.628 8.241 0.387 18327
758 1 3 . 1 1 60 60 PHE N N 60 116.900 116.900 115.923 0.977 18327
759 1 3 . 1 1 60 60 PHE HA H 60 5.120 5.120 5.093 0.027 18327
760 1 3 . 1 1 60 60 PHE CA C 60 54.060 54.060 55.175 -1.115 18327
761 1 3 . 1 1 60 60 PHE CB C 60 37.190 37.190 40.078 -2.888 18327
762 1 3 . 1 1 60 60 PHE H H 60 8.724 8.724 8.584 0.140 18327
763 1 3 . 1 1 61 61 PRO HA H 61 3.480 3.480 3.527 -0.047 18327
764 1 3 . 1 1 61 61 PRO CA C 61 62.200 62.200 62.458 -0.258 18327
765 1 3 . 1 1 61 61 PRO CB C 61 31.190 31.190 30.859 0.331 18327
766 1 3 . 1 1 62 62 ALA N N 62 124.600 124.600 128.350 -3.750 18327
767 1 3 . 1 1 62 62 ALA HA H 62 3.720 3.720 4.220 -0.500 18327
768 1 3 . 1 1 62 62 ALA CA C 62 54.370 54.370 54.451 -0.081 18327
769 1 3 . 1 1 62 62 ALA CB C 62 17.650 17.650 18.363 -0.713 18327
770 1 3 . 1 1 62 62 ALA H H 62 7.898 7.898 8.489 -0.591 18327
771 1 3 . 1 1 63 63 SER N N 63 109.700 109.700 112.626 -2.926 18327
772 1 3 . 1 1 63 63 SER HA H 63 4.200 4.200 4.079 0.121 18327
773 1 3 . 1 1 63 63 SER CA C 63 59.400 59.400 60.593 -1.193 18327
774 1 3 . 1 1 63 63 SER CB C 63 62.380 62.380 62.697 -0.317 18327
775 1 3 . 1 1 63 63 SER H H 63 8.030 8.030 8.029 0.001 18327
776 1 3 . 1 1 64 64 TYR N N 64 120.300 120.300 117.354 2.946 18327
777 1 3 . 1 1 64 64 TYR HA H 64 4.260 4.260 4.738 -0.478 18327
778 1 3 . 1 1 64 64 TYR CA C 64 57.720 57.720 56.178 1.542 18327
779 1 3 . 1 1 64 64 TYR CB C 64 37.560 37.560 37.220 0.340 18327
780 1 3 . 1 1 64 64 TYR H H 64 7.124 7.124 7.099 0.025 18327
781 1 3 . 1 1 65 65 ILE N N 65 118.000 118.000 118.058 -0.058 18327
782 1 3 . 1 1 65 65 ILE HA H 65 4.830 4.830 5.080 -0.250 18327
783 1 3 . 1 1 65 65 ILE CA C 65 56.980 56.980 58.920 -1.940 18327
784 1 3 . 1 1 65 65 ILE CB C 65 39.630 39.630 42.629 -2.999 18327
785 1 3 . 1 1 65 65 ILE H H 65 7.671 7.671 7.597 0.074 18327
786 1 3 . 1 1 66 66 HIS N N 66 124.500 124.500 121.552 2.948 18327
787 1 3 . 1 1 66 66 HIS HA H 66 5.130 5.130 4.790 0.340 18327
788 1 3 . 1 1 66 66 HIS CA C 66 53.060 53.060 54.470 -1.410 18327
789 1 3 . 1 1 66 66 HIS CB C 66 30.510 30.510 33.494 -2.984 18327
790 1 3 . 1 1 66 66 HIS H H 66 9.159 9.159 8.641 0.518 18327
791 1 3 . 1 1 67 67 LEU N N 67 127.400 127.400 126.615 0.785 18327
792 1 3 . 1 1 67 67 LEU HA H 67 4.560 4.560 5.040 -0.480 18327
793 1 3 . 1 1 67 67 LEU CA C 67 55.300 55.300 54.738 0.562 18327
794 1 3 . 1 1 67 67 LEU CB C 67 42.060 42.060 43.305 -1.245 18327
795 1 3 . 1 1 67 67 LEU H H 67 8.979 8.979 8.769 0.210 18327
796 1 3 . 1 1 68 68 LYS N N 68 121.900 121.900 121.586 0.314 18327
797 1 3 . 1 1 68 68 LYS HA H 68 4.490 4.490 4.317 0.173 18327
798 1 3 . 1 1 68 68 LYS CA C 68 55.110 55.110 55.565 -0.455 18327
799 1 3 . 1 1 68 68 LYS CB C 68 34.610 34.610 34.153 0.457 18327
800 1 3 . 1 1 68 68 LYS H H 68 8.499 8.499 8.696 -0.197 18327
801 1 3 . 1 1 69 69 GLU N N 69 122.100 122.100 125.273 -3.173 18327
802 1 3 . 1 1 69 69 GLU HA H 69 4.290 4.290 4.269 0.021 18327
803 1 3 . 1 1 69 69 GLU CA C 69 56.610 56.610 56.555 0.055 18327
804 1 3 . 1 1 69 69 GLU CB C 69 30.330 30.330 28.588 1.742 18327
805 1 3 . 1 1 69 69 GLU H H 69 8.569 8.569 8.887 -0.318 18327
806 1 3 . 1 1 70 70 ALA N N 70 123.300 123.300 126.038 -2.738 18327
807 1 3 . 1 1 70 70 ALA HA H 70 4.210 4.210 4.407 -0.198 18327
808 1 3 . 1 1 70 70 ALA CA C 70 51.810 51.810 52.203 -0.393 18327
809 1 3 . 1 1 70 70 ALA CB C 70 19.700 19.700 19.398 0.302 18327
810 1 3 . 1 1 70 70 ALA H H 70 8.181 8.181 8.072 0.109 18327
811 1 3 . 1 1 71 71 ILE N N 71 120.000 120.000 118.584 1.416 18327
812 1 3 . 1 1 71 71 ILE HA H 71 4.070 4.070 4.338 -0.268 18327
813 1 3 . 1 1 71 71 ILE CA C 71 60.330 60.330 60.256 0.074 18327
814 1 3 . 1 1 71 71 ILE CB C 71 38.690 38.690 39.796 -1.106 18327
815 1 3 . 1 1 71 71 ILE H H 71 7.789 7.789 8.140 -0.351 18327
816 1 3 . 1 1 72 72 VAL N N 72 124.400 124.400 119.521 4.879 18327
817 1 3 . 1 1 72 72 VAL HA H 72 4.070 4.070 4.546 -0.476 18327
818 1 3 . 1 1 72 72 VAL CA C 72 61.640 61.640 60.416 1.224 18327
819 1 3 . 1 1 72 72 VAL CB C 72 32.690 32.690 35.195 -2.505 18327
820 1 3 . 1 1 72 72 VAL H H 72 8.089 8.089 8.174 -0.085 18327
821 1 3 . 1 1 73 73 GLU N N 73 125.940 125.940 121.207 4.733 18327
822 1 3 . 1 1 73 73 GLU HA H 73 4.300 4.300 4.574 -0.274 18327
823 1 3 . 1 1 73 73 GLU CA C 73 56.610 56.610 55.691 0.918 18327
824 1 3 . 1 1 73 73 GLU CB C 73 30.710 30.710 30.806 -0.096 18327
825 1 3 . 1 1 73 73 GLU H H 73 8.464 8.464 8.466 -0.002 18327
826 1 4 . 1 1 13 13 TYR HA H 13 5.560 5.560 4.576 0.984 18327
827 1 4 . 1 1 13 13 TYR CA C 13 55.860 55.860 56.523 -0.663 18327
828 1 4 . 1 1 13 13 TYR CB C 13 42.440 42.440 40.795 1.645 18327
829 1 4 . 1 1 14 14 GLY N N 14 105.400 105.400 107.944 -2.544 18327
830 1 4 . 1 1 14 14 GLY CA C 14 45.240 45.240 44.295 0.945 18327
831 1 4 . 1 1 14 14 GLY H H 14 8.406 8.406 8.539 -0.133 18327
832 1 4 . 1 1 15 15 VAL N N 15 118.900 118.900 126.799 -7.899 18327
833 1 4 . 1 1 15 15 VAL HA H 15 5.330 5.330 4.719 0.611 18327
834 1 4 . 1 1 15 15 VAL CA C 15 59.210 59.210 60.924 -1.714 18327
835 1 4 . 1 1 15 15 VAL CB C 15 35.740 35.740 33.449 2.291 18327
836 1 4 . 1 1 15 15 VAL H H 15 8.854 8.854 8.528 0.326 18327
837 1 4 . 1 1 16 16 ALA N N 16 129.400 129.400 129.235 0.165 18327
838 1 4 . 1 1 16 16 ALA HA H 16 5.000 5.000 4.757 0.243 18327
839 1 4 . 1 1 16 16 ALA CA C 16 52.000 52.000 51.645 0.355 18327
840 1 4 . 1 1 16 16 ALA CB C 16 19.330 19.330 20.044 -0.714 18327
841 1 4 . 1 1 16 16 ALA H H 16 9.112 9.112 8.944 0.168 18327
842 1 4 . 1 1 17 17 PHE N N 17 123.900 123.900 123.610 0.290 18327
843 1 4 . 1 1 17 17 PHE HA H 17 4.740 4.740 4.667 0.073 18327
844 1 4 . 1 1 17 17 PHE CA C 17 56.230 56.230 57.773 -1.543 18327
845 1 4 . 1 1 17 17 PHE CB C 17 40.000 40.000 40.559 -0.558 18327
846 1 4 . 1 1 17 17 PHE H H 17 8.785 8.785 8.996 -0.211 18327
847 1 4 . 1 1 18 18 TYR N N 18 118.100 118.100 118.928 -0.828 18327
848 1 4 . 1 1 18 18 TYR HA H 18 4.490 4.490 4.473 0.017 18327
849 1 4 . 1 1 18 18 TYR CA C 18 55.300 55.300 57.557 -2.257 18327
850 1 4 . 1 1 18 18 TYR CB C 18 42.810 42.810 41.625 1.185 18327
851 1 4 . 1 1 18 18 TYR H H 18 7.288 7.288 7.370 -0.082 18327
852 1 4 . 1 1 19 19 ASN N N 19 116.800 116.800 122.123 -5.323 18327
853 1 4 . 1 1 19 19 ASN HA H 19 4.710 4.710 4.906 -0.196 18327
854 1 4 . 1 1 19 19 ASN CA C 19 52.940 52.940 53.382 -0.442 18327
855 1 4 . 1 1 19 19 ASN CB C 19 39.060 39.060 39.417 -0.357 18327
856 1 4 . 1 1 19 19 ASN H H 19 8.122 8.122 8.414 -0.292 18327
857 1 4 . 1 1 20 20 TYR N N 20 122.000 122.000 125.657 -3.657 18327
858 1 4 . 1 1 20 20 TYR HA H 20 4.710 4.710 4.886 -0.176 18327
859 1 4 . 1 1 20 20 TYR CA C 20 57.720 57.720 57.246 0.474 18327
860 1 4 . 1 1 20 20 TYR CB C 20 42.250 42.250 42.824 -0.574 18327
861 1 4 . 1 1 20 20 TYR H H 20 8.994 8.994 9.232 -0.238 18327
862 1 4 . 1 1 21 21 ASP N N 21 128.500 128.500 123.481 5.019 18327
863 1 4 . 1 1 21 21 ASP HA H 21 4.790 4.790 4.717 0.073 18327
864 1 4 . 1 1 21 21 ASP CA C 21 52.370 52.370 52.499 -0.129 18327
865 1 4 . 1 1 21 21 ASP CB C 21 41.130 41.130 44.210 -3.080 18327
866 1 4 . 1 1 21 21 ASP H H 21 7.839 7.839 7.711 0.128 18327
867 1 4 . 1 1 22 22 ALA N N 22 125.200 125.200 122.630 2.570 18327
868 1 4 . 1 1 22 22 ALA HA H 22 4.050 4.050 4.160 -0.110 18327
869 1 4 . 1 1 22 22 ALA CA C 22 52.940 52.940 53.309 -0.370 18327
870 1 4 . 1 1 22 22 ALA CB C 22 20.450 20.450 18.951 1.498 18327
871 1 4 . 1 1 22 22 ALA H H 22 8.107 8.107 8.260 -0.153 18327
872 1 4 . 1 1 23 23 ARG N N 23 122.200 122.200 123.670 -1.470 18327
873 1 4 . 1 1 23 23 ARG HA H 23 4.350 4.350 4.429 -0.079 18327
874 1 4 . 1 1 23 23 ARG CA C 23 55.490 55.490 55.541 -0.051 18327
875 1 4 . 1 1 23 23 ARG CB C 23 30.700 30.700 30.633 0.067 18327
876 1 4 . 1 1 23 23 ARG H H 23 8.889 8.889 8.835 0.054 18327
877 1 4 . 1 1 24 24 GLY N N 24 105.200 105.200 107.021 -1.821 18327
878 1 4 . 1 1 24 24 GLY CA C 24 44.500 44.500 45.201 -0.701 18327
879 1 4 . 1 1 24 24 GLY H H 24 7.267 7.267 7.560 -0.293 18327
880 1 4 . 1 1 25 25 ALA N N 25 122.200 122.200 122.643 -0.443 18327
881 1 4 . 1 1 25 25 ALA HA H 25 4.160 4.160 4.236 -0.076 18327
882 1 4 . 1 1 25 25 ALA CA C 25 54.440 54.440 54.245 0.195 18327
883 1 4 . 1 1 25 25 ALA CB C 25 18.770 18.770 18.703 0.067 18327
884 1 4 . 1 1 25 25 ALA H H 25 8.621 8.621 8.462 0.159 18327
885 1 4 . 1 1 26 26 ASP N N 26 114.700 114.700 118.942 -4.242 18327
886 1 4 . 1 1 26 26 ASP HA H 26 4.700 4.700 4.739 -0.039 18327
887 1 4 . 1 1 26 26 ASP CA C 26 53.870 53.870 53.656 0.214 18327
888 1 4 . 1 1 26 26 ASP CB C 26 40.390 40.390 40.408 -0.018 18327
889 1 4 . 1 1 26 26 ASP H H 26 8.949 8.949 8.474 0.475 18327
890 1 4 . 1 1 27 27 GLU N N 27 118.800 118.800 119.241 -0.441 18327
891 1 4 . 1 1 27 27 GLU HA H 27 5.220 5.220 4.840 0.380 18327
892 1 4 . 1 1 27 27 GLU CA C 27 54.930 54.930 55.304 -0.374 18327
893 1 4 . 1 1 27 27 GLU CB C 27 32.880 32.880 31.369 1.511 18327
894 1 4 . 1 1 27 27 GLU H H 27 7.542 7.542 7.524 0.018 18327
895 1 4 . 1 1 28 28 LEU N N 28 121.400 121.400 120.180 1.220 18327
896 1 4 . 1 1 28 28 LEU HA H 28 4.760 4.760 4.750 0.010 18327
897 1 4 . 1 1 28 28 LEU CA C 28 53.120 53.120 54.497 -1.377 18327
898 1 4 . 1 1 28 28 LEU CB C 28 44.500 44.500 45.274 -0.774 18327
899 1 4 . 1 1 28 28 LEU H H 28 8.897 8.897 8.392 0.505 18327
900 1 4 . 1 1 29 29 SER N N 29 115.700 115.700 120.664 -4.964 18327
901 1 4 . 1 1 29 29 SER HA H 29 5.030 5.030 4.908 0.122 18327
902 1 4 . 1 1 29 29 SER CA C 29 58.470 58.470 58.160 0.310 18327
903 1 4 . 1 1 29 29 SER CB C 29 63.690 63.690 64.582 -0.892 18327
904 1 4 . 1 1 29 29 SER H H 29 7.949 7.949 8.394 -0.445 18327
905 1 4 . 1 1 30 30 LEU N N 30 121.300 121.300 119.794 1.506 18327
906 1 4 . 1 1 30 30 LEU HA H 30 4.800 4.800 4.697 0.103 18327
907 1 4 . 1 1 30 30 LEU CA C 30 52.940 52.940 55.624 -2.684 18327
908 1 4 . 1 1 30 30 LEU CB C 30 46.370 46.370 46.657 -0.287 18327
909 1 4 . 1 1 30 30 LEU H H 30 9.503 9.503 8.492 1.012 18327
910 1 4 . 1 1 31 31 GLN N N 31 123.100 123.100 119.663 3.437 18327
911 1 4 . 1 1 31 31 GLN HA H 31 5.070 5.070 4.772 0.298 18327
912 1 4 . 1 1 31 31 GLN CA C 31 52.940 52.940 54.154 -1.214 18327
913 1 4 . 1 1 31 31 GLN CB C 31 31.190 31.190 32.143 -0.953 18327
914 1 4 . 1 1 31 31 GLN H H 31 9.152 9.152 8.298 0.854 18327
915 1 4 . 1 1 32 32 ILE N N 32 120.800 120.800 120.053 0.747 18327
916 1 4 . 1 1 32 32 ILE HA H 32 3.030 3.030 3.579 -0.549 18327
917 1 4 . 1 1 32 32 ILE CA C 32 64.250 64.250 62.495 1.755 18327
918 1 4 . 1 1 32 32 ILE CB C 32 37.940 37.940 37.312 0.628 18327
919 1 4 . 1 1 32 32 ILE H H 32 8.019 8.019 8.487 -0.468 18327
920 1 4 . 1 1 33 33 GLY N N 33 115.700 115.700 114.094 1.606 18327
921 1 4 . 1 1 33 33 GLY CA C 33 44.500 44.500 44.928 -0.428 18327
922 1 4 . 1 1 33 33 GLY H H 33 8.777 8.777 8.586 0.191 18327
923 1 4 . 1 1 34 34 ASP N N 34 122.300 122.300 121.241 1.059 18327
924 1 4 . 1 1 34 34 ASP HA H 34 4.640 4.640 4.990 -0.350 18327
925 1 4 . 1 1 34 34 ASP CA C 34 55.860 55.860 53.805 2.055 18327
926 1 4 . 1 1 34 34 ASP CB C 34 41.310 41.310 41.984 -0.674 18327
927 1 4 . 1 1 34 34 ASP H H 34 8.690 8.690 7.576 1.114 18327
928 1 4 . 1 1 35 35 THR N N 35 117.900 117.900 115.343 2.557 18327
929 1 4 . 1 1 35 35 THR HA H 35 5.160 5.160 5.148 0.012 18327
930 1 4 . 1 1 35 35 THR CA C 35 61.450 61.450 61.338 0.112 18327
931 1 4 . 1 1 35 35 THR CB C 35 69.090 69.090 70.739 -1.649 18327
932 1 4 . 1 1 35 35 THR H H 35 8.389 8.389 8.188 0.201 18327
933 1 4 . 1 1 36 36 VAL N N 36 118.200 118.200 118.025 0.175 18327
934 1 4 . 1 1 36 36 VAL HA H 36 5.100 5.100 4.850 0.250 18327
935 1 4 . 1 1 36 36 VAL CA C 36 57.910 57.910 59.765 -1.855 18327
936 1 4 . 1 1 36 36 VAL CB C 36 34.190 34.190 34.229 -0.039 18327
937 1 4 . 1 1 36 36 VAL H H 36 9.019 9.019 9.041 -0.022 18327
938 1 4 . 1 1 37 37 HIS N N 37 122.100 122.100 119.362 2.738 18327
939 1 4 . 1 1 37 37 HIS HA H 37 4.840 4.840 4.937 -0.097 18327
940 1 4 . 1 1 37 37 HIS CA C 37 52.560 52.560 54.141 -1.581 18327
941 1 4 . 1 1 37 37 HIS CB C 37 31.260 31.260 32.729 -1.469 18327
942 1 4 . 1 1 37 37 HIS H H 37 8.489 8.489 8.699 -0.210 18327
943 1 4 . 1 1 38 38 ILE N N 38 126.400 126.400 126.463 -0.063 18327
944 1 4 . 1 1 38 38 ILE HA H 38 3.780 3.780 4.367 -0.587 18327
945 1 4 . 1 1 38 38 ILE CA C 38 61.640 61.640 61.158 0.482 18327
946 1 4 . 1 1 38 38 ILE CB C 38 38.880 38.880 39.132 -0.251 18327
947 1 4 . 1 1 38 38 ILE H H 38 8.636 8.636 8.778 -0.142 18327
948 1 4 . 1 1 39 39 LEU N N 39 126.000 126.000 124.448 1.552 18327
949 1 4 . 1 1 39 39 LEU HA H 39 4.400 4.400 4.740 -0.340 18327
950 1 4 . 1 1 39 39 LEU CA C 39 55.490 55.490 55.016 0.474 18327
951 1 4 . 1 1 39 39 LEU CB C 39 43.750 43.750 44.451 -0.701 18327
952 1 4 . 1 1 39 39 LEU H H 39 9.162 9.162 8.983 0.179 18327
953 1 4 . 1 1 40 40 GLU N N 40 115.100 115.100 117.860 -2.760 18327
954 1 4 . 1 1 40 40 GLU HA H 40 7.895 7.895 4.817 3.078 18327
955 1 4 . 1 1 41 41 THR N N 41 116.400 116.400 109.278 7.122 18327
956 1 4 . 1 1 41 41 THR HA H 41 4.270 4.270 4.710 -0.440 18327
957 1 4 . 1 1 41 41 THR CA C 41 60.890 60.890 60.612 0.278 18327
958 1 4 . 1 1 41 41 THR CB C 41 69.650 69.650 70.768 -1.118 18327
959 1 4 . 1 1 41 41 THR H H 41 8.162 8.162 8.346 -0.184 18327
960 1 4 . 1 1 43 43 GLU N N 43 123.300 123.300 121.160 2.140 18327
961 1 4 . 1 1 43 43 GLU HA H 43 4.270 4.270 4.319 -0.049 18327
962 1 4 . 1 1 43 43 GLU CA C 43 57.350 57.350 55.012 2.338 18327
963 1 4 . 1 1 43 43 GLU CB C 43 26.790 26.790 29.512 -2.722 18327
964 1 4 . 1 1 43 43 GLU H H 43 8.108 8.108 8.358 -0.250 18327
965 1 4 . 1 1 44 44 GLY CA C 44 45.440 45.440 45.604 -0.164 18327
966 1 4 . 1 1 45 45 TRP N N 45 124.100 124.100 119.115 4.985 18327
967 1 4 . 1 1 45 45 TRP HA H 45 4.690 4.690 4.664 0.026 18327
968 1 4 . 1 1 45 45 TRP H H 45 8.590 8.590 7.389 1.201 18327
969 1 4 . 1 1 46 46 TYR HA H 46 5.600 5.600 4.600 1.000 18327
970 1 4 . 1 1 46 46 TYR CA C 46 54.060 54.060 57.080 -3.020 18327
971 1 4 . 1 1 46 46 TYR CB C 46 42.060 42.060 42.140 -0.080 18327
972 1 4 . 1 1 47 47 ARG N N 47 118.100 118.100 120.841 -2.741 18327
973 1 4 . 1 1 47 47 ARG HA H 47 5.070 5.070 4.932 0.138 18327
974 1 4 . 1 1 47 47 ARG CA C 47 54.060 54.060 54.212 -0.152 18327
975 1 4 . 1 1 47 47 ARG CB C 47 33.250 33.250 34.569 -1.319 18327
976 1 4 . 1 1 47 47 ARG H H 47 8.495 8.495 9.090 -0.595 18327
977 1 4 . 1 1 48 48 GLY N N 48 114.000 114.000 112.970 1.030 18327
978 1 4 . 1 1 48 48 GLY CA C 48 46.560 46.560 46.252 0.308 18327
979 1 4 . 1 1 48 48 GLY H H 48 9.183 9.183 9.149 0.034 18327
980 1 4 . 1 1 49 49 TYR N N 49 116.200 116.200 116.079 0.121 18327
981 1 4 . 1 1 49 49 TYR HA H 49 5.380 5.380 5.071 0.309 18327
982 1 4 . 1 1 49 49 TYR CA C 49 55.110 55.110 56.874 -1.764 18327
983 1 4 . 1 1 49 49 TYR CB C 49 40.750 40.750 39.427 1.323 18327
984 1 4 . 1 1 49 49 TYR H H 49 8.199 8.199 8.371 -0.172 18327
985 1 4 . 1 1 50 50 THR N N 50 112.200 112.200 111.456 0.744 18327
986 1 4 . 1 1 50 50 THR HA H 50 5.120 5.120 4.284 0.836 18327
987 1 4 . 1 1 50 50 THR CA C 50 59.770 59.770 60.597 -0.827 18327
988 1 4 . 1 1 50 50 THR CB C 50 69.460 69.460 69.937 -0.477 18327
989 1 4 . 1 1 50 50 THR H H 50 9.436 9.436 8.311 1.125 18327
990 1 4 . 1 1 51 51 LEU N N 51 121.300 121.300 120.077 1.223 18327
991 1 4 . 1 1 51 51 LEU HA H 51 4.230 4.230 4.359 -0.129 18327
992 1 4 . 1 1 51 51 LEU CA C 51 56.790 56.790 55.312 1.478 18327
993 1 4 . 1 1 51 51 LEU CB C 51 40.000 40.000 42.005 -2.005 18327
994 1 4 . 1 1 51 51 LEU H H 51 8.313 8.313 8.283 0.030 18327
995 1 4 . 1 1 52 52 ARG N N 52 116.600 116.600 117.982 -1.382 18327
996 1 4 . 1 1 52 52 ARG HA H 52 4.250 4.250 4.177 0.073 18327
997 1 4 . 1 1 52 52 ARG CA C 52 57.350 57.350 57.126 0.224 18327
998 1 4 . 1 1 52 52 ARG CB C 52 30.510 30.510 30.924 -0.414 18327
999 1 4 . 1 1 52 52 ARG H H 52 8.053 8.053 7.833 0.220 18327
1000 1 4 . 1 1 53 53 LYS N N 53 122.600 122.600 118.947 3.653 18327
1001 1 4 . 1 1 53 53 LYS HA H 53 4.620 4.620 4.521 0.099 18327
1002 1 4 . 1 1 53 53 LYS CA C 53 54.620 54.620 55.826 -1.206 18327
1003 1 4 . 1 1 53 53 LYS CB C 53 32.310 32.310 34.394 -2.084 18327
1004 1 4 . 1 1 53 53 LYS H H 53 7.655 7.655 7.519 0.136 18327
1005 1 4 . 1 1 54 54 LYS N N 54 124.900 124.900 123.205 1.695 18327
1006 1 4 . 1 1 54 54 LYS HA H 54 4.090 4.090 4.279 -0.189 18327
1007 1 4 . 1 1 54 54 LYS CA C 54 58.470 58.470 58.034 0.436 18327
1008 1 4 . 1 1 54 54 LYS CB C 54 32.130 32.130 32.599 -0.469 18327
1009 1 4 . 1 1 54 54 LYS H H 54 8.499 8.499 8.707 -0.208 18327
1010 1 4 . 1 1 55 55 SER N N 55 110.100 110.100 114.473 -4.373 18327
1011 1 4 . 1 1 55 55 SER HA H 55 4.140 4.140 4.272 -0.132 18327
1012 1 4 . 1 1 55 55 SER CA C 55 58.470 58.470 60.042 -1.572 18327
1013 1 4 . 1 1 55 55 SER CB C 55 63.310 63.310 62.714 0.596 18327
1014 1 4 . 1 1 55 55 SER H H 55 7.862 7.862 8.015 -0.153 18327
1015 1 4 . 1 1 56 56 LYS N N 56 124.000 124.000 122.157 1.843 18327
1016 1 4 . 1 1 56 56 LYS HA H 56 4.700 4.700 4.349 0.351 18327
1017 1 4 . 1 1 56 56 LYS CA C 56 54.810 54.810 55.673 -0.863 18327
1018 1 4 . 1 1 56 56 LYS CB C 56 33.250 33.250 31.752 1.498 18327
1019 1 4 . 1 1 56 56 LYS H H 56 7.481 7.481 8.239 -0.758 18327
1020 1 4 . 1 1 57 57 LYS N N 57 125.700 125.700 121.627 4.073 18327
1021 1 4 . 1 1 57 57 LYS HA H 57 5.330 5.330 4.543 0.787 18327
1022 1 4 . 1 1 57 57 LYS CA C 57 54.620 54.620 55.071 -0.451 18327
1023 1 4 . 1 1 57 57 LYS CB C 57 34.240 34.240 35.135 -0.895 18327
1024 1 4 . 1 1 57 57 LYS H H 57 8.475 8.475 7.784 0.691 18327
1025 1 4 . 1 1 58 58 GLY N N 58 109.400 109.400 107.672 1.728 18327
1026 1 4 . 1 1 58 58 GLY CA C 58 45.620 45.620 45.377 0.243 18327
1027 1 4 . 1 1 58 58 GLY H H 58 9.073 9.073 8.842 0.231 18327
1028 1 4 . 1 1 59 59 ILE N N 59 113.900 113.900 118.230 -4.330 18327
1029 1 4 . 1 1 59 59 ILE HA H 59 6.000 6.000 4.881 1.119 18327
1030 1 4 . 1 1 59 59 ILE CA C 59 59.590 59.590 58.627 0.963 18327
1031 1 4 . 1 1 59 59 ILE CB C 59 41.140 41.140 42.280 -1.140 18327
1032 1 4 . 1 1 59 59 ILE H H 59 8.628 8.628 8.154 0.474 18327
1033 1 4 . 1 1 60 60 PHE N N 60 116.900 116.900 114.048 2.852 18327
1034 1 4 . 1 1 60 60 PHE HA H 60 5.120 5.120 5.149 -0.029 18327
1035 1 4 . 1 1 60 60 PHE CA C 60 54.060 54.060 55.249 -1.189 18327
1036 1 4 . 1 1 60 60 PHE CB C 60 37.190 37.190 39.486 -2.296 18327
1037 1 4 . 1 1 60 60 PHE H H 60 8.724 8.724 8.438 0.286 18327
1038 1 4 . 1 1 61 61 PRO HA H 61 3.480 3.480 3.670 -0.190 18327
1039 1 4 . 1 1 61 61 PRO CA C 61 62.200 62.200 61.818 0.382 18327
1040 1 4 . 1 1 61 61 PRO CB C 61 31.190 31.190 31.451 -0.261 18327
1041 1 4 . 1 1 62 62 ALA N N 62 124.600 124.600 126.051 -1.451 18327
1042 1 4 . 1 1 62 62 ALA HA H 62 3.720 3.720 4.138 -0.418 18327
1043 1 4 . 1 1 62 62 ALA CA C 62 54.370 54.370 54.780 -0.410 18327
1044 1 4 . 1 1 62 62 ALA CB C 62 17.650 17.650 18.353 -0.703 18327
1045 1 4 . 1 1 62 62 ALA H H 62 7.898 7.898 8.267 -0.369 18327
1046 1 4 . 1 1 63 63 SER N N 63 109.700 109.700 112.753 -3.053 18327
1047 1 4 . 1 1 63 63 SER HA H 63 4.200 4.200 4.307 -0.107 18327
1048 1 4 . 1 1 63 63 SER CA C 63 59.400 59.400 60.527 -1.127 18327
1049 1 4 . 1 1 63 63 SER CB C 63 62.380 62.380 63.012 -0.632 18327
1050 1 4 . 1 1 63 63 SER H H 63 8.030 8.030 7.991 0.039 18327
1051 1 4 . 1 1 64 64 TYR N N 64 120.300 120.300 119.221 1.079 18327
1052 1 4 . 1 1 64 64 TYR HA H 64 4.260 4.260 4.423 -0.163 18327
1053 1 4 . 1 1 64 64 TYR CA C 64 57.720 57.720 59.520 -1.800 18327
1054 1 4 . 1 1 64 64 TYR CB C 64 37.560 37.560 38.381 -0.821 18327
1055 1 4 . 1 1 64 64 TYR H H 64 7.124 7.124 7.998 -0.874 18327
1056 1 4 . 1 1 65 65 ILE N N 65 118.000 118.000 115.764 2.236 18327
1057 1 4 . 1 1 65 65 ILE HA H 65 4.830 4.830 5.018 -0.188 18327
1058 1 4 . 1 1 65 65 ILE CA C 65 56.980 56.980 60.022 -3.042 18327
1059 1 4 . 1 1 65 65 ILE CB C 65 39.630 39.630 40.281 -0.650 18327
1060 1 4 . 1 1 65 65 ILE H H 65 7.671 7.671 7.474 0.197 18327
1061 1 4 . 1 1 66 66 HIS N N 66 124.500 124.500 126.538 -2.038 18327
1062 1 4 . 1 1 66 66 HIS HA H 66 5.130 5.130 5.028 0.102 18327
1063 1 4 . 1 1 66 66 HIS CA C 66 53.060 53.060 54.207 -1.147 18327
1064 1 4 . 1 1 66 66 HIS CB C 66 30.510 30.510 33.566 -3.057 18327
1065 1 4 . 1 1 66 66 HIS H H 66 9.159 9.159 8.999 0.160 18327
1066 1 4 . 1 1 67 67 LEU N N 67 127.400 127.400 127.619 -0.219 18327
1067 1 4 . 1 1 67 67 LEU HA H 67 4.560 4.560 4.679 -0.119 18327
1068 1 4 . 1 1 67 67 LEU CA C 67 55.300 55.300 56.365 -1.065 18327
1069 1 4 . 1 1 67 67 LEU CB C 67 42.060 42.060 42.758 -0.698 18327
1070 1 4 . 1 1 67 67 LEU H H 67 8.979 8.979 8.872 0.107 18327
1071 1 4 . 1 1 68 68 LYS N N 68 121.900 121.900 121.632 0.268 18327
1072 1 4 . 1 1 68 68 LYS HA H 68 4.490 4.490 4.596 -0.106 18327
1073 1 4 . 1 1 68 68 LYS CA C 68 55.110 55.110 55.434 -0.324 18327
1074 1 4 . 1 1 68 68 LYS CB C 68 34.610 34.610 36.544 -1.935 18327
1075 1 4 . 1 1 68 68 LYS H H 68 8.499 8.499 9.102 -0.603 18327
1076 1 4 . 1 1 69 69 GLU N N 69 122.100 122.100 122.730 -0.630 18327
1077 1 4 . 1 1 69 69 GLU HA H 69 4.290 4.290 4.267 0.023 18327
1078 1 4 . 1 1 69 69 GLU CA C 69 56.610 56.610 56.836 -0.226 18327
1079 1 4 . 1 1 69 69 GLU CB C 69 30.330 30.330 29.660 0.670 18327
1080 1 4 . 1 1 69 69 GLU H H 69 8.569 8.569 8.762 -0.193 18327
1081 1 4 . 1 1 70 70 ALA N N 70 123.300 123.300 127.223 -3.923 18327
1082 1 4 . 1 1 70 70 ALA HA H 70 4.210 4.210 4.088 0.122 18327
1083 1 4 . 1 1 70 70 ALA CA C 70 51.810 51.810 52.416 -0.606 18327
1084 1 4 . 1 1 70 70 ALA CB C 70 19.700 19.700 18.079 1.621 18327
1085 1 4 . 1 1 70 70 ALA H H 70 8.181 8.181 8.346 -0.165 18327
1086 1 4 . 1 1 71 71 ILE N N 71 120.000 120.000 118.207 1.793 18327
1087 1 4 . 1 1 71 71 ILE HA H 71 4.070 4.070 4.117 -0.047 18327
1088 1 4 . 1 1 71 71 ILE CA C 71 60.330 60.330 60.707 -0.377 18327
1089 1 4 . 1 1 71 71 ILE CB C 71 38.690 38.690 38.363 0.327 18327
1090 1 4 . 1 1 71 71 ILE H H 71 7.789 7.789 8.182 -0.393 18327
1091 1 4 . 1 1 72 72 VAL N N 72 124.400 124.400 122.276 2.124 18327
1092 1 4 . 1 1 72 72 VAL HA H 72 4.070 4.070 4.145 -0.075 18327
1093 1 4 . 1 1 72 72 VAL CA C 72 61.640 61.640 61.753 -0.113 18327
1094 1 4 . 1 1 72 72 VAL CB C 72 32.690 32.690 32.181 0.508 18327
1095 1 4 . 1 1 72 72 VAL H H 72 8.089 8.089 8.052 0.037 18327
1096 1 4 . 1 1 73 73 GLU N N 73 125.940 125.940 118.639 7.301 18327
1097 1 4 . 1 1 73 73 GLU HA H 73 4.300 4.300 4.163 0.137 18327
1098 1 4 . 1 1 73 73 GLU CA C 73 56.610 56.610 56.772 -0.162 18327
1099 1 4 . 1 1 73 73 GLU CB C 73 30.710 30.710 29.722 0.988 18327
1100 1 4 . 1 1 73 73 GLU H H 73 8.464 8.464 8.399 0.065 18327
1101 1 5 . 1 1 13 13 TYR HA H 13 5.560 5.560 4.805 0.755 18327
1102 1 5 . 1 1 13 13 TYR CA C 13 55.860 55.860 56.998 -1.138 18327
1103 1 5 . 1 1 13 13 TYR CB C 13 42.440 42.440 42.126 0.314 18327
1104 1 5 . 1 1 14 14 GLY N N 14 105.400 105.400 106.674 -1.274 18327
1105 1 5 . 1 1 14 14 GLY CA C 14 45.240 45.240 43.547 1.693 18327
1106 1 5 . 1 1 14 14 GLY H H 14 8.406 8.406 9.085 -0.679 18327
1107 1 5 . 1 1 15 15 VAL N N 15 118.900 118.900 120.529 -1.629 18327
1108 1 5 . 1 1 15 15 VAL HA H 15 5.330 5.330 4.829 0.501 18327
1109 1 5 . 1 1 15 15 VAL CA C 15 59.210 59.210 60.272 -1.062 18327
1110 1 5 . 1 1 15 15 VAL CB C 15 35.740 35.740 36.197 -0.457 18327
1111 1 5 . 1 1 15 15 VAL H H 15 8.854 8.854 8.092 0.762 18327
1112 1 5 . 1 1 16 16 ALA N N 16 129.400 129.400 127.788 1.612 18327
1113 1 5 . 1 1 16 16 ALA HA H 16 5.000 5.000 4.931 0.069 18327
1114 1 5 . 1 1 16 16 ALA CA C 16 52.000 52.000 51.086 0.914 18327
1115 1 5 . 1 1 16 16 ALA CB C 16 19.330 19.330 20.578 -1.248 18327
1116 1 5 . 1 1 16 16 ALA H H 16 9.112 9.112 9.039 0.073 18327
1117 1 5 . 1 1 17 17 PHE N N 17 123.900 123.900 123.635 0.265 18327
1118 1 5 . 1 1 17 17 PHE HA H 17 4.740 4.740 4.646 0.094 18327
1119 1 5 . 1 1 17 17 PHE CA C 17 56.230 56.230 57.480 -1.250 18327
1120 1 5 . 1 1 17 17 PHE CB C 17 40.000 40.000 40.868 -0.868 18327
1121 1 5 . 1 1 17 17 PHE H H 17 8.785 8.785 8.677 0.108 18327
1122 1 5 . 1 1 18 18 TYR N N 18 118.100 118.100 119.828 -1.728 18327
1123 1 5 . 1 1 18 18 TYR HA H 18 4.490 4.490 4.501 -0.011 18327
1124 1 5 . 1 1 18 18 TYR CA C 18 55.300 55.300 57.608 -2.308 18327
1125 1 5 . 1 1 18 18 TYR CB C 18 42.810 42.810 41.273 1.537 18327
1126 1 5 . 1 1 18 18 TYR H H 18 7.288 7.288 7.651 -0.363 18327
1127 1 5 . 1 1 19 19 ASN N N 19 116.800 116.800 120.839 -4.039 18327
1128 1 5 . 1 1 19 19 ASN HA H 19 4.710 4.710 4.952 -0.242 18327
1129 1 5 . 1 1 19 19 ASN CA C 19 52.940 52.940 53.365 -0.425 18327
1130 1 5 . 1 1 19 19 ASN CB C 19 39.060 39.060 40.242 -1.183 18327
1131 1 5 . 1 1 19 19 ASN H H 19 8.122 8.122 8.685 -0.563 18327
1132 1 5 . 1 1 20 20 TYR N N 20 122.000 122.000 122.577 -0.577 18327
1133 1 5 . 1 1 20 20 TYR HA H 20 4.710 4.710 4.663 0.047 18327
1134 1 5 . 1 1 20 20 TYR CA C 20 57.720 57.720 58.387 -0.667 18327
1135 1 5 . 1 1 20 20 TYR CB C 20 42.250 42.250 42.548 -0.298 18327
1136 1 5 . 1 1 20 20 TYR H H 20 8.994 8.994 8.991 0.003 18327
1137 1 5 . 1 1 21 21 ASP N N 21 128.500 128.500 122.509 5.991 18327
1138 1 5 . 1 1 21 21 ASP HA H 21 4.790 4.790 5.010 -0.220 18327
1139 1 5 . 1 1 21 21 ASP CA C 21 52.370 52.370 52.601 -0.231 18327
1140 1 5 . 1 1 21 21 ASP CB C 21 41.130 41.130 42.794 -1.664 18327
1141 1 5 . 1 1 21 21 ASP H H 21 7.839 7.839 7.478 0.361 18327
1142 1 5 . 1 1 22 22 ALA N N 22 125.200 125.200 122.430 2.770 18327
1143 1 5 . 1 1 22 22 ALA HA H 22 4.050 4.050 4.493 -0.443 18327
1144 1 5 . 1 1 22 22 ALA CA C 22 52.940 52.940 52.892 0.048 18327
1145 1 5 . 1 1 22 22 ALA CB C 22 20.450 20.450 19.501 0.949 18327
1146 1 5 . 1 1 22 22 ALA H H 22 8.107 8.107 8.458 -0.351 18327
1147 1 5 . 1 1 23 23 ARG N N 23 122.200 122.200 122.383 -0.183 18327
1148 1 5 . 1 1 23 23 ARG HA H 23 4.350 4.350 4.491 -0.141 18327
1149 1 5 . 1 1 23 23 ARG CA C 23 55.490 55.490 55.716 -0.226 18327
1150 1 5 . 1 1 23 23 ARG CB C 23 30.700 30.700 30.628 0.072 18327
1151 1 5 . 1 1 23 23 ARG H H 23 8.889 8.889 9.067 -0.178 18327
1152 1 5 . 1 1 24 24 GLY N N 24 105.200 105.200 106.954 -1.754 18327
1153 1 5 . 1 1 24 24 GLY CA C 24 44.500 44.500 44.587 -0.088 18327
1154 1 5 . 1 1 24 24 GLY H H 24 7.267 7.267 7.567 -0.300 18327
1155 1 5 . 1 1 25 25 ALA N N 25 122.200 122.200 121.433 0.767 18327
1156 1 5 . 1 1 25 25 ALA HA H 25 4.160 4.160 4.362 -0.202 18327
1157 1 5 . 1 1 25 25 ALA CA C 25 54.440 54.440 53.939 0.501 18327
1158 1 5 . 1 1 25 25 ALA CB C 25 18.770 18.770 19.137 -0.367 18327
1159 1 5 . 1 1 25 25 ALA H H 25 8.621 8.621 8.504 0.117 18327
1160 1 5 . 1 1 26 26 ASP N N 26 114.700 114.700 119.934 -5.234 18327
1161 1 5 . 1 1 26 26 ASP HA H 26 4.700 4.700 4.744 -0.044 18327
1162 1 5 . 1 1 26 26 ASP CA C 26 53.870 53.870 53.836 0.035 18327
1163 1 5 . 1 1 26 26 ASP CB C 26 40.390 40.390 40.490 -0.100 18327
1164 1 5 . 1 1 26 26 ASP H H 26 8.949 8.949 8.555 0.394 18327
1165 1 5 . 1 1 27 27 GLU N N 27 118.800 118.800 117.844 0.956 18327
1166 1 5 . 1 1 27 27 GLU HA H 27 5.220 5.220 4.983 0.237 18327
1167 1 5 . 1 1 27 27 GLU CA C 27 54.930 54.930 54.430 0.500 18327
1168 1 5 . 1 1 27 27 GLU CB C 27 32.880 32.880 32.311 0.569 18327
1169 1 5 . 1 1 27 27 GLU H H 27 7.542 7.542 7.555 -0.013 18327
1170 1 5 . 1 1 28 28 LEU N N 28 121.400 121.400 120.151 1.249 18327
1171 1 5 . 1 1 28 28 LEU HA H 28 4.760 4.760 4.779 -0.019 18327
1172 1 5 . 1 1 28 28 LEU CA C 28 53.120 53.120 53.713 -0.593 18327
1173 1 5 . 1 1 28 28 LEU CB C 28 44.500 44.500 46.046 -1.546 18327
1174 1 5 . 1 1 28 28 LEU H H 28 8.897 8.897 8.356 0.541 18327
1175 1 5 . 1 1 29 29 SER N N 29 115.700 115.700 116.395 -0.695 18327
1176 1 5 . 1 1 29 29 SER HA H 29 5.030 5.030 5.131 -0.101 18327
1177 1 5 . 1 1 29 29 SER CA C 29 58.470 58.470 57.970 0.500 18327
1178 1 5 . 1 1 29 29 SER CB C 29 63.690 63.690 64.221 -0.531 18327
1179 1 5 . 1 1 29 29 SER H H 29 7.949 7.949 8.393 -0.444 18327
1180 1 5 . 1 1 30 30 LEU N N 30 121.300 121.300 121.776 -0.476 18327
1181 1 5 . 1 1 30 30 LEU HA H 30 4.800 4.800 4.641 0.159 18327
1182 1 5 . 1 1 30 30 LEU CA C 30 52.940 52.940 55.536 -2.596 18327
1183 1 5 . 1 1 30 30 LEU CB C 30 46.370 46.370 46.082 0.288 18327
1184 1 5 . 1 1 30 30 LEU H H 30 9.503 9.503 8.951 0.552 18327
1185 1 5 . 1 1 31 31 GLN N N 31 123.100 123.100 121.007 2.093 18327
1186 1 5 . 1 1 31 31 GLN HA H 31 5.070 5.070 4.700 0.370 18327
1187 1 5 . 1 1 31 31 GLN CA C 31 52.940 52.940 54.257 -1.317 18327
1188 1 5 . 1 1 31 31 GLN CB C 31 31.190 31.190 32.586 -1.396 18327
1189 1 5 . 1 1 31 31 GLN H H 31 9.152 9.152 8.495 0.657 18327
1190 1 5 . 1 1 32 32 ILE N N 32 120.800 120.800 121.393 -0.593 18327
1191 1 5 . 1 1 32 32 ILE HA H 32 3.030 3.030 3.880 -0.850 18327
1192 1 5 . 1 1 32 32 ILE CA C 32 64.250 64.250 62.251 1.999 18327
1193 1 5 . 1 1 32 32 ILE CB C 32 37.940 37.940 37.639 0.301 18327
1194 1 5 . 1 1 32 32 ILE H H 32 8.019 8.019 8.517 -0.498 18327
1195 1 5 . 1 1 33 33 GLY N N 33 115.700 115.700 114.322 1.378 18327
1196 1 5 . 1 1 33 33 GLY CA C 33 44.500 44.500 44.883 -0.383 18327
1197 1 5 . 1 1 33 33 GLY H H 33 8.777 8.777 8.525 0.252 18327
1198 1 5 . 1 1 34 34 ASP N N 34 122.300 122.300 121.984 0.316 18327
1199 1 5 . 1 1 34 34 ASP HA H 34 4.640 4.640 4.893 -0.253 18327
1200 1 5 . 1 1 34 34 ASP CA C 34 55.860 55.860 53.512 2.348 18327
1201 1 5 . 1 1 34 34 ASP CB C 34 41.310 41.310 42.324 -1.014 18327
1202 1 5 . 1 1 34 34 ASP H H 34 8.690 8.690 7.590 1.100 18327
1203 1 5 . 1 1 35 35 THR N N 35 117.900 117.900 116.339 1.561 18327
1204 1 5 . 1 1 35 35 THR HA H 35 5.160 5.160 5.162 -0.002 18327
1205 1 5 . 1 1 35 35 THR CA C 35 61.450 61.450 61.396 0.054 18327
1206 1 5 . 1 1 35 35 THR CB C 35 69.090 69.090 70.662 -1.571 18327
1207 1 5 . 1 1 35 35 THR H H 35 8.389 8.389 8.311 0.078 18327
1208 1 5 . 1 1 36 36 VAL N N 36 118.200 118.200 117.395 0.805 18327
1209 1 5 . 1 1 36 36 VAL HA H 36 5.100 5.100 4.793 0.307 18327
1210 1 5 . 1 1 36 36 VAL CA C 36 57.910 57.910 60.107 -2.197 18327
1211 1 5 . 1 1 36 36 VAL CB C 36 34.190 34.190 34.797 -0.607 18327
1212 1 5 . 1 1 36 36 VAL H H 36 9.019 9.019 9.023 -0.004 18327
1213 1 5 . 1 1 37 37 HIS N N 37 122.100 122.100 119.349 2.751 18327
1214 1 5 . 1 1 37 37 HIS HA H 37 4.840 4.840 4.928 -0.088 18327
1215 1 5 . 1 1 37 37 HIS CA C 37 52.560 52.560 54.283 -1.723 18327
1216 1 5 . 1 1 37 37 HIS CB C 37 31.260 31.260 33.512 -2.252 18327
1217 1 5 . 1 1 37 37 HIS H H 37 8.489 8.489 8.255 0.234 18327
1218 1 5 . 1 1 38 38 ILE N N 38 126.400 126.400 124.274 2.126 18327
1219 1 5 . 1 1 38 38 ILE HA H 38 3.780 3.780 4.040 -0.260 18327
1220 1 5 . 1 1 38 38 ILE CA C 38 61.640 61.640 61.242 0.398 18327
1221 1 5 . 1 1 38 38 ILE CB C 38 38.880 38.880 38.841 0.039 18327
1222 1 5 . 1 1 38 38 ILE H H 38 8.636 8.636 8.308 0.328 18327
1223 1 5 . 1 1 39 39 LEU N N 39 126.000 126.000 123.771 2.229 18327
1224 1 5 . 1 1 39 39 LEU HA H 39 4.400 4.400 4.818 -0.418 18327
1225 1 5 . 1 1 39 39 LEU CA C 39 55.490 55.490 55.312 0.179 18327
1226 1 5 . 1 1 39 39 LEU CB C 39 43.750 43.750 44.777 -1.027 18327
1227 1 5 . 1 1 39 39 LEU H H 39 9.162 9.162 8.426 0.736 18327
1228 1 5 . 1 1 40 40 GLU N N 40 115.100 115.100 117.504 -2.404 18327
1229 1 5 . 1 1 40 40 GLU HA H 40 7.895 7.895 4.708 3.187 18327
1230 1 5 . 1 1 41 41 THR N N 41 116.400 116.400 111.318 5.082 18327
1231 1 5 . 1 1 41 41 THR HA H 41 4.270 4.270 4.749 -0.479 18327
1232 1 5 . 1 1 41 41 THR CA C 41 60.890 60.890 60.395 0.495 18327
1233 1 5 . 1 1 41 41 THR CB C 41 69.650 69.650 71.225 -1.575 18327
1234 1 5 . 1 1 41 41 THR H H 41 8.162 8.162 8.423 -0.261 18327
1235 1 5 . 1 1 43 43 GLU N N 43 123.300 123.300 121.184 2.116 18327
1236 1 5 . 1 1 43 43 GLU HA H 43 4.270 4.270 4.461 -0.191 18327
1237 1 5 . 1 1 43 43 GLU CA C 43 57.350 57.350 55.793 1.557 18327
1238 1 5 . 1 1 43 43 GLU CB C 43 26.790 26.790 29.638 -2.848 18327
1239 1 5 . 1 1 43 43 GLU H H 43 8.108 8.108 8.460 -0.352 18327
1240 1 5 . 1 1 44 44 GLY CA C 44 45.440 45.440 45.843 -0.403 18327
1241 1 5 . 1 1 45 45 TRP N N 45 124.100 124.100 118.892 5.208 18327
1242 1 5 . 1 1 45 45 TRP HA H 45 4.690 4.690 4.595 0.095 18327
1243 1 5 . 1 1 45 45 TRP H H 45 8.590 8.590 7.366 1.224 18327
1244 1 5 . 1 1 46 46 TYR HA H 46 5.600 5.600 4.591 1.008 18327
1245 1 5 . 1 1 46 46 TYR CA C 46 54.060 54.060 57.450 -3.390 18327
1246 1 5 . 1 1 46 46 TYR CB C 46 42.060 42.060 41.847 0.213 18327
1247 1 5 . 1 1 47 47 ARG N N 47 118.100 118.100 123.713 -5.613 18327
1248 1 5 . 1 1 47 47 ARG HA H 47 5.070 5.070 5.008 0.062 18327
1249 1 5 . 1 1 47 47 ARG CA C 47 54.060 54.060 54.144 -0.084 18327
1250 1 5 . 1 1 47 47 ARG CB C 47 33.250 33.250 34.086 -0.836 18327
1251 1 5 . 1 1 47 47 ARG H H 47 8.495 8.495 9.096 -0.601 18327
1252 1 5 . 1 1 48 48 GLY N N 48 114.000 114.000 114.417 -0.417 18327
1253 1 5 . 1 1 48 48 GLY CA C 48 46.560 46.560 46.584 -0.024 18327
1254 1 5 . 1 1 48 48 GLY H H 48 9.183 9.183 9.020 0.163 18327
1255 1 5 . 1 1 49 49 TYR N N 49 116.200 116.200 116.904 -0.704 18327
1256 1 5 . 1 1 49 49 TYR HA H 49 5.380 5.380 5.097 0.283 18327
1257 1 5 . 1 1 49 49 TYR CA C 49 55.110 55.110 56.979 -1.869 18327
1258 1 5 . 1 1 49 49 TYR CB C 49 40.750 40.750 40.270 0.480 18327
1259 1 5 . 1 1 49 49 TYR H H 49 8.199 8.199 8.466 -0.267 18327
1260 1 5 . 1 1 50 50 THR N N 50 112.200 112.200 112.561 -0.361 18327
1261 1 5 . 1 1 50 50 THR HA H 50 5.120 5.120 4.179 0.941 18327
1262 1 5 . 1 1 50 50 THR CA C 50 59.770 59.770 61.115 -1.345 18327
1263 1 5 . 1 1 50 50 THR CB C 50 69.460 69.460 69.731 -0.271 18327
1264 1 5 . 1 1 50 50 THR H H 50 9.436 9.436 8.689 0.747 18327
1265 1 5 . 1 1 51 51 LEU N N 51 121.300 121.300 120.218 1.082 18327
1266 1 5 . 1 1 51 51 LEU HA H 51 4.230 4.230 4.314 -0.084 18327
1267 1 5 . 1 1 51 51 LEU CA C 51 56.790 56.790 55.604 1.186 18327
1268 1 5 . 1 1 51 51 LEU CB C 51 40.000 40.000 42.066 -2.066 18327
1269 1 5 . 1 1 51 51 LEU H H 51 8.313 8.313 8.072 0.241 18327
1270 1 5 . 1 1 52 52 ARG N N 52 116.600 116.600 119.033 -2.433 18327
1271 1 5 . 1 1 52 52 ARG HA H 52 4.250 4.250 4.088 0.162 18327
1272 1 5 . 1 1 52 52 ARG CA C 52 57.350 57.350 57.483 -0.133 18327
1273 1 5 . 1 1 52 52 ARG CB C 52 30.510 30.510 30.509 0.001 18327
1274 1 5 . 1 1 52 52 ARG H H 52 8.053 8.053 8.155 -0.102 18327
1275 1 5 . 1 1 53 53 LYS N N 53 122.600 122.600 117.406 5.194 18327
1276 1 5 . 1 1 53 53 LYS HA H 53 4.620 4.620 4.552 0.068 18327
1277 1 5 . 1 1 53 53 LYS CA C 53 54.620 54.620 55.050 -0.430 18327
1278 1 5 . 1 1 53 53 LYS CB C 53 32.310 32.310 34.234 -1.924 18327
1279 1 5 . 1 1 53 53 LYS H H 53 7.655 7.655 7.427 0.228 18327
1280 1 5 . 1 1 54 54 LYS N N 54 124.900 124.900 125.606 -0.706 18327
1281 1 5 . 1 1 54 54 LYS HA H 54 4.090 4.090 4.331 -0.241 18327
1282 1 5 . 1 1 54 54 LYS CA C 54 58.470 58.470 57.818 0.652 18327
1283 1 5 . 1 1 54 54 LYS CB C 54 32.130 32.130 32.388 -0.258 18327
1284 1 5 . 1 1 54 54 LYS H H 54 8.499 8.499 8.712 -0.213 18327
1285 1 5 . 1 1 55 55 SER N N 55 110.100 110.100 113.049 -2.949 18327
1286 1 5 . 1 1 55 55 SER HA H 55 4.140 4.140 4.235 -0.095 18327
1287 1 5 . 1 1 55 55 SER CA C 55 58.470 58.470 60.142 -1.673 18327
1288 1 5 . 1 1 55 55 SER CB C 55 63.310 63.310 63.410 -0.100 18327
1289 1 5 . 1 1 55 55 SER H H 55 7.862 7.862 8.103 -0.241 18327
1290 1 5 . 1 1 56 56 LYS N N 56 124.000 124.000 120.711 3.289 18327
1291 1 5 . 1 1 56 56 LYS HA H 56 4.700 4.700 4.499 0.201 18327
1292 1 5 . 1 1 56 56 LYS CA C 56 54.810 54.810 55.203 -0.393 18327
1293 1 5 . 1 1 56 56 LYS CB C 56 33.250 33.250 34.124 -0.874 18327
1294 1 5 . 1 1 56 56 LYS H H 56 7.481 7.481 7.303 0.178 18327
1295 1 5 . 1 1 57 57 LYS N N 57 125.700 125.700 120.782 4.918 18327
1296 1 5 . 1 1 57 57 LYS HA H 57 5.330 5.330 4.682 0.648 18327
1297 1 5 . 1 1 57 57 LYS CA C 57 54.620 54.620 54.892 -0.272 18327
1298 1 5 . 1 1 57 57 LYS CB C 57 34.240 34.240 36.524 -2.284 18327
1299 1 5 . 1 1 57 57 LYS H H 57 8.475 8.475 8.339 0.136 18327
1300 1 5 . 1 1 58 58 GLY N N 58 109.400 109.400 107.395 2.005 18327
1301 1 5 . 1 1 58 58 GLY CA C 58 45.620 45.620 45.701 -0.081 18327
1302 1 5 . 1 1 58 58 GLY H H 58 9.073 9.073 8.643 0.430 18327
1303 1 5 . 1 1 59 59 ILE N N 59 113.900 113.900 116.889 -2.989 18327
1304 1 5 . 1 1 59 59 ILE HA H 59 6.000 6.000 5.212 0.788 18327
1305 1 5 . 1 1 59 59 ILE CA C 59 59.590 59.590 59.114 0.476 18327
1306 1 5 . 1 1 59 59 ILE CB C 59 41.140 41.140 42.032 -0.892 18327
1307 1 5 . 1 1 59 59 ILE H H 59 8.628 8.628 8.223 0.405 18327
1308 1 5 . 1 1 60 60 PHE N N 60 116.900 116.900 114.308 2.592 18327
1309 1 5 . 1 1 60 60 PHE HA H 60 5.120 5.120 5.169 -0.049 18327
1310 1 5 . 1 1 60 60 PHE CA C 60 54.060 54.060 55.204 -1.144 18327
1311 1 5 . 1 1 60 60 PHE CB C 60 37.190 37.190 39.480 -2.290 18327
1312 1 5 . 1 1 60 60 PHE H H 60 8.724 8.724 8.678 0.046 18327
1313 1 5 . 1 1 61 61 PRO HA H 61 3.480 3.480 3.899 -0.419 18327
1314 1 5 . 1 1 61 61 PRO CA C 61 62.200 62.200 62.089 0.111 18327
1315 1 5 . 1 1 61 61 PRO CB C 61 31.190 31.190 31.856 -0.666 18327
1316 1 5 . 1 1 62 62 ALA N N 62 124.600 124.600 127.799 -3.199 18327
1317 1 5 . 1 1 62 62 ALA HA H 62 3.720 3.720 4.410 -0.690 18327
1318 1 5 . 1 1 62 62 ALA CA C 62 54.370 54.370 55.258 -0.888 18327
1319 1 5 . 1 1 62 62 ALA CB C 62 17.650 17.650 18.220 -0.570 18327
1320 1 5 . 1 1 62 62 ALA H H 62 7.898 7.898 8.601 -0.703 18327
1321 1 5 . 1 1 63 63 SER N N 63 109.700 109.700 114.232 -4.532 18327
1322 1 5 . 1 1 63 63 SER HA H 63 4.200 4.200 4.292 -0.092 18327
1323 1 5 . 1 1 63 63 SER CA C 63 59.400 59.400 60.712 -1.312 18327
1324 1 5 . 1 1 63 63 SER CB C 63 62.380 62.380 62.648 -0.268 18327
1325 1 5 . 1 1 63 63 SER H H 63 8.030 8.030 8.421 -0.391 18327
1326 1 5 . 1 1 64 64 TYR N N 64 120.300 120.300 117.358 2.942 18327
1327 1 5 . 1 1 64 64 TYR HA H 64 4.260 4.260 4.420 -0.160 18327
1328 1 5 . 1 1 64 64 TYR CA C 64 57.720 57.720 59.203 -1.483 18327
1329 1 5 . 1 1 64 64 TYR CB C 64 37.560 37.560 38.175 -0.615 18327
1330 1 5 . 1 1 64 64 TYR H H 64 7.124 7.124 7.968 -0.844 18327
1331 1 5 . 1 1 65 65 ILE N N 65 118.000 118.000 115.913 2.087 18327
1332 1 5 . 1 1 65 65 ILE HA H 65 4.830 4.830 5.116 -0.286 18327
1333 1 5 . 1 1 65 65 ILE CA C 65 56.980 56.980 58.419 -1.439 18327
1334 1 5 . 1 1 65 65 ILE CB C 65 39.630 39.630 39.853 -0.223 18327
1335 1 5 . 1 1 65 65 ILE H H 65 7.671 7.671 7.465 0.206 18327
1336 1 5 . 1 1 66 66 HIS N N 66 124.500 124.500 123.608 0.892 18327
1337 1 5 . 1 1 66 66 HIS HA H 66 5.130 5.130 4.927 0.203 18327
1338 1 5 . 1 1 66 66 HIS CA C 66 53.060 53.060 54.147 -1.087 18327
1339 1 5 . 1 1 66 66 HIS CB C 66 30.510 30.510 33.407 -2.897 18327
1340 1 5 . 1 1 66 66 HIS H H 66 9.159 9.159 8.850 0.309 18327
1341 1 5 . 1 1 67 67 LEU N N 67 127.400 127.400 128.527 -1.127 18327
1342 1 5 . 1 1 67 67 LEU HA H 67 4.560 4.560 5.017 -0.457 18327
1343 1 5 . 1 1 67 67 LEU CA C 67 55.300 55.300 54.660 0.639 18327
1344 1 5 . 1 1 67 67 LEU CB C 67 42.060 42.060 44.134 -2.074 18327
1345 1 5 . 1 1 67 67 LEU H H 67 8.979 8.979 8.946 0.033 18327
1346 1 5 . 1 1 68 68 LYS N N 68 121.900 121.900 121.529 0.371 18327
1347 1 5 . 1 1 68 68 LYS HA H 68 4.490 4.490 4.573 -0.083 18327
1348 1 5 . 1 1 68 68 LYS CA C 68 55.110 55.110 55.161 -0.051 18327
1349 1 5 . 1 1 68 68 LYS CB C 68 34.610 34.610 34.099 0.511 18327
1350 1 5 . 1 1 68 68 LYS H H 68 8.499 8.499 8.928 -0.429 18327
1351 1 5 . 1 1 69 69 GLU N N 69 122.100 122.100 122.957 -0.857 18327
1352 1 5 . 1 1 69 69 GLU HA H 69 4.290 4.290 4.193 0.097 18327
1353 1 5 . 1 1 69 69 GLU CA C 69 56.610 56.610 56.672 -0.062 18327
1354 1 5 . 1 1 69 69 GLU CB C 69 30.330 30.330 29.233 1.097 18327
1355 1 5 . 1 1 69 69 GLU H H 69 8.569 8.569 8.578 -0.009 18327
1356 1 5 . 1 1 70 70 ALA N N 70 123.300 123.300 125.064 -1.764 18327
1357 1 5 . 1 1 70 70 ALA HA H 70 4.210 4.210 4.107 0.103 18327
1358 1 5 . 1 1 70 70 ALA CA C 70 51.810 51.810 52.664 -0.854 18327
1359 1 5 . 1 1 70 70 ALA CB C 70 19.700 19.700 18.680 1.020 18327
1360 1 5 . 1 1 70 70 ALA H H 70 8.181 8.181 8.579 -0.398 18327
1361 1 5 . 1 1 71 71 ILE N N 71 120.000 120.000 118.837 1.163 18327
1362 1 5 . 1 1 71 71 ILE HA H 71 4.070 4.070 4.039 0.031 18327
1363 1 5 . 1 1 71 71 ILE CA C 71 60.330 60.330 61.138 -0.808 18327
1364 1 5 . 1 1 71 71 ILE CB C 71 38.690 38.690 38.554 0.135 18327
1365 1 5 . 1 1 71 71 ILE H H 71 7.789 7.789 8.212 -0.423 18327
1366 1 5 . 1 1 72 72 VAL N N 72 124.400 124.400 120.666 3.734 18327
1367 1 5 . 1 1 72 72 VAL HA H 72 4.070 4.070 4.241 -0.171 18327
1368 1 5 . 1 1 72 72 VAL CA C 72 61.640 61.640 61.788 -0.148 18327
1369 1 5 . 1 1 72 72 VAL CB C 72 32.690 32.690 32.390 0.300 18327
1370 1 5 . 1 1 72 72 VAL H H 72 8.089 8.089 8.060 0.029 18327
1371 1 5 . 1 1 73 73 GLU N N 73 125.940 125.940 123.668 2.272 18327
1372 1 5 . 1 1 73 73 GLU HA H 73 4.300 4.300 4.512 -0.212 18327
1373 1 5 . 1 1 73 73 GLU CA C 73 56.610 56.610 55.881 0.729 18327
1374 1 5 . 1 1 73 73 GLU CB C 73 30.710 30.710 31.009 -0.299 18327
1375 1 5 . 1 1 73 73 GLU H H 73 8.464 8.464 8.563 -0.099 18327
1376 1 6 . 1 1 13 13 TYR HA H 13 5.560 5.560 4.805 0.755 18327
1377 1 6 . 1 1 13 13 TYR CA C 13 55.860 55.860 57.291 -1.431 18327
1378 1 6 . 1 1 13 13 TYR CB C 13 42.440 42.440 41.106 1.334 18327
1379 1 6 . 1 1 14 14 GLY N N 14 105.400 105.400 105.400 0.000 18327
1380 1 6 . 1 1 14 14 GLY CA C 14 45.240 45.240 44.428 0.812 18327
1381 1 6 . 1 1 14 14 GLY H H 14 8.406 8.406 8.459 -0.053 18327
1382 1 6 . 1 1 15 15 VAL N N 15 118.900 118.900 119.931 -1.031 18327
1383 1 6 . 1 1 15 15 VAL HA H 15 5.330 5.330 4.869 0.461 18327
1384 1 6 . 1 1 15 15 VAL CA C 15 59.210 59.210 59.719 -0.509 18327
1385 1 6 . 1 1 15 15 VAL CB C 15 35.740 35.740 36.316 -0.576 18327
1386 1 6 . 1 1 15 15 VAL H H 15 8.854 8.854 8.204 0.650 18327
1387 1 6 . 1 1 16 16 ALA N N 16 129.400 129.400 125.921 3.479 18327
1388 1 6 . 1 1 16 16 ALA HA H 16 5.000 5.000 4.919 0.081 18327
1389 1 6 . 1 1 16 16 ALA CA C 16 52.000 52.000 50.956 1.044 18327
1390 1 6 . 1 1 16 16 ALA CB C 16 19.330 19.330 20.777 -1.447 18327
1391 1 6 . 1 1 16 16 ALA H H 16 9.112 9.112 9.186 -0.074 18327
1392 1 6 . 1 1 17 17 PHE N N 17 123.900 123.900 124.733 -0.833 18327
1393 1 6 . 1 1 17 17 PHE HA H 17 4.740 4.740 4.682 0.058 18327
1394 1 6 . 1 1 17 17 PHE CA C 17 56.230 56.230 57.181 -0.951 18327
1395 1 6 . 1 1 17 17 PHE CB C 17 40.000 40.000 41.184 -1.184 18327
1396 1 6 . 1 1 17 17 PHE H H 17 8.785 8.785 8.481 0.304 18327
1397 1 6 . 1 1 18 18 TYR N N 18 118.100 118.100 118.917 -0.817 18327
1398 1 6 . 1 1 18 18 TYR HA H 18 4.490 4.490 4.519 -0.029 18327
1399 1 6 . 1 1 18 18 TYR CA C 18 55.300 55.300 57.687 -2.387 18327
1400 1 6 . 1 1 18 18 TYR CB C 18 42.810 42.810 40.919 1.891 18327
1401 1 6 . 1 1 18 18 TYR H H 18 7.288 7.288 7.728 -0.440 18327
1402 1 6 . 1 1 19 19 ASN N N 19 116.800 116.800 121.128 -4.328 18327
1403 1 6 . 1 1 19 19 ASN HA H 19 4.710 4.710 4.885 -0.175 18327
1404 1 6 . 1 1 19 19 ASN CA C 19 52.940 52.940 53.891 -0.951 18327
1405 1 6 . 1 1 19 19 ASN CB C 19 39.060 39.060 40.230 -1.170 18327
1406 1 6 . 1 1 19 19 ASN H H 19 8.122 8.122 8.654 -0.532 18327
1407 1 6 . 1 1 20 20 TYR N N 20 122.000 122.000 122.090 -0.090 18327
1408 1 6 . 1 1 20 20 TYR HA H 20 4.710 4.710 4.640 0.070 18327
1409 1 6 . 1 1 20 20 TYR CA C 20 57.720 57.720 58.340 -0.620 18327
1410 1 6 . 1 1 20 20 TYR CB C 20 42.250 42.250 42.281 -0.031 18327
1411 1 6 . 1 1 20 20 TYR H H 20 8.994 8.994 8.366 0.628 18327
1412 1 6 . 1 1 21 21 ASP N N 21 128.500 128.500 121.106 7.394 18327
1413 1 6 . 1 1 21 21 ASP HA H 21 4.790 4.790 4.948 -0.158 18327
1414 1 6 . 1 1 21 21 ASP CA C 21 52.370 52.370 53.182 -0.812 18327
1415 1 6 . 1 1 21 21 ASP CB C 21 41.130 41.130 44.432 -3.302 18327
1416 1 6 . 1 1 21 21 ASP H H 21 7.839 7.839 7.932 -0.093 18327
1417 1 6 . 1 1 22 22 ALA N N 22 125.200 125.200 122.510 2.690 18327
1418 1 6 . 1 1 22 22 ALA HA H 22 4.050 4.050 4.504 -0.454 18327
1419 1 6 . 1 1 22 22 ALA CA C 22 52.940 52.940 53.095 -0.155 18327
1420 1 6 . 1 1 22 22 ALA CB C 22 20.450 20.450 19.830 0.620 18327
1421 1 6 . 1 1 22 22 ALA H H 22 8.107 8.107 8.467 -0.360 18327
1422 1 6 . 1 1 23 23 ARG N N 23 122.200 122.200 118.987 3.213 18327
1423 1 6 . 1 1 23 23 ARG HA H 23 4.350 4.350 4.499 -0.149 18327
1424 1 6 . 1 1 23 23 ARG CA C 23 55.490 55.490 56.183 -0.693 18327
1425 1 6 . 1 1 23 23 ARG CB C 23 30.700 30.700 30.603 0.097 18327
1426 1 6 . 1 1 23 23 ARG H H 23 8.889 8.889 8.764 0.125 18327
1427 1 6 . 1 1 24 24 GLY N N 24 105.200 105.200 107.337 -2.137 18327
1428 1 6 . 1 1 24 24 GLY CA C 24 44.500 44.500 44.688 -0.188 18327
1429 1 6 . 1 1 24 24 GLY H H 24 7.267 7.267 7.605 -0.338 18327
1430 1 6 . 1 1 25 25 ALA N N 25 122.200 122.200 121.442 0.758 18327
1431 1 6 . 1 1 25 25 ALA HA H 25 4.160 4.160 4.364 -0.204 18327
1432 1 6 . 1 1 25 25 ALA CA C 25 54.440 54.440 53.999 0.441 18327
1433 1 6 . 1 1 25 25 ALA CB C 25 18.770 18.770 19.130 -0.360 18327
1434 1 6 . 1 1 25 25 ALA H H 25 8.621 8.621 8.488 0.133 18327
1435 1 6 . 1 1 26 26 ASP N N 26 114.700 114.700 119.545 -4.845 18327
1436 1 6 . 1 1 26 26 ASP HA H 26 4.700 4.700 4.725 -0.025 18327
1437 1 6 . 1 1 26 26 ASP CA C 26 53.870 53.870 53.323 0.547 18327
1438 1 6 . 1 1 26 26 ASP CB C 26 40.390 40.390 40.562 -0.173 18327
1439 1 6 . 1 1 26 26 ASP H H 26 8.949 8.949 8.523 0.426 18327
1440 1 6 . 1 1 27 27 GLU N N 27 118.800 118.800 118.016 0.784 18327
1441 1 6 . 1 1 27 27 GLU HA H 27 5.220 5.220 4.921 0.299 18327
1442 1 6 . 1 1 27 27 GLU CA C 27 54.930 54.930 54.706 0.224 18327
1443 1 6 . 1 1 27 27 GLU CB C 27 32.880 32.880 31.750 1.130 18327
1444 1 6 . 1 1 27 27 GLU H H 27 7.542 7.542 7.536 0.006 18327
1445 1 6 . 1 1 28 28 LEU N N 28 121.400 121.400 119.647 1.753 18327
1446 1 6 . 1 1 28 28 LEU HA H 28 4.760 4.760 4.732 0.028 18327
1447 1 6 . 1 1 28 28 LEU CA C 28 53.120 53.120 53.707 -0.587 18327
1448 1 6 . 1 1 28 28 LEU CB C 28 44.500 44.500 45.151 -0.651 18327
1449 1 6 . 1 1 28 28 LEU H H 28 8.897 8.897 8.477 0.420 18327
1450 1 6 . 1 1 29 29 SER N N 29 115.700 115.700 117.229 -1.529 18327
1451 1 6 . 1 1 29 29 SER HA H 29 5.030 5.030 4.949 0.081 18327
1452 1 6 . 1 1 29 29 SER CA C 29 58.470 58.470 57.904 0.566 18327
1453 1 6 . 1 1 29 29 SER CB C 29 63.690 63.690 64.539 -0.849 18327
1454 1 6 . 1 1 29 29 SER H H 29 7.949 7.949 8.323 -0.374 18327
1455 1 6 . 1 1 30 30 LEU N N 30 121.300 121.300 119.212 2.088 18327
1456 1 6 . 1 1 30 30 LEU HA H 30 4.800 4.800 4.655 0.145 18327
1457 1 6 . 1 1 30 30 LEU CA C 30 52.940 52.940 55.328 -2.388 18327
1458 1 6 . 1 1 30 30 LEU CB C 30 46.370 46.370 46.231 0.139 18327
1459 1 6 . 1 1 30 30 LEU H H 30 9.503 9.503 8.729 0.774 18327
1460 1 6 . 1 1 31 31 GLN N N 31 123.100 123.100 120.500 2.600 18327
1461 1 6 . 1 1 31 31 GLN HA H 31 5.070 5.070 4.676 0.394 18327
1462 1 6 . 1 1 31 31 GLN CA C 31 52.940 52.940 54.284 -1.344 18327
1463 1 6 . 1 1 31 31 GLN CB C 31 31.190 31.190 32.738 -1.548 18327
1464 1 6 . 1 1 31 31 GLN H H 31 9.152 9.152 8.401 0.751 18327
1465 1 6 . 1 1 32 32 ILE N N 32 120.800 120.800 120.754 0.046 18327
1466 1 6 . 1 1 32 32 ILE HA H 32 3.030 3.030 3.925 -0.895 18327
1467 1 6 . 1 1 32 32 ILE CA C 32 64.250 64.250 62.681 1.569 18327
1468 1 6 . 1 1 32 32 ILE CB C 32 37.940 37.940 37.486 0.454 18327
1469 1 6 . 1 1 32 32 ILE H H 32 8.019 8.019 8.569 -0.550 18327
1470 1 6 . 1 1 33 33 GLY N N 33 115.700 115.700 114.109 1.591 18327
1471 1 6 . 1 1 33 33 GLY CA C 33 44.500 44.500 44.817 -0.317 18327
1472 1 6 . 1 1 33 33 GLY H H 33 8.777 8.777 8.668 0.109 18327
1473 1 6 . 1 1 34 34 ASP N N 34 122.300 122.300 122.444 -0.144 18327
1474 1 6 . 1 1 34 34 ASP HA H 34 4.640 4.640 4.881 -0.241 18327
1475 1 6 . 1 1 34 34 ASP CA C 34 55.860 55.860 54.181 1.679 18327
1476 1 6 . 1 1 34 34 ASP CB C 34 41.310 41.310 42.587 -1.277 18327
1477 1 6 . 1 1 34 34 ASP H H 34 8.690 8.690 7.758 0.932 18327
1478 1 6 . 1 1 35 35 THR N N 35 117.900 117.900 116.553 1.347 18327
1479 1 6 . 1 1 35 35 THR HA H 35 5.160 5.160 5.085 0.075 18327
1480 1 6 . 1 1 35 35 THR CA C 35 61.450 61.450 61.967 -0.517 18327
1481 1 6 . 1 1 35 35 THR CB C 35 69.090 69.090 70.204 -1.114 18327
1482 1 6 . 1 1 35 35 THR H H 35 8.389 8.389 8.482 -0.093 18327
1483 1 6 . 1 1 36 36 VAL N N 36 118.200 118.200 116.889 1.311 18327
1484 1 6 . 1 1 36 36 VAL HA H 36 5.100 5.100 4.512 0.588 18327
1485 1 6 . 1 1 36 36 VAL CA C 36 57.910 57.910 60.395 -2.485 18327
1486 1 6 . 1 1 36 36 VAL CB C 36 34.190 34.190 34.510 -0.320 18327
1487 1 6 . 1 1 36 36 VAL H H 36 9.019 9.019 9.101 -0.082 18327
1488 1 6 . 1 1 37 37 HIS N N 37 122.100 122.100 118.847 3.253 18327
1489 1 6 . 1 1 37 37 HIS HA H 37 4.840 4.840 4.930 -0.090 18327
1490 1 6 . 1 1 37 37 HIS CA C 37 52.560 52.560 55.123 -2.563 18327
1491 1 6 . 1 1 37 37 HIS CB C 37 31.260 31.260 33.030 -1.770 18327
1492 1 6 . 1 1 37 37 HIS H H 37 8.489 8.489 8.100 0.389 18327
1493 1 6 . 1 1 38 38 ILE N N 38 126.400 126.400 125.422 0.978 18327
1494 1 6 . 1 1 38 38 ILE HA H 38 3.780 3.780 4.015 -0.235 18327
1495 1 6 . 1 1 38 38 ILE CA C 38 61.640 61.640 60.620 1.020 18327
1496 1 6 . 1 1 38 38 ILE CB C 38 38.880 38.880 38.908 -0.028 18327
1497 1 6 . 1 1 38 38 ILE H H 38 8.636 8.636 8.299 0.337 18327
1498 1 6 . 1 1 39 39 LEU N N 39 126.000 126.000 125.199 0.801 18327
1499 1 6 . 1 1 39 39 LEU HA H 39 4.400 4.400 4.665 -0.265 18327
1500 1 6 . 1 1 39 39 LEU CA C 39 55.490 55.490 54.944 0.546 18327
1501 1 6 . 1 1 39 39 LEU CB C 39 43.750 43.750 44.380 -0.631 18327
1502 1 6 . 1 1 39 39 LEU H H 39 9.162 9.162 8.045 1.117 18327
1503 1 6 . 1 1 40 40 GLU N N 40 115.100 115.100 116.415 -1.315 18327
1504 1 6 . 1 1 40 40 GLU HA H 40 7.895 7.895 4.675 3.220 18327
1505 1 6 . 1 1 41 41 THR N N 41 116.400 116.400 109.774 6.626 18327
1506 1 6 . 1 1 41 41 THR HA H 41 4.270 4.270 4.846 -0.576 18327
1507 1 6 . 1 1 41 41 THR CA C 41 60.890 60.890 60.037 0.853 18327
1508 1 6 . 1 1 41 41 THR CB C 41 69.650 69.650 70.701 -1.050 18327
1509 1 6 . 1 1 41 41 THR H H 41 8.162 8.162 8.250 -0.088 18327
1510 1 6 . 1 1 43 43 GLU N N 43 123.300 123.300 120.055 3.245 18327
1511 1 6 . 1 1 43 43 GLU HA H 43 4.270 4.270 4.367 -0.097 18327
1512 1 6 . 1 1 43 43 GLU CA C 43 57.350 57.350 57.288 0.062 18327
1513 1 6 . 1 1 43 43 GLU CB C 43 26.790 26.790 30.111 -3.321 18327
1514 1 6 . 1 1 43 43 GLU H H 43 8.108 8.108 8.578 -0.470 18327
1515 1 6 . 1 1 44 44 GLY CA C 44 45.440 45.440 45.568 -0.128 18327
1516 1 6 . 1 1 45 45 TRP N N 45 124.100 124.100 120.881 3.219 18327
1517 1 6 . 1 1 45 45 TRP HA H 45 4.690 4.690 4.742 -0.052 18327
1518 1 6 . 1 1 45 45 TRP H H 45 8.590 8.590 7.330 1.260 18327
1519 1 6 . 1 1 46 46 TYR HA H 46 5.600 5.600 4.554 1.046 18327
1520 1 6 . 1 1 46 46 TYR CA C 46 54.060 54.060 57.000 -2.940 18327
1521 1 6 . 1 1 46 46 TYR CB C 46 42.060 42.060 42.365 -0.305 18327
1522 1 6 . 1 1 47 47 ARG N N 47 118.100 118.100 122.834 -4.734 18327
1523 1 6 . 1 1 47 47 ARG HA H 47 5.070 5.070 4.838 0.232 18327
1524 1 6 . 1 1 47 47 ARG CA C 47 54.060 54.060 54.579 -0.519 18327
1525 1 6 . 1 1 47 47 ARG CB C 47 33.250 33.250 33.549 -0.299 18327
1526 1 6 . 1 1 47 47 ARG H H 47 8.495 8.495 9.111 -0.616 18327
1527 1 6 . 1 1 48 48 GLY N N 48 114.000 114.000 114.458 -0.458 18327
1528 1 6 . 1 1 48 48 GLY CA C 48 46.560 46.560 46.386 0.174 18327
1529 1 6 . 1 1 48 48 GLY H H 48 9.183 9.183 8.853 0.330 18327
1530 1 6 . 1 1 49 49 TYR N N 49 116.200 116.200 116.574 -0.374 18327
1531 1 6 . 1 1 49 49 TYR HA H 49 5.380 5.380 5.148 0.232 18327
1532 1 6 . 1 1 49 49 TYR CA C 49 55.110 55.110 56.757 -1.647 18327
1533 1 6 . 1 1 49 49 TYR CB C 49 40.750 40.750 40.463 0.287 18327
1534 1 6 . 1 1 49 49 TYR H H 49 8.199 8.199 8.731 -0.532 18327
1535 1 6 . 1 1 50 50 THR N N 50 112.200 112.200 112.910 -0.710 18327
1536 1 6 . 1 1 50 50 THR HA H 50 5.120 5.120 4.244 0.876 18327
1537 1 6 . 1 1 50 50 THR CA C 50 59.770 59.770 60.690 -0.920 18327
1538 1 6 . 1 1 50 50 THR CB C 50 69.460 69.460 70.035 -0.575 18327
1539 1 6 . 1 1 50 50 THR H H 50 9.436 9.436 8.969 0.467 18327
1540 1 6 . 1 1 51 51 LEU N N 51 121.300 121.300 120.460 0.840 18327
1541 1 6 . 1 1 51 51 LEU HA H 51 4.230 4.230 4.285 -0.055 18327
1542 1 6 . 1 1 51 51 LEU CA C 51 56.790 56.790 56.430 0.360 18327
1543 1 6 . 1 1 51 51 LEU CB C 51 40.000 40.000 41.963 -1.963 18327
1544 1 6 . 1 1 51 51 LEU H H 51 8.313 8.313 8.018 0.295 18327
1545 1 6 . 1 1 52 52 ARG N N 52 116.600 116.600 116.866 -0.266 18327
1546 1 6 . 1 1 52 52 ARG HA H 52 4.250 4.250 4.194 0.056 18327
1547 1 6 . 1 1 52 52 ARG CA C 52 57.350 57.350 57.544 -0.194 18327
1548 1 6 . 1 1 52 52 ARG CB C 52 30.510 30.510 30.907 -0.397 18327
1549 1 6 . 1 1 52 52 ARG H H 52 8.053 8.053 8.252 -0.199 18327
1550 1 6 . 1 1 53 53 LYS N N 53 122.600 122.600 118.919 3.681 18327
1551 1 6 . 1 1 53 53 LYS HA H 53 4.620 4.620 4.579 0.041 18327
1552 1 6 . 1 1 53 53 LYS CA C 53 54.620 54.620 54.906 -0.286 18327
1553 1 6 . 1 1 53 53 LYS CB C 53 32.310 32.310 33.662 -1.352 18327
1554 1 6 . 1 1 53 53 LYS H H 53 7.655 7.655 7.496 0.159 18327
1555 1 6 . 1 1 54 54 LYS N N 54 124.900 124.900 125.525 -0.625 18327
1556 1 6 . 1 1 54 54 LYS HA H 54 4.090 4.090 4.328 -0.238 18327
1557 1 6 . 1 1 54 54 LYS CA C 54 58.470 58.470 58.304 0.166 18327
1558 1 6 . 1 1 54 54 LYS CB C 54 32.130 32.130 32.168 -0.038 18327
1559 1 6 . 1 1 54 54 LYS H H 54 8.499 8.499 8.669 -0.170 18327
1560 1 6 . 1 1 55 55 SER N N 55 110.100 110.100 113.428 -3.328 18327
1561 1 6 . 1 1 55 55 SER HA H 55 4.140 4.140 4.234 -0.094 18327
1562 1 6 . 1 1 55 55 SER CA C 55 58.470 58.470 60.177 -1.707 18327
1563 1 6 . 1 1 55 55 SER CB C 55 63.310 63.310 63.064 0.246 18327
1564 1 6 . 1 1 55 55 SER H H 55 7.862 7.862 8.152 -0.290 18327
1565 1 6 . 1 1 56 56 LYS N N 56 124.000 124.000 121.796 2.204 18327
1566 1 6 . 1 1 56 56 LYS HA H 56 4.700 4.700 4.417 0.283 18327
1567 1 6 . 1 1 56 56 LYS CA C 56 54.810 54.810 55.418 -0.608 18327
1568 1 6 . 1 1 56 56 LYS CB C 56 33.250 33.250 31.939 1.311 18327
1569 1 6 . 1 1 56 56 LYS H H 56 7.481 7.481 8.083 -0.602 18327
1570 1 6 . 1 1 57 57 LYS N N 57 125.700 125.700 122.348 3.352 18327
1571 1 6 . 1 1 57 57 LYS HA H 57 5.330 5.330 4.520 0.810 18327
1572 1 6 . 1 1 57 57 LYS CA C 57 54.620 54.620 55.405 -0.785 18327
1573 1 6 . 1 1 57 57 LYS CB C 57 34.240 34.240 34.749 -0.509 18327
1574 1 6 . 1 1 57 57 LYS H H 57 8.475 8.475 7.797 0.678 18327
1575 1 6 . 1 1 58 58 GLY N N 58 109.400 109.400 106.151 3.249 18327
1576 1 6 . 1 1 58 58 GLY CA C 58 45.620 45.620 45.481 0.139 18327
1577 1 6 . 1 1 58 58 GLY H H 58 9.073 9.073 8.797 0.276 18327
1578 1 6 . 1 1 59 59 ILE N N 59 113.900 113.900 116.533 -2.633 18327
1579 1 6 . 1 1 59 59 ILE HA H 59 6.000 6.000 4.740 1.260 18327
1580 1 6 . 1 1 59 59 ILE CA C 59 59.590 59.590 59.436 0.154 18327
1581 1 6 . 1 1 59 59 ILE CB C 59 41.140 41.140 41.855 -0.715 18327
1582 1 6 . 1 1 59 59 ILE H H 59 8.628 8.628 8.179 0.449 18327
1583 1 6 . 1 1 60 60 PHE N N 60 116.900 116.900 114.092 2.808 18327
1584 1 6 . 1 1 60 60 PHE HA H 60 5.120 5.120 5.089 0.031 18327
1585 1 6 . 1 1 60 60 PHE CA C 60 54.060 54.060 55.137 -1.077 18327
1586 1 6 . 1 1 60 60 PHE CB C 60 37.190 37.190 39.184 -1.994 18327
1587 1 6 . 1 1 60 60 PHE H H 60 8.724 8.724 8.229 0.495 18327
1588 1 6 . 1 1 61 61 PRO HA H 61 3.480 3.480 3.711 -0.231 18327
1589 1 6 . 1 1 61 61 PRO CA C 61 62.200 62.200 62.020 0.180 18327
1590 1 6 . 1 1 61 61 PRO CB C 61 31.190 31.190 30.881 0.309 18327
1591 1 6 . 1 1 62 62 ALA N N 62 124.600 124.600 128.355 -3.755 18327
1592 1 6 . 1 1 62 62 ALA HA H 62 3.720 3.720 4.310 -0.590 18327
1593 1 6 . 1 1 62 62 ALA CA C 62 54.370 54.370 55.093 -0.723 18327
1594 1 6 . 1 1 62 62 ALA CB C 62 17.650 17.650 18.078 -0.428 18327
1595 1 6 . 1 1 62 62 ALA H H 62 7.898 7.898 8.516 -0.618 18327
1596 1 6 . 1 1 63 63 SER N N 63 109.700 109.700 113.649 -3.949 18327
1597 1 6 . 1 1 63 63 SER HA H 63 4.200 4.200 4.227 -0.027 18327
1598 1 6 . 1 1 63 63 SER CA C 63 59.400 59.400 60.524 -1.124 18327
1599 1 6 . 1 1 63 63 SER CB C 63 62.380 62.380 62.846 -0.466 18327
1600 1 6 . 1 1 63 63 SER H H 63 8.030 8.030 8.455 -0.425 18327
1601 1 6 . 1 1 64 64 TYR N N 64 120.300 120.300 117.018 3.282 18327
1602 1 6 . 1 1 64 64 TYR HA H 64 4.260 4.260 4.453 -0.193 18327
1603 1 6 . 1 1 64 64 TYR CA C 64 57.720 57.720 58.747 -1.027 18327
1604 1 6 . 1 1 64 64 TYR CB C 64 37.560 37.560 38.255 -0.695 18327
1605 1 6 . 1 1 64 64 TYR H H 64 7.124 7.124 7.941 -0.817 18327
1606 1 6 . 1 1 65 65 ILE N N 65 118.000 118.000 116.747 1.253 18327
1607 1 6 . 1 1 65 65 ILE HA H 65 4.830 4.830 4.924 -0.094 18327
1608 1 6 . 1 1 65 65 ILE CA C 65 56.980 56.980 59.225 -2.245 18327
1609 1 6 . 1 1 65 65 ILE CB C 65 39.630 39.630 39.220 0.410 18327
1610 1 6 . 1 1 65 65 ILE H H 65 7.671 7.671 7.301 0.370 18327
1611 1 6 . 1 1 66 66 HIS N N 66 124.500 124.500 121.719 2.781 18327
1612 1 6 . 1 1 66 66 HIS HA H 66 5.130 5.130 4.916 0.214 18327
1613 1 6 . 1 1 66 66 HIS CA C 66 53.060 53.060 54.793 -1.733 18327
1614 1 6 . 1 1 66 66 HIS CB C 66 30.510 30.510 32.458 -1.948 18327
1615 1 6 . 1 1 66 66 HIS H H 66 9.159 9.159 8.823 0.336 18327
1616 1 6 . 1 1 67 67 LEU N N 67 127.400 127.400 128.265 -0.865 18327
1617 1 6 . 1 1 67 67 LEU HA H 67 4.560 4.560 4.735 -0.175 18327
1618 1 6 . 1 1 67 67 LEU CA C 67 55.300 55.300 55.246 0.054 18327
1619 1 6 . 1 1 67 67 LEU CB C 67 42.060 42.060 43.156 -1.096 18327
1620 1 6 . 1 1 67 67 LEU H H 67 8.979 8.979 8.939 0.040 18327
1621 1 6 . 1 1 68 68 LYS N N 68 121.900 121.900 123.705 -1.805 18327
1622 1 6 . 1 1 68 68 LYS HA H 68 4.490 4.490 4.456 0.034 18327
1623 1 6 . 1 1 68 68 LYS CA C 68 55.110 55.110 55.353 -0.243 18327
1624 1 6 . 1 1 68 68 LYS CB C 68 34.610 34.610 33.125 1.485 18327
1625 1 6 . 1 1 68 68 LYS H H 68 8.499 8.499 9.016 -0.517 18327
1626 1 6 . 1 1 69 69 GLU N N 69 122.100 122.100 125.498 -3.398 18327
1627 1 6 . 1 1 69 69 GLU HA H 69 4.290 4.290 4.023 0.267 18327
1628 1 6 . 1 1 69 69 GLU CA C 69 56.610 56.610 57.757 -1.147 18327
1629 1 6 . 1 1 69 69 GLU CB C 69 30.330 30.330 29.927 0.403 18327
1630 1 6 . 1 1 69 69 GLU H H 69 8.569 8.569 8.431 0.138 18327
1631 1 6 . 1 1 70 70 ALA N N 70 123.300 123.300 126.632 -3.332 18327
1632 1 6 . 1 1 70 70 ALA HA H 70 4.210 4.210 4.165 0.045 18327
1633 1 6 . 1 1 70 70 ALA CA C 70 51.810 51.810 52.690 -0.880 18327
1634 1 6 . 1 1 70 70 ALA CB C 70 19.700 19.700 18.144 1.556 18327
1635 1 6 . 1 1 70 70 ALA H H 70 8.181 8.181 8.560 -0.379 18327
1636 1 6 . 1 1 71 71 ILE N N 71 120.000 120.000 120.597 -0.597 18327
1637 1 6 . 1 1 71 71 ILE HA H 71 4.070 4.070 4.151 -0.081 18327
1638 1 6 . 1 1 71 71 ILE CA C 71 60.330 60.330 61.223 -0.893 18327
1639 1 6 . 1 1 71 71 ILE CB C 71 38.690 38.690 39.410 -0.720 18327
1640 1 6 . 1 1 71 71 ILE H H 71 7.789 7.789 8.256 -0.467 18327
1641 1 6 . 1 1 72 72 VAL N N 72 124.400 124.400 120.614 3.786 18327
1642 1 6 . 1 1 72 72 VAL HA H 72 4.070 4.070 4.349 -0.279 18327
1643 1 6 . 1 1 72 72 VAL CA C 72 61.640 61.640 61.880 -0.240 18327
1644 1 6 . 1 1 72 72 VAL CB C 72 32.690 32.690 32.919 -0.229 18327
1645 1 6 . 1 1 72 72 VAL H H 72 8.089 8.089 8.305 -0.216 18327
1646 1 6 . 1 1 73 73 GLU N N 73 125.940 125.940 122.894 3.046 18327
1647 1 6 . 1 1 73 73 GLU HA H 73 4.300 4.300 4.695 -0.395 18327
1648 1 6 . 1 1 73 73 GLU CA C 73 56.610 56.610 55.252 1.357 18327
1649 1 6 . 1 1 73 73 GLU CB C 73 30.710 30.710 31.436 -0.726 18327
1650 1 6 . 1 1 73 73 GLU H H 73 8.464 8.464 8.464 -0.000 18327
1651 1 7 . 1 1 13 13 TYR HA H 13 5.560 5.560 4.568 0.992 18327
1652 1 7 . 1 1 13 13 TYR CA C 13 55.860 55.860 55.959 -0.098 18327
1653 1 7 . 1 1 13 13 TYR CB C 13 42.440 42.440 40.657 1.783 18327
1654 1 7 . 1 1 14 14 GLY N N 14 105.400 105.400 105.951 -0.551 18327
1655 1 7 . 1 1 14 14 GLY CA C 14 45.240 45.240 43.613 1.627 18327
1656 1 7 . 1 1 14 14 GLY H H 14 8.406 8.406 8.477 -0.071 18327
1657 1 7 . 1 1 15 15 VAL N N 15 118.900 118.900 120.691 -1.791 18327
1658 1 7 . 1 1 15 15 VAL HA H 15 5.330 5.330 4.766 0.564 18327
1659 1 7 . 1 1 15 15 VAL CA C 15 59.210 59.210 59.846 -0.636 18327
1660 1 7 . 1 1 15 15 VAL CB C 15 35.740 35.740 35.131 0.609 18327
1661 1 7 . 1 1 15 15 VAL H H 15 8.854 8.854 8.262 0.592 18327
1662 1 7 . 1 1 16 16 ALA N N 16 129.400 129.400 126.797 2.603 18327
1663 1 7 . 1 1 16 16 ALA HA H 16 5.000 5.000 4.685 0.315 18327
1664 1 7 . 1 1 16 16 ALA CA C 16 52.000 52.000 50.916 1.084 18327
1665 1 7 . 1 1 16 16 ALA CB C 16 19.330 19.330 20.648 -1.318 18327
1666 1 7 . 1 1 16 16 ALA H H 16 9.112 9.112 9.005 0.107 18327
1667 1 7 . 1 1 17 17 PHE N N 17 123.900 123.900 123.356 0.544 18327
1668 1 7 . 1 1 17 17 PHE HA H 17 4.740 4.740 4.615 0.125 18327
1669 1 7 . 1 1 17 17 PHE CA C 17 56.230 56.230 57.340 -1.111 18327
1670 1 7 . 1 1 17 17 PHE CB C 17 40.000 40.000 40.858 -0.858 18327
1671 1 7 . 1 1 17 17 PHE H H 17 8.785 8.785 8.393 0.392 18327
1672 1 7 . 1 1 18 18 TYR N N 18 118.100 118.100 119.136 -1.036 18327
1673 1 7 . 1 1 18 18 TYR HA H 18 4.490 4.490 4.448 0.042 18327
1674 1 7 . 1 1 18 18 TYR CA C 18 55.300 55.300 57.687 -2.387 18327
1675 1 7 . 1 1 18 18 TYR CB C 18 42.810 42.810 40.792 2.018 18327
1676 1 7 . 1 1 18 18 TYR H H 18 7.288 7.288 7.674 -0.386 18327
1677 1 7 . 1 1 19 19 ASN N N 19 116.800 116.800 121.427 -4.627 18327
1678 1 7 . 1 1 19 19 ASN HA H 19 4.710 4.710 4.852 -0.142 18327
1679 1 7 . 1 1 19 19 ASN CA C 19 52.940 52.940 53.001 -0.061 18327
1680 1 7 . 1 1 19 19 ASN CB C 19 39.060 39.060 39.553 -0.493 18327
1681 1 7 . 1 1 19 19 ASN H H 19 8.122 8.122 8.506 -0.384 18327
1682 1 7 . 1 1 20 20 TYR N N 20 122.000 122.000 124.624 -2.624 18327
1683 1 7 . 1 1 20 20 TYR HA H 20 4.710 4.710 4.712 -0.002 18327
1684 1 7 . 1 1 20 20 TYR CA C 20 57.720 57.720 58.019 -0.299 18327
1685 1 7 . 1 1 20 20 TYR CB C 20 42.250 42.250 42.488 -0.238 18327
1686 1 7 . 1 1 20 20 TYR H H 20 8.994 8.994 8.866 0.128 18327
1687 1 7 . 1 1 21 21 ASP N N 21 128.500 128.500 121.526 6.974 18327
1688 1 7 . 1 1 21 21 ASP HA H 21 4.790 4.790 4.760 0.030 18327
1689 1 7 . 1 1 21 21 ASP CA C 21 52.370 52.370 52.479 -0.109 18327
1690 1 7 . 1 1 21 21 ASP CB C 21 41.130 41.130 43.782 -2.652 18327
1691 1 7 . 1 1 21 21 ASP H H 21 7.839 7.839 7.620 0.219 18327
1692 1 7 . 1 1 22 22 ALA N N 22 125.200 125.200 121.299 3.901 18327
1693 1 7 . 1 1 22 22 ALA HA H 22 4.050 4.050 4.349 -0.299 18327
1694 1 7 . 1 1 22 22 ALA CA C 22 52.940 52.940 52.230 0.710 18327
1695 1 7 . 1 1 22 22 ALA CB C 22 20.450 20.450 19.769 0.681 18327
1696 1 7 . 1 1 22 22 ALA H H 22 8.107 8.107 7.987 0.120 18327
1697 1 7 . 1 1 23 23 ARG N N 23 122.200 122.200 121.318 0.882 18327
1698 1 7 . 1 1 23 23 ARG HA H 23 4.350 4.350 4.059 0.291 18327
1699 1 7 . 1 1 23 23 ARG CA C 23 55.490 55.490 57.528 -2.038 18327
1700 1 7 . 1 1 23 23 ARG CB C 23 30.700 30.700 30.744 -0.044 18327
1701 1 7 . 1 1 23 23 ARG H H 23 8.889 8.889 8.826 0.063 18327
1702 1 7 . 1 1 24 24 GLY N N 24 105.200 105.200 104.089 1.111 18327
1703 1 7 . 1 1 24 24 GLY CA C 24 44.500 44.500 44.662 -0.162 18327
1704 1 7 . 1 1 24 24 GLY H H 24 7.267 7.267 7.435 -0.168 18327
1705 1 7 . 1 1 25 25 ALA N N 25 122.200 122.200 121.245 0.955 18327
1706 1 7 . 1 1 25 25 ALA HA H 25 4.160 4.160 4.246 -0.086 18327
1707 1 7 . 1 1 25 25 ALA CA C 25 54.440 54.440 53.903 0.537 18327
1708 1 7 . 1 1 25 25 ALA CB C 25 18.770 18.770 19.022 -0.252 18327
1709 1 7 . 1 1 25 25 ALA H H 25 8.621 8.621 8.312 0.309 18327
1710 1 7 . 1 1 26 26 ASP N N 26 114.700 114.700 119.669 -4.969 18327
1711 1 7 . 1 1 26 26 ASP HA H 26 4.700 4.700 4.753 -0.053 18327
1712 1 7 . 1 1 26 26 ASP CA C 26 53.870 53.870 53.866 0.004 18327
1713 1 7 . 1 1 26 26 ASP CB C 26 40.390 40.390 40.601 -0.211 18327
1714 1 7 . 1 1 26 26 ASP H H 26 8.949 8.949 8.525 0.424 18327
1715 1 7 . 1 1 27 27 GLU N N 27 118.800 118.800 117.011 1.789 18327
1716 1 7 . 1 1 27 27 GLU HA H 27 5.220 5.220 4.899 0.321 18327
1717 1 7 . 1 1 27 27 GLU CA C 27 54.930 54.930 54.364 0.566 18327
1718 1 7 . 1 1 27 27 GLU CB C 27 32.880 32.880 32.712 0.168 18327
1719 1 7 . 1 1 27 27 GLU H H 27 7.542 7.542 7.623 -0.081 18327
1720 1 7 . 1 1 28 28 LEU N N 28 121.400 121.400 120.881 0.519 18327
1721 1 7 . 1 1 28 28 LEU HA H 28 4.760 4.760 4.778 -0.018 18327
1722 1 7 . 1 1 28 28 LEU CA C 28 53.120 53.120 54.108 -0.988 18327
1723 1 7 . 1 1 28 28 LEU CB C 28 44.500 44.500 45.615 -1.115 18327
1724 1 7 . 1 1 28 28 LEU H H 28 8.897 8.897 8.218 0.679 18327
1725 1 7 . 1 1 29 29 SER N N 29 115.700 115.700 119.559 -3.859 18327
1726 1 7 . 1 1 29 29 SER HA H 29 5.030 5.030 5.016 0.014 18327
1727 1 7 . 1 1 29 29 SER CA C 29 58.470 58.470 58.880 -0.410 18327
1728 1 7 . 1 1 29 29 SER CB C 29 63.690 63.690 64.123 -0.433 18327
1729 1 7 . 1 1 29 29 SER H H 29 7.949 7.949 8.428 -0.479 18327
1730 1 7 . 1 1 30 30 LEU N N 30 121.300 121.300 120.506 0.794 18327
1731 1 7 . 1 1 30 30 LEU HA H 30 4.800 4.800 4.561 0.239 18327
1732 1 7 . 1 1 30 30 LEU CA C 30 52.940 52.940 55.328 -2.388 18327
1733 1 7 . 1 1 30 30 LEU CB C 30 46.370 46.370 46.318 0.052 18327
1734 1 7 . 1 1 30 30 LEU H H 30 9.503 9.503 8.763 0.740 18327
1735 1 7 . 1 1 31 31 GLN N N 31 123.100 123.100 120.541 2.559 18327
1736 1 7 . 1 1 31 31 GLN HA H 31 5.070 5.070 4.870 0.200 18327
1737 1 7 . 1 1 31 31 GLN CA C 31 52.940 52.940 54.041 -1.101 18327
1738 1 7 . 1 1 31 31 GLN CB C 31 31.190 31.190 32.571 -1.381 18327
1739 1 7 . 1 1 31 31 GLN H H 31 9.152 9.152 8.304 0.848 18327
1740 1 7 . 1 1 32 32 ILE N N 32 120.800 120.800 121.300 -0.500 18327
1741 1 7 . 1 1 32 32 ILE HA H 32 3.030 3.030 3.779 -0.749 18327
1742 1 7 . 1 1 32 32 ILE CA C 32 64.250 64.250 62.593 1.657 18327
1743 1 7 . 1 1 32 32 ILE CB C 32 37.940 37.940 37.469 0.471 18327
1744 1 7 . 1 1 32 32 ILE H H 32 8.019 8.019 8.681 -0.662 18327
1745 1 7 . 1 1 33 33 GLY N N 33 115.700 115.700 114.114 1.586 18327
1746 1 7 . 1 1 33 33 GLY CA C 33 44.500 44.500 44.742 -0.242 18327
1747 1 7 . 1 1 33 33 GLY H H 33 8.777 8.777 8.442 0.335 18327
1748 1 7 . 1 1 34 34 ASP N N 34 122.300 122.300 121.876 0.424 18327
1749 1 7 . 1 1 34 34 ASP HA H 34 4.640 4.640 4.879 -0.239 18327
1750 1 7 . 1 1 34 34 ASP CA C 34 55.860 55.860 53.661 2.199 18327
1751 1 7 . 1 1 34 34 ASP CB C 34 41.310 41.310 42.770 -1.460 18327
1752 1 7 . 1 1 34 34 ASP H H 34 8.690 8.690 7.654 1.036 18327
1753 1 7 . 1 1 35 35 THR N N 35 117.900 117.900 115.371 2.529 18327
1754 1 7 . 1 1 35 35 THR HA H 35 5.160 5.160 5.170 -0.010 18327
1755 1 7 . 1 1 35 35 THR CA C 35 61.450 61.450 61.499 -0.049 18327
1756 1 7 . 1 1 35 35 THR CB C 35 69.090 69.090 70.925 -1.835 18327
1757 1 7 . 1 1 35 35 THR H H 35 8.389 8.389 8.298 0.091 18327
1758 1 7 . 1 1 36 36 VAL N N 36 118.200 118.200 117.820 0.380 18327
1759 1 7 . 1 1 36 36 VAL HA H 36 5.100 5.100 4.787 0.313 18327
1760 1 7 . 1 1 36 36 VAL CA C 36 57.910 57.910 59.753 -1.843 18327
1761 1 7 . 1 1 36 36 VAL CB C 36 34.190 34.190 34.367 -0.177 18327
1762 1 7 . 1 1 36 36 VAL H H 36 9.019 9.019 8.974 0.045 18327
1763 1 7 . 1 1 37 37 HIS N N 37 122.100 122.100 119.916 2.184 18327
1764 1 7 . 1 1 37 37 HIS HA H 37 4.840 4.840 4.971 -0.131 18327
1765 1 7 . 1 1 37 37 HIS CA C 37 52.560 52.560 54.071 -1.511 18327
1766 1 7 . 1 1 37 37 HIS CB C 37 31.260 31.260 33.227 -1.967 18327
1767 1 7 . 1 1 37 37 HIS H H 37 8.489 8.489 8.778 -0.289 18327
1768 1 7 . 1 1 38 38 ILE N N 38 126.400 126.400 126.414 -0.014 18327
1769 1 7 . 1 1 38 38 ILE HA H 38 3.780 3.780 4.473 -0.693 18327
1770 1 7 . 1 1 38 38 ILE CA C 38 61.640 61.640 60.868 0.772 18327
1771 1 7 . 1 1 38 38 ILE CB C 38 38.880 38.880 38.520 0.360 18327
1772 1 7 . 1 1 38 38 ILE H H 38 8.636 8.636 8.950 -0.314 18327
1773 1 7 . 1 1 39 39 LEU N N 39 126.000 126.000 127.379 -1.379 18327
1774 1 7 . 1 1 39 39 LEU HA H 39 4.400 4.400 4.606 -0.206 18327
1775 1 7 . 1 1 39 39 LEU CA C 39 55.490 55.490 55.425 0.065 18327
1776 1 7 . 1 1 39 39 LEU CB C 39 43.750 43.750 43.042 0.708 18327
1777 1 7 . 1 1 39 39 LEU H H 39 9.162 9.162 8.697 0.465 18327
1778 1 7 . 1 1 40 40 GLU N N 40 115.100 115.100 117.060 -1.960 18327
1779 1 7 . 1 1 40 40 GLU HA H 40 7.895 7.895 4.692 3.203 18327
1780 1 7 . 1 1 41 41 THR N N 41 116.400 116.400 113.095 3.305 18327
1781 1 7 . 1 1 41 41 THR HA H 41 4.270 4.270 4.707 -0.437 18327
1782 1 7 . 1 1 41 41 THR CA C 41 60.890 60.890 61.528 -0.638 18327
1783 1 7 . 1 1 41 41 THR CB C 41 69.650 69.650 69.665 -0.015 18327
1784 1 7 . 1 1 41 41 THR H H 41 8.162 8.162 8.499 -0.337 18327
1785 1 7 . 1 1 43 43 GLU N N 43 123.300 123.300 122.724 0.576 18327
1786 1 7 . 1 1 43 43 GLU HA H 43 4.270 4.270 3.718 0.552 18327
1787 1 7 . 1 1 43 43 GLU CA C 43 57.350 57.350 56.923 0.426 18327
1788 1 7 . 1 1 43 43 GLU CB C 43 26.790 26.790 28.809 -2.019 18327
1789 1 7 . 1 1 43 43 GLU H H 43 8.108 8.108 8.458 -0.350 18327
1790 1 7 . 1 1 44 44 GLY CA C 44 45.440 45.440 45.408 0.032 18327
1791 1 7 . 1 1 45 45 TRP N N 45 124.100 124.100 119.143 4.957 18327
1792 1 7 . 1 1 45 45 TRP HA H 45 4.690 4.690 4.732 -0.042 18327
1793 1 7 . 1 1 45 45 TRP H H 45 8.590 8.590 7.548 1.042 18327
1794 1 7 . 1 1 46 46 TYR HA H 46 5.600 5.600 4.724 0.876 18327
1795 1 7 . 1 1 46 46 TYR CA C 46 54.060 54.060 57.014 -2.954 18327
1796 1 7 . 1 1 46 46 TYR CB C 46 42.060 42.060 42.828 -0.768 18327
1797 1 7 . 1 1 47 47 ARG N N 47 118.100 118.100 119.957 -1.857 18327
1798 1 7 . 1 1 47 47 ARG HA H 47 5.070 5.070 5.066 0.004 18327
1799 1 7 . 1 1 47 47 ARG CA C 47 54.060 54.060 54.251 -0.191 18327
1800 1 7 . 1 1 47 47 ARG CB C 47 33.250 33.250 34.874 -1.624 18327
1801 1 7 . 1 1 47 47 ARG H H 47 8.495 8.495 8.878 -0.383 18327
1802 1 7 . 1 1 48 48 GLY N N 48 114.000 114.000 113.431 0.569 18327
1803 1 7 . 1 1 48 48 GLY CA C 48 46.560 46.560 46.294 0.266 18327
1804 1 7 . 1 1 48 48 GLY H H 48 9.183 9.183 9.156 0.027 18327
1805 1 7 . 1 1 49 49 TYR N N 49 116.200 116.200 115.809 0.391 18327
1806 1 7 . 1 1 49 49 TYR HA H 49 5.380 5.380 5.238 0.142 18327
1807 1 7 . 1 1 49 49 TYR CA C 49 55.110 55.110 56.770 -1.659 18327
1808 1 7 . 1 1 49 49 TYR CB C 49 40.750 40.750 39.743 1.007 18327
1809 1 7 . 1 1 49 49 TYR H H 49 8.199 8.199 8.492 -0.293 18327
1810 1 7 . 1 1 50 50 THR N N 50 112.200 112.200 111.461 0.739 18327
1811 1 7 . 1 1 50 50 THR HA H 50 5.120 5.120 4.326 0.794 18327
1812 1 7 . 1 1 50 50 THR CA C 50 59.770 59.770 60.495 -0.724 18327
1813 1 7 . 1 1 50 50 THR CB C 50 69.460 69.460 69.948 -0.488 18327
1814 1 7 . 1 1 50 50 THR H H 50 9.436 9.436 8.290 1.146 18327
1815 1 7 . 1 1 51 51 LEU N N 51 121.300 121.300 120.430 0.870 18327
1816 1 7 . 1 1 51 51 LEU HA H 51 4.230 4.230 4.260 -0.030 18327
1817 1 7 . 1 1 51 51 LEU CA C 51 56.790 56.790 55.870 0.920 18327
1818 1 7 . 1 1 51 51 LEU CB C 51 40.000 40.000 42.210 -2.210 18327
1819 1 7 . 1 1 51 51 LEU H H 51 8.313 8.313 8.005 0.308 18327
1820 1 7 . 1 1 52 52 ARG N N 52 116.600 116.600 117.593 -0.993 18327
1821 1 7 . 1 1 52 52 ARG HA H 52 4.250 4.250 4.145 0.105 18327
1822 1 7 . 1 1 52 52 ARG CA C 52 57.350 57.350 57.153 0.197 18327
1823 1 7 . 1 1 52 52 ARG CB C 52 30.510 30.510 30.690 -0.180 18327
1824 1 7 . 1 1 52 52 ARG H H 52 8.053 8.053 7.563 0.490 18327
1825 1 7 . 1 1 53 53 LYS N N 53 122.600 122.600 117.884 4.716 18327
1826 1 7 . 1 1 53 53 LYS HA H 53 4.620 4.620 4.580 0.040 18327
1827 1 7 . 1 1 53 53 LYS CA C 53 54.620 54.620 55.120 -0.500 18327
1828 1 7 . 1 1 53 53 LYS CB C 53 32.310 32.310 32.525 -0.215 18327
1829 1 7 . 1 1 53 53 LYS H H 53 7.655 7.655 7.898 -0.243 18327
1830 1 7 . 1 1 54 54 LYS N N 54 124.900 124.900 125.693 -0.793 18327
1831 1 7 . 1 1 54 54 LYS HA H 54 4.090 4.090 4.352 -0.262 18327
1832 1 7 . 1 1 54 54 LYS CA C 54 58.470 58.470 58.446 0.024 18327
1833 1 7 . 1 1 54 54 LYS CB C 54 32.130 32.130 32.721 -0.591 18327
1834 1 7 . 1 1 54 54 LYS H H 54 8.499 8.499 8.868 -0.369 18327
1835 1 7 . 1 1 55 55 SER N N 55 110.100 110.100 112.953 -2.853 18327
1836 1 7 . 1 1 55 55 SER HA H 55 4.140 4.140 4.435 -0.295 18327
1837 1 7 . 1 1 55 55 SER CA C 55 58.470 58.470 58.597 -0.127 18327
1838 1 7 . 1 1 55 55 SER CB C 55 63.310 63.310 63.361 -0.051 18327
1839 1 7 . 1 1 55 55 SER H H 55 7.862 7.862 7.942 -0.080 18327
1840 1 7 . 1 1 56 56 LYS N N 56 124.000 124.000 122.687 1.313 18327
1841 1 7 . 1 1 56 56 LYS HA H 56 4.700 4.700 4.554 0.146 18327
1842 1 7 . 1 1 56 56 LYS CA C 56 54.810 54.810 55.355 -0.545 18327
1843 1 7 . 1 1 56 56 LYS CB C 56 33.250 33.250 33.138 0.112 18327
1844 1 7 . 1 1 56 56 LYS H H 56 7.481 7.481 7.457 0.024 18327
1845 1 7 . 1 1 57 57 LYS N N 57 125.700 125.700 122.334 3.366 18327
1846 1 7 . 1 1 57 57 LYS HA H 57 5.330 5.330 4.857 0.473 18327
1847 1 7 . 1 1 57 57 LYS CA C 57 54.620 54.620 55.439 -0.819 18327
1848 1 7 . 1 1 57 57 LYS CB C 57 34.240 34.240 34.423 -0.183 18327
1849 1 7 . 1 1 57 57 LYS H H 57 8.475 8.475 8.350 0.125 18327
1850 1 7 . 1 1 58 58 GLY N N 58 109.400 109.400 108.168 1.232 18327
1851 1 7 . 1 1 58 58 GLY CA C 58 45.620 45.620 45.604 0.016 18327
1852 1 7 . 1 1 58 58 GLY H H 58 9.073 9.073 8.660 0.413 18327
1853 1 7 . 1 1 59 59 ILE N N 59 113.900 113.900 116.876 -2.976 18327
1854 1 7 . 1 1 59 59 ILE HA H 59 6.000 6.000 4.952 1.048 18327
1855 1 7 . 1 1 59 59 ILE CA C 59 59.590 59.590 59.197 0.393 18327
1856 1 7 . 1 1 59 59 ILE CB C 59 41.140 41.140 41.973 -0.833 18327
1857 1 7 . 1 1 59 59 ILE H H 59 8.628 8.628 8.338 0.290 18327
1858 1 7 . 1 1 60 60 PHE N N 60 116.900 116.900 114.204 2.696 18327
1859 1 7 . 1 1 60 60 PHE HA H 60 5.120 5.120 5.207 -0.087 18327
1860 1 7 . 1 1 60 60 PHE CA C 60 54.060 54.060 55.097 -1.037 18327
1861 1 7 . 1 1 60 60 PHE CB C 60 37.190 37.190 39.539 -2.349 18327
1862 1 7 . 1 1 60 60 PHE H H 60 8.724 8.724 8.096 0.628 18327
1863 1 7 . 1 1 61 61 PRO HA H 61 3.480 3.480 3.869 -0.389 18327
1864 1 7 . 1 1 61 61 PRO CA C 61 62.200 62.200 62.149 0.051 18327
1865 1 7 . 1 1 61 61 PRO CB C 61 31.190 31.190 31.821 -0.631 18327
1866 1 7 . 1 1 62 62 ALA N N 62 124.600 124.600 126.452 -1.852 18327
1867 1 7 . 1 1 62 62 ALA HA H 62 3.720 3.720 4.417 -0.697 18327
1868 1 7 . 1 1 62 62 ALA CA C 62 54.370 54.370 55.055 -0.685 18327
1869 1 7 . 1 1 62 62 ALA CB C 62 17.650 17.650 18.341 -0.691 18327
1870 1 7 . 1 1 62 62 ALA H H 62 7.898 7.898 8.571 -0.673 18327
1871 1 7 . 1 1 63 63 SER N N 63 109.700 109.700 112.884 -3.184 18327
1872 1 7 . 1 1 63 63 SER HA H 63 4.200 4.200 4.439 -0.239 18327
1873 1 7 . 1 1 63 63 SER CA C 63 59.400 59.400 60.530 -1.130 18327
1874 1 7 . 1 1 63 63 SER CB C 63 62.380 62.380 62.954 -0.574 18327
1875 1 7 . 1 1 63 63 SER H H 63 8.030 8.030 8.130 -0.100 18327
1876 1 7 . 1 1 64 64 TYR N N 64 120.300 120.300 117.956 2.344 18327
1877 1 7 . 1 1 64 64 TYR HA H 64 4.260 4.260 4.233 0.027 18327
1878 1 7 . 1 1 64 64 TYR CA C 64 57.720 57.720 58.927 -1.207 18327
1879 1 7 . 1 1 64 64 TYR CB C 64 37.560 37.560 38.257 -0.697 18327
1880 1 7 . 1 1 64 64 TYR H H 64 7.124 7.124 7.887 -0.763 18327
1881 1 7 . 1 1 65 65 ILE N N 65 118.000 118.000 115.840 2.160 18327
1882 1 7 . 1 1 65 65 ILE HA H 65 4.830 4.830 4.829 0.001 18327
1883 1 7 . 1 1 65 65 ILE CA C 65 56.980 56.980 59.136 -2.155 18327
1884 1 7 . 1 1 65 65 ILE CB C 65 39.630 39.630 39.440 0.190 18327
1885 1 7 . 1 1 65 65 ILE H H 65 7.671 7.671 7.397 0.274 18327
1886 1 7 . 1 1 66 66 HIS N N 66 124.500 124.500 121.802 2.698 18327
1887 1 7 . 1 1 66 66 HIS HA H 66 5.130 5.130 4.968 0.162 18327
1888 1 7 . 1 1 66 66 HIS CA C 66 53.060 53.060 54.347 -1.287 18327
1889 1 7 . 1 1 66 66 HIS CB C 66 30.510 30.510 31.933 -1.423 18327
1890 1 7 . 1 1 66 66 HIS H H 66 9.159 9.159 8.699 0.460 18327
1891 1 7 . 1 1 67 67 LEU N N 67 127.400 127.400 125.965 1.435 18327
1892 1 7 . 1 1 67 67 LEU HA H 67 4.560 4.560 4.607 -0.047 18327
1893 1 7 . 1 1 67 67 LEU CA C 67 55.300 55.300 56.098 -0.798 18327
1894 1 7 . 1 1 67 67 LEU CB C 67 42.060 42.060 42.951 -0.891 18327
1895 1 7 . 1 1 67 67 LEU H H 67 8.979 8.979 9.056 -0.077 18327
1896 1 7 . 1 1 68 68 LYS N N 68 121.900 121.900 120.656 1.244 18327
1897 1 7 . 1 1 68 68 LYS HA H 68 4.490 4.490 4.455 0.035 18327
1898 1 7 . 1 1 68 68 LYS CA C 68 55.110 55.110 55.784 -0.674 18327
1899 1 7 . 1 1 68 68 LYS CB C 68 34.610 34.610 33.040 1.570 18327
1900 1 7 . 1 1 68 68 LYS H H 68 8.499 8.499 8.539 -0.040 18327
1901 1 7 . 1 1 69 69 GLU N N 69 122.100 122.100 117.263 4.837 18327
1902 1 7 . 1 1 69 69 GLU HA H 69 4.290 4.290 3.924 0.366 18327
1903 1 7 . 1 1 69 69 GLU CA C 69 56.610 56.610 57.046 -0.436 18327
1904 1 7 . 1 1 69 69 GLU CB C 69 30.330 30.330 27.786 2.544 18327
1905 1 7 . 1 1 69 69 GLU H H 69 8.569 8.569 8.538 0.031 18327
1906 1 7 . 1 1 70 70 ALA N N 70 123.300 123.300 117.490 5.810 18327
1907 1 7 . 1 1 70 70 ALA HA H 70 4.210 4.210 3.706 0.504 18327
1908 1 7 . 1 1 70 70 ALA CA C 70 51.810 51.810 52.326 -0.516 18327
1909 1 7 . 1 1 70 70 ALA CB C 70 19.700 19.700 18.748 0.952 18327
1910 1 7 . 1 1 70 70 ALA H H 70 8.181 8.181 7.456 0.725 18327
1911 1 7 . 1 1 71 71 ILE N N 71 120.000 120.000 120.240 -0.240 18327
1912 1 7 . 1 1 71 71 ILE HA H 71 4.070 4.070 3.955 0.115 18327
1913 1 7 . 1 1 71 71 ILE CA C 71 60.330 60.330 61.757 -1.427 18327
1914 1 7 . 1 1 71 71 ILE CB C 71 38.690 38.690 38.114 0.576 18327
1915 1 7 . 1 1 71 71 ILE H H 71 7.789 7.789 8.380 -0.591 18327
1916 1 7 . 1 1 72 72 VAL N N 72 124.400 124.400 126.136 -1.736 18327
1917 1 7 . 1 1 72 72 VAL HA H 72 4.070 4.070 4.495 -0.425 18327
1918 1 7 . 1 1 72 72 VAL CA C 72 61.640 61.640 60.342 1.298 18327
1919 1 7 . 1 1 72 72 VAL CB C 72 32.690 32.690 33.291 -0.601 18327
1920 1 7 . 1 1 72 72 VAL H H 72 8.089 8.089 8.202 -0.113 18327
1921 1 7 . 1 1 73 73 GLU N N 73 125.940 125.940 119.415 6.525 18327
1922 1 7 . 1 1 73 73 GLU HA H 73 4.300 4.300 4.877 -0.577 18327
1923 1 7 . 1 1 73 73 GLU CA C 73 56.610 56.610 55.918 0.692 18327
1924 1 7 . 1 1 73 73 GLU CB C 73 30.710 30.710 32.526 -1.816 18327
1925 1 7 . 1 1 73 73 GLU H H 73 8.464 8.464 9.061 -0.597 18327
1926 1 8 . 1 1 13 13 TYR HA H 13 5.560 5.560 4.732 0.828 18327
1927 1 8 . 1 1 13 13 TYR CA C 13 55.860 55.860 56.814 -0.954 18327
1928 1 8 . 1 1 13 13 TYR CB C 13 42.440 42.440 40.211 2.229 18327
1929 1 8 . 1 1 14 14 GLY N N 14 105.400 105.400 107.435 -2.035 18327
1930 1 8 . 1 1 14 14 GLY CA C 14 45.240 45.240 43.353 1.887 18327
1931 1 8 . 1 1 14 14 GLY H H 14 8.406 8.406 8.625 -0.219 18327
1932 1 8 . 1 1 15 15 VAL N N 15 118.900 118.900 121.186 -2.286 18327
1933 1 8 . 1 1 15 15 VAL HA H 15 5.330 5.330 4.831 0.499 18327
1934 1 8 . 1 1 15 15 VAL CA C 15 59.210 59.210 60.500 -1.290 18327
1935 1 8 . 1 1 15 15 VAL CB C 15 35.740 35.740 35.822 -0.082 18327
1936 1 8 . 1 1 15 15 VAL H H 15 8.854 8.854 8.332 0.522 18327
1937 1 8 . 1 1 16 16 ALA N N 16 129.400 129.400 127.338 2.062 18327
1938 1 8 . 1 1 16 16 ALA HA H 16 5.000 5.000 4.767 0.233 18327
1939 1 8 . 1 1 16 16 ALA CA C 16 52.000 52.000 51.564 0.436 18327
1940 1 8 . 1 1 16 16 ALA CB C 16 19.330 19.330 20.396 -1.066 18327
1941 1 8 . 1 1 16 16 ALA H H 16 9.112 9.112 9.150 -0.038 18327
1942 1 8 . 1 1 17 17 PHE N N 17 123.900 123.900 123.096 0.804 18327
1943 1 8 . 1 1 17 17 PHE HA H 17 4.740 4.740 4.640 0.100 18327
1944 1 8 . 1 1 17 17 PHE CA C 17 56.230 56.230 57.904 -1.674 18327
1945 1 8 . 1 1 17 17 PHE CB C 17 40.000 40.000 40.365 -0.366 18327
1946 1 8 . 1 1 17 17 PHE H H 17 8.785 8.785 8.809 -0.024 18327
1947 1 8 . 1 1 18 18 TYR N N 18 118.100 118.100 118.405 -0.305 18327
1948 1 8 . 1 1 18 18 TYR HA H 18 4.490 4.490 4.561 -0.071 18327
1949 1 8 . 1 1 18 18 TYR CA C 18 55.300 55.300 57.567 -2.267 18327
1950 1 8 . 1 1 18 18 TYR CB C 18 42.810 42.810 42.226 0.584 18327
1951 1 8 . 1 1 18 18 TYR H H 18 7.288 7.288 7.622 -0.334 18327
1952 1 8 . 1 1 19 19 ASN N N 19 116.800 116.800 121.333 -4.533 18327
1953 1 8 . 1 1 19 19 ASN HA H 19 4.710 4.710 4.781 -0.071 18327
1954 1 8 . 1 1 19 19 ASN CA C 19 52.940 52.940 53.878 -0.938 18327
1955 1 8 . 1 1 19 19 ASN CB C 19 39.060 39.060 38.839 0.221 18327
1956 1 8 . 1 1 19 19 ASN H H 19 8.122 8.122 8.870 -0.748 18327
1957 1 8 . 1 1 20 20 TYR N N 20 122.000 122.000 124.950 -2.950 18327
1958 1 8 . 1 1 20 20 TYR HA H 20 4.710 4.710 4.723 -0.013 18327
1959 1 8 . 1 1 20 20 TYR CA C 20 57.720 57.720 57.791 -0.071 18327
1960 1 8 . 1 1 20 20 TYR CB C 20 42.250 42.250 42.768 -0.518 18327
1961 1 8 . 1 1 20 20 TYR H H 20 8.994 8.994 8.537 0.457 18327
1962 1 8 . 1 1 21 21 ASP N N 21 128.500 128.500 122.675 5.825 18327
1963 1 8 . 1 1 21 21 ASP HA H 21 4.790 4.790 4.853 -0.063 18327
1964 1 8 . 1 1 21 21 ASP CA C 21 52.370 52.370 52.355 0.015 18327
1965 1 8 . 1 1 21 21 ASP CB C 21 41.130 41.130 42.950 -1.820 18327
1966 1 8 . 1 1 21 21 ASP H H 21 7.839 7.839 7.603 0.236 18327
1967 1 8 . 1 1 22 22 ALA N N 22 125.200 125.200 121.710 3.490 18327
1968 1 8 . 1 1 22 22 ALA HA H 22 4.050 4.050 4.557 -0.507 18327
1969 1 8 . 1 1 22 22 ALA CA C 22 52.940 52.940 52.505 0.435 18327
1970 1 8 . 1 1 22 22 ALA CB C 22 20.450 20.450 19.496 0.954 18327
1971 1 8 . 1 1 22 22 ALA H H 22 8.107 8.107 8.390 -0.283 18327
1972 1 8 . 1 1 23 23 ARG N N 23 122.200 122.200 122.184 0.016 18327
1973 1 8 . 1 1 23 23 ARG HA H 23 4.350 4.350 4.547 -0.197 18327
1974 1 8 . 1 1 23 23 ARG CA C 23 55.490 55.490 55.751 -0.261 18327
1975 1 8 . 1 1 23 23 ARG CB C 23 30.700 30.700 30.911 -0.211 18327
1976 1 8 . 1 1 23 23 ARG H H 23 8.889 8.889 9.007 -0.118 18327
1977 1 8 . 1 1 24 24 GLY N N 24 105.200 105.200 107.237 -2.037 18327
1978 1 8 . 1 1 24 24 GLY CA C 24 44.500 44.500 44.644 -0.144 18327
1979 1 8 . 1 1 24 24 GLY H H 24 7.267 7.267 7.602 -0.335 18327
1980 1 8 . 1 1 25 25 ALA N N 25 122.200 122.200 121.340 0.860 18327
1981 1 8 . 1 1 25 25 ALA HA H 25 4.160 4.160 4.366 -0.206 18327
1982 1 8 . 1 1 25 25 ALA CA C 25 54.440 54.440 54.015 0.425 18327
1983 1 8 . 1 1 25 25 ALA CB C 25 18.770 18.770 19.102 -0.332 18327
1984 1 8 . 1 1 25 25 ALA H H 25 8.621 8.621 8.490 0.131 18327
1985 1 8 . 1 1 26 26 ASP N N 26 114.700 114.700 119.310 -4.610 18327
1986 1 8 . 1 1 26 26 ASP HA H 26 4.700 4.700 4.727 -0.027 18327
1987 1 8 . 1 1 26 26 ASP CA C 26 53.870 53.870 53.266 0.604 18327
1988 1 8 . 1 1 26 26 ASP CB C 26 40.390 40.390 40.473 -0.083 18327
1989 1 8 . 1 1 26 26 ASP H H 26 8.949 8.949 8.562 0.387 18327
1990 1 8 . 1 1 27 27 GLU N N 27 118.800 118.800 118.111 0.689 18327
1991 1 8 . 1 1 27 27 GLU HA H 27 5.220 5.220 4.973 0.247 18327
1992 1 8 . 1 1 27 27 GLU CA C 27 54.930 54.930 54.516 0.414 18327
1993 1 8 . 1 1 27 27 GLU CB C 27 32.880 32.880 31.887 0.993 18327
1994 1 8 . 1 1 27 27 GLU H H 27 7.542 7.542 7.550 -0.008 18327
1995 1 8 . 1 1 28 28 LEU N N 28 121.400 121.400 119.263 2.137 18327
1996 1 8 . 1 1 28 28 LEU HA H 28 4.760 4.760 4.743 0.017 18327
1997 1 8 . 1 1 28 28 LEU CA C 28 53.120 53.120 53.707 -0.587 18327
1998 1 8 . 1 1 28 28 LEU CB C 28 44.500 44.500 45.430 -0.930 18327
1999 1 8 . 1 1 28 28 LEU H H 28 8.897 8.897 8.252 0.645 18327
2000 1 8 . 1 1 29 29 SER N N 29 115.700 115.700 116.927 -1.227 18327
2001 1 8 . 1 1 29 29 SER HA H 29 5.030 5.030 4.987 0.043 18327
2002 1 8 . 1 1 29 29 SER CA C 29 58.470 58.470 57.493 0.977 18327
2003 1 8 . 1 1 29 29 SER CB C 29 63.690 63.690 64.182 -0.492 18327
2004 1 8 . 1 1 29 29 SER H H 29 7.949 7.949 8.285 -0.336 18327
2005 1 8 . 1 1 30 30 LEU N N 30 121.300 121.300 118.676 2.624 18327
2006 1 8 . 1 1 30 30 LEU HA H 30 4.800 4.800 4.702 0.098 18327
2007 1 8 . 1 1 30 30 LEU CA C 30 52.940 52.940 55.351 -2.411 18327
2008 1 8 . 1 1 30 30 LEU CB C 30 46.370 46.370 46.023 0.347 18327
2009 1 8 . 1 1 30 30 LEU H H 30 9.503 9.503 8.552 0.951 18327
2010 1 8 . 1 1 31 31 GLN N N 31 123.100 123.100 120.534 2.566 18327
2011 1 8 . 1 1 31 31 GLN HA H 31 5.070 5.070 4.715 0.355 18327
2012 1 8 . 1 1 31 31 GLN CA C 31 52.940 52.940 54.820 -1.880 18327
2013 1 8 . 1 1 31 31 GLN CB C 31 31.190 31.190 32.566 -1.376 18327
2014 1 8 . 1 1 31 31 GLN H H 31 9.152 9.152 8.480 0.672 18327
2015 1 8 . 1 1 32 32 ILE N N 32 120.800 120.800 122.011 -1.211 18327
2016 1 8 . 1 1 32 32 ILE HA H 32 3.030 3.030 3.700 -0.670 18327
2017 1 8 . 1 1 32 32 ILE CA C 32 64.250 64.250 62.663 1.587 18327
2018 1 8 . 1 1 32 32 ILE CB C 32 37.940 37.940 37.213 0.727 18327
2019 1 8 . 1 1 32 32 ILE H H 32 8.019 8.019 8.580 -0.561 18327
2020 1 8 . 1 1 33 33 GLY N N 33 115.700 115.700 114.183 1.517 18327
2021 1 8 . 1 1 33 33 GLY CA C 33 44.500 44.500 44.817 -0.317 18327
2022 1 8 . 1 1 33 33 GLY H H 33 8.777 8.777 8.459 0.318 18327
2023 1 8 . 1 1 34 34 ASP N N 34 122.300 122.300 122.334 -0.034 18327
2024 1 8 . 1 1 34 34 ASP HA H 34 4.640 4.640 4.872 -0.232 18327
2025 1 8 . 1 1 34 34 ASP CA C 34 55.860 55.860 53.640 2.220 18327
2026 1 8 . 1 1 34 34 ASP CB C 34 41.310 41.310 41.807 -0.497 18327
2027 1 8 . 1 1 34 34 ASP H H 34 8.690 8.690 7.664 1.026 18327
2028 1 8 . 1 1 35 35 THR N N 35 117.900 117.900 115.883 2.017 18327
2029 1 8 . 1 1 35 35 THR HA H 35 5.160 5.160 5.266 -0.106 18327
2030 1 8 . 1 1 35 35 THR CA C 35 61.450 61.450 61.633 -0.183 18327
2031 1 8 . 1 1 35 35 THR CB C 35 69.090 69.090 70.501 -1.411 18327
2032 1 8 . 1 1 35 35 THR H H 35 8.389 8.389 8.322 0.067 18327
2033 1 8 . 1 1 36 36 VAL N N 36 118.200 118.200 116.323 1.877 18327
2034 1 8 . 1 1 36 36 VAL HA H 36 5.100 5.100 4.429 0.671 18327
2035 1 8 . 1 1 36 36 VAL CA C 36 57.910 57.910 60.255 -2.345 18327
2036 1 8 . 1 1 36 36 VAL CB C 36 34.190 34.190 34.414 -0.224 18327
2037 1 8 . 1 1 36 36 VAL H H 36 9.019 9.019 9.047 -0.028 18327
2038 1 8 . 1 1 37 37 HIS N N 37 122.100 122.100 119.975 2.125 18327
2039 1 8 . 1 1 37 37 HIS HA H 37 4.840 4.840 4.987 -0.147 18327
2040 1 8 . 1 1 37 37 HIS CA C 37 52.560 52.560 53.807 -1.247 18327
2041 1 8 . 1 1 37 37 HIS CB C 37 31.260 31.260 33.099 -1.839 18327
2042 1 8 . 1 1 37 37 HIS H H 37 8.489 8.489 8.596 -0.107 18327
2043 1 8 . 1 1 38 38 ILE N N 38 126.400 126.400 126.190 0.210 18327
2044 1 8 . 1 1 38 38 ILE HA H 38 3.780 3.780 4.317 -0.537 18327
2045 1 8 . 1 1 38 38 ILE CA C 38 61.640 61.640 60.735 0.905 18327
2046 1 8 . 1 1 38 38 ILE CB C 38 38.880 38.880 38.645 0.235 18327
2047 1 8 . 1 1 38 38 ILE H H 38 8.636 8.636 8.958 -0.322 18327
2048 1 8 . 1 1 39 39 LEU N N 39 126.000 126.000 126.315 -0.315 18327
2049 1 8 . 1 1 39 39 LEU HA H 39 4.400 4.400 4.652 -0.252 18327
2050 1 8 . 1 1 39 39 LEU CA C 39 55.490 55.490 55.207 0.283 18327
2051 1 8 . 1 1 39 39 LEU CB C 39 43.750 43.750 43.728 0.022 18327
2052 1 8 . 1 1 39 39 LEU H H 39 9.162 9.162 8.861 0.301 18327
2053 1 8 . 1 1 40 40 GLU N N 40 115.100 115.100 116.529 -1.429 18327
2054 1 8 . 1 1 40 40 GLU HA H 40 7.895 7.895 4.543 3.352 18327
2055 1 8 . 1 1 41 41 THR N N 41 116.400 116.400 112.754 3.646 18327
2056 1 8 . 1 1 41 41 THR HA H 41 4.270 4.270 4.552 -0.282 18327
2057 1 8 . 1 1 41 41 THR CA C 41 60.890 60.890 61.646 -0.756 18327
2058 1 8 . 1 1 41 41 THR CB C 41 69.650 69.650 70.097 -0.447 18327
2059 1 8 . 1 1 41 41 THR H H 41 8.162 8.162 8.442 -0.280 18327
2060 1 8 . 1 1 43 43 GLU N N 43 123.300 123.300 121.669 1.631 18327
2061 1 8 . 1 1 43 43 GLU HA H 43 4.270 4.270 4.216 0.054 18327
2062 1 8 . 1 1 43 43 GLU CA C 43 57.350 57.350 55.307 2.043 18327
2063 1 8 . 1 1 43 43 GLU CB C 43 26.790 26.790 29.036 -2.246 18327
2064 1 8 . 1 1 43 43 GLU H H 43 8.108 8.108 8.316 -0.208 18327
2065 1 8 . 1 1 44 44 GLY CA C 44 45.440 45.440 45.130 0.310 18327
2066 1 8 . 1 1 45 45 TRP N N 45 124.100 124.100 120.121 3.979 18327
2067 1 8 . 1 1 45 45 TRP HA H 45 4.690 4.690 4.742 -0.052 18327
2068 1 8 . 1 1 45 45 TRP H H 45 8.590 8.590 6.814 1.776 18327
2069 1 8 . 1 1 46 46 TYR HA H 46 5.600 5.600 4.843 0.757 18327
2070 1 8 . 1 1 46 46 TYR CA C 46 54.060 54.060 56.257 -2.197 18327
2071 1 8 . 1 1 46 46 TYR CB C 46 42.060 42.060 41.886 0.174 18327
2072 1 8 . 1 1 47 47 ARG N N 47 118.100 118.100 120.084 -1.984 18327
2073 1 8 . 1 1 47 47 ARG HA H 47 5.070 5.070 4.697 0.373 18327
2074 1 8 . 1 1 47 47 ARG CA C 47 54.060 54.060 54.370 -0.310 18327
2075 1 8 . 1 1 47 47 ARG CB C 47 33.250 33.250 34.710 -1.460 18327
2076 1 8 . 1 1 47 47 ARG H H 47 8.495 8.495 8.944 -0.449 18327
2077 1 8 . 1 1 48 48 GLY N N 48 114.000 114.000 113.303 0.697 18327
2078 1 8 . 1 1 48 48 GLY CA C 48 46.560 46.560 46.379 0.181 18327
2079 1 8 . 1 1 48 48 GLY H H 48 9.183 9.183 8.752 0.431 18327
2080 1 8 . 1 1 49 49 TYR N N 49 116.200 116.200 117.648 -1.448 18327
2081 1 8 . 1 1 49 49 TYR HA H 49 5.380 5.380 5.029 0.351 18327
2082 1 8 . 1 1 49 49 TYR CA C 49 55.110 55.110 57.108 -1.998 18327
2083 1 8 . 1 1 49 49 TYR CB C 49 40.750 40.750 39.301 1.449 18327
2084 1 8 . 1 1 49 49 TYR H H 49 8.199 8.199 8.445 -0.246 18327
2085 1 8 . 1 1 50 50 THR N N 50 112.200 112.200 111.637 0.563 18327
2086 1 8 . 1 1 50 50 THR HA H 50 5.120 5.120 4.215 0.905 18327
2087 1 8 . 1 1 50 50 THR CA C 50 59.770 59.770 61.747 -1.977 18327
2088 1 8 . 1 1 50 50 THR CB C 50 69.460 69.460 69.869 -0.409 18327
2089 1 8 . 1 1 50 50 THR H H 50 9.436 9.436 8.327 1.109 18327
2090 1 8 . 1 1 51 51 LEU N N 51 121.300 121.300 120.253 1.047 18327
2091 1 8 . 1 1 51 51 LEU HA H 51 4.230 4.230 4.267 -0.037 18327
2092 1 8 . 1 1 51 51 LEU CA C 51 56.790 56.790 56.084 0.706 18327
2093 1 8 . 1 1 51 51 LEU CB C 51 40.000 40.000 41.995 -1.994 18327
2094 1 8 . 1 1 51 51 LEU H H 51 8.313 8.313 8.023 0.290 18327
2095 1 8 . 1 1 52 52 ARG N N 52 116.600 116.600 118.526 -1.926 18327
2096 1 8 . 1 1 52 52 ARG HA H 52 4.250 4.250 4.081 0.169 18327
2097 1 8 . 1 1 52 52 ARG CA C 52 57.350 57.350 57.605 -0.255 18327
2098 1 8 . 1 1 52 52 ARG CB C 52 30.510 30.510 30.639 -0.129 18327
2099 1 8 . 1 1 52 52 ARG H H 52 8.053 8.053 7.751 0.302 18327
2100 1 8 . 1 1 53 53 LYS N N 53 122.600 122.600 117.577 5.023 18327
2101 1 8 . 1 1 53 53 LYS HA H 53 4.620 4.620 4.508 0.112 18327
2102 1 8 . 1 1 53 53 LYS CA C 53 54.620 54.620 55.771 -1.151 18327
2103 1 8 . 1 1 53 53 LYS CB C 53 32.310 32.310 33.010 -0.700 18327
2104 1 8 . 1 1 53 53 LYS H H 53 7.655 7.655 7.672 -0.017 18327
2105 1 8 . 1 1 54 54 LYS N N 54 124.900 124.900 122.941 1.959 18327
2106 1 8 . 1 1 54 54 LYS HA H 54 4.090 4.090 4.393 -0.303 18327
2107 1 8 . 1 1 54 54 LYS CA C 54 58.470 58.470 58.479 -0.009 18327
2108 1 8 . 1 1 54 54 LYS CB C 54 32.130 32.130 32.543 -0.413 18327
2109 1 8 . 1 1 54 54 LYS H H 54 8.499 8.499 8.648 -0.149 18327
2110 1 8 . 1 1 55 55 SER N N 55 110.100 110.100 113.648 -3.548 18327
2111 1 8 . 1 1 55 55 SER HA H 55 4.140 4.140 4.327 -0.187 18327
2112 1 8 . 1 1 55 55 SER CA C 55 58.470 58.470 60.234 -1.764 18327
2113 1 8 . 1 1 55 55 SER CB C 55 63.310 63.310 63.415 -0.105 18327
2114 1 8 . 1 1 55 55 SER H H 55 7.862 7.862 8.340 -0.478 18327
2115 1 8 . 1 1 56 56 LYS N N 56 124.000 124.000 122.210 1.790 18327
2116 1 8 . 1 1 56 56 LYS HA H 56 4.700 4.700 4.470 0.230 18327
2117 1 8 . 1 1 56 56 LYS CA C 56 54.810 54.810 55.555 -0.745 18327
2118 1 8 . 1 1 56 56 LYS CB C 56 33.250 33.250 33.350 -0.100 18327
2119 1 8 . 1 1 56 56 LYS H H 56 7.481 7.481 7.314 0.167 18327
2120 1 8 . 1 1 57 57 LYS N N 57 125.700 125.700 123.215 2.485 18327
2121 1 8 . 1 1 57 57 LYS HA H 57 5.330 5.330 4.665 0.665 18327
2122 1 8 . 1 1 57 57 LYS CA C 57 54.620 54.620 54.928 -0.308 18327
2123 1 8 . 1 1 57 57 LYS CB C 57 34.240 34.240 35.551 -1.311 18327
2124 1 8 . 1 1 57 57 LYS H H 57 8.475 8.475 8.417 0.058 18327
2125 1 8 . 1 1 58 58 GLY N N 58 109.400 109.400 107.638 1.762 18327
2126 1 8 . 1 1 58 58 GLY CA C 58 45.620 45.620 45.666 -0.047 18327
2127 1 8 . 1 1 58 58 GLY H H 58 9.073 9.073 8.470 0.603 18327
2128 1 8 . 1 1 59 59 ILE N N 59 113.900 113.900 116.929 -3.029 18327
2129 1 8 . 1 1 59 59 ILE HA H 59 6.000 6.000 4.589 1.411 18327
2130 1 8 . 1 1 59 59 ILE CA C 59 59.590 59.590 59.915 -0.325 18327
2131 1 8 . 1 1 59 59 ILE CB C 59 41.140 41.140 42.059 -0.920 18327
2132 1 8 . 1 1 59 59 ILE H H 59 8.628 8.628 8.165 0.463 18327
2133 1 8 . 1 1 60 60 PHE N N 60 116.900 116.900 114.304 2.596 18327
2134 1 8 . 1 1 60 60 PHE HA H 60 5.120 5.120 4.545 0.575 18327
2135 1 8 . 1 1 60 60 PHE CA C 60 54.060 54.060 54.721 -0.661 18327
2136 1 8 . 1 1 60 60 PHE CB C 60 37.190 37.190 39.766 -2.576 18327
2137 1 8 . 1 1 60 60 PHE H H 60 8.724 8.724 7.855 0.869 18327
2138 1 8 . 1 1 61 61 PRO HA H 61 3.480 3.480 4.034 -0.554 18327
2139 1 8 . 1 1 61 61 PRO CA C 61 62.200 62.200 62.203 -0.003 18327
2140 1 8 . 1 1 61 61 PRO CB C 61 31.190 31.190 31.518 -0.328 18327
2141 1 8 . 1 1 62 62 ALA N N 62 124.600 124.600 127.772 -3.172 18327
2142 1 8 . 1 1 62 62 ALA HA H 62 3.720 3.720 3.836 -0.116 18327
2143 1 8 . 1 1 62 62 ALA CA C 62 54.370 54.370 54.676 -0.306 18327
2144 1 8 . 1 1 62 62 ALA CB C 62 17.650 17.650 17.931 -0.281 18327
2145 1 8 . 1 1 62 62 ALA H H 62 7.898 7.898 8.372 -0.474 18327
2146 1 8 . 1 1 63 63 SER N N 63 109.700 109.700 113.959 -4.259 18327
2147 1 8 . 1 1 63 63 SER HA H 63 4.200 4.200 4.186 0.014 18327
2148 1 8 . 1 1 63 63 SER CA C 63 59.400 59.400 60.772 -1.371 18327
2149 1 8 . 1 1 63 63 SER CB C 63 62.380 62.380 63.055 -0.675 18327
2150 1 8 . 1 1 63 63 SER H H 63 8.030 8.030 8.481 -0.451 18327
2151 1 8 . 1 1 64 64 TYR N N 64 120.300 120.300 116.796 3.504 18327
2152 1 8 . 1 1 64 64 TYR HA H 64 4.260 4.260 4.404 -0.144 18327
2153 1 8 . 1 1 64 64 TYR CA C 64 57.720 57.720 58.992 -1.272 18327
2154 1 8 . 1 1 64 64 TYR CB C 64 37.560 37.560 38.144 -0.584 18327
2155 1 8 . 1 1 64 64 TYR H H 64 7.124 7.124 8.134 -1.010 18327
2156 1 8 . 1 1 65 65 ILE N N 65 118.000 118.000 116.172 1.828 18327
2157 1 8 . 1 1 65 65 ILE HA H 65 4.830 4.830 4.881 -0.051 18327
2158 1 8 . 1 1 65 65 ILE CA C 65 56.980 56.980 59.111 -2.131 18327
2159 1 8 . 1 1 65 65 ILE CB C 65 39.630 39.630 39.569 0.061 18327
2160 1 8 . 1 1 65 65 ILE H H 65 7.671 7.671 7.399 0.272 18327
2161 1 8 . 1 1 66 66 HIS N N 66 124.500 124.500 121.664 2.836 18327
2162 1 8 . 1 1 66 66 HIS HA H 66 5.130 5.130 4.885 0.245 18327
2163 1 8 . 1 1 66 66 HIS CA C 66 53.060 53.060 54.511 -1.451 18327
2164 1 8 . 1 1 66 66 HIS CB C 66 30.510 30.510 33.044 -2.534 18327
2165 1 8 . 1 1 66 66 HIS H H 66 9.159 9.159 8.638 0.521 18327
2166 1 8 . 1 1 67 67 LEU N N 67 127.400 127.400 126.857 0.543 18327
2167 1 8 . 1 1 67 67 LEU HA H 67 4.560 4.560 4.343 0.217 18327
2168 1 8 . 1 1 67 67 LEU CA C 67 55.300 55.300 56.218 -0.918 18327
2169 1 8 . 1 1 67 67 LEU CB C 67 42.060 42.060 42.269 -0.209 18327
2170 1 8 . 1 1 67 67 LEU H H 67 8.979 8.979 8.984 -0.005 18327
2171 1 8 . 1 1 68 68 LYS N N 68 121.900 121.900 125.233 -3.333 18327
2172 1 8 . 1 1 68 68 LYS HA H 68 4.490 4.490 4.465 0.025 18327
2173 1 8 . 1 1 68 68 LYS CA C 68 55.110 55.110 55.266 -0.156 18327
2174 1 8 . 1 1 68 68 LYS CB C 68 34.610 34.610 34.322 0.289 18327
2175 1 8 . 1 1 68 68 LYS H H 68 8.499 8.499 8.833 -0.334 18327
2176 1 8 . 1 1 69 69 GLU N N 69 122.100 122.100 122.308 -0.208 18327
2177 1 8 . 1 1 69 69 GLU HA H 69 4.290 4.290 4.091 0.199 18327
2178 1 8 . 1 1 69 69 GLU CA C 69 56.610 56.610 57.995 -1.385 18327
2179 1 8 . 1 1 69 69 GLU CB C 69 30.330 30.330 29.880 0.451 18327
2180 1 8 . 1 1 69 69 GLU H H 69 8.569 8.569 8.206 0.363 18327
2181 1 8 . 1 1 70 70 ALA N N 70 123.300 123.300 129.211 -5.911 18327
2182 1 8 . 1 1 70 70 ALA HA H 70 4.210 4.210 4.143 0.067 18327
2183 1 8 . 1 1 70 70 ALA CA C 70 51.810 51.810 52.709 -0.899 18327
2184 1 8 . 1 1 70 70 ALA CB C 70 19.700 19.700 17.420 2.280 18327
2185 1 8 . 1 1 70 70 ALA H H 70 8.181 8.181 8.669 -0.488 18327
2186 1 8 . 1 1 71 71 ILE N N 71 120.000 120.000 114.451 5.549 18327
2187 1 8 . 1 1 71 71 ILE HA H 71 4.070 4.070 4.082 -0.012 18327
2188 1 8 . 1 1 71 71 ILE CA C 71 60.330 60.330 61.513 -1.183 18327
2189 1 8 . 1 1 71 71 ILE CB C 71 38.690 38.690 38.453 0.237 18327
2190 1 8 . 1 1 71 71 ILE H H 71 7.789 7.789 7.991 -0.202 18327
2191 1 8 . 1 1 72 72 VAL N N 72 124.400 124.400 121.204 3.196 18327
2192 1 8 . 1 1 72 72 VAL HA H 72 4.070 4.070 4.342 -0.272 18327
2193 1 8 . 1 1 72 72 VAL CA C 72 61.640 61.640 60.934 0.706 18327
2194 1 8 . 1 1 72 72 VAL CB C 72 32.690 32.690 33.164 -0.474 18327
2195 1 8 . 1 1 72 72 VAL H H 72 8.089 8.089 8.082 0.007 18327
2196 1 8 . 1 1 73 73 GLU N N 73 125.940 125.940 119.377 6.563 18327
2197 1 8 . 1 1 73 73 GLU HA H 73 4.300 4.300 4.478 -0.178 18327
2198 1 8 . 1 1 73 73 GLU CA C 73 56.610 56.610 54.809 1.801 18327
2199 1 8 . 1 1 73 73 GLU CB C 73 30.710 30.710 30.956 -0.246 18327
2200 1 8 . 1 1 73 73 GLU H H 73 8.464 8.464 8.092 0.372 18327
2201 1 9 . 1 1 13 13 TYR HA H 13 5.560 5.560 4.575 0.985 18327
2202 1 9 . 1 1 13 13 TYR CA C 13 55.860 55.860 56.974 -1.114 18327
2203 1 9 . 1 1 13 13 TYR CB C 13 42.440 42.440 40.843 1.597 18327
2204 1 9 . 1 1 14 14 GLY N N 14 105.400 105.400 106.215 -0.815 18327
2205 1 9 . 1 1 14 14 GLY CA C 14 45.240 45.240 43.534 1.706 18327
2206 1 9 . 1 1 14 14 GLY H H 14 8.406 8.406 8.524 -0.118 18327
2207 1 9 . 1 1 15 15 VAL N N 15 118.900 118.900 120.700 -1.800 18327
2208 1 9 . 1 1 15 15 VAL HA H 15 5.330 5.330 4.820 0.510 18327
2209 1 9 . 1 1 15 15 VAL CA C 15 59.210 59.210 60.780 -1.570 18327
2210 1 9 . 1 1 15 15 VAL CB C 15 35.740 35.740 36.190 -0.449 18327
2211 1 9 . 1 1 15 15 VAL H H 15 8.854 8.854 8.499 0.355 18327
2212 1 9 . 1 1 16 16 ALA N N 16 129.400 129.400 129.092 0.308 18327
2213 1 9 . 1 1 16 16 ALA HA H 16 5.000 5.000 4.883 0.117 18327
2214 1 9 . 1 1 16 16 ALA CA C 16 52.000 52.000 51.329 0.671 18327
2215 1 9 . 1 1 16 16 ALA CB C 16 19.330 19.330 20.387 -1.057 18327
2216 1 9 . 1 1 16 16 ALA H H 16 9.112 9.112 9.109 0.003 18327
2217 1 9 . 1 1 17 17 PHE N N 17 123.900 123.900 124.593 -0.693 18327
2218 1 9 . 1 1 17 17 PHE HA H 17 4.740 4.740 4.641 0.099 18327
2219 1 9 . 1 1 17 17 PHE CA C 17 56.230 56.230 56.511 -0.281 18327
2220 1 9 . 1 1 17 17 PHE CB C 17 40.000 40.000 39.710 0.290 18327
2221 1 9 . 1 1 17 17 PHE H H 17 8.785 8.785 8.192 0.593 18327
2222 1 9 . 1 1 18 18 TYR N N 18 118.100 118.100 118.230 -0.130 18327
2223 1 9 . 1 1 18 18 TYR HA H 18 4.490 4.490 4.438 0.052 18327
2224 1 9 . 1 1 18 18 TYR CA C 18 55.300 55.300 57.656 -2.356 18327
2225 1 9 . 1 1 18 18 TYR CB C 18 42.810 42.810 42.727 0.083 18327
2226 1 9 . 1 1 18 18 TYR H H 18 7.288 7.288 7.623 -0.335 18327
2227 1 9 . 1 1 19 19 ASN N N 19 116.800 116.800 119.860 -3.060 18327
2228 1 9 . 1 1 19 19 ASN HA H 19 4.710 4.710 4.767 -0.057 18327
2229 1 9 . 1 1 19 19 ASN CA C 19 52.940 52.940 53.177 -0.237 18327
2230 1 9 . 1 1 19 19 ASN CB C 19 39.060 39.060 39.151 -0.091 18327
2231 1 9 . 1 1 19 19 ASN H H 19 8.122 8.122 8.575 -0.453 18327
2232 1 9 . 1 1 20 20 TYR N N 20 122.000 122.000 122.688 -0.688 18327
2233 1 9 . 1 1 20 20 TYR HA H 20 4.710 4.710 4.495 0.215 18327
2234 1 9 . 1 1 20 20 TYR CA C 20 57.720 57.720 57.538 0.182 18327
2235 1 9 . 1 1 20 20 TYR CB C 20 42.250 42.250 42.873 -0.623 18327
2236 1 9 . 1 1 20 20 TYR H H 20 8.994 8.994 8.722 0.272 18327
2237 1 9 . 1 1 21 21 ASP N N 21 128.500 128.500 121.991 6.509 18327
2238 1 9 . 1 1 21 21 ASP HA H 21 4.790 4.790 5.128 -0.338 18327
2239 1 9 . 1 1 21 21 ASP CA C 21 52.370 52.370 51.691 0.679 18327
2240 1 9 . 1 1 21 21 ASP CB C 21 41.130 41.130 43.966 -2.836 18327
2241 1 9 . 1 1 21 21 ASP H H 21 7.839 7.839 7.623 0.216 18327
2242 1 9 . 1 1 22 22 ALA N N 22 125.200 125.200 125.334 -0.134 18327
2243 1 9 . 1 1 22 22 ALA HA H 22 4.050 4.050 4.346 -0.296 18327
2244 1 9 . 1 1 22 22 ALA CA C 22 52.940 52.940 52.993 -0.053 18327
2245 1 9 . 1 1 22 22 ALA CB C 22 20.450 20.450 19.586 0.864 18327
2246 1 9 . 1 1 22 22 ALA H H 22 8.107 8.107 8.112 -0.005 18327
2247 1 9 . 1 1 23 23 ARG N N 23 122.200 122.200 121.218 0.982 18327
2248 1 9 . 1 1 23 23 ARG HA H 23 4.350 4.350 4.252 0.098 18327
2249 1 9 . 1 1 23 23 ARG CA C 23 55.490 55.490 57.379 -1.889 18327
2250 1 9 . 1 1 23 23 ARG CB C 23 30.700 30.700 30.935 -0.235 18327
2251 1 9 . 1 1 23 23 ARG H H 23 8.889 8.889 8.773 0.116 18327
2252 1 9 . 1 1 24 24 GLY N N 24 105.200 105.200 104.573 0.627 18327
2253 1 9 . 1 1 24 24 GLY CA C 24 44.500 44.500 44.610 -0.110 18327
2254 1 9 . 1 1 24 24 GLY H H 24 7.267 7.267 7.553 -0.286 18327
2255 1 9 . 1 1 25 25 ALA N N 25 122.200 122.200 121.326 0.874 18327
2256 1 9 . 1 1 25 25 ALA HA H 25 4.160 4.160 4.253 -0.093 18327
2257 1 9 . 1 1 25 25 ALA CA C 25 54.440 54.440 53.841 0.599 18327
2258 1 9 . 1 1 25 25 ALA CB C 25 18.770 18.770 19.079 -0.309 18327
2259 1 9 . 1 1 25 25 ALA H H 25 8.621 8.621 8.316 0.305 18327
2260 1 9 . 1 1 26 26 ASP N N 26 114.700 114.700 116.780 -2.080 18327
2261 1 9 . 1 1 26 26 ASP HA H 26 4.700 4.700 4.581 0.119 18327
2262 1 9 . 1 1 26 26 ASP CA C 26 53.870 53.870 53.506 0.364 18327
2263 1 9 . 1 1 26 26 ASP CB C 26 40.390 40.390 40.533 -0.143 18327
2264 1 9 . 1 1 26 26 ASP H H 26 8.949 8.949 8.386 0.563 18327
2265 1 9 . 1 1 27 27 GLU N N 27 118.800 118.800 118.834 -0.034 18327
2266 1 9 . 1 1 27 27 GLU HA H 27 5.220 5.220 4.896 0.324 18327
2267 1 9 . 1 1 27 27 GLU CA C 27 54.930 54.930 55.275 -0.345 18327
2268 1 9 . 1 1 27 27 GLU CB C 27 32.880 32.880 32.538 0.342 18327
2269 1 9 . 1 1 27 27 GLU H H 27 7.542 7.542 7.617 -0.075 18327
2270 1 9 . 1 1 28 28 LEU N N 28 121.400 121.400 121.016 0.384 18327
2271 1 9 . 1 1 28 28 LEU HA H 28 4.760 4.760 4.734 0.026 18327
2272 1 9 . 1 1 28 28 LEU CA C 28 53.120 53.120 54.316 -1.196 18327
2273 1 9 . 1 1 28 28 LEU CB C 28 44.500 44.500 45.449 -0.949 18327
2274 1 9 . 1 1 28 28 LEU H H 28 8.897 8.897 8.247 0.650 18327
2275 1 9 . 1 1 29 29 SER N N 29 115.700 115.700 119.197 -3.497 18327
2276 1 9 . 1 1 29 29 SER HA H 29 5.030 5.030 4.610 0.420 18327
2277 1 9 . 1 1 29 29 SER CA C 29 58.470 58.470 59.224 -0.754 18327
2278 1 9 . 1 1 29 29 SER CB C 29 63.690 63.690 63.876 -0.186 18327
2279 1 9 . 1 1 29 29 SER H H 29 7.949 7.949 8.511 -0.562 18327
2280 1 9 . 1 1 30 30 LEU N N 30 121.300 121.300 120.307 0.993 18327
2281 1 9 . 1 1 30 30 LEU HA H 30 4.800 4.800 4.683 0.117 18327
2282 1 9 . 1 1 30 30 LEU CA C 30 52.940 52.940 55.464 -2.524 18327
2283 1 9 . 1 1 30 30 LEU CB C 30 46.370 46.370 46.151 0.219 18327
2284 1 9 . 1 1 30 30 LEU H H 30 9.503 9.503 8.551 0.952 18327
2285 1 9 . 1 1 31 31 GLN N N 31 123.100 123.100 121.863 1.237 18327
2286 1 9 . 1 1 31 31 GLN HA H 31 5.070 5.070 4.694 0.376 18327
2287 1 9 . 1 1 31 31 GLN CA C 31 52.940 52.940 54.118 -1.179 18327
2288 1 9 . 1 1 31 31 GLN CB C 31 31.190 31.190 32.531 -1.341 18327
2289 1 9 . 1 1 31 31 GLN H H 31 9.152 9.152 8.549 0.603 18327
2290 1 9 . 1 1 32 32 ILE N N 32 120.800 120.800 121.438 -0.638 18327
2291 1 9 . 1 1 32 32 ILE HA H 32 3.030 3.030 4.103 -1.073 18327
2292 1 9 . 1 1 32 32 ILE CA C 32 64.250 64.250 61.826 2.424 18327
2293 1 9 . 1 1 32 32 ILE CB C 32 37.940 37.940 37.731 0.209 18327
2294 1 9 . 1 1 32 32 ILE H H 32 8.019 8.019 8.624 -0.605 18327
2295 1 9 . 1 1 33 33 GLY N N 33 115.700 115.700 114.567 1.133 18327
2296 1 9 . 1 1 33 33 GLY CA C 33 44.500 44.500 44.929 -0.429 18327
2297 1 9 . 1 1 33 33 GLY H H 33 8.777 8.777 8.787 -0.010 18327
2298 1 9 . 1 1 34 34 ASP N N 34 122.300 122.300 122.223 0.077 18327
2299 1 9 . 1 1 34 34 ASP HA H 34 4.640 4.640 4.859 -0.219 18327
2300 1 9 . 1 1 34 34 ASP CA C 34 55.860 55.860 53.675 2.185 18327
2301 1 9 . 1 1 34 34 ASP CB C 34 41.310 41.310 42.759 -1.449 18327
2302 1 9 . 1 1 34 34 ASP H H 34 8.690 8.690 7.656 1.034 18327
2303 1 9 . 1 1 35 35 THR N N 35 117.900 117.900 116.181 1.719 18327
2304 1 9 . 1 1 35 35 THR HA H 35 5.160 5.160 5.264 -0.104 18327
2305 1 9 . 1 1 35 35 THR CA C 35 61.450 61.450 61.364 0.086 18327
2306 1 9 . 1 1 35 35 THR CB C 35 69.090 69.090 70.303 -1.213 18327
2307 1 9 . 1 1 35 35 THR H H 35 8.389 8.389 8.530 -0.141 18327
2308 1 9 . 1 1 36 36 VAL N N 36 118.200 118.200 116.430 1.770 18327
2309 1 9 . 1 1 36 36 VAL HA H 36 5.100 5.100 4.405 0.695 18327
2310 1 9 . 1 1 36 36 VAL CA C 36 57.910 57.910 60.422 -2.512 18327
2311 1 9 . 1 1 36 36 VAL CB C 36 34.190 34.190 34.803 -0.613 18327
2312 1 9 . 1 1 36 36 VAL H H 36 9.019 9.019 9.053 -0.034 18327
2313 1 9 . 1 1 37 37 HIS N N 37 122.100 122.100 119.599 2.501 18327
2314 1 9 . 1 1 37 37 HIS HA H 37 4.840 4.840 4.929 -0.089 18327
2315 1 9 . 1 1 37 37 HIS CA C 37 52.560 52.560 54.579 -2.019 18327
2316 1 9 . 1 1 37 37 HIS CB C 37 31.260 31.260 33.441 -2.181 18327
2317 1 9 . 1 1 37 37 HIS H H 37 8.489 8.489 8.437 0.052 18327
2318 1 9 . 1 1 38 38 ILE N N 38 126.400 126.400 125.284 1.116 18327
2319 1 9 . 1 1 38 38 ILE HA H 38 3.780 3.780 4.192 -0.412 18327
2320 1 9 . 1 1 38 38 ILE CA C 38 61.640 61.640 60.693 0.947 18327
2321 1 9 . 1 1 38 38 ILE CB C 38 38.880 38.880 38.888 -0.008 18327
2322 1 9 . 1 1 38 38 ILE H H 38 8.636 8.636 8.305 0.331 18327
2323 1 9 . 1 1 39 39 LEU N N 39 126.000 126.000 125.038 0.962 18327
2324 1 9 . 1 1 39 39 LEU HA H 39 4.400 4.400 4.985 -0.585 18327
2325 1 9 . 1 1 39 39 LEU CA C 39 55.490 55.490 55.396 0.094 18327
2326 1 9 . 1 1 39 39 LEU CB C 39 43.750 43.750 44.781 -1.031 18327
2327 1 9 . 1 1 39 39 LEU H H 39 9.162 9.162 8.776 0.386 18327
2328 1 9 . 1 1 40 40 GLU N N 40 115.100 115.100 117.349 -2.249 18327
2329 1 9 . 1 1 40 40 GLU HA H 40 7.895 7.895 4.751 3.144 18327
2330 1 9 . 1 1 41 41 THR N N 41 116.400 116.400 109.979 6.421 18327
2331 1 9 . 1 1 41 41 THR HA H 41 4.270 4.270 4.769 -0.499 18327
2332 1 9 . 1 1 41 41 THR CA C 41 60.890 60.890 60.394 0.496 18327
2333 1 9 . 1 1 41 41 THR CB C 41 69.650 69.650 71.774 -2.124 18327
2334 1 9 . 1 1 41 41 THR H H 41 8.162 8.162 8.311 -0.149 18327
2335 1 9 . 1 1 43 43 GLU N N 43 123.300 123.300 121.721 1.579 18327
2336 1 9 . 1 1 43 43 GLU HA H 43 4.270 4.270 4.364 -0.094 18327
2337 1 9 . 1 1 43 43 GLU CA C 43 57.350 57.350 55.071 2.279 18327
2338 1 9 . 1 1 43 43 GLU CB C 43 26.790 26.790 29.394 -2.604 18327
2339 1 9 . 1 1 43 43 GLU H H 43 8.108 8.108 8.403 -0.295 18327
2340 1 9 . 1 1 44 44 GLY CA C 44 45.440 45.440 45.602 -0.162 18327
2341 1 9 . 1 1 45 45 TRP N N 45 124.100 124.100 118.936 5.164 18327
2342 1 9 . 1 1 45 45 TRP HA H 45 4.690 4.690 4.674 0.016 18327
2343 1 9 . 1 1 45 45 TRP H H 45 8.590 8.590 7.417 1.173 18327
2344 1 9 . 1 1 46 46 TYR HA H 46 5.600 5.600 4.568 1.032 18327
2345 1 9 . 1 1 46 46 TYR CA C 46 54.060 54.060 57.124 -3.064 18327
2346 1 9 . 1 1 46 46 TYR CB C 46 42.060 42.060 42.186 -0.126 18327
2347 1 9 . 1 1 47 47 ARG N N 47 118.100 118.100 121.498 -3.398 18327
2348 1 9 . 1 1 47 47 ARG HA H 47 5.070 5.070 4.872 0.198 18327
2349 1 9 . 1 1 47 47 ARG CA C 47 54.060 54.060 54.805 -0.745 18327
2350 1 9 . 1 1 47 47 ARG CB C 47 33.250 33.250 34.023 -0.773 18327
2351 1 9 . 1 1 47 47 ARG H H 47 8.495 8.495 8.994 -0.499 18327
2352 1 9 . 1 1 48 48 GLY N N 48 114.000 114.000 114.715 -0.715 18327
2353 1 9 . 1 1 48 48 GLY CA C 48 46.560 46.560 46.591 -0.031 18327
2354 1 9 . 1 1 48 48 GLY H H 48 9.183 9.183 8.939 0.244 18327
2355 1 9 . 1 1 49 49 TYR N N 49 116.200 116.200 116.951 -0.751 18327
2356 1 9 . 1 1 49 49 TYR HA H 49 5.380 5.380 5.000 0.380 18327
2357 1 9 . 1 1 49 49 TYR CA C 49 55.110 55.110 56.971 -1.861 18327
2358 1 9 . 1 1 49 49 TYR CB C 49 40.750 40.750 39.193 1.557 18327
2359 1 9 . 1 1 49 49 TYR H H 49 8.199 8.199 8.489 -0.290 18327
2360 1 9 . 1 1 50 50 THR N N 50 112.200 112.200 111.322 0.878 18327
2361 1 9 . 1 1 50 50 THR HA H 50 5.120 5.120 4.192 0.928 18327
2362 1 9 . 1 1 50 50 THR CA C 50 59.770 59.770 61.466 -1.696 18327
2363 1 9 . 1 1 50 50 THR CB C 50 69.460 69.460 70.049 -0.589 18327
2364 1 9 . 1 1 50 50 THR H H 50 9.436 9.436 8.228 1.208 18327
2365 1 9 . 1 1 51 51 LEU N N 51 121.300 121.300 120.615 0.685 18327
2366 1 9 . 1 1 51 51 LEU HA H 51 4.230 4.230 4.342 -0.112 18327
2367 1 9 . 1 1 51 51 LEU CA C 51 56.790 56.790 55.815 0.975 18327
2368 1 9 . 1 1 51 51 LEU CB C 51 40.000 40.000 42.013 -2.013 18327
2369 1 9 . 1 1 51 51 LEU H H 51 8.313 8.313 8.329 -0.016 18327
2370 1 9 . 1 1 52 52 ARG N N 52 116.600 116.600 118.552 -1.952 18327
2371 1 9 . 1 1 52 52 ARG HA H 52 4.250 4.250 4.079 0.171 18327
2372 1 9 . 1 1 52 52 ARG CA C 52 57.350 57.350 57.411 -0.061 18327
2373 1 9 . 1 1 52 52 ARG CB C 52 30.510 30.510 30.627 -0.116 18327
2374 1 9 . 1 1 52 52 ARG H H 52 8.053 8.053 7.679 0.374 18327
2375 1 9 . 1 1 53 53 LYS N N 53 122.600 122.600 117.041 5.559 18327
2376 1 9 . 1 1 53 53 LYS HA H 53 4.620 4.620 4.525 0.095 18327
2377 1 9 . 1 1 53 53 LYS CA C 53 54.620 54.620 56.052 -1.432 18327
2378 1 9 . 1 1 53 53 LYS CB C 53 32.310 32.310 34.245 -1.935 18327
2379 1 9 . 1 1 53 53 LYS H H 53 7.655 7.655 7.686 -0.031 18327
2380 1 9 . 1 1 54 54 LYS N N 54 124.900 124.900 123.656 1.244 18327
2381 1 9 . 1 1 54 54 LYS HA H 54 4.090 4.090 4.523 -0.433 18327
2382 1 9 . 1 1 54 54 LYS CA C 54 58.470 58.470 58.485 -0.015 18327
2383 1 9 . 1 1 54 54 LYS CB C 54 32.130 32.130 32.219 -0.089 18327
2384 1 9 . 1 1 54 54 LYS H H 54 8.499 8.499 8.777 -0.278 18327
2385 1 9 . 1 1 55 55 SER N N 55 110.100 110.100 114.313 -4.213 18327
2386 1 9 . 1 1 55 55 SER HA H 55 4.140 4.140 4.245 -0.105 18327
2387 1 9 . 1 1 55 55 SER CA C 55 58.470 58.470 60.620 -2.150 18327
2388 1 9 . 1 1 55 55 SER CB C 55 63.310 63.310 63.203 0.107 18327
2389 1 9 . 1 1 55 55 SER H H 55 7.862 7.862 8.006 -0.144 18327
2390 1 9 . 1 1 56 56 LYS N N 56 124.000 124.000 121.988 2.012 18327
2391 1 9 . 1 1 56 56 LYS HA H 56 4.700 4.700 4.331 0.369 18327
2392 1 9 . 1 1 56 56 LYS CA C 56 54.810 54.810 55.836 -1.026 18327
2393 1 9 . 1 1 56 56 LYS CB C 56 33.250 33.250 31.475 1.775 18327
2394 1 9 . 1 1 56 56 LYS H H 56 7.481 7.481 8.314 -0.833 18327
2395 1 9 . 1 1 57 57 LYS N N 57 125.700 125.700 121.868 3.832 18327
2396 1 9 . 1 1 57 57 LYS HA H 57 5.330 5.330 4.559 0.771 18327
2397 1 9 . 1 1 57 57 LYS CA C 57 54.620 54.620 55.387 -0.767 18327
2398 1 9 . 1 1 57 57 LYS CB C 57 34.240 34.240 34.689 -0.449 18327
2399 1 9 . 1 1 57 57 LYS H H 57 8.475 8.475 7.723 0.752 18327
2400 1 9 . 1 1 58 58 GLY N N 58 109.400 109.400 106.180 3.220 18327
2401 1 9 . 1 1 58 58 GLY CA C 58 45.620 45.620 44.710 0.910 18327
2402 1 9 . 1 1 58 58 GLY H H 58 9.073 9.073 8.324 0.749 18327
2403 1 9 . 1 1 59 59 ILE N N 59 113.900 113.900 116.983 -3.083 18327
2404 1 9 . 1 1 59 59 ILE HA H 59 6.000 6.000 5.370 0.630 18327
2405 1 9 . 1 1 59 59 ILE CA C 59 59.590 59.590 59.389 0.202 18327
2406 1 9 . 1 1 59 59 ILE CB C 59 41.140 41.140 41.346 -0.206 18327
2407 1 9 . 1 1 59 59 ILE H H 59 8.628 8.628 8.494 0.134 18327
2408 1 9 . 1 1 60 60 PHE N N 60 116.900 116.900 115.143 1.757 18327
2409 1 9 . 1 1 60 60 PHE HA H 60 5.120 5.120 5.266 -0.146 18327
2410 1 9 . 1 1 60 60 PHE CA C 60 54.060 54.060 55.049 -0.989 18327
2411 1 9 . 1 1 60 60 PHE CB C 60 37.190 37.190 39.555 -2.365 18327
2412 1 9 . 1 1 60 60 PHE H H 60 8.724 8.724 8.591 0.133 18327
2413 1 9 . 1 1 61 61 PRO HA H 61 3.480 3.480 3.777 -0.297 18327
2414 1 9 . 1 1 61 61 PRO CA C 61 62.200 62.200 62.070 0.130 18327
2415 1 9 . 1 1 61 61 PRO CB C 61 31.190 31.190 31.592 -0.402 18327
2416 1 9 . 1 1 62 62 ALA N N 62 124.600 124.600 128.624 -4.024 18327
2417 1 9 . 1 1 62 62 ALA HA H 62 3.720 3.720 4.297 -0.577 18327
2418 1 9 . 1 1 62 62 ALA CA C 62 54.370 54.370 54.750 -0.380 18327
2419 1 9 . 1 1 62 62 ALA CB C 62 17.650 17.650 18.139 -0.489 18327
2420 1 9 . 1 1 62 62 ALA H H 62 7.898 7.898 8.408 -0.510 18327
2421 1 9 . 1 1 63 63 SER N N 63 109.700 109.700 111.498 -1.798 18327
2422 1 9 . 1 1 63 63 SER HA H 63 4.200 4.200 4.115 0.085 18327
2423 1 9 . 1 1 63 63 SER CA C 63 59.400 59.400 60.276 -0.876 18327
2424 1 9 . 1 1 63 63 SER CB C 63 62.380 62.380 62.674 -0.294 18327
2425 1 9 . 1 1 63 63 SER H H 63 8.030 8.030 8.176 -0.146 18327
2426 1 9 . 1 1 64 64 TYR N N 64 120.300 120.300 119.119 1.181 18327
2427 1 9 . 1 1 64 64 TYR HA H 64 4.260 4.260 4.830 -0.570 18327
2428 1 9 . 1 1 64 64 TYR CA C 64 57.720 57.720 57.263 0.457 18327
2429 1 9 . 1 1 64 64 TYR CB C 64 37.560 37.560 37.565 -0.005 18327
2430 1 9 . 1 1 64 64 TYR H H 64 7.124 7.124 6.975 0.149 18327
2431 1 9 . 1 1 65 65 ILE N N 65 118.000 118.000 118.102 -0.102 18327
2432 1 9 . 1 1 65 65 ILE HA H 65 4.830 4.830 5.029 -0.199 18327
2433 1 9 . 1 1 65 65 ILE CA C 65 56.980 56.980 59.134 -2.154 18327
2434 1 9 . 1 1 65 65 ILE CB C 65 39.630 39.630 42.706 -3.076 18327
2435 1 9 . 1 1 65 65 ILE H H 65 7.671 7.671 7.741 -0.070 18327
2436 1 9 . 1 1 66 66 HIS N N 66 124.500 124.500 122.415 2.085 18327
2437 1 9 . 1 1 66 66 HIS HA H 66 5.130 5.130 4.814 0.316 18327
2438 1 9 . 1 1 66 66 HIS CA C 66 53.060 53.060 54.317 -1.257 18327
2439 1 9 . 1 1 66 66 HIS CB C 66 30.510 30.510 32.865 -2.355 18327
2440 1 9 . 1 1 66 66 HIS H H 66 9.159 9.159 9.083 0.076 18327
2441 1 9 . 1 1 67 67 LEU N N 67 127.400 127.400 125.878 1.522 18327
2442 1 9 . 1 1 67 67 LEU HA H 67 4.560 4.560 5.112 -0.552 18327
2443 1 9 . 1 1 67 67 LEU CA C 67 55.300 55.300 53.986 1.314 18327
2444 1 9 . 1 1 67 67 LEU CB C 67 42.060 42.060 42.871 -0.811 18327
2445 1 9 . 1 1 67 67 LEU H H 67 8.979 8.979 8.692 0.287 18327
2446 1 9 . 1 1 68 68 LYS N N 68 121.900 121.900 122.922 -1.022 18327
2447 1 9 . 1 1 68 68 LYS HA H 68 4.490 4.490 4.460 0.030 18327
2448 1 9 . 1 1 68 68 LYS CA C 68 55.110 55.110 55.061 0.049 18327
2449 1 9 . 1 1 68 68 LYS CB C 68 34.610 34.610 34.047 0.563 18327
2450 1 9 . 1 1 68 68 LYS H H 68 8.499 8.499 8.938 -0.439 18327
2451 1 9 . 1 1 69 69 GLU N N 69 122.100 122.100 124.247 -2.147 18327
2452 1 9 . 1 1 69 69 GLU HA H 69 4.290 4.290 4.059 0.231 18327
2453 1 9 . 1 1 69 69 GLU CA C 69 56.610 56.610 56.636 -0.026 18327
2454 1 9 . 1 1 69 69 GLU CB C 69 30.330 30.330 28.972 1.358 18327
2455 1 9 . 1 1 69 69 GLU H H 69 8.569 8.569 8.490 0.079 18327
2456 1 9 . 1 1 70 70 ALA N N 70 123.300 123.300 125.428 -2.128 18327
2457 1 9 . 1 1 70 70 ALA HA H 70 4.210 4.210 4.121 0.089 18327
2458 1 9 . 1 1 70 70 ALA CA C 70 51.810 51.810 52.895 -1.085 18327
2459 1 9 . 1 1 70 70 ALA CB C 70 19.700 19.700 18.598 1.102 18327
2460 1 9 . 1 1 70 70 ALA H H 70 8.181 8.181 8.649 -0.468 18327
2461 1 9 . 1 1 71 71 ILE N N 71 120.000 120.000 122.717 -2.717 18327
2462 1 9 . 1 1 71 71 ILE HA H 71 4.070 4.070 4.313 -0.243 18327
2463 1 9 . 1 1 71 71 ILE CA C 71 60.330 60.330 60.518 -0.188 18327
2464 1 9 . 1 1 71 71 ILE CB C 71 38.690 38.690 39.302 -0.612 18327
2465 1 9 . 1 1 71 71 ILE H H 71 7.789 7.789 7.998 -0.209 18327
2466 1 9 . 1 1 72 72 VAL N N 72 124.400 124.400 121.730 2.670 18327
2467 1 9 . 1 1 72 72 VAL HA H 72 4.070 4.070 4.419 -0.349 18327
2468 1 9 . 1 1 72 72 VAL CA C 72 61.640 61.640 61.467 0.173 18327
2469 1 9 . 1 1 72 72 VAL CB C 72 32.690 32.690 33.098 -0.408 18327
2470 1 9 . 1 1 72 72 VAL H H 72 8.089 8.089 8.143 -0.054 18327
2471 1 9 . 1 1 73 73 GLU N N 73 125.940 125.940 122.338 3.602 18327
2472 1 9 . 1 1 73 73 GLU HA H 73 4.300 4.300 4.492 -0.192 18327
2473 1 9 . 1 1 73 73 GLU CA C 73 56.610 56.610 56.090 0.520 18327
2474 1 9 . 1 1 73 73 GLU CB C 73 30.710 30.710 28.355 2.355 18327
2475 1 9 . 1 1 73 73 GLU H H 73 8.464 8.464 8.553 -0.089 18327
2476 1 10 . 1 1 13 13 TYR HA H 13 5.560 5.560 4.532 1.028 18327
2477 1 10 . 1 1 13 13 TYR CA C 13 55.860 55.860 57.535 -1.675 18327
2478 1 10 . 1 1 13 13 TYR CB C 13 42.440 42.440 40.689 1.751 18327
2479 1 10 . 1 1 14 14 GLY N N 14 105.400 105.400 107.181 -1.781 18327
2480 1 10 . 1 1 14 14 GLY CA C 14 45.240 45.240 43.880 1.360 18327
2481 1 10 . 1 1 14 14 GLY H H 14 8.406 8.406 8.467 -0.061 18327
2482 1 10 . 1 1 15 15 VAL N N 15 118.900 118.900 124.180 -5.280 18327
2483 1 10 . 1 1 15 15 VAL HA H 15 5.330 5.330 4.765 0.565 18327
2484 1 10 . 1 1 15 15 VAL CA C 15 59.210 59.210 60.259 -1.049 18327
2485 1 10 . 1 1 15 15 VAL CB C 15 35.740 35.740 34.694 1.046 18327
2486 1 10 . 1 1 15 15 VAL H H 15 8.854 8.854 8.486 0.368 18327
2487 1 10 . 1 1 16 16 ALA N N 16 129.400 129.400 128.164 1.236 18327
2488 1 10 . 1 1 16 16 ALA HA H 16 5.000 5.000 4.763 0.237 18327
2489 1 10 . 1 1 16 16 ALA CA C 16 52.000 52.000 51.732 0.268 18327
2490 1 10 . 1 1 16 16 ALA CB C 16 19.330 19.330 20.278 -0.948 18327
2491 1 10 . 1 1 16 16 ALA H H 16 9.112 9.112 9.068 0.044 18327
2492 1 10 . 1 1 17 17 PHE N N 17 123.900 123.900 123.847 0.053 18327
2493 1 10 . 1 1 17 17 PHE HA H 17 4.740 4.740 4.703 0.037 18327
2494 1 10 . 1 1 17 17 PHE CA C 17 56.230 56.230 57.292 -1.062 18327
2495 1 10 . 1 1 17 17 PHE CB C 17 40.000 40.000 41.426 -1.426 18327
2496 1 10 . 1 1 17 17 PHE H H 17 8.785 8.785 8.556 0.229 18327
2497 1 10 . 1 1 18 18 TYR N N 18 118.100 118.100 118.818 -0.718 18327
2498 1 10 . 1 1 18 18 TYR HA H 18 4.490 4.490 4.537 -0.047 18327
2499 1 10 . 1 1 18 18 TYR CA C 18 55.300 55.300 57.540 -2.240 18327
2500 1 10 . 1 1 18 18 TYR CB C 18 42.810 42.810 40.846 1.964 18327
2501 1 10 . 1 1 18 18 TYR H H 18 7.288 7.288 7.790 -0.502 18327
2502 1 10 . 1 1 19 19 ASN N N 19 116.800 116.800 121.010 -4.210 18327
2503 1 10 . 1 1 19 19 ASN HA H 19 4.710 4.710 4.869 -0.159 18327
2504 1 10 . 1 1 19 19 ASN CA C 19 52.940 52.940 53.252 -0.312 18327
2505 1 10 . 1 1 19 19 ASN CB C 19 39.060 39.060 39.647 -0.587 18327
2506 1 10 . 1 1 19 19 ASN H H 19 8.122 8.122 8.656 -0.534 18327
2507 1 10 . 1 1 20 20 TYR N N 20 122.000 122.000 123.490 -1.490 18327
2508 1 10 . 1 1 20 20 TYR HA H 20 4.710 4.710 4.681 0.029 18327
2509 1 10 . 1 1 20 20 TYR CA C 20 57.720 57.720 58.024 -0.304 18327
2510 1 10 . 1 1 20 20 TYR CB C 20 42.250 42.250 42.602 -0.352 18327
2511 1 10 . 1 1 20 20 TYR H H 20 8.994 8.994 8.787 0.207 18327
2512 1 10 . 1 1 21 21 ASP N N 21 128.500 128.500 121.520 6.980 18327
2513 1 10 . 1 1 21 21 ASP HA H 21 4.790 4.790 4.785 0.005 18327
2514 1 10 . 1 1 21 21 ASP CA C 21 52.370 52.370 51.847 0.523 18327
2515 1 10 . 1 1 21 21 ASP CB C 21 41.130 41.130 43.219 -2.089 18327
2516 1 10 . 1 1 21 21 ASP H H 21 7.839 7.839 7.591 0.248 18327
2517 1 10 . 1 1 22 22 ALA N N 22 125.200 125.200 121.686 3.514 18327
2518 1 10 . 1 1 22 22 ALA HA H 22 4.050 4.050 4.433 -0.383 18327
2519 1 10 . 1 1 22 22 ALA CA C 22 52.940 52.940 52.636 0.304 18327
2520 1 10 . 1 1 22 22 ALA CB C 22 20.450 20.450 19.532 0.918 18327
2521 1 10 . 1 1 22 22 ALA H H 22 8.107 8.107 8.502 -0.395 18327
2522 1 10 . 1 1 23 23 ARG N N 23 122.200 122.200 120.797 1.403 18327
2523 1 10 . 1 1 23 23 ARG HA H 23 4.350 4.350 4.368 -0.018 18327
2524 1 10 . 1 1 23 23 ARG CA C 23 55.490 55.490 55.489 0.001 18327
2525 1 10 . 1 1 23 23 ARG CB C 23 30.700 30.700 31.156 -0.456 18327
2526 1 10 . 1 1 23 23 ARG H H 23 8.889 8.889 8.605 0.284 18327
2527 1 10 . 1 1 24 24 GLY N N 24 105.200 105.200 107.789 -2.589 18327
2528 1 10 . 1 1 24 24 GLY CA C 24 44.500 44.500 45.187 -0.687 18327
2529 1 10 . 1 1 24 24 GLY H H 24 7.267 7.267 7.572 -0.305 18327
2530 1 10 . 1 1 25 25 ALA N N 25 122.200 122.200 122.431 -0.231 18327
2531 1 10 . 1 1 25 25 ALA HA H 25 4.160 4.160 4.289 -0.129 18327
2532 1 10 . 1 1 25 25 ALA CA C 25 54.440 54.440 54.046 0.394 18327
2533 1 10 . 1 1 25 25 ALA CB C 25 18.770 18.770 18.793 -0.023 18327
2534 1 10 . 1 1 25 25 ALA H H 25 8.621 8.621 8.435 0.186 18327
2535 1 10 . 1 1 26 26 ASP N N 26 114.700 114.700 119.386 -4.686 18327
2536 1 10 . 1 1 26 26 ASP HA H 26 4.700 4.700 4.752 -0.052 18327
2537 1 10 . 1 1 26 26 ASP CA C 26 53.870 53.870 53.767 0.103 18327
2538 1 10 . 1 1 26 26 ASP CB C 26 40.390 40.390 40.383 0.007 18327
2539 1 10 . 1 1 26 26 ASP H H 26 8.949 8.949 8.565 0.384 18327
2540 1 10 . 1 1 27 27 GLU N N 27 118.800 118.800 117.679 1.121 18327
2541 1 10 . 1 1 27 27 GLU HA H 27 5.220 5.220 4.661 0.559 18327
2542 1 10 . 1 1 27 27 GLU CA C 27 54.930 54.930 53.768 1.162 18327
2543 1 10 . 1 1 27 27 GLU CB C 27 32.880 32.880 32.291 0.590 18327
2544 1 10 . 1 1 27 27 GLU H H 27 7.542 7.542 7.542 -0.000 18327
2545 1 10 . 1 1 28 28 LEU N N 28 121.400 121.400 119.645 1.755 18327
2546 1 10 . 1 1 28 28 LEU HA H 28 4.760 4.760 4.755 0.005 18327
2547 1 10 . 1 1 28 28 LEU CA C 28 53.120 53.120 54.111 -0.991 18327
2548 1 10 . 1 1 28 28 LEU CB C 28 44.500 44.500 45.532 -1.032 18327
2549 1 10 . 1 1 28 28 LEU H H 28 8.897 8.897 8.282 0.615 18327
2550 1 10 . 1 1 29 29 SER N N 29 115.700 115.700 118.241 -2.541 18327
2551 1 10 . 1 1 29 29 SER HA H 29 5.030 5.030 5.100 -0.070 18327
2552 1 10 . 1 1 29 29 SER CA C 29 58.470 58.470 57.750 0.720 18327
2553 1 10 . 1 1 29 29 SER CB C 29 63.690 63.690 64.415 -0.725 18327
2554 1 10 . 1 1 29 29 SER H H 29 7.949 7.949 8.396 -0.447 18327
2555 1 10 . 1 1 30 30 LEU N N 30 121.300 121.300 120.473 0.827 18327
2556 1 10 . 1 1 30 30 LEU HA H 30 4.800 4.800 4.614 0.186 18327
2557 1 10 . 1 1 30 30 LEU CA C 30 52.940 52.940 55.515 -2.575 18327
2558 1 10 . 1 1 30 30 LEU CB C 30 46.370 46.370 46.756 -0.386 18327
2559 1 10 . 1 1 30 30 LEU H H 30 9.503 9.503 8.650 0.853 18327
2560 1 10 . 1 1 31 31 GLN N N 31 123.100 123.100 120.922 2.178 18327
2561 1 10 . 1 1 31 31 GLN HA H 31 5.070 5.070 4.713 0.357 18327
2562 1 10 . 1 1 31 31 GLN CA C 31 52.940 52.940 54.293 -1.353 18327
2563 1 10 . 1 1 31 31 GLN CB C 31 31.190 31.190 32.501 -1.311 18327
2564 1 10 . 1 1 31 31 GLN H H 31 9.152 9.152 8.506 0.646 18327
2565 1 10 . 1 1 32 32 ILE N N 32 120.800 120.800 122.398 -1.598 18327
2566 1 10 . 1 1 32 32 ILE HA H 32 3.030 3.030 3.767 -0.737 18327
2567 1 10 . 1 1 32 32 ILE CA C 32 64.250 64.250 62.642 1.608 18327
2568 1 10 . 1 1 32 32 ILE CB C 32 37.940 37.940 37.429 0.511 18327
2569 1 10 . 1 1 32 32 ILE H H 32 8.019 8.019 8.687 -0.668 18327
2570 1 10 . 1 1 33 33 GLY N N 33 115.700 115.700 114.571 1.129 18327
2571 1 10 . 1 1 33 33 GLY CA C 33 44.500 44.500 44.882 -0.382 18327
2572 1 10 . 1 1 33 33 GLY H H 33 8.777 8.777 8.642 0.135 18327
2573 1 10 . 1 1 34 34 ASP N N 34 122.300 122.300 122.242 0.058 18327
2574 1 10 . 1 1 34 34 ASP HA H 34 4.640 4.640 4.873 -0.233 18327
2575 1 10 . 1 1 34 34 ASP CA C 34 55.860 55.860 54.280 1.580 18327
2576 1 10 . 1 1 34 34 ASP CB C 34 41.310 41.310 42.614 -1.304 18327
2577 1 10 . 1 1 34 34 ASP H H 34 8.690 8.690 7.727 0.963 18327
2578 1 10 . 1 1 35 35 THR N N 35 117.900 117.900 116.239 1.661 18327
2579 1 10 . 1 1 35 35 THR HA H 35 5.160 5.160 5.070 0.090 18327
2580 1 10 . 1 1 35 35 THR CA C 35 61.450 61.450 61.900 -0.450 18327
2581 1 10 . 1 1 35 35 THR CB C 35 69.090 69.090 70.257 -1.167 18327
2582 1 10 . 1 1 35 35 THR H H 35 8.389 8.389 8.329 0.060 18327
2583 1 10 . 1 1 36 36 VAL N N 36 118.200 118.200 115.888 2.312 18327
2584 1 10 . 1 1 36 36 VAL HA H 36 5.100 5.100 4.453 0.647 18327
2585 1 10 . 1 1 36 36 VAL CA C 36 57.910 57.910 60.820 -2.910 18327
2586 1 10 . 1 1 36 36 VAL CB C 36 34.190 34.190 35.254 -1.064 18327
2587 1 10 . 1 1 36 36 VAL H H 36 9.019 9.019 8.990 0.029 18327
2588 1 10 . 1 1 37 37 HIS N N 37 122.100 122.100 119.550 2.550 18327
2589 1 10 . 1 1 37 37 HIS HA H 37 4.840 4.840 4.984 -0.144 18327
2590 1 10 . 1 1 37 37 HIS CA C 37 52.560 52.560 54.568 -2.008 18327
2591 1 10 . 1 1 37 37 HIS CB C 37 31.260 31.260 32.977 -1.717 18327
2592 1 10 . 1 1 37 37 HIS H H 37 8.489 8.489 8.140 0.349 18327
2593 1 10 . 1 1 38 38 ILE N N 38 126.400 126.400 125.150 1.250 18327
2594 1 10 . 1 1 38 38 ILE HA H 38 3.780 3.780 4.156 -0.376 18327
2595 1 10 . 1 1 38 38 ILE CA C 38 61.640 61.640 60.906 0.734 18327
2596 1 10 . 1 1 38 38 ILE CB C 38 38.880 38.880 39.036 -0.156 18327
2597 1 10 . 1 1 38 38 ILE H H 38 8.636 8.636 8.144 0.492 18327
2598 1 10 . 1 1 39 39 LEU N N 39 126.000 126.000 124.808 1.192 18327
2599 1 10 . 1 1 39 39 LEU HA H 39 4.400 4.400 4.781 -0.381 18327
2600 1 10 . 1 1 39 39 LEU CA C 39 55.490 55.490 55.248 0.242 18327
2601 1 10 . 1 1 39 39 LEU CB C 39 43.750 43.750 44.154 -0.404 18327
2602 1 10 . 1 1 39 39 LEU H H 39 9.162 9.162 8.528 0.634 18327
2603 1 10 . 1 1 40 40 GLU N N 40 115.100 115.100 116.850 -1.750 18327
2604 1 10 . 1 1 40 40 GLU HA H 40 7.895 7.895 4.643 3.252 18327
2605 1 10 . 1 1 41 41 THR N N 41 116.400 116.400 114.298 2.102 18327
2606 1 10 . 1 1 41 41 THR HA H 41 4.270 4.270 4.616 -0.346 18327
2607 1 10 . 1 1 41 41 THR CA C 41 60.890 60.890 61.467 -0.577 18327
2608 1 10 . 1 1 41 41 THR CB C 41 69.650 69.650 69.920 -0.270 18327
2609 1 10 . 1 1 41 41 THR H H 41 8.162 8.162 8.532 -0.370 18327
2610 1 10 . 1 1 43 43 GLU N N 43 123.300 123.300 120.815 2.485 18327
2611 1 10 . 1 1 43 43 GLU HA H 43 4.270 4.270 4.409 -0.139 18327
2612 1 10 . 1 1 43 43 GLU CA C 43 57.350 57.350 56.523 0.827 18327
2613 1 10 . 1 1 43 43 GLU CB C 43 26.790 26.790 29.159 -2.369 18327
2614 1 10 . 1 1 43 43 GLU H H 43 8.108 8.108 8.302 -0.194 18327
2615 1 10 . 1 1 44 44 GLY CA C 44 45.440 45.440 45.532 -0.092 18327
2616 1 10 . 1 1 45 45 TRP N N 45 124.100 124.100 120.886 3.214 18327
2617 1 10 . 1 1 45 45 TRP HA H 45 4.690 4.690 4.731 -0.041 18327
2618 1 10 . 1 1 45 45 TRP H H 45 8.590 8.590 7.469 1.121 18327
2619 1 10 . 1 1 46 46 TYR HA H 46 5.600 5.600 4.587 1.013 18327
2620 1 10 . 1 1 46 46 TYR CA C 46 54.060 54.060 57.096 -3.035 18327
2621 1 10 . 1 1 46 46 TYR CB C 46 42.060 42.060 42.160 -0.100 18327
2622 1 10 . 1 1 47 47 ARG N N 47 118.100 118.100 124.088 -5.988 18327
2623 1 10 . 1 1 47 47 ARG HA H 47 5.070 5.070 4.914 0.156 18327
2624 1 10 . 1 1 47 47 ARG CA C 47 54.060 54.060 54.591 -0.531 18327
2625 1 10 . 1 1 47 47 ARG CB C 47 33.250 33.250 33.261 -0.011 18327
2626 1 10 . 1 1 47 47 ARG H H 47 8.495 8.495 9.118 -0.623 18327
2627 1 10 . 1 1 48 48 GLY N N 48 114.000 114.000 114.658 -0.658 18327
2628 1 10 . 1 1 48 48 GLY CA C 48 46.560 46.560 46.356 0.204 18327
2629 1 10 . 1 1 48 48 GLY H H 48 9.183 9.183 8.973 0.210 18327
2630 1 10 . 1 1 49 49 TYR N N 49 116.200 116.200 116.679 -0.479 18327
2631 1 10 . 1 1 49 49 TYR HA H 49 5.380 5.380 5.156 0.224 18327
2632 1 10 . 1 1 49 49 TYR CA C 49 55.110 55.110 56.772 -1.662 18327
2633 1 10 . 1 1 49 49 TYR CB C 49 40.750 40.750 39.819 0.931 18327
2634 1 10 . 1 1 49 49 TYR H H 49 8.199 8.199 8.543 -0.344 18327
2635 1 10 . 1 1 50 50 THR N N 50 112.200 112.200 113.311 -1.111 18327
2636 1 10 . 1 1 50 50 THR HA H 50 5.120 5.120 4.102 1.018 18327
2637 1 10 . 1 1 50 50 THR CA C 50 59.770 59.770 61.921 -2.151 18327
2638 1 10 . 1 1 50 50 THR CB C 50 69.460 69.460 69.914 -0.454 18327
2639 1 10 . 1 1 50 50 THR H H 50 9.436 9.436 8.626 0.810 18327
2640 1 10 . 1 1 51 51 LEU N N 51 121.300 121.300 119.814 1.486 18327
2641 1 10 . 1 1 51 51 LEU HA H 51 4.230 4.230 4.303 -0.073 18327
2642 1 10 . 1 1 51 51 LEU CA C 51 56.790 56.790 56.496 0.294 18327
2643 1 10 . 1 1 51 51 LEU CB C 51 40.000 40.000 42.002 -2.002 18327
2644 1 10 . 1 1 51 51 LEU H H 51 8.313 8.313 7.977 0.336 18327
2645 1 10 . 1 1 52 52 ARG N N 52 116.600 116.600 118.335 -1.735 18327
2646 1 10 . 1 1 52 52 ARG HA H 52 4.250 4.250 4.091 0.159 18327
2647 1 10 . 1 1 52 52 ARG CA C 52 57.350 57.350 57.912 -0.562 18327
2648 1 10 . 1 1 52 52 ARG CB C 52 30.510 30.510 30.646 -0.136 18327
2649 1 10 . 1 1 52 52 ARG H H 52 8.053 8.053 8.159 -0.106 18327
2650 1 10 . 1 1 53 53 LYS N N 53 122.600 122.600 117.568 5.032 18327
2651 1 10 . 1 1 53 53 LYS HA H 53 4.620 4.620 4.518 0.102 18327
2652 1 10 . 1 1 53 53 LYS CA C 53 54.620 54.620 54.966 -0.346 18327
2653 1 10 . 1 1 53 53 LYS CB C 53 32.310 32.310 33.049 -0.739 18327
2654 1 10 . 1 1 53 53 LYS H H 53 7.655 7.655 7.513 0.142 18327
2655 1 10 . 1 1 54 54 LYS N N 54 124.900 124.900 124.142 0.758 18327
2656 1 10 . 1 1 54 54 LYS HA H 54 4.090 4.090 4.423 -0.333 18327
2657 1 10 . 1 1 54 54 LYS CA C 54 58.470 58.470 58.462 0.008 18327
2658 1 10 . 1 1 54 54 LYS CB C 54 32.130 32.130 32.485 -0.355 18327
2659 1 10 . 1 1 54 54 LYS H H 54 8.499 8.499 8.683 -0.184 18327
2660 1 10 . 1 1 55 55 SER N N 55 110.100 110.100 113.758 -3.658 18327
2661 1 10 . 1 1 55 55 SER HA H 55 4.140 4.140 4.300 -0.160 18327
2662 1 10 . 1 1 55 55 SER CA C 55 58.470 58.470 60.035 -1.565 18327
2663 1 10 . 1 1 55 55 SER CB C 55 63.310 63.310 63.201 0.109 18327
2664 1 10 . 1 1 55 55 SER H H 55 7.862 7.862 8.035 -0.173 18327
2665 1 10 . 1 1 56 56 LYS N N 56 124.000 124.000 122.367 1.633 18327
2666 1 10 . 1 1 56 56 LYS HA H 56 4.700 4.700 4.478 0.222 18327
2667 1 10 . 1 1 56 56 LYS CA C 56 54.810 54.810 55.259 -0.449 18327
2668 1 10 . 1 1 56 56 LYS CB C 56 33.250 33.250 31.964 1.286 18327
2669 1 10 . 1 1 56 56 LYS H H 56 7.481 7.481 7.994 -0.513 18327
2670 1 10 . 1 1 57 57 LYS N N 57 125.700 125.700 121.478 4.222 18327
2671 1 10 . 1 1 57 57 LYS HA H 57 5.330 5.330 4.463 0.867 18327
2672 1 10 . 1 1 57 57 LYS CA C 57 54.620 54.620 55.607 -0.987 18327
2673 1 10 . 1 1 57 57 LYS CB C 57 34.240 34.240 34.314 -0.074 18327
2674 1 10 . 1 1 57 57 LYS H H 57 8.475 8.475 7.737 0.738 18327
2675 1 10 . 1 1 58 58 GLY N N 58 109.400 109.400 107.102 2.298 18327
2676 1 10 . 1 1 58 58 GLY CA C 58 45.620 45.620 45.323 0.297 18327
2677 1 10 . 1 1 58 58 GLY H H 58 9.073 9.073 8.955 0.118 18327
2678 1 10 . 1 1 59 59 ILE N N 59 113.900 113.900 117.624 -3.724 18327
2679 1 10 . 1 1 59 59 ILE HA H 59 6.000 6.000 5.131 0.869 18327
2680 1 10 . 1 1 59 59 ILE CA C 59 59.590 59.590 58.438 1.152 18327
2681 1 10 . 1 1 59 59 ILE CB C 59 41.140 41.140 42.419 -1.279 18327
2682 1 10 . 1 1 59 59 ILE H H 59 8.628 8.628 8.045 0.583 18327
2683 1 10 . 1 1 60 60 PHE N N 60 116.900 116.900 113.917 2.983 18327
2684 1 10 . 1 1 60 60 PHE HA H 60 5.120 5.120 5.150 -0.030 18327
2685 1 10 . 1 1 60 60 PHE CA C 60 54.060 54.060 54.995 -0.935 18327
2686 1 10 . 1 1 60 60 PHE CB C 60 37.190 37.190 40.324 -3.134 18327
2687 1 10 . 1 1 60 60 PHE H H 60 8.724 8.724 8.552 0.172 18327
2688 1 10 . 1 1 61 61 PRO HA H 61 3.480 3.480 3.865 -0.385 18327
2689 1 10 . 1 1 61 61 PRO CA C 61 62.200 62.200 62.363 -0.163 18327
2690 1 10 . 1 1 61 61 PRO CB C 61 31.190 31.190 31.201 -0.011 18327
2691 1 10 . 1 1 62 62 ALA N N 62 124.600 124.600 128.754 -4.154 18327
2692 1 10 . 1 1 62 62 ALA HA H 62 3.720 3.720 4.517 -0.797 18327
2693 1 10 . 1 1 62 62 ALA CA C 62 54.370 54.370 55.530 -1.160 18327
2694 1 10 . 1 1 62 62 ALA CB C 62 17.650 17.650 18.529 -0.879 18327
2695 1 10 . 1 1 62 62 ALA H H 62 7.898 7.898 8.699 -0.801 18327
2696 1 10 . 1 1 63 63 SER N N 63 109.700 109.700 113.585 -3.885 18327
2697 1 10 . 1 1 63 63 SER HA H 63 4.200 4.200 4.242 -0.042 18327
2698 1 10 . 1 1 63 63 SER CA C 63 59.400 59.400 60.999 -1.599 18327
2699 1 10 . 1 1 63 63 SER CB C 63 62.380 62.380 62.963 -0.583 18327
2700 1 10 . 1 1 63 63 SER H H 63 8.030 8.030 8.495 -0.465 18327
2701 1 10 . 1 1 64 64 TYR N N 64 120.300 120.300 117.170 3.130 18327
2702 1 10 . 1 1 64 64 TYR HA H 64 4.260 4.260 4.542 -0.282 18327
2703 1 10 . 1 1 64 64 TYR CA C 64 57.720 57.720 59.279 -1.559 18327
2704 1 10 . 1 1 64 64 TYR CB C 64 37.560 37.560 38.428 -0.868 18327
2705 1 10 . 1 1 64 64 TYR H H 64 7.124 7.124 7.497 -0.373 18327
2706 1 10 . 1 1 65 65 ILE N N 65 118.000 118.000 117.846 0.154 18327
2707 1 10 . 1 1 65 65 ILE HA H 65 4.830 4.830 4.886 -0.056 18327
2708 1 10 . 1 1 65 65 ILE CA C 65 56.980 56.980 59.160 -2.180 18327
2709 1 10 . 1 1 65 65 ILE CB C 65 39.630 39.630 38.510 1.120 18327
2710 1 10 . 1 1 65 65 ILE H H 65 7.671 7.671 7.608 0.063 18327
2711 1 10 . 1 1 66 66 HIS N N 66 124.500 124.500 122.399 2.101 18327
2712 1 10 . 1 1 66 66 HIS HA H 66 5.130 5.130 5.022 0.108 18327
2713 1 10 . 1 1 66 66 HIS CA C 66 53.060 53.060 53.764 -0.704 18327
2714 1 10 . 1 1 66 66 HIS CB C 66 30.510 30.510 32.089 -1.579 18327
2715 1 10 . 1 1 66 66 HIS H H 66 9.159 9.159 9.043 0.116 18327
2716 1 10 . 1 1 67 67 LEU N N 67 127.400 127.400 124.966 2.434 18327
2717 1 10 . 1 1 67 67 LEU HA H 67 4.560 4.560 4.422 0.138 18327
2718 1 10 . 1 1 67 67 LEU CA C 67 55.300 55.300 55.715 -0.415 18327
2719 1 10 . 1 1 67 67 LEU CB C 67 42.060 42.060 42.185 -0.125 18327
2720 1 10 . 1 1 67 67 LEU H H 67 8.979 8.979 8.934 0.045 18327
2721 1 10 . 1 1 68 68 LYS N N 68 121.900 121.900 121.126 0.774 18327
2722 1 10 . 1 1 68 68 LYS HA H 68 4.490 4.490 4.387 0.103 18327
2723 1 10 . 1 1 68 68 LYS CA C 68 55.110 55.110 55.788 -0.678 18327
2724 1 10 . 1 1 68 68 LYS CB C 68 34.610 34.610 35.140 -0.530 18327
2725 1 10 . 1 1 68 68 LYS H H 68 8.499 8.499 8.676 -0.177 18327
2726 1 10 . 1 1 69 69 GLU N N 69 122.100 122.100 124.924 -2.824 18327
2727 1 10 . 1 1 69 69 GLU HA H 69 4.290 4.290 4.275 0.015 18327
2728 1 10 . 1 1 69 69 GLU CA C 69 56.610 56.610 57.882 -1.272 18327
2729 1 10 . 1 1 69 69 GLU CB C 69 30.330 30.330 29.479 0.851 18327
2730 1 10 . 1 1 69 69 GLU H H 69 8.569 8.569 8.645 -0.076 18327
2731 1 10 . 1 1 70 70 ALA N N 70 123.300 123.300 124.687 -1.387 18327
2732 1 10 . 1 1 70 70 ALA HA H 70 4.210 4.210 4.222 -0.012 18327
2733 1 10 . 1 1 70 70 ALA CA C 70 51.810 51.810 52.558 -0.748 18327
2734 1 10 . 1 1 70 70 ALA CB C 70 19.700 19.700 18.896 0.804 18327
2735 1 10 . 1 1 70 70 ALA H H 70 8.181 8.181 8.426 -0.245 18327
2736 1 10 . 1 1 71 71 ILE N N 71 120.000 120.000 123.296 -3.296 18327
2737 1 10 . 1 1 71 71 ILE HA H 71 4.070 4.070 4.099 -0.029 18327
2738 1 10 . 1 1 71 71 ILE CA C 71 60.330 60.330 61.399 -1.069 18327
2739 1 10 . 1 1 71 71 ILE CB C 71 38.690 38.690 38.740 -0.050 18327
2740 1 10 . 1 1 71 71 ILE H H 71 7.789 7.789 8.062 -0.273 18327
2741 1 10 . 1 1 72 72 VAL N N 72 124.400 124.400 120.374 4.026 18327
2742 1 10 . 1 1 72 72 VAL HA H 72 4.070 4.070 4.152 -0.082 18327
2743 1 10 . 1 1 72 72 VAL CA C 72 61.640 61.640 61.861 -0.221 18327
2744 1 10 . 1 1 72 72 VAL CB C 72 32.690 32.690 32.118 0.572 18327
2745 1 10 . 1 1 72 72 VAL H H 72 8.089 8.089 8.274 -0.185 18327
2746 1 10 . 1 1 73 73 GLU N N 73 125.940 125.940 119.815 6.125 18327
2747 1 10 . 1 1 73 73 GLU HA H 73 4.300 4.300 4.312 -0.012 18327
2748 1 10 . 1 1 73 73 GLU CA C 73 56.610 56.610 55.974 0.636 18327
2749 1 10 . 1 1 73 73 GLU CB C 73 30.710 30.710 30.091 0.619 18327
2750 1 10 . 1 1 73 73 GLU H H 73 8.464 8.464 8.355 0.109 18327
2751 1 11 . 1 1 13 13 TYR HA H 13 5.560 5.560 4.549 1.011 18327
2752 1 11 . 1 1 13 13 TYR CA C 13 55.860 55.860 57.307 -1.447 18327
2753 1 11 . 1 1 13 13 TYR CB C 13 42.440 42.440 42.016 0.424 18327
2754 1 11 . 1 1 14 14 GLY N N 14 105.400 105.400 107.052 -1.652 18327
2755 1 11 . 1 1 14 14 GLY CA C 14 45.240 45.240 43.651 1.589 18327
2756 1 11 . 1 1 14 14 GLY H H 14 8.406 8.406 8.441 -0.035 18327
2757 1 11 . 1 1 15 15 VAL N N 15 118.900 118.900 122.569 -3.669 18327
2758 1 11 . 1 1 15 15 VAL HA H 15 5.330 5.330 4.831 0.499 18327
2759 1 11 . 1 1 15 15 VAL CA C 15 59.210 59.210 61.029 -1.819 18327
2760 1 11 . 1 1 15 15 VAL CB C 15 35.740 35.740 36.507 -0.767 18327
2761 1 11 . 1 1 15 15 VAL H H 15 8.854 8.854 8.200 0.654 18327
2762 1 11 . 1 1 16 16 ALA N N 16 129.400 129.400 128.242 1.158 18327
2763 1 11 . 1 1 16 16 ALA HA H 16 5.000 5.000 4.703 0.297 18327
2764 1 11 . 1 1 16 16 ALA CA C 16 52.000 52.000 51.231 0.769 18327
2765 1 11 . 1 1 16 16 ALA CB C 16 19.330 19.330 20.255 -0.925 18327
2766 1 11 . 1 1 16 16 ALA H H 16 9.112 9.112 9.081 0.031 18327
2767 1 11 . 1 1 17 17 PHE N N 17 123.900 123.900 125.132 -1.232 18327
2768 1 11 . 1 1 17 17 PHE HA H 17 4.740 4.740 4.677 0.063 18327
2769 1 11 . 1 1 17 17 PHE CA C 17 56.230 56.230 57.108 -0.878 18327
2770 1 11 . 1 1 17 17 PHE CB C 17 40.000 40.000 40.963 -0.963 18327
2771 1 11 . 1 1 17 17 PHE H H 17 8.785 8.785 8.291 0.494 18327
2772 1 11 . 1 1 18 18 TYR N N 18 118.100 118.100 119.430 -1.330 18327
2773 1 11 . 1 1 18 18 TYR HA H 18 4.490 4.490 4.500 -0.010 18327
2774 1 11 . 1 1 18 18 TYR CA C 18 55.300 55.300 57.533 -2.233 18327
2775 1 11 . 1 1 18 18 TYR CB C 18 42.810 42.810 41.080 1.730 18327
2776 1 11 . 1 1 18 18 TYR H H 18 7.288 7.288 7.650 -0.362 18327
2777 1 11 . 1 1 19 19 ASN N N 19 116.800 116.800 121.113 -4.313 18327
2778 1 11 . 1 1 19 19 ASN HA H 19 4.710 4.710 4.850 -0.140 18327
2779 1 11 . 1 1 19 19 ASN CA C 19 52.940 52.940 53.480 -0.540 18327
2780 1 11 . 1 1 19 19 ASN CB C 19 39.060 39.060 39.488 -0.428 18327
2781 1 11 . 1 1 19 19 ASN H H 19 8.122 8.122 8.629 -0.507 18327
2782 1 11 . 1 1 20 20 TYR N N 20 122.000 122.000 121.949 0.051 18327
2783 1 11 . 1 1 20 20 TYR HA H 20 4.710 4.710 4.687 0.023 18327
2784 1 11 . 1 1 20 20 TYR CA C 20 57.720 57.720 57.856 -0.136 18327
2785 1 11 . 1 1 20 20 TYR CB C 20 42.250 42.250 42.963 -0.713 18327
2786 1 11 . 1 1 20 20 TYR H H 20 8.994 8.994 8.430 0.564 18327
2787 1 11 . 1 1 21 21 ASP N N 21 128.500 128.500 120.676 7.824 18327
2788 1 11 . 1 1 21 21 ASP HA H 21 4.790 4.790 4.875 -0.085 18327
2789 1 11 . 1 1 21 21 ASP CA C 21 52.370 52.370 52.063 0.307 18327
2790 1 11 . 1 1 21 21 ASP CB C 21 41.130 41.130 43.778 -2.648 18327
2791 1 11 . 1 1 21 21 ASP H H 21 7.839 7.839 7.757 0.082 18327
2792 1 11 . 1 1 22 22 ALA N N 22 125.200 125.200 124.701 0.499 18327
2793 1 11 . 1 1 22 22 ALA HA H 22 4.050 4.050 4.294 -0.244 18327
2794 1 11 . 1 1 22 22 ALA CA C 22 52.940 52.940 53.078 -0.138 18327
2795 1 11 . 1 1 22 22 ALA CB C 22 20.450 20.450 19.430 1.020 18327
2796 1 11 . 1 1 22 22 ALA H H 22 8.107 8.107 8.351 -0.244 18327
2797 1 11 . 1 1 23 23 ARG N N 23 122.200 122.200 121.555 0.645 18327
2798 1 11 . 1 1 23 23 ARG HA H 23 4.350 4.350 4.119 0.231 18327
2799 1 11 . 1 1 23 23 ARG CA C 23 55.490 55.490 57.474 -1.984 18327
2800 1 11 . 1 1 23 23 ARG CB C 23 30.700 30.700 30.783 -0.083 18327
2801 1 11 . 1 1 23 23 ARG H H 23 8.889 8.889 8.699 0.190 18327
2802 1 11 . 1 1 24 24 GLY N N 24 105.200 105.200 104.365 0.835 18327
2803 1 11 . 1 1 24 24 GLY CA C 24 44.500 44.500 44.559 -0.059 18327
2804 1 11 . 1 1 24 24 GLY H H 24 7.267 7.267 7.559 -0.292 18327
2805 1 11 . 1 1 25 25 ALA N N 25 122.200 122.200 121.158 1.042 18327
2806 1 11 . 1 1 25 25 ALA HA H 25 4.160 4.160 4.359 -0.199 18327
2807 1 11 . 1 1 25 25 ALA CA C 25 54.440 54.440 54.036 0.404 18327
2808 1 11 . 1 1 25 25 ALA CB C 25 18.770 18.770 19.132 -0.362 18327
2809 1 11 . 1 1 25 25 ALA H H 25 8.621 8.621 8.448 0.173 18327
2810 1 11 . 1 1 26 26 ASP N N 26 114.700 114.700 118.888 -4.188 18327
2811 1 11 . 1 1 26 26 ASP HA H 26 4.700 4.700 4.735 -0.035 18327
2812 1 11 . 1 1 26 26 ASP CA C 26 53.870 53.870 53.978 -0.108 18327
2813 1 11 . 1 1 26 26 ASP CB C 26 40.390 40.390 40.280 0.110 18327
2814 1 11 . 1 1 26 26 ASP H H 26 8.949 8.949 8.492 0.457 18327
2815 1 11 . 1 1 27 27 GLU N N 27 118.800 118.800 118.143 0.657 18327
2816 1 11 . 1 1 27 27 GLU HA H 27 5.220 5.220 4.954 0.266 18327
2817 1 11 . 1 1 27 27 GLU CA C 27 54.930 54.930 54.544 0.386 18327
2818 1 11 . 1 1 27 27 GLU CB C 27 32.880 32.880 32.356 0.524 18327
2819 1 11 . 1 1 27 27 GLU H H 27 7.542 7.542 7.607 -0.065 18327
2820 1 11 . 1 1 28 28 LEU N N 28 121.400 121.400 120.699 0.701 18327
2821 1 11 . 1 1 28 28 LEU HA H 28 4.760 4.760 4.755 0.005 18327
2822 1 11 . 1 1 28 28 LEU CA C 28 53.120 53.120 54.267 -1.147 18327
2823 1 11 . 1 1 28 28 LEU CB C 28 44.500 44.500 45.416 -0.916 18327
2824 1 11 . 1 1 28 28 LEU H H 28 8.897 8.897 8.270 0.627 18327
2825 1 11 . 1 1 29 29 SER N N 29 115.700 115.700 119.588 -3.888 18327
2826 1 11 . 1 1 29 29 SER HA H 29 5.030 5.030 5.023 0.007 18327
2827 1 11 . 1 1 29 29 SER CA C 29 58.470 58.470 58.771 -0.301 18327
2828 1 11 . 1 1 29 29 SER CB C 29 63.690 63.690 63.921 -0.231 18327
2829 1 11 . 1 1 29 29 SER H H 29 7.949 7.949 8.537 -0.588 18327
2830 1 11 . 1 1 30 30 LEU N N 30 121.300 121.300 120.036 1.264 18327
2831 1 11 . 1 1 30 30 LEU HA H 30 4.800 4.800 4.646 0.154 18327
2832 1 11 . 1 1 30 30 LEU CA C 30 52.940 52.940 55.647 -2.707 18327
2833 1 11 . 1 1 30 30 LEU CB C 30 46.370 46.370 45.894 0.476 18327
2834 1 11 . 1 1 30 30 LEU H H 30 9.503 9.503 8.339 1.164 18327
2835 1 11 . 1 1 31 31 GLN N N 31 123.100 123.100 120.806 2.294 18327
2836 1 11 . 1 1 31 31 GLN HA H 31 5.070 5.070 4.747 0.323 18327
2837 1 11 . 1 1 31 31 GLN CA C 31 52.940 52.940 54.584 -1.644 18327
2838 1 11 . 1 1 31 31 GLN CB C 31 31.190 31.190 32.408 -1.218 18327
2839 1 11 . 1 1 31 31 GLN H H 31 9.152 9.152 8.369 0.783 18327
2840 1 11 . 1 1 32 32 ILE N N 32 120.800 120.800 120.719 0.081 18327
2841 1 11 . 1 1 32 32 ILE HA H 32 3.030 3.030 3.934 -0.904 18327
2842 1 11 . 1 1 32 32 ILE CA C 32 64.250 64.250 62.032 2.218 18327
2843 1 11 . 1 1 32 32 ILE CB C 32 37.940 37.940 37.387 0.553 18327
2844 1 11 . 1 1 32 32 ILE H H 32 8.019 8.019 8.521 -0.502 18327
2845 1 11 . 1 1 33 33 GLY N N 33 115.700 115.700 114.477 1.223 18327
2846 1 11 . 1 1 33 33 GLY CA C 33 44.500 44.500 44.980 -0.480 18327
2847 1 11 . 1 1 33 33 GLY H H 33 8.777 8.777 8.944 -0.167 18327
2848 1 11 . 1 1 34 34 ASP N N 34 122.300 122.300 121.224 1.076 18327
2849 1 11 . 1 1 34 34 ASP HA H 34 4.640 4.640 4.964 -0.324 18327
2850 1 11 . 1 1 34 34 ASP CA C 34 55.860 55.860 53.225 2.635 18327
2851 1 11 . 1 1 34 34 ASP CB C 34 41.310 41.310 42.383 -1.073 18327
2852 1 11 . 1 1 34 34 ASP H H 34 8.690 8.690 7.661 1.029 18327
2853 1 11 . 1 1 35 35 THR N N 35 117.900 117.900 115.204 2.696 18327
2854 1 11 . 1 1 35 35 THR HA H 35 5.160 5.160 5.219 -0.059 18327
2855 1 11 . 1 1 35 35 THR CA C 35 61.450 61.450 61.205 0.245 18327
2856 1 11 . 1 1 35 35 THR CB C 35 69.090 69.090 70.469 -1.379 18327
2857 1 11 . 1 1 35 35 THR H H 35 8.389 8.389 8.358 0.031 18327
2858 1 11 . 1 1 36 36 VAL N N 36 118.200 118.200 116.672 1.528 18327
2859 1 11 . 1 1 36 36 VAL HA H 36 5.100 5.100 4.779 0.321 18327
2860 1 11 . 1 1 36 36 VAL CA C 36 57.910 57.910 59.662 -1.752 18327
2861 1 11 . 1 1 36 36 VAL CB C 36 34.190 34.190 34.900 -0.710 18327
2862 1 11 . 1 1 36 36 VAL H H 36 9.019 9.019 8.953 0.066 18327
2863 1 11 . 1 1 37 37 HIS N N 37 122.100 122.100 119.135 2.965 18327
2864 1 11 . 1 1 37 37 HIS HA H 37 4.840 4.840 4.944 -0.104 18327
2865 1 11 . 1 1 37 37 HIS CA C 37 52.560 52.560 54.765 -2.205 18327
2866 1 11 . 1 1 37 37 HIS CB C 37 31.260 31.260 33.081 -1.821 18327
2867 1 11 . 1 1 37 37 HIS H H 37 8.489 8.489 8.409 0.080 18327
2868 1 11 . 1 1 38 38 ILE N N 38 126.400 126.400 125.402 0.998 18327
2869 1 11 . 1 1 38 38 ILE HA H 38 3.780 3.780 4.181 -0.401 18327
2870 1 11 . 1 1 38 38 ILE CA C 38 61.640 61.640 60.937 0.703 18327
2871 1 11 . 1 1 38 38 ILE CB C 38 38.880 38.880 38.404 0.476 18327
2872 1 11 . 1 1 38 38 ILE H H 38 8.636 8.636 8.260 0.376 18327
2873 1 11 . 1 1 39 39 LEU N N 39 126.000 126.000 125.697 0.303 18327
2874 1 11 . 1 1 39 39 LEU HA H 39 4.400 4.400 4.856 -0.456 18327
2875 1 11 . 1 1 39 39 LEU CA C 39 55.490 55.490 55.169 0.321 18327
2876 1 11 . 1 1 39 39 LEU CB C 39 43.750 43.750 44.228 -0.478 18327
2877 1 11 . 1 1 39 39 LEU H H 39 9.162 9.162 8.234 0.928 18327
2878 1 11 . 1 1 40 40 GLU N N 40 115.100 115.100 116.754 -1.654 18327
2879 1 11 . 1 1 40 40 GLU HA H 40 7.895 7.895 4.642 3.253 18327
2880 1 11 . 1 1 41 41 THR N N 41 116.400 116.400 113.153 3.247 18327
2881 1 11 . 1 1 41 41 THR HA H 41 4.270 4.270 4.786 -0.516 18327
2882 1 11 . 1 1 41 41 THR CA C 41 60.890 60.890 60.803 0.086 18327
2883 1 11 . 1 1 41 41 THR CB C 41 69.650 69.650 69.940 -0.290 18327
2884 1 11 . 1 1 41 41 THR H H 41 8.162 8.162 8.397 -0.235 18327
2885 1 11 . 1 1 43 43 GLU N N 43 123.300 123.300 121.407 1.893 18327
2886 1 11 . 1 1 43 43 GLU HA H 43 4.270 4.270 4.312 -0.042 18327
2887 1 11 . 1 1 43 43 GLU CA C 43 57.350 57.350 55.554 1.796 18327
2888 1 11 . 1 1 43 43 GLU CB C 43 26.790 26.790 29.493 -2.703 18327
2889 1 11 . 1 1 43 43 GLU H H 43 8.108 8.108 8.411 -0.303 18327
2890 1 11 . 1 1 44 44 GLY CA C 44 45.440 45.440 45.049 0.391 18327
2891 1 11 . 1 1 45 45 TRP N N 45 124.100 124.100 120.428 3.672 18327
2892 1 11 . 1 1 45 45 TRP HA H 45 4.690 4.690 4.643 0.047 18327
2893 1 11 . 1 1 45 45 TRP H H 45 8.590 8.590 7.386 1.204 18327
2894 1 11 . 1 1 46 46 TYR HA H 46 5.600 5.600 4.512 1.088 18327
2895 1 11 . 1 1 46 46 TYR CA C 46 54.060 54.060 57.036 -2.976 18327
2896 1 11 . 1 1 46 46 TYR CB C 46 42.060 42.060 42.008 0.052 18327
2897 1 11 . 1 1 47 47 ARG N N 47 118.100 118.100 123.109 -5.009 18327
2898 1 11 . 1 1 47 47 ARG HA H 47 5.070 5.070 4.896 0.174 18327
2899 1 11 . 1 1 47 47 ARG CA C 47 54.060 54.060 54.864 -0.804 18327
2900 1 11 . 1 1 47 47 ARG CB C 47 33.250 33.250 33.647 -0.397 18327
2901 1 11 . 1 1 47 47 ARG H H 47 8.495 8.495 9.169 -0.674 18327
2902 1 11 . 1 1 48 48 GLY N N 48 114.000 114.000 115.064 -1.064 18327
2903 1 11 . 1 1 48 48 GLY CA C 48 46.560 46.560 46.733 -0.173 18327
2904 1 11 . 1 1 48 48 GLY H H 48 9.183 9.183 9.339 -0.156 18327
2905 1 11 . 1 1 49 49 TYR N N 49 116.200 116.200 117.335 -1.135 18327
2906 1 11 . 1 1 49 49 TYR HA H 49 5.380 5.380 5.109 0.271 18327
2907 1 11 . 1 1 49 49 TYR CA C 49 55.110 55.110 56.803 -1.693 18327
2908 1 11 . 1 1 49 49 TYR CB C 49 40.750 40.750 39.824 0.926 18327
2909 1 11 . 1 1 49 49 TYR H H 49 8.199 8.199 8.537 -0.338 18327
2910 1 11 . 1 1 50 50 THR N N 50 112.200 112.200 111.987 0.213 18327
2911 1 11 . 1 1 50 50 THR HA H 50 5.120 5.120 4.108 1.012 18327
2912 1 11 . 1 1 50 50 THR CA C 50 59.770 59.770 61.523 -1.753 18327
2913 1 11 . 1 1 50 50 THR CB C 50 69.460 69.460 69.946 -0.486 18327
2914 1 11 . 1 1 50 50 THR H H 50 9.436 9.436 8.599 0.837 18327
2915 1 11 . 1 1 51 51 LEU N N 51 121.300 121.300 120.574 0.726 18327
2916 1 11 . 1 1 51 51 LEU HA H 51 4.230 4.230 4.260 -0.030 18327
2917 1 11 . 1 1 51 51 LEU CA C 51 56.790 56.790 55.735 1.055 18327
2918 1 11 . 1 1 51 51 LEU CB C 51 40.000 40.000 42.033 -2.034 18327
2919 1 11 . 1 1 51 51 LEU H H 51 8.313 8.313 8.259 0.054 18327
2920 1 11 . 1 1 52 52 ARG N N 52 116.600 116.600 119.219 -2.619 18327
2921 1 11 . 1 1 52 52 ARG HA H 52 4.250 4.250 4.062 0.188 18327
2922 1 11 . 1 1 52 52 ARG CA C 52 57.350 57.350 57.963 -0.613 18327
2923 1 11 . 1 1 52 52 ARG CB C 52 30.510 30.510 30.525 -0.015 18327
2924 1 11 . 1 1 52 52 ARG H H 52 8.053 8.053 7.506 0.547 18327
2925 1 11 . 1 1 53 53 LYS N N 53 122.600 122.600 115.698 6.902 18327
2926 1 11 . 1 1 53 53 LYS HA H 53 4.620 4.620 4.525 0.095 18327
2927 1 11 . 1 1 53 53 LYS CA C 53 54.620 54.620 54.938 -0.318 18327
2928 1 11 . 1 1 53 53 LYS CB C 53 32.310 32.310 32.983 -0.673 18327
2929 1 11 . 1 1 53 53 LYS H H 53 7.655 7.655 7.688 -0.033 18327
2930 1 11 . 1 1 54 54 LYS N N 54 124.900 124.900 124.803 0.097 18327
2931 1 11 . 1 1 54 54 LYS HA H 54 4.090 4.090 4.403 -0.313 18327
2932 1 11 . 1 1 54 54 LYS CA C 54 58.470 58.470 58.209 0.261 18327
2933 1 11 . 1 1 54 54 LYS CB C 54 32.130 32.130 32.716 -0.586 18327
2934 1 11 . 1 1 54 54 LYS H H 54 8.499 8.499 8.785 -0.286 18327
2935 1 11 . 1 1 55 55 SER N N 55 110.100 110.100 113.282 -3.182 18327
2936 1 11 . 1 1 55 55 SER HA H 55 4.140 4.140 4.269 -0.129 18327
2937 1 11 . 1 1 55 55 SER CA C 55 58.470 58.470 60.132 -1.662 18327
2938 1 11 . 1 1 55 55 SER CB C 55 63.310 63.310 63.135 0.175 18327
2939 1 11 . 1 1 55 55 SER H H 55 7.862 7.862 8.071 -0.209 18327
2940 1 11 . 1 1 56 56 LYS N N 56 124.000 124.000 122.651 1.349 18327
2941 1 11 . 1 1 56 56 LYS HA H 56 4.700 4.700 4.503 0.197 18327
2942 1 11 . 1 1 56 56 LYS CA C 56 54.810 54.810 55.604 -0.794 18327
2943 1 11 . 1 1 56 56 LYS CB C 56 33.250 33.250 34.144 -0.894 18327
2944 1 11 . 1 1 56 56 LYS H H 56 7.481 7.481 7.563 -0.082 18327
2945 1 11 . 1 1 57 57 LYS N N 57 125.700 125.700 120.708 4.992 18327
2946 1 11 . 1 1 57 57 LYS HA H 57 5.330 5.330 4.626 0.704 18327
2947 1 11 . 1 1 57 57 LYS CA C 57 54.620 54.620 54.839 -0.219 18327
2948 1 11 . 1 1 57 57 LYS CB C 57 34.240 34.240 36.524 -2.284 18327
2949 1 11 . 1 1 57 57 LYS H H 57 8.475 8.475 8.370 0.105 18327
2950 1 11 . 1 1 58 58 GLY N N 58 109.400 109.400 107.022 2.378 18327
2951 1 11 . 1 1 58 58 GLY CA C 58 45.620 45.620 45.322 0.298 18327
2952 1 11 . 1 1 58 58 GLY H H 58 9.073 9.073 8.660 0.413 18327
2953 1 11 . 1 1 59 59 ILE N N 59 113.900 113.900 117.472 -3.572 18327
2954 1 11 . 1 1 59 59 ILE HA H 59 6.000 6.000 5.336 0.664 18327
2955 1 11 . 1 1 59 59 ILE CA C 59 59.590 59.590 58.687 0.903 18327
2956 1 11 . 1 1 59 59 ILE CB C 59 41.140 41.140 41.628 -0.488 18327
2957 1 11 . 1 1 59 59 ILE H H 59 8.628 8.628 8.367 0.261 18327
2958 1 11 . 1 1 60 60 PHE N N 60 116.900 116.900 114.462 2.438 18327
2959 1 11 . 1 1 60 60 PHE HA H 60 5.120 5.120 5.119 0.001 18327
2960 1 11 . 1 1 60 60 PHE CA C 60 54.060 54.060 55.155 -1.095 18327
2961 1 11 . 1 1 60 60 PHE CB C 60 37.190 37.190 40.394 -3.204 18327
2962 1 11 . 1 1 60 60 PHE H H 60 8.724 8.724 8.577 0.147 18327
2963 1 11 . 1 1 61 61 PRO HA H 61 3.480 3.480 3.911 -0.431 18327
2964 1 11 . 1 1 61 61 PRO CA C 61 62.200 62.200 62.116 0.084 18327
2965 1 11 . 1 1 61 61 PRO CB C 61 31.190 31.190 31.376 -0.186 18327
2966 1 11 . 1 1 62 62 ALA N N 62 124.600 124.600 127.146 -2.546 18327
2967 1 11 . 1 1 62 62 ALA HA H 62 3.720 3.720 4.386 -0.666 18327
2968 1 11 . 1 1 62 62 ALA CA C 62 54.370 54.370 54.835 -0.465 18327
2969 1 11 . 1 1 62 62 ALA CB C 62 17.650 17.650 18.119 -0.469 18327
2970 1 11 . 1 1 62 62 ALA H H 62 7.898 7.898 8.130 -0.232 18327
2971 1 11 . 1 1 63 63 SER N N 63 109.700 109.700 110.976 -1.276 18327
2972 1 11 . 1 1 63 63 SER HA H 63 4.200 4.200 4.053 0.147 18327
2973 1 11 . 1 1 63 63 SER CA C 63 59.400 59.400 60.800 -1.400 18327
2974 1 11 . 1 1 63 63 SER CB C 63 62.380 62.380 62.906 -0.526 18327
2975 1 11 . 1 1 63 63 SER H H 63 8.030 8.030 7.335 0.695 18327
2976 1 11 . 1 1 64 64 TYR N N 64 120.300 120.300 117.022 3.278 18327
2977 1 11 . 1 1 64 64 TYR HA H 64 4.260 4.260 4.401 -0.141 18327
2978 1 11 . 1 1 64 64 TYR CA C 64 57.720 57.720 59.000 -1.280 18327
2979 1 11 . 1 1 64 64 TYR CB C 64 37.560 37.560 38.669 -1.109 18327
2980 1 11 . 1 1 64 64 TYR H H 64 7.124 7.124 7.048 0.076 18327
2981 1 11 . 1 1 65 65 ILE N N 65 118.000 118.000 117.056 0.944 18327
2982 1 11 . 1 1 65 65 ILE HA H 65 4.830 4.830 4.633 0.197 18327
2983 1 11 . 1 1 65 65 ILE CA C 65 56.980 56.980 60.216 -3.236 18327
2984 1 11 . 1 1 65 65 ILE CB C 65 39.630 39.630 38.499 1.131 18327
2985 1 11 . 1 1 65 65 ILE H H 65 7.671 7.671 7.253 0.418 18327
2986 1 11 . 1 1 66 66 HIS N N 66 124.500 124.500 121.764 2.736 18327
2987 1 11 . 1 1 66 66 HIS HA H 66 5.130 5.130 4.815 0.315 18327
2988 1 11 . 1 1 66 66 HIS CA C 66 53.060 53.060 54.711 -1.651 18327
2989 1 11 . 1 1 66 66 HIS CB C 66 30.510 30.510 33.519 -3.009 18327
2990 1 11 . 1 1 66 66 HIS H H 66 9.159 9.159 8.921 0.238 18327
2991 1 11 . 1 1 67 67 LEU N N 67 127.400 127.400 124.536 2.864 18327
2992 1 11 . 1 1 67 67 LEU HA H 67 4.560 4.560 4.658 -0.098 18327
2993 1 11 . 1 1 67 67 LEU CA C 67 55.300 55.300 55.779 -0.479 18327
2994 1 11 . 1 1 67 67 LEU CB C 67 42.060 42.060 42.167 -0.107 18327
2995 1 11 . 1 1 67 67 LEU H H 67 8.979 8.979 8.785 0.194 18327
2996 1 11 . 1 1 68 68 LYS N N 68 121.900 121.900 123.292 -1.392 18327
2997 1 11 . 1 1 68 68 LYS HA H 68 4.490 4.490 4.486 0.004 18327
2998 1 11 . 1 1 68 68 LYS CA C 68 55.110 55.110 55.903 -0.793 18327
2999 1 11 . 1 1 68 68 LYS CB C 68 34.610 34.610 33.544 1.066 18327
3000 1 11 . 1 1 68 68 LYS H H 68 8.499 8.499 8.584 -0.085 18327
3001 1 11 . 1 1 69 69 GLU N N 69 122.100 122.100 121.252 0.848 18327
3002 1 11 . 1 1 69 69 GLU HA H 69 4.290 4.290 4.237 0.053 18327
3003 1 11 . 1 1 69 69 GLU CA C 69 56.610 56.610 56.606 0.004 18327
3004 1 11 . 1 1 69 69 GLU CB C 69 30.330 30.330 29.683 0.647 18327
3005 1 11 . 1 1 69 69 GLU H H 69 8.569 8.569 7.931 0.638 18327
3006 1 11 . 1 1 70 70 ALA N N 70 123.300 123.300 127.224 -3.924 18327
3007 1 11 . 1 1 70 70 ALA HA H 70 4.210 4.210 4.089 0.121 18327
3008 1 11 . 1 1 70 70 ALA CA C 70 51.810 51.810 52.758 -0.948 18327
3009 1 11 . 1 1 70 70 ALA CB C 70 19.700 19.700 17.929 1.771 18327
3010 1 11 . 1 1 70 70 ALA H H 70 8.181 8.181 8.421 -0.240 18327
3011 1 11 . 1 1 71 71 ILE N N 71 120.000 120.000 116.731 3.269 18327
3012 1 11 . 1 1 71 71 ILE HA H 71 4.070 4.070 4.028 0.042 18327
3013 1 11 . 1 1 71 71 ILE CA C 71 60.330 60.330 61.236 -0.906 18327
3014 1 11 . 1 1 71 71 ILE CB C 71 38.690 38.690 38.491 0.199 18327
3015 1 11 . 1 1 71 71 ILE H H 71 7.789 7.789 7.889 -0.100 18327
3016 1 11 . 1 1 72 72 VAL N N 72 124.400 124.400 124.223 0.177 18327
3017 1 11 . 1 1 72 72 VAL HA H 72 4.070 4.070 3.916 0.154 18327
3018 1 11 . 1 1 72 72 VAL CA C 72 61.640 61.640 63.217 -1.577 18327
3019 1 11 . 1 1 72 72 VAL CB C 72 32.690 32.690 32.045 0.644 18327
3020 1 11 . 1 1 72 72 VAL H H 72 8.089 8.089 8.119 -0.030 18327
3021 1 11 . 1 1 73 73 GLU N N 73 125.940 125.940 120.859 5.081 18327
3022 1 11 . 1 1 73 73 GLU HA H 73 4.300 4.300 4.186 0.114 18327
3023 1 11 . 1 1 73 73 GLU CA C 73 56.610 56.610 56.880 -0.270 18327
3024 1 11 . 1 1 73 73 GLU CB C 73 30.710 30.710 30.064 0.646 18327
3025 1 11 . 1 1 73 73 GLU H H 73 8.464 8.464 8.388 0.076 18327
3026 1 12 . 1 1 13 13 TYR HA H 13 5.560 5.560 4.693 0.867 18327
3027 1 12 . 1 1 13 13 TYR CA C 13 55.860 55.860 55.948 -0.088 18327
3028 1 12 . 1 1 13 13 TYR CB C 13 42.440 42.440 41.546 0.894 18327
3029 1 12 . 1 1 14 14 GLY N N 14 105.400 105.400 105.820 -0.420 18327
3030 1 12 . 1 1 14 14 GLY CA C 14 45.240 45.240 44.327 0.913 18327
3031 1 12 . 1 1 14 14 GLY H H 14 8.406 8.406 8.508 -0.102 18327
3032 1 12 . 1 1 15 15 VAL N N 15 118.900 118.900 122.150 -3.250 18327
3033 1 12 . 1 1 15 15 VAL HA H 15 5.330 5.330 4.779 0.551 18327
3034 1 12 . 1 1 15 15 VAL CA C 15 59.210 59.210 60.590 -1.380 18327
3035 1 12 . 1 1 15 15 VAL CB C 15 35.740 35.740 34.743 0.997 18327
3036 1 12 . 1 1 15 15 VAL H H 15 8.854 8.854 8.486 0.368 18327
3037 1 12 . 1 1 16 16 ALA N N 16 129.400 129.400 128.241 1.159 18327
3038 1 12 . 1 1 16 16 ALA HA H 16 5.000 5.000 4.448 0.552 18327
3039 1 12 . 1 1 16 16 ALA CA C 16 52.000 52.000 51.832 0.168 18327
3040 1 12 . 1 1 16 16 ALA CB C 16 19.330 19.330 19.902 -0.572 18327
3041 1 12 . 1 1 16 16 ALA H H 16 9.112 9.112 8.999 0.113 18327
3042 1 12 . 1 1 17 17 PHE N N 17 123.900 123.900 124.208 -0.308 18327
3043 1 12 . 1 1 17 17 PHE HA H 17 4.740 4.740 4.636 0.104 18327
3044 1 12 . 1 1 17 17 PHE CA C 17 56.230 56.230 57.062 -0.832 18327
3045 1 12 . 1 1 17 17 PHE CB C 17 40.000 40.000 41.236 -1.236 18327
3046 1 12 . 1 1 17 17 PHE H H 17 8.785 8.785 8.528 0.257 18327
3047 1 12 . 1 1 18 18 TYR N N 18 118.100 118.100 118.979 -0.879 18327
3048 1 12 . 1 1 18 18 TYR HA H 18 4.490 4.490 4.458 0.032 18327
3049 1 12 . 1 1 18 18 TYR CA C 18 55.300 55.300 57.574 -2.273 18327
3050 1 12 . 1 1 18 18 TYR CB C 18 42.810 42.810 40.514 2.296 18327
3051 1 12 . 1 1 18 18 TYR H H 18 7.288 7.288 7.675 -0.387 18327
3052 1 12 . 1 1 19 19 ASN N N 19 116.800 116.800 121.300 -4.500 18327
3053 1 12 . 1 1 19 19 ASN HA H 19 4.710 4.710 4.956 -0.246 18327
3054 1 12 . 1 1 19 19 ASN CA C 19 52.940 52.940 53.918 -0.978 18327
3055 1 12 . 1 1 19 19 ASN CB C 19 39.060 39.060 39.650 -0.590 18327
3056 1 12 . 1 1 19 19 ASN H H 19 8.122 8.122 8.540 -0.418 18327
3057 1 12 . 1 1 20 20 TYR N N 20 122.000 122.000 126.224 -4.224 18327
3058 1 12 . 1 1 20 20 TYR HA H 20 4.710 4.710 4.828 -0.118 18327
3059 1 12 . 1 1 20 20 TYR CA C 20 57.720 57.720 57.530 0.190 18327
3060 1 12 . 1 1 20 20 TYR CB C 20 42.250 42.250 42.895 -0.645 18327
3061 1 12 . 1 1 20 20 TYR H H 20 8.994 8.994 8.998 -0.004 18327
3062 1 12 . 1 1 21 21 ASP N N 21 128.500 128.500 122.003 6.497 18327
3063 1 12 . 1 1 21 21 ASP HA H 21 4.790 4.790 4.883 -0.093 18327
3064 1 12 . 1 1 21 21 ASP CA C 21 52.370 52.370 52.594 -0.224 18327
3065 1 12 . 1 1 21 21 ASP CB C 21 41.130 41.130 44.046 -2.916 18327
3066 1 12 . 1 1 21 21 ASP H H 21 7.839 7.839 7.613 0.226 18327
3067 1 12 . 1 1 22 22 ALA N N 22 125.200 125.200 123.630 1.570 18327
3068 1 12 . 1 1 22 22 ALA HA H 22 4.050 4.050 4.439 -0.389 18327
3069 1 12 . 1 1 22 22 ALA CA C 22 52.940 52.940 53.111 -0.171 18327
3070 1 12 . 1 1 22 22 ALA CB C 22 20.450 20.450 18.908 1.542 18327
3071 1 12 . 1 1 22 22 ALA H H 22 8.107 8.107 8.268 -0.161 18327
3072 1 12 . 1 1 23 23 ARG N N 23 122.200 122.200 124.231 -2.031 18327
3073 1 12 . 1 1 23 23 ARG HA H 23 4.350 4.350 4.416 -0.066 18327
3074 1 12 . 1 1 23 23 ARG CA C 23 55.490 55.490 55.967 -0.477 18327
3075 1 12 . 1 1 23 23 ARG CB C 23 30.700 30.700 30.707 -0.007 18327
3076 1 12 . 1 1 23 23 ARG H H 23 8.889 8.889 8.841 0.048 18327
3077 1 12 . 1 1 24 24 GLY N N 24 105.200 105.200 107.104 -1.904 18327
3078 1 12 . 1 1 24 24 GLY CA C 24 44.500 44.500 44.628 -0.128 18327
3079 1 12 . 1 1 24 24 GLY H H 24 7.267 7.267 7.560 -0.293 18327
3080 1 12 . 1 1 25 25 ALA N N 25 122.200 122.200 121.474 0.726 18327
3081 1 12 . 1 1 25 25 ALA HA H 25 4.160 4.160 4.362 -0.202 18327
3082 1 12 . 1 1 25 25 ALA CA C 25 54.440 54.440 53.697 0.743 18327
3083 1 12 . 1 1 25 25 ALA CB C 25 18.770 18.770 19.151 -0.381 18327
3084 1 12 . 1 1 25 25 ALA H H 25 8.621 8.621 8.464 0.157 18327
3085 1 12 . 1 1 26 26 ASP N N 26 114.700 114.700 119.389 -4.689 18327
3086 1 12 . 1 1 26 26 ASP HA H 26 4.700 4.700 4.722 -0.022 18327
3087 1 12 . 1 1 26 26 ASP CA C 26 53.870 53.870 53.789 0.081 18327
3088 1 12 . 1 1 26 26 ASP CB C 26 40.390 40.390 40.094 0.296 18327
3089 1 12 . 1 1 26 26 ASP H H 26 8.949 8.949 8.533 0.416 18327
3090 1 12 . 1 1 27 27 GLU N N 27 118.800 118.800 119.033 -0.233 18327
3091 1 12 . 1 1 27 27 GLU HA H 27 5.220 5.220 4.949 0.271 18327
3092 1 12 . 1 1 27 27 GLU CA C 27 54.930 54.930 54.843 0.087 18327
3093 1 12 . 1 1 27 27 GLU CB C 27 32.880 32.880 32.298 0.582 18327
3094 1 12 . 1 1 27 27 GLU H H 27 7.542 7.542 7.642 -0.100 18327
3095 1 12 . 1 1 28 28 LEU N N 28 121.400 121.400 120.552 0.848 18327
3096 1 12 . 1 1 28 28 LEU HA H 28 4.760 4.760 4.716 0.044 18327
3097 1 12 . 1 1 28 28 LEU CA C 28 53.120 53.120 54.577 -1.457 18327
3098 1 12 . 1 1 28 28 LEU CB C 28 44.500 44.500 45.240 -0.740 18327
3099 1 12 . 1 1 28 28 LEU H H 28 8.897 8.897 8.239 0.658 18327
3100 1 12 . 1 1 29 29 SER N N 29 115.700 115.700 120.018 -4.318 18327
3101 1 12 . 1 1 29 29 SER HA H 29 5.030 5.030 4.542 0.488 18327
3102 1 12 . 1 1 29 29 SER CA C 29 58.470 58.470 59.937 -1.467 18327
3103 1 12 . 1 1 29 29 SER CB C 29 63.690 63.690 63.862 -0.172 18327
3104 1 12 . 1 1 29 29 SER H H 29 7.949 7.949 8.480 -0.531 18327
3105 1 12 . 1 1 30 30 LEU N N 30 121.300 121.300 121.052 0.248 18327
3106 1 12 . 1 1 30 30 LEU HA H 30 4.800 4.800 4.728 0.072 18327
3107 1 12 . 1 1 30 30 LEU CA C 30 52.940 52.940 55.537 -2.597 18327
3108 1 12 . 1 1 30 30 LEU CB C 30 46.370 46.370 46.063 0.307 18327
3109 1 12 . 1 1 30 30 LEU H H 30 9.503 9.503 8.589 0.914 18327
3110 1 12 . 1 1 31 31 GLN N N 31 123.100 123.100 121.088 2.012 18327
3111 1 12 . 1 1 31 31 GLN HA H 31 5.070 5.070 4.717 0.353 18327
3112 1 12 . 1 1 31 31 GLN CA C 31 52.940 52.940 54.285 -1.345 18327
3113 1 12 . 1 1 31 31 GLN CB C 31 31.190 31.190 32.498 -1.308 18327
3114 1 12 . 1 1 31 31 GLN H H 31 9.152 9.152 8.540 0.612 18327
3115 1 12 . 1 1 32 32 ILE N N 32 120.800 120.800 120.926 -0.126 18327
3116 1 12 . 1 1 32 32 ILE HA H 32 3.030 3.030 3.668 -0.638 18327
3117 1 12 . 1 1 32 32 ILE CA C 32 64.250 64.250 62.441 1.809 18327
3118 1 12 . 1 1 32 32 ILE CB C 32 37.940 37.940 37.592 0.348 18327
3119 1 12 . 1 1 32 32 ILE H H 32 8.019 8.019 8.419 -0.400 18327
3120 1 12 . 1 1 33 33 GLY N N 33 115.700 115.700 114.296 1.404 18327
3121 1 12 . 1 1 33 33 GLY CA C 33 44.500 44.500 44.837 -0.337 18327
3122 1 12 . 1 1 33 33 GLY H H 33 8.777 8.777 8.703 0.074 18327
3123 1 12 . 1 1 34 34 ASP N N 34 122.300 122.300 120.767 1.533 18327
3124 1 12 . 1 1 34 34 ASP HA H 34 4.640 4.640 4.935 -0.295 18327
3125 1 12 . 1 1 34 34 ASP CA C 34 55.860 55.860 53.815 2.045 18327
3126 1 12 . 1 1 34 34 ASP CB C 34 41.310 41.310 42.498 -1.188 18327
3127 1 12 . 1 1 34 34 ASP H H 34 8.690 8.690 7.599 1.091 18327
3128 1 12 . 1 1 35 35 THR N N 35 117.900 117.900 114.923 2.977 18327
3129 1 12 . 1 1 35 35 THR HA H 35 5.160 5.160 5.016 0.144 18327
3130 1 12 . 1 1 35 35 THR CA C 35 61.450 61.450 61.715 -0.265 18327
3131 1 12 . 1 1 35 35 THR CB C 35 69.090 69.090 70.436 -1.346 18327
3132 1 12 . 1 1 35 35 THR H H 35 8.389 8.389 8.392 -0.003 18327
3133 1 12 . 1 1 36 36 VAL N N 36 118.200 118.200 116.566 1.634 18327
3134 1 12 . 1 1 36 36 VAL HA H 36 5.100 5.100 4.757 0.343 18327
3135 1 12 . 1 1 36 36 VAL CA C 36 57.910 57.910 59.549 -1.639 18327
3136 1 12 . 1 1 36 36 VAL CB C 36 34.190 34.190 34.801 -0.611 18327
3137 1 12 . 1 1 36 36 VAL H H 36 9.019 9.019 9.118 -0.099 18327
3138 1 12 . 1 1 37 37 HIS N N 37 122.100 122.100 119.035 3.065 18327
3139 1 12 . 1 1 37 37 HIS HA H 37 4.840 4.840 5.040 -0.200 18327
3140 1 12 . 1 1 37 37 HIS CA C 37 52.560 52.560 54.736 -2.176 18327
3141 1 12 . 1 1 37 37 HIS CB C 37 31.260 31.260 33.050 -1.790 18327
3142 1 12 . 1 1 37 37 HIS H H 37 8.489 8.489 8.040 0.449 18327
3143 1 12 . 1 1 38 38 ILE N N 38 126.400 126.400 125.364 1.036 18327
3144 1 12 . 1 1 38 38 ILE HA H 38 3.780 3.780 4.099 -0.319 18327
3145 1 12 . 1 1 38 38 ILE CA C 38 61.640 61.640 61.205 0.435 18327
3146 1 12 . 1 1 38 38 ILE CB C 38 38.880 38.880 39.114 -0.234 18327
3147 1 12 . 1 1 38 38 ILE H H 38 8.636 8.636 8.537 0.099 18327
3148 1 12 . 1 1 39 39 LEU N N 39 126.000 126.000 122.814 3.186 18327
3149 1 12 . 1 1 39 39 LEU HA H 39 4.400 4.400 4.737 -0.337 18327
3150 1 12 . 1 1 39 39 LEU CA C 39 55.490 55.490 55.004 0.486 18327
3151 1 12 . 1 1 39 39 LEU CB C 39 43.750 43.750 44.667 -0.917 18327
3152 1 12 . 1 1 39 39 LEU H H 39 9.162 9.162 8.389 0.773 18327
3153 1 12 . 1 1 40 40 GLU N N 40 115.100 115.100 117.812 -2.712 18327
3154 1 12 . 1 1 40 40 GLU HA H 40 7.895 7.895 4.719 3.176 18327
3155 1 12 . 1 1 41 41 THR N N 41 116.400 116.400 111.279 5.121 18327
3156 1 12 . 1 1 41 41 THR HA H 41 4.270 4.270 4.917 -0.647 18327
3157 1 12 . 1 1 41 41 THR CA C 41 60.890 60.890 61.188 -0.298 18327
3158 1 12 . 1 1 41 41 THR CB C 41 69.650 69.650 71.083 -1.433 18327
3159 1 12 . 1 1 41 41 THR H H 41 8.162 8.162 8.413 -0.251 18327
3160 1 12 . 1 1 43 43 GLU N N 43 123.300 123.300 120.929 2.371 18327
3161 1 12 . 1 1 43 43 GLU HA H 43 4.270 4.270 4.297 -0.027 18327
3162 1 12 . 1 1 43 43 GLU CA C 43 57.350 57.350 55.896 1.454 18327
3163 1 12 . 1 1 43 43 GLU CB C 43 26.790 26.790 29.617 -2.827 18327
3164 1 12 . 1 1 43 43 GLU H H 43 8.108 8.108 8.459 -0.351 18327
3165 1 12 . 1 1 44 44 GLY CA C 44 45.440 45.440 45.114 0.327 18327
3166 1 12 . 1 1 45 45 TRP N N 45 124.100 124.100 120.322 3.778 18327
3167 1 12 . 1 1 45 45 TRP HA H 45 4.690 4.690 4.620 0.070 18327
3168 1 12 . 1 1 45 45 TRP H H 45 8.590 8.590 6.761 1.829 18327
3169 1 12 . 1 1 46 46 TYR HA H 46 5.600 5.600 4.609 0.991 18327
3170 1 12 . 1 1 46 46 TYR CA C 46 54.060 54.060 56.602 -2.542 18327
3171 1 12 . 1 1 46 46 TYR CB C 46 42.060 42.060 39.440 2.620 18327
3172 1 12 . 1 1 47 47 ARG N N 47 118.100 118.100 123.447 -5.347 18327
3173 1 12 . 1 1 47 47 ARG HA H 47 5.070 5.070 4.759 0.311 18327
3174 1 12 . 1 1 47 47 ARG CA C 47 54.060 54.060 54.297 -0.237 18327
3175 1 12 . 1 1 47 47 ARG CB C 47 33.250 33.250 33.687 -0.437 18327
3176 1 12 . 1 1 47 47 ARG H H 47 8.495 8.495 8.990 -0.495 18327
3177 1 12 . 1 1 48 48 GLY N N 48 114.000 114.000 113.959 0.041 18327
3178 1 12 . 1 1 48 48 GLY CA C 48 46.560 46.560 46.432 0.128 18327
3179 1 12 . 1 1 48 48 GLY H H 48 9.183 9.183 9.055 0.128 18327
3180 1 12 . 1 1 49 49 TYR N N 49 116.200 116.200 117.231 -1.031 18327
3181 1 12 . 1 1 49 49 TYR HA H 49 5.380 5.380 5.116 0.264 18327
3182 1 12 . 1 1 49 49 TYR CA C 49 55.110 55.110 57.131 -2.021 18327
3183 1 12 . 1 1 49 49 TYR CB C 49 40.750 40.750 39.665 1.085 18327
3184 1 12 . 1 1 49 49 TYR H H 49 8.199 8.199 8.406 -0.207 18327
3185 1 12 . 1 1 50 50 THR N N 50 112.200 112.200 112.822 -0.622 18327
3186 1 12 . 1 1 50 50 THR HA H 50 5.120 5.120 4.085 1.035 18327
3187 1 12 . 1 1 50 50 THR CA C 50 59.770 59.770 62.048 -2.278 18327
3188 1 12 . 1 1 50 50 THR CB C 50 69.460 69.460 69.780 -0.320 18327
3189 1 12 . 1 1 50 50 THR H H 50 9.436 9.436 8.620 0.816 18327
3190 1 12 . 1 1 51 51 LEU N N 51 121.300 121.300 119.875 1.425 18327
3191 1 12 . 1 1 51 51 LEU HA H 51 4.230 4.230 4.332 -0.102 18327
3192 1 12 . 1 1 51 51 LEU CA C 51 56.790 56.790 55.193 1.597 18327
3193 1 12 . 1 1 51 51 LEU CB C 51 40.000 40.000 41.694 -1.694 18327
3194 1 12 . 1 1 51 51 LEU H H 51 8.313 8.313 8.189 0.124 18327
3195 1 12 . 1 1 52 52 ARG N N 52 116.600 116.600 118.334 -1.734 18327
3196 1 12 . 1 1 52 52 ARG HA H 52 4.250 4.250 4.348 -0.098 18327
3197 1 12 . 1 1 52 52 ARG CA C 52 57.350 57.350 56.507 0.843 18327
3198 1 12 . 1 1 52 52 ARG CB C 52 30.510 30.510 31.321 -0.811 18327
3199 1 12 . 1 1 52 52 ARG H H 52 8.053 8.053 8.374 -0.321 18327
3200 1 12 . 1 1 53 53 LYS N N 53 122.600 122.600 119.136 3.464 18327
3201 1 12 . 1 1 53 53 LYS HA H 53 4.620 4.620 4.521 0.099 18327
3202 1 12 . 1 1 53 53 LYS CA C 53 54.620 54.620 55.390 -0.770 18327
3203 1 12 . 1 1 53 53 LYS CB C 53 32.310 32.310 34.028 -1.718 18327
3204 1 12 . 1 1 53 53 LYS H H 53 7.655 7.655 7.548 0.107 18327
3205 1 12 . 1 1 54 54 LYS N N 54 124.900 124.900 124.136 0.764 18327
3206 1 12 . 1 1 54 54 LYS HA H 54 4.090 4.090 4.231 -0.141 18327
3207 1 12 . 1 1 54 54 LYS CA C 54 58.470 58.470 58.085 0.385 18327
3208 1 12 . 1 1 54 54 LYS CB C 54 32.130 32.130 32.651 -0.521 18327
3209 1 12 . 1 1 54 54 LYS H H 54 8.499 8.499 8.797 -0.298 18327
3210 1 12 . 1 1 55 55 SER N N 55 110.100 110.100 112.480 -2.380 18327
3211 1 12 . 1 1 55 55 SER HA H 55 4.140 4.140 4.314 -0.174 18327
3212 1 12 . 1 1 55 55 SER CA C 55 58.470 58.470 59.536 -1.066 18327
3213 1 12 . 1 1 55 55 SER CB C 55 63.310 63.310 63.247 0.063 18327
3214 1 12 . 1 1 55 55 SER H H 55 7.862 7.862 7.980 -0.118 18327
3215 1 12 . 1 1 56 56 LYS N N 56 124.000 124.000 122.366 1.634 18327
3216 1 12 . 1 1 56 56 LYS HA H 56 4.700 4.700 4.472 0.228 18327
3217 1 12 . 1 1 56 56 LYS CA C 56 54.810 54.810 55.180 -0.370 18327
3218 1 12 . 1 1 56 56 LYS CB C 56 33.250 33.250 32.596 0.654 18327
3219 1 12 . 1 1 56 56 LYS H H 56 7.481 7.481 7.391 0.090 18327
3220 1 12 . 1 1 57 57 LYS N N 57 125.700 125.700 123.606 2.094 18327
3221 1 12 . 1 1 57 57 LYS HA H 57 5.330 5.330 4.715 0.615 18327
3222 1 12 . 1 1 57 57 LYS CA C 57 54.620 54.620 55.619 -0.999 18327
3223 1 12 . 1 1 57 57 LYS CB C 57 34.240 34.240 34.266 -0.025 18327
3224 1 12 . 1 1 57 57 LYS H H 57 8.475 8.475 7.985 0.490 18327
3225 1 12 . 1 1 58 58 GLY N N 58 109.400 109.400 108.697 0.703 18327
3226 1 12 . 1 1 58 58 GLY CA C 58 45.620 45.620 45.214 0.406 18327
3227 1 12 . 1 1 58 58 GLY H H 58 9.073 9.073 8.537 0.536 18327
3228 1 12 . 1 1 59 59 ILE N N 59 113.900 113.900 119.649 -5.749 18327
3229 1 12 . 1 1 59 59 ILE HA H 59 6.000 6.000 4.828 1.172 18327
3230 1 12 . 1 1 59 59 ILE CA C 59 59.590 59.590 59.592 -0.002 18327
3231 1 12 . 1 1 59 59 ILE CB C 59 41.140 41.140 42.519 -1.379 18327
3232 1 12 . 1 1 59 59 ILE H H 59 8.628 8.628 8.353 0.275 18327
3233 1 12 . 1 1 60 60 PHE N N 60 116.900 116.900 117.003 -0.103 18327
3234 1 12 . 1 1 60 60 PHE HA H 60 5.120 5.120 5.052 0.068 18327
3235 1 12 . 1 1 60 60 PHE CA C 60 54.060 54.060 55.018 -0.958 18327
3236 1 12 . 1 1 60 60 PHE CB C 60 37.190 37.190 39.753 -2.563 18327
3237 1 12 . 1 1 60 60 PHE H H 60 8.724 8.724 8.719 0.005 18327
3238 1 12 . 1 1 61 61 PRO HA H 61 3.480 3.480 3.357 0.123 18327
3239 1 12 . 1 1 61 61 PRO CA C 61 62.200 62.200 62.391 -0.191 18327
3240 1 12 . 1 1 61 61 PRO CB C 61 31.190 31.190 31.018 0.172 18327
3241 1 12 . 1 1 62 62 ALA N N 62 124.600 124.600 127.142 -2.542 18327
3242 1 12 . 1 1 62 62 ALA HA H 62 3.720 3.720 4.126 -0.406 18327
3243 1 12 . 1 1 62 62 ALA CA C 62 54.370 54.370 54.475 -0.105 18327
3244 1 12 . 1 1 62 62 ALA CB C 62 17.650 17.650 18.121 -0.471 18327
3245 1 12 . 1 1 62 62 ALA H H 62 7.898 7.898 8.175 -0.277 18327
3246 1 12 . 1 1 63 63 SER N N 63 109.700 109.700 112.041 -2.341 18327
3247 1 12 . 1 1 63 63 SER HA H 63 4.200 4.200 4.285 -0.085 18327
3248 1 12 . 1 1 63 63 SER CA C 63 59.400 59.400 60.355 -0.955 18327
3249 1 12 . 1 1 63 63 SER CB C 63 62.380 62.380 62.820 -0.440 18327
3250 1 12 . 1 1 63 63 SER H H 63 8.030 8.030 8.063 -0.033 18327
3251 1 12 . 1 1 64 64 TYR N N 64 120.300 120.300 119.617 0.683 18327
3252 1 12 . 1 1 64 64 TYR HA H 64 4.260 4.260 4.374 -0.114 18327
3253 1 12 . 1 1 64 64 TYR CA C 64 57.720 57.720 60.032 -2.312 18327
3254 1 12 . 1 1 64 64 TYR CB C 64 37.560 37.560 38.656 -1.096 18327
3255 1 12 . 1 1 64 64 TYR H H 64 7.124 7.124 7.395 -0.271 18327
3256 1 12 . 1 1 65 65 ILE N N 65 118.000 118.000 116.367 1.633 18327
3257 1 12 . 1 1 65 65 ILE HA H 65 4.830 4.830 4.845 -0.015 18327
3258 1 12 . 1 1 65 65 ILE CA C 65 56.980 56.980 60.324 -3.344 18327
3259 1 12 . 1 1 65 65 ILE CB C 65 39.630 39.630 39.495 0.135 18327
3260 1 12 . 1 1 65 65 ILE H H 65 7.671 7.671 7.455 0.216 18327
3261 1 12 . 1 1 66 66 HIS N N 66 124.500 124.500 126.313 -1.813 18327
3262 1 12 . 1 1 66 66 HIS HA H 66 5.130 5.130 4.965 0.165 18327
3263 1 12 . 1 1 66 66 HIS CA C 66 53.060 53.060 54.006 -0.946 18327
3264 1 12 . 1 1 66 66 HIS CB C 66 30.510 30.510 33.634 -3.124 18327
3265 1 12 . 1 1 66 66 HIS H H 66 9.159 9.159 8.718 0.441 18327
3266 1 12 . 1 1 67 67 LEU N N 67 127.400 127.400 125.660 1.740 18327
3267 1 12 . 1 1 67 67 LEU HA H 67 4.560 4.560 4.528 0.032 18327
3268 1 12 . 1 1 67 67 LEU CA C 67 55.300 55.300 55.791 -0.491 18327
3269 1 12 . 1 1 67 67 LEU CB C 67 42.060 42.060 41.877 0.183 18327
3270 1 12 . 1 1 67 67 LEU H H 67 8.979 8.979 8.889 0.090 18327
3271 1 12 . 1 1 68 68 LYS N N 68 121.900 121.900 122.006 -0.106 18327
3272 1 12 . 1 1 68 68 LYS HA H 68 4.490 4.490 4.494 -0.004 18327
3273 1 12 . 1 1 68 68 LYS CA C 68 55.110 55.110 55.910 -0.800 18327
3274 1 12 . 1 1 68 68 LYS CB C 68 34.610 34.610 33.441 1.169 18327
3275 1 12 . 1 1 68 68 LYS H H 68 8.499 8.499 8.819 -0.320 18327
3276 1 12 . 1 1 69 69 GLU N N 69 122.100 122.100 116.894 5.206 18327
3277 1 12 . 1 1 69 69 GLU HA H 69 4.290 4.290 3.924 0.366 18327
3278 1 12 . 1 1 69 69 GLU CA C 69 56.610 56.610 57.716 -1.106 18327
3279 1 12 . 1 1 69 69 GLU CB C 69 30.330 30.330 30.074 0.256 18327
3280 1 12 . 1 1 69 69 GLU H H 69 8.569 8.569 8.266 0.303 18327
3281 1 12 . 1 1 70 70 ALA N N 70 123.300 123.300 122.164 1.136 18327
3282 1 12 . 1 1 70 70 ALA HA H 70 4.210 4.210 4.419 -0.209 18327
3283 1 12 . 1 1 70 70 ALA CA C 70 51.810 51.810 52.134 -0.324 18327
3284 1 12 . 1 1 70 70 ALA CB C 70 19.700 19.700 19.351 0.350 18327
3285 1 12 . 1 1 70 70 ALA H H 70 8.181 8.181 8.122 0.059 18327
3286 1 12 . 1 1 71 71 ILE N N 71 120.000 120.000 119.698 0.302 18327
3287 1 12 . 1 1 71 71 ILE HA H 71 4.070 4.070 4.124 -0.054 18327
3288 1 12 . 1 1 71 71 ILE CA C 71 60.330 60.330 61.391 -1.061 18327
3289 1 12 . 1 1 71 71 ILE CB C 71 38.690 38.690 38.329 0.361 18327
3290 1 12 . 1 1 71 71 ILE H H 71 7.789 7.789 8.122 -0.333 18327
3291 1 12 . 1 1 72 72 VAL N N 72 124.400 124.400 119.981 4.419 18327
3292 1 12 . 1 1 72 72 VAL HA H 72 4.070 4.070 4.284 -0.214 18327
3293 1 12 . 1 1 72 72 VAL CA C 72 61.640 61.640 62.018 -0.378 18327
3294 1 12 . 1 1 72 72 VAL CB C 72 32.690 32.690 31.973 0.717 18327
3295 1 12 . 1 1 72 72 VAL H H 72 8.089 8.089 8.095 -0.006 18327
3296 1 12 . 1 1 73 73 GLU N N 73 125.940 125.940 122.416 3.524 18327
3297 1 12 . 1 1 73 73 GLU HA H 73 4.300 4.300 4.181 0.119 18327
3298 1 12 . 1 1 73 73 GLU CA C 73 56.610 56.610 56.828 -0.218 18327
3299 1 12 . 1 1 73 73 GLU CB C 73 30.710 30.710 30.141 0.569 18327
3300 1 12 . 1 1 73 73 GLU H H 73 8.464 8.464 8.373 0.091 18327
3301 1 13 . 1 1 13 13 TYR HA H 13 5.560 5.560 4.688 0.872 18327
3302 1 13 . 1 1 13 13 TYR CA C 13 55.860 55.860 55.978 -0.118 18327
3303 1 13 . 1 1 13 13 TYR CB C 13 42.440 42.440 41.178 1.262 18327
3304 1 13 . 1 1 14 14 GLY N N 14 105.400 105.400 107.137 -1.737 18327
3305 1 13 . 1 1 14 14 GLY CA C 14 45.240 45.240 43.624 1.616 18327
3306 1 13 . 1 1 14 14 GLY H H 14 8.406 8.406 8.626 -0.220 18327
3307 1 13 . 1 1 15 15 VAL N N 15 118.900 118.900 122.536 -3.636 18327
3308 1 13 . 1 1 15 15 VAL HA H 15 5.330 5.330 4.923 0.407 18327
3309 1 13 . 1 1 15 15 VAL CA C 15 59.210 59.210 59.900 -0.690 18327
3310 1 13 . 1 1 15 15 VAL CB C 15 35.740 35.740 35.164 0.576 18327
3311 1 13 . 1 1 15 15 VAL H H 15 8.854 8.854 8.384 0.470 18327
3312 1 13 . 1 1 16 16 ALA N N 16 129.400 129.400 129.184 0.216 18327
3313 1 13 . 1 1 16 16 ALA HA H 16 5.000 5.000 4.892 0.108 18327
3314 1 13 . 1 1 16 16 ALA CA C 16 52.000 52.000 51.583 0.417 18327
3315 1 13 . 1 1 16 16 ALA CB C 16 19.330 19.330 19.846 -0.516 18327
3316 1 13 . 1 1 16 16 ALA H H 16 9.112 9.112 9.162 -0.049 18327
3317 1 13 . 1 1 17 17 PHE N N 17 123.900 123.900 125.977 -2.077 18327
3318 1 13 . 1 1 17 17 PHE HA H 17 4.740 4.740 4.776 -0.036 18327
3319 1 13 . 1 1 17 17 PHE CA C 17 56.230 56.230 57.429 -1.199 18327
3320 1 13 . 1 1 17 17 PHE CB C 17 40.000 40.000 40.136 -0.136 18327
3321 1 13 . 1 1 17 17 PHE H H 17 8.785 8.785 9.255 -0.470 18327
3322 1 13 . 1 1 18 18 TYR N N 18 118.100 118.100 118.200 -0.100 18327
3323 1 13 . 1 1 18 18 TYR HA H 18 4.490 4.490 4.433 0.057 18327
3324 1 13 . 1 1 18 18 TYR CA C 18 55.300 55.300 57.259 -1.959 18327
3325 1 13 . 1 1 18 18 TYR CB C 18 42.810 42.810 41.233 1.577 18327
3326 1 13 . 1 1 18 18 TYR H H 18 7.288 7.288 7.529 -0.241 18327
3327 1 13 . 1 1 19 19 ASN N N 19 116.800 116.800 121.717 -4.917 18327
3328 1 13 . 1 1 19 19 ASN HA H 19 4.710 4.710 4.994 -0.284 18327
3329 1 13 . 1 1 19 19 ASN CA C 19 52.940 52.940 53.600 -0.660 18327
3330 1 13 . 1 1 19 19 ASN CB C 19 39.060 39.060 39.627 -0.566 18327
3331 1 13 . 1 1 19 19 ASN H H 19 8.122 8.122 8.383 -0.261 18327
3332 1 13 . 1 1 20 20 TYR N N 20 122.000 122.000 122.820 -0.820 18327
3333 1 13 . 1 1 20 20 TYR HA H 20 4.710 4.710 4.777 -0.067 18327
3334 1 13 . 1 1 20 20 TYR CA C 20 57.720 57.720 58.066 -0.346 18327
3335 1 13 . 1 1 20 20 TYR CB C 20 42.250 42.250 42.652 -0.402 18327
3336 1 13 . 1 1 20 20 TYR H H 20 8.994 8.994 8.941 0.053 18327
3337 1 13 . 1 1 21 21 ASP N N 21 128.500 128.500 121.944 6.556 18327
3338 1 13 . 1 1 21 21 ASP HA H 21 4.790 4.790 4.779 0.011 18327
3339 1 13 . 1 1 21 21 ASP CA C 21 52.370 52.370 51.536 0.834 18327
3340 1 13 . 1 1 21 21 ASP CB C 21 41.130 41.130 43.707 -2.577 18327
3341 1 13 . 1 1 21 21 ASP H H 21 7.839 7.839 7.585 0.254 18327
3342 1 13 . 1 1 22 22 ALA N N 22 125.200 125.200 123.633 1.567 18327
3343 1 13 . 1 1 22 22 ALA HA H 22 4.050 4.050 4.205 -0.155 18327
3344 1 13 . 1 1 22 22 ALA CA C 22 52.940 52.940 53.262 -0.322 18327
3345 1 13 . 1 1 22 22 ALA CB C 22 20.450 20.450 19.445 1.004 18327
3346 1 13 . 1 1 22 22 ALA H H 22 8.107 8.107 8.211 -0.104 18327
3347 1 13 . 1 1 23 23 ARG N N 23 122.200 122.200 122.708 -0.508 18327
3348 1 13 . 1 1 23 23 ARG HA H 23 4.350 4.350 4.165 0.185 18327
3349 1 13 . 1 1 23 23 ARG CA C 23 55.490 55.490 57.309 -1.819 18327
3350 1 13 . 1 1 23 23 ARG CB C 23 30.700 30.700 30.602 0.097 18327
3351 1 13 . 1 1 23 23 ARG H H 23 8.889 8.889 8.428 0.461 18327
3352 1 13 . 1 1 24 24 GLY N N 24 105.200 105.200 106.302 -1.102 18327
3353 1 13 . 1 1 24 24 GLY CA C 24 44.500 44.500 43.975 0.525 18327
3354 1 13 . 1 1 24 24 GLY H H 24 7.267 7.267 7.655 -0.388 18327
3355 1 13 . 1 1 25 25 ALA N N 25 122.200 122.200 121.305 0.895 18327
3356 1 13 . 1 1 25 25 ALA HA H 25 4.160 4.160 4.224 -0.064 18327
3357 1 13 . 1 1 25 25 ALA CA C 25 54.440 54.440 53.862 0.578 18327
3358 1 13 . 1 1 25 25 ALA CB C 25 18.770 18.770 19.094 -0.324 18327
3359 1 13 . 1 1 25 25 ALA H H 25 8.621 8.621 8.301 0.320 18327
3360 1 13 . 1 1 26 26 ASP N N 26 114.700 114.700 119.510 -4.810 18327
3361 1 13 . 1 1 26 26 ASP HA H 26 4.700 4.700 4.671 0.029 18327
3362 1 13 . 1 1 26 26 ASP CA C 26 53.870 53.870 53.748 0.122 18327
3363 1 13 . 1 1 26 26 ASP CB C 26 40.390 40.390 40.597 -0.207 18327
3364 1 13 . 1 1 26 26 ASP H H 26 8.949 8.949 8.460 0.489 18327
3365 1 13 . 1 1 27 27 GLU N N 27 118.800 118.800 118.921 -0.121 18327
3366 1 13 . 1 1 27 27 GLU HA H 27 5.220 5.220 4.598 0.622 18327
3367 1 13 . 1 1 27 27 GLU CA C 27 54.930 54.930 54.659 0.271 18327
3368 1 13 . 1 1 27 27 GLU CB C 27 32.880 32.880 32.511 0.369 18327
3369 1 13 . 1 1 27 27 GLU H H 27 7.542 7.542 7.564 -0.022 18327
3370 1 13 . 1 1 28 28 LEU N N 28 121.400 121.400 120.305 1.095 18327
3371 1 13 . 1 1 28 28 LEU HA H 28 4.760 4.760 4.707 0.053 18327
3372 1 13 . 1 1 28 28 LEU CA C 28 53.120 53.120 54.330 -1.210 18327
3373 1 13 . 1 1 28 28 LEU CB C 28 44.500 44.500 45.384 -0.884 18327
3374 1 13 . 1 1 28 28 LEU H H 28 8.897 8.897 8.169 0.728 18327
3375 1 13 . 1 1 29 29 SER N N 29 115.700 115.700 119.058 -3.358 18327
3376 1 13 . 1 1 29 29 SER HA H 29 5.030 5.030 4.783 0.247 18327
3377 1 13 . 1 1 29 29 SER CA C 29 58.470 58.470 58.604 -0.134 18327
3378 1 13 . 1 1 29 29 SER CB C 29 63.690 63.690 63.862 -0.172 18327
3379 1 13 . 1 1 29 29 SER H H 29 7.949 7.949 8.471 -0.522 18327
3380 1 13 . 1 1 30 30 LEU N N 30 121.300 121.300 121.428 -0.128 18327
3381 1 13 . 1 1 30 30 LEU HA H 30 4.800 4.800 4.704 0.096 18327
3382 1 13 . 1 1 30 30 LEU CA C 30 52.940 52.940 55.643 -2.703 18327
3383 1 13 . 1 1 30 30 LEU CB C 30 46.370 46.370 46.027 0.343 18327
3384 1 13 . 1 1 30 30 LEU H H 30 9.503 9.503 8.773 0.730 18327
3385 1 13 . 1 1 31 31 GLN N N 31 123.100 123.100 120.936 2.164 18327
3386 1 13 . 1 1 31 31 GLN HA H 31 5.070 5.070 4.709 0.361 18327
3387 1 13 . 1 1 31 31 GLN CA C 31 52.940 52.940 54.019 -1.079 18327
3388 1 13 . 1 1 31 31 GLN CB C 31 31.190 31.190 32.892 -1.702 18327
3389 1 13 . 1 1 31 31 GLN H H 31 9.152 9.152 8.414 0.738 18327
3390 1 13 . 1 1 32 32 ILE N N 32 120.800 120.800 120.879 -0.079 18327
3391 1 13 . 1 1 32 32 ILE HA H 32 3.030 3.030 3.919 -0.889 18327
3392 1 13 . 1 1 32 32 ILE CA C 32 64.250 64.250 62.261 1.990 18327
3393 1 13 . 1 1 32 32 ILE CB C 32 37.940 37.940 37.542 0.398 18327
3394 1 13 . 1 1 32 32 ILE H H 32 8.019 8.019 8.169 -0.150 18327
3395 1 13 . 1 1 33 33 GLY N N 33 115.700 115.700 114.135 1.565 18327
3396 1 13 . 1 1 33 33 GLY CA C 33 44.500 44.500 44.801 -0.301 18327
3397 1 13 . 1 1 33 33 GLY H H 33 8.777 8.777 8.867 -0.090 18327
3398 1 13 . 1 1 34 34 ASP N N 34 122.300 122.300 121.715 0.585 18327
3399 1 13 . 1 1 34 34 ASP HA H 34 4.640 4.640 4.920 -0.280 18327
3400 1 13 . 1 1 34 34 ASP CA C 34 55.860 55.860 53.582 2.278 18327
3401 1 13 . 1 1 34 34 ASP CB C 34 41.310 41.310 42.665 -1.355 18327
3402 1 13 . 1 1 34 34 ASP H H 34 8.690 8.690 7.717 0.973 18327
3403 1 13 . 1 1 35 35 THR N N 35 117.900 117.900 114.531 3.369 18327
3404 1 13 . 1 1 35 35 THR HA H 35 5.160 5.160 5.350 -0.190 18327
3405 1 13 . 1 1 35 35 THR CA C 35 61.450 61.450 61.073 0.377 18327
3406 1 13 . 1 1 35 35 THR CB C 35 69.090 69.090 71.215 -2.125 18327
3407 1 13 . 1 1 35 35 THR H H 35 8.389 8.389 8.257 0.132 18327
3408 1 13 . 1 1 36 36 VAL N N 36 118.200 118.200 118.026 0.174 18327
3409 1 13 . 1 1 36 36 VAL HA H 36 5.100 5.100 4.368 0.732 18327
3410 1 13 . 1 1 36 36 VAL CA C 36 57.910 57.910 60.670 -2.760 18327
3411 1 13 . 1 1 36 36 VAL CB C 36 34.190 34.190 35.136 -0.946 18327
3412 1 13 . 1 1 36 36 VAL H H 36 9.019 9.019 9.024 -0.005 18327
3413 1 13 . 1 1 37 37 HIS N N 37 122.100 122.100 119.043 3.057 18327
3414 1 13 . 1 1 37 37 HIS HA H 37 4.840 4.840 4.921 -0.081 18327
3415 1 13 . 1 1 37 37 HIS CA C 37 52.560 52.560 53.703 -1.143 18327
3416 1 13 . 1 1 37 37 HIS CB C 37 31.260 31.260 33.549 -2.289 18327
3417 1 13 . 1 1 37 37 HIS H H 37 8.489 8.489 8.686 -0.197 18327
3418 1 13 . 1 1 38 38 ILE N N 38 126.400 126.400 125.279 1.121 18327
3419 1 13 . 1 1 38 38 ILE HA H 38 3.780 3.780 4.510 -0.730 18327
3420 1 13 . 1 1 38 38 ILE CA C 38 61.640 61.640 60.519 1.121 18327
3421 1 13 . 1 1 38 38 ILE CB C 38 38.880 38.880 38.777 0.103 18327
3422 1 13 . 1 1 38 38 ILE H H 38 8.636 8.636 8.746 -0.110 18327
3423 1 13 . 1 1 39 39 LEU N N 39 126.000 126.000 124.411 1.589 18327
3424 1 13 . 1 1 39 39 LEU HA H 39 4.400 4.400 4.695 -0.295 18327
3425 1 13 . 1 1 39 39 LEU CA C 39 55.490 55.490 54.567 0.923 18327
3426 1 13 . 1 1 39 39 LEU CB C 39 43.750 43.750 42.702 1.048 18327
3427 1 13 . 1 1 39 39 LEU H H 39 9.162 9.162 8.725 0.437 18327
3428 1 13 . 1 1 40 40 GLU N N 40 115.100 115.100 117.678 -2.578 18327
3429 1 13 . 1 1 40 40 GLU HA H 40 7.895 7.895 4.628 3.267 18327
3430 1 13 . 1 1 41 41 THR N N 41 116.400 116.400 110.826 5.574 18327
3431 1 13 . 1 1 41 41 THR HA H 41 4.270 4.270 4.810 -0.540 18327
3432 1 13 . 1 1 41 41 THR CA C 41 60.890 60.890 60.346 0.544 18327
3433 1 13 . 1 1 41 41 THR CB C 41 69.650 69.650 71.564 -1.914 18327
3434 1 13 . 1 1 41 41 THR H H 41 8.162 8.162 8.327 -0.165 18327
3435 1 13 . 1 1 43 43 GLU N N 43 123.300 123.300 121.177 2.123 18327
3436 1 13 . 1 1 43 43 GLU HA H 43 4.270 4.270 4.421 -0.151 18327
3437 1 13 . 1 1 43 43 GLU CA C 43 57.350 57.350 55.826 1.524 18327
3438 1 13 . 1 1 43 43 GLU CB C 43 26.790 26.790 29.913 -3.123 18327
3439 1 13 . 1 1 43 43 GLU H H 43 8.108 8.108 8.465 -0.357 18327
3440 1 13 . 1 1 44 44 GLY CA C 44 45.440 45.440 45.289 0.151 18327
3441 1 13 . 1 1 45 45 TRP N N 45 124.100 124.100 119.493 4.607 18327
3442 1 13 . 1 1 45 45 TRP HA H 45 4.690 4.690 4.622 0.068 18327
3443 1 13 . 1 1 45 45 TRP H H 45 8.590 8.590 7.363 1.227 18327
3444 1 13 . 1 1 46 46 TYR HA H 46 5.600 5.600 4.646 0.954 18327
3445 1 13 . 1 1 46 46 TYR CA C 46 54.060 54.060 57.129 -3.069 18327
3446 1 13 . 1 1 46 46 TYR CB C 46 42.060 42.060 41.388 0.672 18327
3447 1 13 . 1 1 47 47 ARG N N 47 118.100 118.100 122.196 -4.096 18327
3448 1 13 . 1 1 47 47 ARG HA H 47 5.070 5.070 4.932 0.138 18327
3449 1 13 . 1 1 47 47 ARG CA C 47 54.060 54.060 53.892 0.168 18327
3450 1 13 . 1 1 47 47 ARG CB C 47 33.250 33.250 34.844 -1.594 18327
3451 1 13 . 1 1 47 47 ARG H H 47 8.495 8.495 9.026 -0.531 18327
3452 1 13 . 1 1 48 48 GLY N N 48 114.000 114.000 111.600 2.400 18327
3453 1 13 . 1 1 48 48 GLY CA C 48 46.560 46.560 46.008 0.552 18327
3454 1 13 . 1 1 48 48 GLY H H 48 9.183 9.183 8.734 0.449 18327
3455 1 13 . 1 1 49 49 TYR N N 49 116.200 116.200 115.746 0.454 18327
3456 1 13 . 1 1 49 49 TYR HA H 49 5.380 5.380 5.175 0.205 18327
3457 1 13 . 1 1 49 49 TYR CA C 49 55.110 55.110 56.778 -1.668 18327
3458 1 13 . 1 1 49 49 TYR CB C 49 40.750 40.750 39.723 1.027 18327
3459 1 13 . 1 1 49 49 TYR H H 49 8.199 8.199 8.379 -0.180 18327
3460 1 13 . 1 1 50 50 THR N N 50 112.200 112.200 111.476 0.724 18327
3461 1 13 . 1 1 50 50 THR HA H 50 5.120 5.120 4.295 0.825 18327
3462 1 13 . 1 1 50 50 THR CA C 50 59.770 59.770 60.663 -0.893 18327
3463 1 13 . 1 1 50 50 THR CB C 50 69.460 69.460 69.652 -0.192 18327
3464 1 13 . 1 1 50 50 THR H H 50 9.436 9.436 8.379 1.057 18327
3465 1 13 . 1 1 51 51 LEU N N 51 121.300 121.300 120.202 1.098 18327
3466 1 13 . 1 1 51 51 LEU HA H 51 4.230 4.230 4.414 -0.184 18327
3467 1 13 . 1 1 51 51 LEU CA C 51 56.790 56.790 53.854 2.936 18327
3468 1 13 . 1 1 51 51 LEU CB C 51 40.000 40.000 41.607 -1.607 18327
3469 1 13 . 1 1 51 51 LEU H H 51 8.313 8.313 8.381 -0.068 18327
3470 1 13 . 1 1 52 52 ARG N N 52 116.600 116.600 118.744 -2.144 18327
3471 1 13 . 1 1 52 52 ARG HA H 52 4.250 4.250 4.249 0.001 18327
3472 1 13 . 1 1 52 52 ARG CA C 52 57.350 57.350 57.308 0.042 18327
3473 1 13 . 1 1 52 52 ARG CB C 52 30.510 30.510 31.425 -0.915 18327
3474 1 13 . 1 1 52 52 ARG H H 52 8.053 8.053 8.402 -0.349 18327
3475 1 13 . 1 1 53 53 LYS N N 53 122.600 122.600 117.044 5.556 18327
3476 1 13 . 1 1 53 53 LYS HA H 53 4.620 4.620 4.469 0.151 18327
3477 1 13 . 1 1 53 53 LYS CA C 53 54.620 54.620 55.178 -0.559 18327
3478 1 13 . 1 1 53 53 LYS CB C 53 32.310 32.310 34.770 -2.460 18327
3479 1 13 . 1 1 53 53 LYS H H 53 7.655 7.655 7.625 0.030 18327
3480 1 13 . 1 1 54 54 LYS N N 54 124.900 124.900 124.215 0.685 18327
3481 1 13 . 1 1 54 54 LYS HA H 54 4.090 4.090 4.092 -0.002 18327
3482 1 13 . 1 1 54 54 LYS CA C 54 58.470 58.470 58.745 -0.275 18327
3483 1 13 . 1 1 54 54 LYS CB C 54 32.130 32.130 32.304 -0.174 18327
3484 1 13 . 1 1 54 54 LYS H H 54 8.499 8.499 8.696 -0.197 18327
3485 1 13 . 1 1 55 55 SER N N 55 110.100 110.100 112.435 -2.335 18327
3486 1 13 . 1 1 55 55 SER HA H 55 4.140 4.140 4.264 -0.124 18327
3487 1 13 . 1 1 55 55 SER CA C 55 58.470 58.470 60.036 -1.566 18327
3488 1 13 . 1 1 55 55 SER CB C 55 63.310 63.310 63.015 0.295 18327
3489 1 13 . 1 1 55 55 SER H H 55 7.862 7.862 8.056 -0.194 18327
3490 1 13 . 1 1 56 56 LYS N N 56 124.000 124.000 123.314 0.686 18327
3491 1 13 . 1 1 56 56 LYS HA H 56 4.700 4.700 4.357 0.343 18327
3492 1 13 . 1 1 56 56 LYS CA C 56 54.810 54.810 55.272 -0.461 18327
3493 1 13 . 1 1 56 56 LYS CB C 56 33.250 33.250 31.389 1.861 18327
3494 1 13 . 1 1 56 56 LYS H H 56 7.481 7.481 7.398 0.083 18327
3495 1 13 . 1 1 57 57 LYS N N 57 125.700 125.700 122.839 2.861 18327
3496 1 13 . 1 1 57 57 LYS HA H 57 5.330 5.330 4.889 0.441 18327
3497 1 13 . 1 1 57 57 LYS CA C 57 54.620 54.620 55.154 -0.534 18327
3498 1 13 . 1 1 57 57 LYS CB C 57 34.240 34.240 35.291 -1.051 18327
3499 1 13 . 1 1 57 57 LYS H H 57 8.475 8.475 7.645 0.830 18327
3500 1 13 . 1 1 58 58 GLY N N 58 109.400 109.400 109.328 0.072 18327
3501 1 13 . 1 1 58 58 GLY CA C 58 45.620 45.620 45.650 -0.030 18327
3502 1 13 . 1 1 58 58 GLY H H 58 9.073 9.073 8.597 0.476 18327
3503 1 13 . 1 1 59 59 ILE N N 59 113.900 113.900 119.847 -5.947 18327
3504 1 13 . 1 1 59 59 ILE HA H 59 6.000 6.000 5.049 0.951 18327
3505 1 13 . 1 1 59 59 ILE CA C 59 59.590 59.590 59.857 -0.267 18327
3506 1 13 . 1 1 59 59 ILE CB C 59 41.140 41.140 42.680 -1.540 18327
3507 1 13 . 1 1 59 59 ILE H H 59 8.628 8.628 7.942 0.686 18327
3508 1 13 . 1 1 60 60 PHE N N 60 116.900 116.900 116.917 -0.017 18327
3509 1 13 . 1 1 60 60 PHE HA H 60 5.120 5.120 5.285 -0.165 18327
3510 1 13 . 1 1 60 60 PHE CA C 60 54.060 54.060 55.385 -1.325 18327
3511 1 13 . 1 1 60 60 PHE CB C 60 37.190 37.190 40.139 -2.949 18327
3512 1 13 . 1 1 60 60 PHE H H 60 8.724 8.724 8.976 -0.252 18327
3513 1 13 . 1 1 61 61 PRO HA H 61 3.480 3.480 4.095 -0.615 18327
3514 1 13 . 1 1 61 61 PRO CA C 61 62.200 62.200 61.846 0.354 18327
3515 1 13 . 1 1 61 61 PRO CB C 61 31.190 31.190 32.017 -0.827 18327
3516 1 13 . 1 1 62 62 ALA N N 62 124.600 124.600 126.330 -1.730 18327
3517 1 13 . 1 1 62 62 ALA HA H 62 3.720 3.720 4.254 -0.534 18327
3518 1 13 . 1 1 62 62 ALA CA C 62 54.370 54.370 54.980 -0.610 18327
3519 1 13 . 1 1 62 62 ALA CB C 62 17.650 17.650 18.353 -0.703 18327
3520 1 13 . 1 1 62 62 ALA H H 62 7.898 7.898 8.062 -0.164 18327
3521 1 13 . 1 1 63 63 SER N N 63 109.700 109.700 113.492 -3.792 18327
3522 1 13 . 1 1 63 63 SER HA H 63 4.200 4.200 4.129 0.071 18327
3523 1 13 . 1 1 63 63 SER CA C 63 59.400 59.400 60.427 -1.027 18327
3524 1 13 . 1 1 63 63 SER CB C 63 62.380 62.380 62.926 -0.546 18327
3525 1 13 . 1 1 63 63 SER H H 63 8.030 8.030 7.975 0.055 18327
3526 1 13 . 1 1 64 64 TYR N N 64 120.300 120.300 117.556 2.744 18327
3527 1 13 . 1 1 64 64 TYR HA H 64 4.260 4.260 4.403 -0.143 18327
3528 1 13 . 1 1 64 64 TYR CA C 64 57.720 57.720 59.140 -1.420 18327
3529 1 13 . 1 1 64 64 TYR CB C 64 37.560 37.560 38.559 -1.000 18327
3530 1 13 . 1 1 64 64 TYR H H 64 7.124 7.124 8.095 -0.971 18327
3531 1 13 . 1 1 65 65 ILE N N 65 118.000 118.000 115.878 2.122 18327
3532 1 13 . 1 1 65 65 ILE HA H 65 4.830 4.830 5.028 -0.198 18327
3533 1 13 . 1 1 65 65 ILE CA C 65 56.980 56.980 58.451 -1.471 18327
3534 1 13 . 1 1 65 65 ILE CB C 65 39.630 39.630 40.798 -1.168 18327
3535 1 13 . 1 1 65 65 ILE H H 65 7.671 7.671 7.603 0.068 18327
3536 1 13 . 1 1 66 66 HIS N N 66 124.500 124.500 121.720 2.780 18327
3537 1 13 . 1 1 66 66 HIS HA H 66 5.130 5.130 4.914 0.216 18327
3538 1 13 . 1 1 66 66 HIS CA C 66 53.060 53.060 54.124 -1.064 18327
3539 1 13 . 1 1 66 66 HIS CB C 66 30.510 30.510 33.740 -3.230 18327
3540 1 13 . 1 1 66 66 HIS H H 66 9.159 9.159 8.781 0.378 18327
3541 1 13 . 1 1 67 67 LEU N N 67 127.400 127.400 129.195 -1.795 18327
3542 1 13 . 1 1 67 67 LEU HA H 67 4.560 4.560 4.797 -0.237 18327
3543 1 13 . 1 1 67 67 LEU CA C 67 55.300 55.300 55.268 0.032 18327
3544 1 13 . 1 1 67 67 LEU CB C 67 42.060 42.060 43.348 -1.288 18327
3545 1 13 . 1 1 67 67 LEU H H 67 8.979 8.979 8.917 0.062 18327
3546 1 13 . 1 1 68 68 LYS N N 68 121.900 121.900 124.956 -3.056 18327
3547 1 13 . 1 1 68 68 LYS HA H 68 4.490 4.490 4.390 0.100 18327
3548 1 13 . 1 1 68 68 LYS CA C 68 55.110 55.110 55.389 -0.279 18327
3549 1 13 . 1 1 68 68 LYS CB C 68 34.610 34.610 32.612 1.998 18327
3550 1 13 . 1 1 68 68 LYS H H 68 8.499 8.499 8.752 -0.253 18327
3551 1 13 . 1 1 69 69 GLU N N 69 122.100 122.100 118.242 3.858 18327
3552 1 13 . 1 1 69 69 GLU HA H 69 4.290 4.290 3.952 0.338 18327
3553 1 13 . 1 1 69 69 GLU CA C 69 56.610 56.610 56.902 -0.292 18327
3554 1 13 . 1 1 69 69 GLU CB C 69 30.330 30.330 28.874 1.456 18327
3555 1 13 . 1 1 69 69 GLU H H 69 8.569 8.569 8.094 0.475 18327
3556 1 13 . 1 1 70 70 ALA N N 70 123.300 123.300 121.987 1.313 18327
3557 1 13 . 1 1 70 70 ALA HA H 70 4.210 4.210 4.191 0.019 18327
3558 1 13 . 1 1 70 70 ALA CA C 70 51.810 51.810 52.134 -0.324 18327
3559 1 13 . 1 1 70 70 ALA CB C 70 19.700 19.700 19.287 0.413 18327
3560 1 13 . 1 1 70 70 ALA H H 70 8.181 8.181 8.246 -0.065 18327
3561 1 13 . 1 1 71 71 ILE N N 71 120.000 120.000 120.068 -0.068 18327
3562 1 13 . 1 1 71 71 ILE HA H 71 4.070 4.070 4.208 -0.138 18327
3563 1 13 . 1 1 71 71 ILE CA C 71 60.330 60.330 61.197 -0.867 18327
3564 1 13 . 1 1 71 71 ILE CB C 71 38.690 38.690 39.382 -0.692 18327
3565 1 13 . 1 1 71 71 ILE H H 71 7.789 7.789 8.401 -0.612 18327
3566 1 13 . 1 1 72 72 VAL N N 72 124.400 124.400 120.512 3.888 18327
3567 1 13 . 1 1 72 72 VAL HA H 72 4.070 4.070 4.432 -0.362 18327
3568 1 13 . 1 1 72 72 VAL CA C 72 61.640 61.640 61.510 0.130 18327
3569 1 13 . 1 1 72 72 VAL CB C 72 32.690 32.690 33.398 -0.708 18327
3570 1 13 . 1 1 72 72 VAL H H 72 8.089 8.089 7.974 0.115 18327
3571 1 13 . 1 1 73 73 GLU N N 73 125.940 125.940 122.004 3.936 18327
3572 1 13 . 1 1 73 73 GLU HA H 73 4.300 4.300 5.105 -0.805 18327
3573 1 13 . 1 1 73 73 GLU CA C 73 56.610 56.610 55.344 1.266 18327
3574 1 13 . 1 1 73 73 GLU CB C 73 30.710 30.710 32.724 -2.014 18327
3575 1 13 . 1 1 73 73 GLU H H 73 8.464 8.464 8.959 -0.495 18327
3576 1 14 . 1 1 13 13 TYR HA H 13 5.560 5.560 4.975 0.585 18327
3577 1 14 . 1 1 13 13 TYR CA C 13 55.860 55.860 55.456 0.404 18327
3578 1 14 . 1 1 13 13 TYR CB C 13 42.440 42.440 39.773 2.667 18327
3579 1 14 . 1 1 14 14 GLY N N 14 105.400 105.400 105.844 -0.444 18327
3580 1 14 . 1 1 14 14 GLY CA C 14 45.240 45.240 43.622 1.618 18327
3581 1 14 . 1 1 14 14 GLY H H 14 8.406 8.406 8.415 -0.009 18327
3582 1 14 . 1 1 15 15 VAL N N 15 118.900 118.900 119.656 -0.756 18327
3583 1 14 . 1 1 15 15 VAL HA H 15 5.330 5.330 4.728 0.602 18327
3584 1 14 . 1 1 15 15 VAL CA C 15 59.210 59.210 60.110 -0.900 18327
3585 1 14 . 1 1 15 15 VAL CB C 15 35.740 35.740 35.353 0.387 18327
3586 1 14 . 1 1 15 15 VAL H H 15 8.854 8.854 8.251 0.603 18327
3587 1 14 . 1 1 16 16 ALA N N 16 129.400 129.400 125.233 4.167 18327
3588 1 14 . 1 1 16 16 ALA HA H 16 5.000 5.000 4.679 0.321 18327
3589 1 14 . 1 1 16 16 ALA CA C 16 52.000 52.000 51.260 0.740 18327
3590 1 14 . 1 1 16 16 ALA CB C 16 19.330 19.330 20.068 -0.738 18327
3591 1 14 . 1 1 16 16 ALA H H 16 9.112 9.112 9.030 0.082 18327
3592 1 14 . 1 1 17 17 PHE N N 17 123.900 123.900 124.790 -0.890 18327
3593 1 14 . 1 1 17 17 PHE HA H 17 4.740 4.740 4.625 0.115 18327
3594 1 14 . 1 1 17 17 PHE CA C 17 56.230 56.230 57.045 -0.815 18327
3595 1 14 . 1 1 17 17 PHE CB C 17 40.000 40.000 39.897 0.103 18327
3596 1 14 . 1 1 17 17 PHE H H 17 8.785 8.785 8.557 0.228 18327
3597 1 14 . 1 1 18 18 TYR N N 18 118.100 118.100 118.341 -0.241 18327
3598 1 14 . 1 1 18 18 TYR HA H 18 4.490 4.490 4.430 0.060 18327
3599 1 14 . 1 1 18 18 TYR CA C 18 55.300 55.300 57.464 -2.164 18327
3600 1 14 . 1 1 18 18 TYR CB C 18 42.810 42.810 41.373 1.438 18327
3601 1 14 . 1 1 18 18 TYR H H 18 7.288 7.288 7.450 -0.162 18327
3602 1 14 . 1 1 19 19 ASN N N 19 116.800 116.800 121.466 -4.666 18327
3603 1 14 . 1 1 19 19 ASN HA H 19 4.710 4.710 4.918 -0.208 18327
3604 1 14 . 1 1 19 19 ASN CA C 19 52.940 52.940 54.124 -1.184 18327
3605 1 14 . 1 1 19 19 ASN CB C 19 39.060 39.060 39.549 -0.489 18327
3606 1 14 . 1 1 19 19 ASN H H 19 8.122 8.122 8.712 -0.590 18327
3607 1 14 . 1 1 20 20 TYR N N 20 122.000 122.000 123.305 -1.305 18327
3608 1 14 . 1 1 20 20 TYR HA H 20 4.710 4.710 4.827 -0.117 18327
3609 1 14 . 1 1 20 20 TYR CA C 20 57.720 57.720 58.126 -0.406 18327
3610 1 14 . 1 1 20 20 TYR CB C 20 42.250 42.250 42.470 -0.220 18327
3611 1 14 . 1 1 20 20 TYR H H 20 8.994 8.994 8.752 0.242 18327
3612 1 14 . 1 1 21 21 ASP N N 21 128.500 128.500 124.476 4.024 18327
3613 1 14 . 1 1 21 21 ASP HA H 21 4.790 4.790 4.838 -0.048 18327
3614 1 14 . 1 1 21 21 ASP CA C 21 52.370 52.370 53.498 -1.128 18327
3615 1 14 . 1 1 21 21 ASP CB C 21 41.130 41.130 42.537 -1.407 18327
3616 1 14 . 1 1 21 21 ASP H H 21 7.839 7.839 8.112 -0.273 18327
3617 1 14 . 1 1 22 22 ALA N N 22 125.200 125.200 122.829 2.371 18327
3618 1 14 . 1 1 22 22 ALA HA H 22 4.050 4.050 4.601 -0.551 18327
3619 1 14 . 1 1 22 22 ALA CA C 22 52.940 52.940 51.889 1.051 18327
3620 1 14 . 1 1 22 22 ALA CB C 22 20.450 20.450 20.038 0.412 18327
3621 1 14 . 1 1 22 22 ALA H H 22 8.107 8.107 8.295 -0.188 18327
3622 1 14 . 1 1 23 23 ARG N N 23 122.200 122.200 121.751 0.449 18327
3623 1 14 . 1 1 23 23 ARG HA H 23 4.350 4.350 4.052 0.298 18327
3624 1 14 . 1 1 23 23 ARG CA C 23 55.490 55.490 57.628 -2.138 18327
3625 1 14 . 1 1 23 23 ARG CB C 23 30.700 30.700 30.721 -0.021 18327
3626 1 14 . 1 1 23 23 ARG H H 23 8.889 8.889 8.674 0.215 18327
3627 1 14 . 1 1 24 24 GLY N N 24 105.200 105.200 104.772 0.428 18327
3628 1 14 . 1 1 24 24 GLY CA C 24 44.500 44.500 44.697 -0.197 18327
3629 1 14 . 1 1 24 24 GLY H H 24 7.267 7.267 7.470 -0.203 18327
3630 1 14 . 1 1 25 25 ALA N N 25 122.200 122.200 121.832 0.368 18327
3631 1 14 . 1 1 25 25 ALA HA H 25 4.160 4.160 4.235 -0.075 18327
3632 1 14 . 1 1 25 25 ALA CA C 25 54.440 54.440 54.037 0.403 18327
3633 1 14 . 1 1 25 25 ALA CB C 25 18.770 18.770 19.102 -0.333 18327
3634 1 14 . 1 1 25 25 ALA H H 25 8.621 8.621 8.207 0.414 18327
3635 1 14 . 1 1 26 26 ASP N N 26 114.700 114.700 117.751 -3.051 18327
3636 1 14 . 1 1 26 26 ASP HA H 26 4.700 4.700 4.575 0.125 18327
3637 1 14 . 1 1 26 26 ASP CA C 26 53.870 53.870 55.091 -1.221 18327
3638 1 14 . 1 1 26 26 ASP CB C 26 40.390 40.390 41.001 -0.611 18327
3639 1 14 . 1 1 26 26 ASP H H 26 8.949 8.949 8.462 0.487 18327
3640 1 14 . 1 1 27 27 GLU N N 27 118.800 118.800 116.400 2.400 18327
3641 1 14 . 1 1 27 27 GLU HA H 27 5.220 5.220 4.713 0.507 18327
3642 1 14 . 1 1 27 27 GLU CA C 27 54.930 54.930 55.765 -0.835 18327
3643 1 14 . 1 1 27 27 GLU CB C 27 32.880 32.880 31.491 1.389 18327
3644 1 14 . 1 1 27 27 GLU H H 27 7.542 7.542 7.378 0.164 18327
3645 1 14 . 1 1 28 28 LEU N N 28 121.400 121.400 120.575 0.825 18327
3646 1 14 . 1 1 28 28 LEU HA H 28 4.760 4.760 4.723 0.037 18327
3647 1 14 . 1 1 28 28 LEU CA C 28 53.120 53.120 54.286 -1.166 18327
3648 1 14 . 1 1 28 28 LEU CB C 28 44.500 44.500 45.111 -0.611 18327
3649 1 14 . 1 1 28 28 LEU H H 28 8.897 8.897 8.007 0.890 18327
3650 1 14 . 1 1 29 29 SER N N 29 115.700 115.700 120.344 -4.644 18327
3651 1 14 . 1 1 29 29 SER HA H 29 5.030 5.030 4.583 0.447 18327
3652 1 14 . 1 1 29 29 SER CA C 29 58.470 58.470 59.675 -1.204 18327
3653 1 14 . 1 1 29 29 SER CB C 29 63.690 63.690 64.314 -0.624 18327
3654 1 14 . 1 1 29 29 SER H H 29 7.949 7.949 8.502 -0.553 18327
3655 1 14 . 1 1 30 30 LEU N N 30 121.300 121.300 122.137 -0.837 18327
3656 1 14 . 1 1 30 30 LEU HA H 30 4.800 4.800 4.780 0.020 18327
3657 1 14 . 1 1 30 30 LEU CA C 30 52.940 52.940 54.946 -2.006 18327
3658 1 14 . 1 1 30 30 LEU CB C 30 46.370 46.370 46.238 0.132 18327
3659 1 14 . 1 1 30 30 LEU H H 30 9.503 9.503 8.668 0.835 18327
3660 1 14 . 1 1 31 31 GLN N N 31 123.100 123.100 121.753 1.347 18327
3661 1 14 . 1 1 31 31 GLN HA H 31 5.070 5.070 4.645 0.425 18327
3662 1 14 . 1 1 31 31 GLN CA C 31 52.940 52.940 53.714 -0.774 18327
3663 1 14 . 1 1 31 31 GLN CB C 31 31.190 31.190 32.594 -1.404 18327
3664 1 14 . 1 1 31 31 GLN H H 31 9.152 9.152 8.444 0.708 18327
3665 1 14 . 1 1 32 32 ILE N N 32 120.800 120.800 121.692 -0.892 18327
3666 1 14 . 1 1 32 32 ILE HA H 32 3.030 3.030 4.002 -0.972 18327
3667 1 14 . 1 1 32 32 ILE CA C 32 64.250 64.250 62.254 1.996 18327
3668 1 14 . 1 1 32 32 ILE CB C 32 37.940 37.940 37.491 0.449 18327
3669 1 14 . 1 1 32 32 ILE H H 32 8.019 8.019 8.488 -0.469 18327
3670 1 14 . 1 1 33 33 GLY N N 33 115.700 115.700 114.630 1.070 18327
3671 1 14 . 1 1 33 33 GLY CA C 33 44.500 44.500 45.117 -0.618 18327
3672 1 14 . 1 1 33 33 GLY H H 33 8.777 8.777 9.056 -0.279 18327
3673 1 14 . 1 1 34 34 ASP N N 34 122.300 122.300 122.324 -0.024 18327
3674 1 14 . 1 1 34 34 ASP HA H 34 4.640 4.640 4.904 -0.264 18327
3675 1 14 . 1 1 34 34 ASP CA C 34 55.860 55.860 53.739 2.121 18327
3676 1 14 . 1 1 34 34 ASP CB C 34 41.310 41.310 42.053 -0.743 18327
3677 1 14 . 1 1 34 34 ASP H H 34 8.690 8.690 7.556 1.134 18327
3678 1 14 . 1 1 35 35 THR N N 35 117.900 117.900 116.922 0.978 18327
3679 1 14 . 1 1 35 35 THR HA H 35 5.160 5.160 4.849 0.311 18327
3680 1 14 . 1 1 35 35 THR CA C 35 61.450 61.450 62.395 -0.945 18327
3681 1 14 . 1 1 35 35 THR CB C 35 69.090 69.090 69.969 -0.879 18327
3682 1 14 . 1 1 35 35 THR H H 35 8.389 8.389 8.401 -0.012 18327
3683 1 14 . 1 1 36 36 VAL N N 36 118.200 118.200 116.655 1.545 18327
3684 1 14 . 1 1 36 36 VAL HA H 36 5.100 5.100 4.347 0.753 18327
3685 1 14 . 1 1 36 36 VAL CA C 36 57.910 57.910 60.489 -2.579 18327
3686 1 14 . 1 1 36 36 VAL CB C 36 34.190 34.190 35.319 -1.129 18327
3687 1 14 . 1 1 36 36 VAL H H 36 9.019 9.019 9.064 -0.045 18327
3688 1 14 . 1 1 37 37 HIS N N 37 122.100 122.100 120.347 1.753 18327
3689 1 14 . 1 1 37 37 HIS HA H 37 4.840 4.840 5.025 -0.185 18327
3690 1 14 . 1 1 37 37 HIS CA C 37 52.560 52.560 54.133 -1.573 18327
3691 1 14 . 1 1 37 37 HIS CB C 37 31.260 31.260 33.344 -2.084 18327
3692 1 14 . 1 1 37 37 HIS H H 37 8.489 8.489 8.088 0.401 18327
3693 1 14 . 1 1 38 38 ILE N N 38 126.400 126.400 124.679 1.721 18327
3694 1 14 . 1 1 38 38 ILE HA H 38 3.780 3.780 4.320 -0.540 18327
3695 1 14 . 1 1 38 38 ILE CA C 38 61.640 61.640 60.909 0.731 18327
3696 1 14 . 1 1 38 38 ILE CB C 38 38.880 38.880 39.693 -0.813 18327
3697 1 14 . 1 1 38 38 ILE H H 38 8.636 8.636 8.497 0.139 18327
3698 1 14 . 1 1 39 39 LEU N N 39 126.000 126.000 123.506 2.494 18327
3699 1 14 . 1 1 39 39 LEU HA H 39 4.400 4.400 4.779 -0.379 18327
3700 1 14 . 1 1 39 39 LEU CA C 39 55.490 55.490 55.147 0.343 18327
3701 1 14 . 1 1 39 39 LEU CB C 39 43.750 43.750 44.671 -0.921 18327
3702 1 14 . 1 1 39 39 LEU H H 39 9.162 9.162 9.023 0.139 18327
3703 1 14 . 1 1 40 40 GLU N N 40 115.100 115.100 117.980 -2.880 18327
3704 1 14 . 1 1 40 40 GLU HA H 40 7.895 7.895 4.774 3.121 18327
3705 1 14 . 1 1 41 41 THR N N 41 116.400 116.400 111.442 4.958 18327
3706 1 14 . 1 1 41 41 THR HA H 41 4.270 4.270 4.653 -0.383 18327
3707 1 14 . 1 1 41 41 THR CA C 41 60.890 60.890 60.865 0.025 18327
3708 1 14 . 1 1 41 41 THR CB C 41 69.650 69.650 70.814 -1.163 18327
3709 1 14 . 1 1 41 41 THR H H 41 8.162 8.162 8.271 -0.109 18327
3710 1 14 . 1 1 43 43 GLU N N 43 123.300 123.300 121.168 2.132 18327
3711 1 14 . 1 1 43 43 GLU HA H 43 4.270 4.270 4.511 -0.241 18327
3712 1 14 . 1 1 43 43 GLU CA C 43 57.350 57.350 55.098 2.252 18327
3713 1 14 . 1 1 43 43 GLU CB C 43 26.790 26.790 29.817 -3.027 18327
3714 1 14 . 1 1 43 43 GLU H H 43 8.108 8.108 8.365 -0.257 18327
3715 1 14 . 1 1 44 44 GLY CA C 44 45.440 45.440 45.273 0.167 18327
3716 1 14 . 1 1 45 45 TRP N N 45 124.100 124.100 119.274 4.826 18327
3717 1 14 . 1 1 45 45 TRP HA H 45 4.690 4.690 4.645 0.045 18327
3718 1 14 . 1 1 45 45 TRP H H 45 8.590 8.590 7.275 1.315 18327
3719 1 14 . 1 1 46 46 TYR HA H 46 5.600 5.600 4.678 0.922 18327
3720 1 14 . 1 1 46 46 TYR CA C 46 54.060 54.060 57.278 -3.218 18327
3721 1 14 . 1 1 46 46 TYR CB C 46 42.060 42.060 41.877 0.183 18327
3722 1 14 . 1 1 47 47 ARG N N 47 118.100 118.100 122.872 -4.772 18327
3723 1 14 . 1 1 47 47 ARG HA H 47 5.070 5.070 4.669 0.401 18327
3724 1 14 . 1 1 47 47 ARG CA C 47 54.060 54.060 54.190 -0.130 18327
3725 1 14 . 1 1 47 47 ARG CB C 47 33.250 33.250 34.489 -1.239 18327
3726 1 14 . 1 1 47 47 ARG H H 47 8.495 8.495 9.086 -0.591 18327
3727 1 14 . 1 1 48 48 GLY N N 48 114.000 114.000 112.809 1.191 18327
3728 1 14 . 1 1 48 48 GLY CA C 48 46.560 46.560 46.500 0.060 18327
3729 1 14 . 1 1 48 48 GLY H H 48 9.183 9.183 8.912 0.271 18327
3730 1 14 . 1 1 49 49 TYR N N 49 116.200 116.200 116.919 -0.719 18327
3731 1 14 . 1 1 49 49 TYR HA H 49 5.380 5.380 5.020 0.360 18327
3732 1 14 . 1 1 49 49 TYR CA C 49 55.110 55.110 57.140 -2.030 18327
3733 1 14 . 1 1 49 49 TYR CB C 49 40.750 40.750 39.633 1.117 18327
3734 1 14 . 1 1 49 49 TYR H H 49 8.199 8.199 8.488 -0.289 18327
3735 1 14 . 1 1 50 50 THR N N 50 112.200 112.200 113.655 -1.455 18327
3736 1 14 . 1 1 50 50 THR HA H 50 5.120 5.120 4.194 0.926 18327
3737 1 14 . 1 1 50 50 THR CA C 50 59.770 59.770 60.972 -1.202 18327
3738 1 14 . 1 1 50 50 THR CB C 50 69.460 69.460 69.916 -0.456 18327
3739 1 14 . 1 1 50 50 THR H H 50 9.436 9.436 8.814 0.622 18327
3740 1 14 . 1 1 51 51 LEU N N 51 121.300 121.300 119.494 1.806 18327
3741 1 14 . 1 1 51 51 LEU HA H 51 4.230 4.230 4.343 -0.113 18327
3742 1 14 . 1 1 51 51 LEU CA C 51 56.790 56.790 55.124 1.666 18327
3743 1 14 . 1 1 51 51 LEU CB C 51 40.000 40.000 41.152 -1.152 18327
3744 1 14 . 1 1 51 51 LEU H H 51 8.313 8.313 7.771 0.542 18327
3745 1 14 . 1 1 52 52 ARG N N 52 116.600 116.600 118.448 -1.848 18327
3746 1 14 . 1 1 52 52 ARG HA H 52 4.250 4.250 4.069 0.181 18327
3747 1 14 . 1 1 52 52 ARG CA C 52 57.350 57.350 57.839 -0.489 18327
3748 1 14 . 1 1 52 52 ARG CB C 52 30.510 30.510 30.363 0.147 18327
3749 1 14 . 1 1 52 52 ARG H H 52 8.053 8.053 8.192 -0.139 18327
3750 1 14 . 1 1 53 53 LYS N N 53 122.600 122.600 117.254 5.346 18327
3751 1 14 . 1 1 53 53 LYS HA H 53 4.620 4.620 4.507 0.113 18327
3752 1 14 . 1 1 53 53 LYS CA C 53 54.620 54.620 55.811 -1.191 18327
3753 1 14 . 1 1 53 53 LYS CB C 53 32.310 32.310 33.285 -0.975 18327
3754 1 14 . 1 1 53 53 LYS H H 53 7.655 7.655 7.479 0.176 18327
3755 1 14 . 1 1 54 54 LYS N N 54 124.900 124.900 124.386 0.514 18327
3756 1 14 . 1 1 54 54 LYS HA H 54 4.090 4.090 4.456 -0.366 18327
3757 1 14 . 1 1 54 54 LYS CA C 54 58.470 58.470 58.246 0.224 18327
3758 1 14 . 1 1 54 54 LYS CB C 54 32.130 32.130 32.661 -0.531 18327
3759 1 14 . 1 1 54 54 LYS H H 54 8.499 8.499 8.733 -0.234 18327
3760 1 14 . 1 1 55 55 SER N N 55 110.100 110.100 113.828 -3.728 18327
3761 1 14 . 1 1 55 55 SER HA H 55 4.140 4.140 4.250 -0.110 18327
3762 1 14 . 1 1 55 55 SER CA C 55 58.470 58.470 60.053 -1.583 18327
3763 1 14 . 1 1 55 55 SER CB C 55 63.310 63.310 63.418 -0.108 18327
3764 1 14 . 1 1 55 55 SER H H 55 7.862 7.862 8.016 -0.154 18327
3765 1 14 . 1 1 56 56 LYS N N 56 124.000 124.000 121.683 2.317 18327
3766 1 14 . 1 1 56 56 LYS HA H 56 4.700 4.700 4.469 0.231 18327
3767 1 14 . 1 1 56 56 LYS CA C 56 54.810 54.810 55.393 -0.583 18327
3768 1 14 . 1 1 56 56 LYS CB C 56 33.250 33.250 32.889 0.361 18327
3769 1 14 . 1 1 56 56 LYS H H 56 7.481 7.481 7.938 -0.457 18327
3770 1 14 . 1 1 57 57 LYS N N 57 125.700 125.700 122.518 3.182 18327
3771 1 14 . 1 1 57 57 LYS HA H 57 5.330 5.330 4.596 0.734 18327
3772 1 14 . 1 1 57 57 LYS CA C 57 54.620 54.620 55.091 -0.471 18327
3773 1 14 . 1 1 57 57 LYS CB C 57 34.240 34.240 35.252 -1.012 18327
3774 1 14 . 1 1 57 57 LYS H H 57 8.475 8.475 8.179 0.296 18327
3775 1 14 . 1 1 58 58 GLY N N 58 109.400 109.400 107.137 2.263 18327
3776 1 14 . 1 1 58 58 GLY CA C 58 45.620 45.620 45.286 0.334 18327
3777 1 14 . 1 1 58 58 GLY H H 58 9.073 9.073 8.679 0.394 18327
3778 1 14 . 1 1 59 59 ILE N N 59 113.900 113.900 119.313 -5.413 18327
3779 1 14 . 1 1 59 59 ILE HA H 59 6.000 6.000 4.999 1.001 18327
3780 1 14 . 1 1 59 59 ILE CA C 59 59.590 59.590 59.143 0.447 18327
3781 1 14 . 1 1 59 59 ILE CB C 59 41.140 41.140 42.643 -1.503 18327
3782 1 14 . 1 1 59 59 ILE H H 59 8.628 8.628 8.283 0.345 18327
3783 1 14 . 1 1 60 60 PHE N N 60 116.900 116.900 117.759 -0.859 18327
3784 1 14 . 1 1 60 60 PHE HA H 60 5.120 5.120 5.158 -0.038 18327
3785 1 14 . 1 1 60 60 PHE CA C 60 54.060 54.060 55.101 -1.041 18327
3786 1 14 . 1 1 60 60 PHE CB C 60 37.190 37.190 40.258 -3.068 18327
3787 1 14 . 1 1 60 60 PHE H H 60 8.724 8.724 8.814 -0.090 18327
3788 1 14 . 1 1 61 61 PRO HA H 61 3.480 3.480 4.028 -0.548 18327
3789 1 14 . 1 1 61 61 PRO CA C 61 62.200 62.200 62.003 0.197 18327
3790 1 14 . 1 1 61 61 PRO CB C 61 31.190 31.190 32.228 -1.038 18327
3791 1 14 . 1 1 62 62 ALA N N 62 124.600 124.600 127.179 -2.579 18327
3792 1 14 . 1 1 62 62 ALA HA H 62 3.720 3.720 4.392 -0.672 18327
3793 1 14 . 1 1 62 62 ALA CA C 62 54.370 54.370 55.081 -0.711 18327
3794 1 14 . 1 1 62 62 ALA CB C 62 17.650 17.650 18.124 -0.474 18327
3795 1 14 . 1 1 62 62 ALA H H 62 7.898 7.898 8.247 -0.349 18327
3796 1 14 . 1 1 63 63 SER N N 63 109.700 109.700 111.814 -2.114 18327
3797 1 14 . 1 1 63 63 SER HA H 63 4.200 4.200 4.184 0.016 18327
3798 1 14 . 1 1 63 63 SER CA C 63 59.400 59.400 60.705 -1.305 18327
3799 1 14 . 1 1 63 63 SER CB C 63 62.380 62.380 62.667 -0.287 18327
3800 1 14 . 1 1 63 63 SER H H 63 8.030 8.030 7.871 0.159 18327
3801 1 14 . 1 1 64 64 TYR N N 64 120.300 120.300 118.495 1.805 18327
3802 1 14 . 1 1 64 64 TYR HA H 64 4.260 4.260 4.656 -0.396 18327
3803 1 14 . 1 1 64 64 TYR CA C 64 57.720 57.720 57.629 0.091 18327
3804 1 14 . 1 1 64 64 TYR CB C 64 37.560 37.560 38.773 -1.213 18327
3805 1 14 . 1 1 64 64 TYR H H 64 7.124 7.124 7.221 -0.097 18327
3806 1 14 . 1 1 65 65 ILE N N 65 118.000 118.000 117.134 0.866 18327
3807 1 14 . 1 1 65 65 ILE HA H 65 4.830 4.830 4.958 -0.128 18327
3808 1 14 . 1 1 65 65 ILE CA C 65 56.980 56.980 59.702 -2.722 18327
3809 1 14 . 1 1 65 65 ILE CB C 65 39.630 39.630 39.010 0.620 18327
3810 1 14 . 1 1 65 65 ILE H H 65 7.671 7.671 7.438 0.233 18327
3811 1 14 . 1 1 66 66 HIS N N 66 124.500 124.500 123.695 0.805 18327
3812 1 14 . 1 1 66 66 HIS HA H 66 5.130 5.130 4.843 0.287 18327
3813 1 14 . 1 1 66 66 HIS CA C 66 53.060 53.060 54.881 -1.821 18327
3814 1 14 . 1 1 66 66 HIS CB C 66 30.510 30.510 32.762 -2.252 18327
3815 1 14 . 1 1 66 66 HIS H H 66 9.159 9.159 8.582 0.577 18327
3816 1 14 . 1 1 67 67 LEU N N 67 127.400 127.400 128.389 -0.989 18327
3817 1 14 . 1 1 67 67 LEU HA H 67 4.560 4.560 4.666 -0.106 18327
3818 1 14 . 1 1 67 67 LEU CA C 67 55.300 55.300 54.968 0.332 18327
3819 1 14 . 1 1 67 67 LEU CB C 67 42.060 42.060 43.335 -1.275 18327
3820 1 14 . 1 1 67 67 LEU H H 67 8.979 8.979 8.813 0.166 18327
3821 1 14 . 1 1 68 68 LYS N N 68 121.900 121.900 124.391 -2.491 18327
3822 1 14 . 1 1 68 68 LYS HA H 68 4.490 4.490 4.462 0.028 18327
3823 1 14 . 1 1 68 68 LYS CA C 68 55.110 55.110 55.508 -0.398 18327
3824 1 14 . 1 1 68 68 LYS CB C 68 34.610 34.610 32.749 1.861 18327
3825 1 14 . 1 1 68 68 LYS H H 68 8.499 8.499 8.551 -0.052 18327
3826 1 14 . 1 1 69 69 GLU N N 69 122.100 122.100 117.956 4.144 18327
3827 1 14 . 1 1 69 69 GLU HA H 69 4.290 4.290 3.756 0.534 18327
3828 1 14 . 1 1 69 69 GLU CA C 69 56.610 56.610 58.015 -1.405 18327
3829 1 14 . 1 1 69 69 GLU CB C 69 30.330 30.330 29.852 0.478 18327
3830 1 14 . 1 1 69 69 GLU H H 69 8.569 8.569 8.167 0.402 18327
3831 1 14 . 1 1 70 70 ALA N N 70 123.300 123.300 122.276 1.024 18327
3832 1 14 . 1 1 70 70 ALA HA H 70 4.210 4.210 3.377 0.833 18327
3833 1 14 . 1 1 70 70 ALA CA C 70 51.810 51.810 51.012 0.798 18327
3834 1 14 . 1 1 70 70 ALA CB C 70 19.700 19.700 19.026 0.674 18327
3835 1 14 . 1 1 70 70 ALA H H 70 8.181 8.181 8.050 0.131 18327
3836 1 14 . 1 1 71 71 ILE N N 71 120.000 120.000 122.380 -2.380 18327
3837 1 14 . 1 1 71 71 ILE HA H 71 4.070 4.070 4.083 -0.013 18327
3838 1 14 . 1 1 71 71 ILE CA C 71 60.330 60.330 61.121 -0.791 18327
3839 1 14 . 1 1 71 71 ILE CB C 71 38.690 38.690 38.299 0.391 18327
3840 1 14 . 1 1 71 71 ILE H H 71 7.789 7.789 8.274 -0.485 18327
3841 1 14 . 1 1 72 72 VAL N N 72 124.400 124.400 121.628 2.772 18327
3842 1 14 . 1 1 72 72 VAL HA H 72 4.070 4.070 4.275 -0.205 18327
3843 1 14 . 1 1 72 72 VAL CA C 72 61.640 61.640 61.811 -0.171 18327
3844 1 14 . 1 1 72 72 VAL CB C 72 32.690 32.690 32.818 -0.128 18327
3845 1 14 . 1 1 72 72 VAL H H 72 8.089 8.089 8.060 0.029 18327
3846 1 14 . 1 1 73 73 GLU N N 73 125.940 125.940 122.999 2.941 18327
3847 1 14 . 1 1 73 73 GLU HA H 73 4.300 4.300 4.255 0.045 18327
3848 1 14 . 1 1 73 73 GLU CA C 73 56.610 56.610 56.959 -0.349 18327
3849 1 14 . 1 1 73 73 GLU CB C 73 30.710 30.710 29.938 0.772 18327
3850 1 14 . 1 1 73 73 GLU H H 73 8.464 8.464 8.634 -0.170 18327
3851 1 15 . 1 1 13 13 TYR HA H 13 5.560 5.560 4.484 1.076 18327
3852 1 15 . 1 1 13 13 TYR CA C 13 55.860 55.860 56.725 -0.865 18327
3853 1 15 . 1 1 13 13 TYR CB C 13 42.440 42.440 41.635 0.805 18327
3854 1 15 . 1 1 14 14 GLY N N 14 105.400 105.400 107.728 -2.328 18327
3855 1 15 . 1 1 14 14 GLY CA C 14 45.240 45.240 43.639 1.601 18327
3856 1 15 . 1 1 14 14 GLY H H 14 8.406 8.406 8.539 -0.133 18327
3857 1 15 . 1 1 15 15 VAL N N 15 118.900 118.900 123.921 -5.021 18327
3858 1 15 . 1 1 15 15 VAL HA H 15 5.330 5.330 4.837 0.493 18327
3859 1 15 . 1 1 15 15 VAL CA C 15 59.210 59.210 60.859 -1.649 18327
3860 1 15 . 1 1 15 15 VAL CB C 15 35.740 35.740 35.733 0.007 18327
3861 1 15 . 1 1 15 15 VAL H H 15 8.854 8.854 8.579 0.275 18327
3862 1 15 . 1 1 16 16 ALA N N 16 129.400 129.400 128.218 1.182 18327
3863 1 15 . 1 1 16 16 ALA HA H 16 5.000 5.000 4.601 0.399 18327
3864 1 15 . 1 1 16 16 ALA CA C 16 52.000 52.000 51.023 0.977 18327
3865 1 15 . 1 1 16 16 ALA CB C 16 19.330 19.330 19.739 -0.409 18327
3866 1 15 . 1 1 16 16 ALA H H 16 9.112 9.112 9.075 0.037 18327
3867 1 15 . 1 1 17 17 PHE N N 17 123.900 123.900 119.999 3.901 18327
3868 1 15 . 1 1 17 17 PHE HA H 17 4.740 4.740 4.930 -0.190 18327
3869 1 15 . 1 1 17 17 PHE CA C 17 56.230 56.230 55.541 0.689 18327
3870 1 15 . 1 1 17 17 PHE CB C 17 40.000 40.000 39.036 0.964 18327
3871 1 15 . 1 1 17 17 PHE H H 17 8.785 8.785 7.997 0.788 18327
3872 1 15 . 1 1 18 18 TYR N N 18 118.100 118.100 119.664 -1.564 18327
3873 1 15 . 1 1 18 18 TYR HA H 18 4.490 4.490 4.435 0.055 18327
3874 1 15 . 1 1 18 18 TYR CA C 18 55.300 55.300 56.924 -1.624 18327
3875 1 15 . 1 1 18 18 TYR CB C 18 42.810 42.810 41.379 1.431 18327
3876 1 15 . 1 1 18 18 TYR H H 18 7.288 7.288 7.229 0.059 18327
3877 1 15 . 1 1 19 19 ASN N N 19 116.800 116.800 121.659 -4.859 18327
3878 1 15 . 1 1 19 19 ASN HA H 19 4.710 4.710 4.716 -0.006 18327
3879 1 15 . 1 1 19 19 ASN CA C 19 52.940 52.940 53.860 -0.920 18327
3880 1 15 . 1 1 19 19 ASN CB C 19 39.060 39.060 39.239 -0.179 18327
3881 1 15 . 1 1 19 19 ASN H H 19 8.122 8.122 8.675 -0.553 18327
3882 1 15 . 1 1 20 20 TYR N N 20 122.000 122.000 124.309 -2.309 18327
3883 1 15 . 1 1 20 20 TYR HA H 20 4.710 4.710 4.705 0.005 18327
3884 1 15 . 1 1 20 20 TYR CA C 20 57.720 57.720 57.890 -0.170 18327
3885 1 15 . 1 1 20 20 TYR CB C 20 42.250 42.250 42.720 -0.470 18327
3886 1 15 . 1 1 20 20 TYR H H 20 8.994 8.994 8.479 0.515 18327
3887 1 15 . 1 1 21 21 ASP N N 21 128.500 128.500 121.690 6.810 18327
3888 1 15 . 1 1 21 21 ASP HA H 21 4.790 4.790 4.937 -0.147 18327
3889 1 15 . 1 1 21 21 ASP CA C 21 52.370 52.370 52.382 -0.012 18327
3890 1 15 . 1 1 21 21 ASP CB C 21 41.130 41.130 43.932 -2.802 18327
3891 1 15 . 1 1 21 21 ASP H H 21 7.839 7.839 7.603 0.236 18327
3892 1 15 . 1 1 22 22 ALA N N 22 125.200 125.200 123.391 1.809 18327
3893 1 15 . 1 1 22 22 ALA HA H 22 4.050 4.050 4.452 -0.402 18327
3894 1 15 . 1 1 22 22 ALA CA C 22 52.940 52.940 52.885 0.055 18327
3895 1 15 . 1 1 22 22 ALA CB C 22 20.450 20.450 19.478 0.972 18327
3896 1 15 . 1 1 22 22 ALA H H 22 8.107 8.107 8.404 -0.297 18327
3897 1 15 . 1 1 23 23 ARG N N 23 122.200 122.200 123.036 -0.836 18327
3898 1 15 . 1 1 23 23 ARG HA H 23 4.350 4.350 4.195 0.155 18327
3899 1 15 . 1 1 23 23 ARG CA C 23 55.490 55.490 57.182 -1.692 18327
3900 1 15 . 1 1 23 23 ARG CB C 23 30.700 30.700 30.554 0.146 18327
3901 1 15 . 1 1 23 23 ARG H H 23 8.889 8.889 8.621 0.268 18327
3902 1 15 . 1 1 24 24 GLY N N 24 105.200 105.200 106.273 -1.073 18327
3903 1 15 . 1 1 24 24 GLY CA C 24 44.500 44.500 43.816 0.684 18327
3904 1 15 . 1 1 24 24 GLY H H 24 7.267 7.267 7.673 -0.406 18327
3905 1 15 . 1 1 25 25 ALA N N 25 122.200 122.200 121.598 0.602 18327
3906 1 15 . 1 1 25 25 ALA HA H 25 4.160 4.160 4.252 -0.092 18327
3907 1 15 . 1 1 25 25 ALA CA C 25 54.440 54.440 53.937 0.503 18327
3908 1 15 . 1 1 25 25 ALA CB C 25 18.770 18.770 19.081 -0.311 18327
3909 1 15 . 1 1 25 25 ALA H H 25 8.621 8.621 8.411 0.210 18327
3910 1 15 . 1 1 26 26 ASP N N 26 114.700 114.700 120.133 -5.433 18327
3911 1 15 . 1 1 26 26 ASP HA H 26 4.700 4.700 4.716 -0.016 18327
3912 1 15 . 1 1 26 26 ASP CA C 26 53.870 53.870 54.095 -0.225 18327
3913 1 15 . 1 1 26 26 ASP CB C 26 40.390 40.390 40.265 0.125 18327
3914 1 15 . 1 1 26 26 ASP H H 26 8.949 8.949 8.528 0.421 18327
3915 1 15 . 1 1 27 27 GLU N N 27 118.800 118.800 118.479 0.321 18327
3916 1 15 . 1 1 27 27 GLU HA H 27 5.220 5.220 4.616 0.604 18327
3917 1 15 . 1 1 27 27 GLU CA C 27 54.930 54.930 55.043 -0.113 18327
3918 1 15 . 1 1 27 27 GLU CB C 27 32.880 32.880 32.122 0.758 18327
3919 1 15 . 1 1 27 27 GLU H H 27 7.542 7.542 7.556 -0.014 18327
3920 1 15 . 1 1 28 28 LEU N N 28 121.400 121.400 120.667 0.733 18327
3921 1 15 . 1 1 28 28 LEU HA H 28 4.760 4.760 4.689 0.071 18327
3922 1 15 . 1 1 28 28 LEU CA C 28 53.120 53.120 54.483 -1.363 18327
3923 1 15 . 1 1 28 28 LEU CB C 28 44.500 44.500 45.266 -0.766 18327
3924 1 15 . 1 1 28 28 LEU H H 28 8.897 8.897 8.342 0.555 18327
3925 1 15 . 1 1 29 29 SER N N 29 115.700 115.700 119.216 -3.516 18327
3926 1 15 . 1 1 29 29 SER HA H 29 5.030 5.030 4.355 0.675 18327
3927 1 15 . 1 1 29 29 SER CA C 29 58.470 58.470 59.763 -1.293 18327
3928 1 15 . 1 1 29 29 SER CB C 29 63.690 63.690 63.825 -0.136 18327
3929 1 15 . 1 1 29 29 SER H H 29 7.949 7.949 8.433 -0.484 18327
3930 1 15 . 1 1 30 30 LEU N N 30 121.300 121.300 119.080 2.220 18327
3931 1 15 . 1 1 30 30 LEU HA H 30 4.800 4.800 4.640 0.160 18327
3932 1 15 . 1 1 30 30 LEU CA C 30 52.940 52.940 55.424 -2.484 18327
3933 1 15 . 1 1 30 30 LEU CB C 30 46.370 46.370 45.629 0.741 18327
3934 1 15 . 1 1 30 30 LEU H H 30 9.503 9.503 8.393 1.110 18327
3935 1 15 . 1 1 31 31 GLN N N 31 123.100 123.100 119.287 3.813 18327
3936 1 15 . 1 1 31 31 GLN HA H 31 5.070 5.070 4.721 0.349 18327
3937 1 15 . 1 1 31 31 GLN CA C 31 52.940 52.940 54.348 -1.408 18327
3938 1 15 . 1 1 31 31 GLN CB C 31 31.190 31.190 33.150 -1.960 18327
3939 1 15 . 1 1 31 31 GLN H H 31 9.152 9.152 8.402 0.750 18327
3940 1 15 . 1 1 32 32 ILE N N 32 120.800 120.800 120.419 0.381 18327
3941 1 15 . 1 1 32 32 ILE HA H 32 3.030 3.030 4.029 -0.999 18327
3942 1 15 . 1 1 32 32 ILE CA C 32 64.250 64.250 62.303 1.947 18327
3943 1 15 . 1 1 32 32 ILE CB C 32 37.940 37.940 37.746 0.194 18327
3944 1 15 . 1 1 32 32 ILE H H 32 8.019 8.019 8.676 -0.657 18327
3945 1 15 . 1 1 33 33 GLY N N 33 115.700 115.700 114.717 0.983 18327
3946 1 15 . 1 1 33 33 GLY CA C 33 44.500 44.500 45.022 -0.522 18327
3947 1 15 . 1 1 33 33 GLY H H 33 8.777 8.777 9.115 -0.338 18327
3948 1 15 . 1 1 34 34 ASP N N 34 122.300 122.300 120.661 1.639 18327
3949 1 15 . 1 1 34 34 ASP HA H 34 4.640 4.640 4.906 -0.266 18327
3950 1 15 . 1 1 34 34 ASP CA C 34 55.860 55.860 53.083 2.777 18327
3951 1 15 . 1 1 34 34 ASP CB C 34 41.310 41.310 42.798 -1.488 18327
3952 1 15 . 1 1 34 34 ASP H H 34 8.690 8.690 7.638 1.052 18327
3953 1 15 . 1 1 35 35 THR N N 35 117.900 117.900 115.424 2.476 18327
3954 1 15 . 1 1 35 35 THR HA H 35 5.160 5.160 5.295 -0.135 18327
3955 1 15 . 1 1 35 35 THR CA C 35 61.450 61.450 61.281 0.169 18327
3956 1 15 . 1 1 35 35 THR CB C 35 69.090 69.090 71.183 -2.093 18327
3957 1 15 . 1 1 35 35 THR H H 35 8.389 8.389 8.208 0.181 18327
3958 1 15 . 1 1 36 36 VAL N N 36 118.200 118.200 117.679 0.521 18327
3959 1 15 . 1 1 36 36 VAL HA H 36 5.100 5.100 4.363 0.737 18327
3960 1 15 . 1 1 36 36 VAL CA C 36 57.910 57.910 60.749 -2.839 18327
3961 1 15 . 1 1 36 36 VAL CB C 36 34.190 34.190 35.075 -0.885 18327
3962 1 15 . 1 1 36 36 VAL H H 36 9.019 9.019 9.074 -0.055 18327
3963 1 15 . 1 1 37 37 HIS N N 37 122.100 122.100 119.330 2.770 18327
3964 1 15 . 1 1 37 37 HIS HA H 37 4.840 4.840 4.976 -0.136 18327
3965 1 15 . 1 1 37 37 HIS CA C 37 52.560 52.560 54.035 -1.475 18327
3966 1 15 . 1 1 37 37 HIS CB C 37 31.260 31.260 33.334 -2.074 18327
3967 1 15 . 1 1 37 37 HIS H H 37 8.489 8.489 8.695 -0.206 18327
3968 1 15 . 1 1 38 38 ILE N N 38 126.400 126.400 126.459 -0.059 18327
3969 1 15 . 1 1 38 38 ILE HA H 38 3.780 3.780 4.571 -0.791 18327
3970 1 15 . 1 1 38 38 ILE CA C 38 61.640 61.640 61.027 0.613 18327
3971 1 15 . 1 1 38 38 ILE CB C 38 38.880 38.880 38.843 0.037 18327
3972 1 15 . 1 1 38 38 ILE H H 38 8.636 8.636 8.868 -0.232 18327
3973 1 15 . 1 1 39 39 LEU N N 39 126.000 126.000 126.320 -0.320 18327
3974 1 15 . 1 1 39 39 LEU HA H 39 4.400 4.400 4.850 -0.450 18327
3975 1 15 . 1 1 39 39 LEU CA C 39 55.490 55.490 55.057 0.433 18327
3976 1 15 . 1 1 39 39 LEU CB C 39 43.750 43.750 43.881 -0.131 18327
3977 1 15 . 1 1 39 39 LEU H H 39 9.162 9.162 8.937 0.226 18327
3978 1 15 . 1 1 40 40 GLU N N 40 115.100 115.100 117.356 -2.256 18327
3979 1 15 . 1 1 40 40 GLU HA H 40 7.895 7.895 4.726 3.169 18327
3980 1 15 . 1 1 41 41 THR N N 41 116.400 116.400 111.560 4.840 18327
3981 1 15 . 1 1 41 41 THR HA H 41 4.270 4.270 4.793 -0.523 18327
3982 1 15 . 1 1 41 41 THR CA C 41 60.890 60.890 60.863 0.027 18327
3983 1 15 . 1 1 41 41 THR CB C 41 69.650 69.650 70.578 -0.928 18327
3984 1 15 . 1 1 41 41 THR H H 41 8.162 8.162 8.421 -0.259 18327
3985 1 15 . 1 1 43 43 GLU N N 43 123.300 123.300 120.706 2.594 18327
3986 1 15 . 1 1 43 43 GLU HA H 43 4.270 4.270 4.232 0.038 18327
3987 1 15 . 1 1 43 43 GLU CA C 43 57.350 57.350 56.172 1.178 18327
3988 1 15 . 1 1 43 43 GLU CB C 43 26.790 26.790 29.571 -2.781 18327
3989 1 15 . 1 1 43 43 GLU H H 43 8.108 8.108 8.392 -0.284 18327
3990 1 15 . 1 1 44 44 GLY CA C 44 45.440 45.440 44.934 0.505 18327
3991 1 15 . 1 1 45 45 TRP N N 45 124.100 124.100 120.820 3.280 18327
3992 1 15 . 1 1 45 45 TRP HA H 45 4.690 4.690 4.397 0.293 18327
3993 1 15 . 1 1 45 45 TRP H H 45 8.590 8.590 7.429 1.161 18327
3994 1 15 . 1 1 46 46 TYR HA H 46 5.600 5.600 4.618 0.982 18327
3995 1 15 . 1 1 46 46 TYR CA C 46 54.060 54.060 57.072 -3.012 18327
3996 1 15 . 1 1 46 46 TYR CB C 46 42.060 42.060 41.618 0.442 18327
3997 1 15 . 1 1 47 47 ARG N N 47 118.100 118.100 122.127 -4.027 18327
3998 1 15 . 1 1 47 47 ARG HA H 47 5.070 5.070 5.262 -0.192 18327
3999 1 15 . 1 1 47 47 ARG CA C 47 54.060 54.060 53.772 0.289 18327
4000 1 15 . 1 1 47 47 ARG CB C 47 33.250 33.250 34.930 -1.680 18327
4001 1 15 . 1 1 47 47 ARG H H 47 8.495 8.495 9.158 -0.663 18327
4002 1 15 . 1 1 48 48 GLY N N 48 114.000 114.000 112.995 1.005 18327
4003 1 15 . 1 1 48 48 GLY CA C 48 46.560 46.560 46.176 0.384 18327
4004 1 15 . 1 1 48 48 GLY H H 48 9.183 9.183 9.077 0.106 18327
4005 1 15 . 1 1 49 49 TYR N N 49 116.200 116.200 116.201 -0.001 18327
4006 1 15 . 1 1 49 49 TYR HA H 49 5.380 5.380 5.091 0.289 18327
4007 1 15 . 1 1 49 49 TYR CA C 49 55.110 55.110 57.088 -1.978 18327
4008 1 15 . 1 1 49 49 TYR CB C 49 40.750 40.750 39.356 1.394 18327
4009 1 15 . 1 1 49 49 TYR H H 49 8.199 8.199 8.454 -0.255 18327
4010 1 15 . 1 1 50 50 THR N N 50 112.200 112.200 111.076 1.124 18327
4011 1 15 . 1 1 50 50 THR HA H 50 5.120 5.120 4.300 0.820 18327
4012 1 15 . 1 1 50 50 THR CA C 50 59.770 59.770 61.416 -1.646 18327
4013 1 15 . 1 1 50 50 THR CB C 50 69.460 69.460 69.981 -0.521 18327
4014 1 15 . 1 1 50 50 THR H H 50 9.436 9.436 8.163 1.273 18327
4015 1 15 . 1 1 51 51 LEU N N 51 121.300 121.300 120.133 1.167 18327
4016 1 15 . 1 1 51 51 LEU HA H 51 4.230 4.230 4.361 -0.131 18327
4017 1 15 . 1 1 51 51 LEU CA C 51 56.790 56.790 56.107 0.683 18327
4018 1 15 . 1 1 51 51 LEU CB C 51 40.000 40.000 42.128 -2.128 18327
4019 1 15 . 1 1 51 51 LEU H H 51 8.313 8.313 8.117 0.196 18327
4020 1 15 . 1 1 52 52 ARG N N 52 116.600 116.600 118.232 -1.632 18327
4021 1 15 . 1 1 52 52 ARG HA H 52 4.250 4.250 4.155 0.095 18327
4022 1 15 . 1 1 52 52 ARG CA C 52 57.350 57.350 57.736 -0.386 18327
4023 1 15 . 1 1 52 52 ARG CB C 52 30.510 30.510 30.866 -0.356 18327
4024 1 15 . 1 1 52 52 ARG H H 52 8.053 8.053 7.599 0.454 18327
4025 1 15 . 1 1 53 53 LYS N N 53 122.600 122.600 117.229 5.371 18327
4026 1 15 . 1 1 53 53 LYS HA H 53 4.620 4.620 4.468 0.152 18327
4027 1 15 . 1 1 53 53 LYS CA C 53 54.620 54.620 55.580 -0.960 18327
4028 1 15 . 1 1 53 53 LYS CB C 53 32.310 32.310 32.281 0.030 18327
4029 1 15 . 1 1 53 53 LYS H H 53 7.655 7.655 7.833 -0.178 18327
4030 1 15 . 1 1 54 54 LYS N N 54 124.900 124.900 123.637 1.263 18327
4031 1 15 . 1 1 54 54 LYS HA H 54 4.090 4.090 4.254 -0.164 18327
4032 1 15 . 1 1 54 54 LYS CA C 54 58.470 58.470 58.534 -0.064 18327
4033 1 15 . 1 1 54 54 LYS CB C 54 32.130 32.130 32.423 -0.293 18327
4034 1 15 . 1 1 54 54 LYS H H 54 8.499 8.499 8.736 -0.237 18327
4035 1 15 . 1 1 55 55 SER N N 55 110.100 110.100 114.290 -4.190 18327
4036 1 15 . 1 1 55 55 SER HA H 55 4.140 4.140 4.318 -0.178 18327
4037 1 15 . 1 1 55 55 SER CA C 55 58.470 58.470 60.628 -2.158 18327
4038 1 15 . 1 1 55 55 SER CB C 55 63.310 63.310 63.296 0.014 18327
4039 1 15 . 1 1 55 55 SER H H 55 7.862 7.862 8.268 -0.406 18327
4040 1 15 . 1 1 56 56 LYS N N 56 124.000 124.000 123.103 0.897 18327
4041 1 15 . 1 1 56 56 LYS HA H 56 4.700 4.700 4.288 0.412 18327
4042 1 15 . 1 1 56 56 LYS CA C 56 54.810 54.810 55.755 -0.945 18327
4043 1 15 . 1 1 56 56 LYS CB C 56 33.250 33.250 31.506 1.744 18327
4044 1 15 . 1 1 56 56 LYS H H 56 7.481 7.481 8.258 -0.777 18327
4045 1 15 . 1 1 57 57 LYS N N 57 125.700 125.700 122.414 3.286 18327
4046 1 15 . 1 1 57 57 LYS HA H 57 5.330 5.330 4.514 0.816 18327
4047 1 15 . 1 1 57 57 LYS CA C 57 54.620 54.620 55.669 -1.049 18327
4048 1 15 . 1 1 57 57 LYS CB C 57 34.240 34.240 34.549 -0.309 18327
4049 1 15 . 1 1 57 57 LYS H H 57 8.475 8.475 7.669 0.806 18327
4050 1 15 . 1 1 58 58 GLY N N 58 109.400 109.400 107.428 1.972 18327
4051 1 15 . 1 1 58 58 GLY CA C 58 45.620 45.620 45.376 0.244 18327
4052 1 15 . 1 1 58 58 GLY H H 58 9.073 9.073 8.631 0.442 18327
4053 1 15 . 1 1 59 59 ILE N N 59 113.900 113.900 117.878 -3.978 18327
4054 1 15 . 1 1 59 59 ILE HA H 59 6.000 6.000 5.355 0.645 18327
4055 1 15 . 1 1 59 59 ILE CA C 59 59.590 59.590 58.126 1.464 18327
4056 1 15 . 1 1 59 59 ILE CB C 59 41.140 41.140 42.364 -1.224 18327
4057 1 15 . 1 1 59 59 ILE H H 59 8.628 8.628 8.167 0.461 18327
4058 1 15 . 1 1 60 60 PHE N N 60 116.900 116.900 113.847 3.053 18327
4059 1 15 . 1 1 60 60 PHE HA H 60 5.120 5.120 5.176 -0.056 18327
4060 1 15 . 1 1 60 60 PHE CA C 60 54.060 54.060 55.510 -1.450 18327
4061 1 15 . 1 1 60 60 PHE CB C 60 37.190 37.190 39.462 -2.272 18327
4062 1 15 . 1 1 60 60 PHE H H 60 8.724 8.724 8.580 0.144 18327
4063 1 15 . 1 1 61 61 PRO HA H 61 3.480 3.480 3.830 -0.350 18327
4064 1 15 . 1 1 61 61 PRO CA C 61 62.200 62.200 62.054 0.146 18327
4065 1 15 . 1 1 61 61 PRO CB C 61 31.190 31.190 31.151 0.039 18327
4066 1 15 . 1 1 62 62 ALA N N 62 124.600 124.600 127.407 -2.807 18327
4067 1 15 . 1 1 62 62 ALA HA H 62 3.720 3.720 4.489 -0.769 18327
4068 1 15 . 1 1 62 62 ALA CA C 62 54.370 54.370 55.339 -0.969 18327
4069 1 15 . 1 1 62 62 ALA CB C 62 17.650 17.650 18.321 -0.671 18327
4070 1 15 . 1 1 62 62 ALA H H 62 7.898 7.898 8.656 -0.758 18327
4071 1 15 . 1 1 63 63 SER N N 63 109.700 109.700 111.640 -1.940 18327
4072 1 15 . 1 1 63 63 SER HA H 63 4.200 4.200 4.459 -0.259 18327
4073 1 15 . 1 1 63 63 SER CA C 63 59.400 59.400 60.210 -0.810 18327
4074 1 15 . 1 1 63 63 SER CB C 63 62.380 62.380 62.695 -0.315 18327
4075 1 15 . 1 1 63 63 SER H H 63 8.030 8.030 8.363 -0.333 18327
4076 1 15 . 1 1 64 64 TYR N N 64 120.300 120.300 118.878 1.422 18327
4077 1 15 . 1 1 64 64 TYR HA H 64 4.260 4.260 3.927 0.333 18327
4078 1 15 . 1 1 64 64 TYR CA C 64 57.720 57.720 59.943 -2.223 18327
4079 1 15 . 1 1 64 64 TYR CB C 64 37.560 37.560 39.135 -1.575 18327
4080 1 15 . 1 1 64 64 TYR H H 64 7.124 7.124 7.243 -0.119 18327
4081 1 15 . 1 1 65 65 ILE N N 65 118.000 118.000 116.357 1.643 18327
4082 1 15 . 1 1 65 65 ILE HA H 65 4.830 4.830 4.762 0.068 18327
4083 1 15 . 1 1 65 65 ILE CA C 65 56.980 56.980 60.008 -3.028 18327
4084 1 15 . 1 1 65 65 ILE CB C 65 39.630 39.630 40.180 -0.550 18327
4085 1 15 . 1 1 65 65 ILE H H 65 7.671 7.671 7.345 0.326 18327
4086 1 15 . 1 1 66 66 HIS N N 66 124.500 124.500 126.127 -1.627 18327
4087 1 15 . 1 1 66 66 HIS HA H 66 5.130 5.130 5.126 0.004 18327
4088 1 15 . 1 1 66 66 HIS CA C 66 53.060 53.060 54.736 -1.676 18327
4089 1 15 . 1 1 66 66 HIS CB C 66 30.510 30.510 33.146 -2.636 18327
4090 1 15 . 1 1 66 66 HIS H H 66 9.159 9.159 9.256 -0.097 18327
4091 1 15 . 1 1 67 67 LEU N N 67 127.400 127.400 126.592 0.808 18327
4092 1 15 . 1 1 67 67 LEU HA H 67 4.560 4.560 4.849 -0.289 18327
4093 1 15 . 1 1 67 67 LEU CA C 67 55.300 55.300 55.498 -0.198 18327
4094 1 15 . 1 1 67 67 LEU CB C 67 42.060 42.060 43.013 -0.952 18327
4095 1 15 . 1 1 67 67 LEU H H 67 8.979 8.979 8.734 0.245 18327
4096 1 15 . 1 1 68 68 LYS N N 68 121.900 121.900 123.734 -1.834 18327
4097 1 15 . 1 1 68 68 LYS HA H 68 4.490 4.490 4.407 0.083 18327
4098 1 15 . 1 1 68 68 LYS CA C 68 55.110 55.110 55.270 -0.160 18327
4099 1 15 . 1 1 68 68 LYS CB C 68 34.610 34.610 34.720 -0.110 18327
4100 1 15 . 1 1 68 68 LYS H H 68 8.499 8.499 8.987 -0.488 18327
4101 1 15 . 1 1 69 69 GLU N N 69 122.100 122.100 124.714 -2.614 18327
4102 1 15 . 1 1 69 69 GLU HA H 69 4.290 4.290 4.087 0.203 18327
4103 1 15 . 1 1 69 69 GLU CA C 69 56.610 56.610 57.957 -1.347 18327
4104 1 15 . 1 1 69 69 GLU CB C 69 30.330 30.330 29.951 0.379 18327
4105 1 15 . 1 1 69 69 GLU H H 69 8.569 8.569 8.453 0.116 18327
4106 1 15 . 1 1 70 70 ALA N N 70 123.300 123.300 126.714 -3.414 18327
4107 1 15 . 1 1 70 70 ALA HA H 70 4.210 4.210 4.060 0.150 18327
4108 1 15 . 1 1 70 70 ALA CA C 70 51.810 51.810 52.909 -1.099 18327
4109 1 15 . 1 1 70 70 ALA CB C 70 19.700 19.700 18.573 1.127 18327
4110 1 15 . 1 1 70 70 ALA H H 70 8.181 8.181 8.434 -0.253 18327
4111 1 15 . 1 1 71 71 ILE N N 71 120.000 120.000 121.447 -1.447 18327
4112 1 15 . 1 1 71 71 ILE HA H 71 4.070 4.070 4.244 -0.174 18327
4113 1 15 . 1 1 71 71 ILE CA C 71 60.330 60.330 60.159 0.171 18327
4114 1 15 . 1 1 71 71 ILE CB C 71 38.690 38.690 39.966 -1.276 18327
4115 1 15 . 1 1 71 71 ILE H H 71 7.789 7.789 8.293 -0.504 18327
4116 1 15 . 1 1 72 72 VAL N N 72 124.400 124.400 121.324 3.076 18327
4117 1 15 . 1 1 72 72 VAL HA H 72 4.070 4.070 4.304 -0.234 18327
4118 1 15 . 1 1 72 72 VAL CA C 72 61.640 61.640 61.490 0.149 18327
4119 1 15 . 1 1 72 72 VAL CB C 72 32.690 32.690 32.272 0.418 18327
4120 1 15 . 1 1 72 72 VAL H H 72 8.089 8.089 8.296 -0.207 18327
4121 1 15 . 1 1 73 73 GLU N N 73 125.940 125.940 124.568 1.372 18327
4122 1 15 . 1 1 73 73 GLU HA H 73 4.300 4.300 4.454 -0.154 18327
4123 1 15 . 1 1 73 73 GLU CA C 73 56.610 56.610 56.503 0.107 18327
4124 1 15 . 1 1 73 73 GLU CB C 73 30.710 30.710 30.862 -0.152 18327
4125 1 15 . 1 1 73 73 GLU H H 73 8.464 8.464 8.542 -0.078 18327
4126 1 16 . 1 1 13 13 TYR HA H 13 5.560 5.560 4.558 1.002 18327
4127 1 16 . 1 1 13 13 TYR CA C 13 55.860 55.860 55.651 0.209 18327
4128 1 16 . 1 1 13 13 TYR CB C 13 42.440 42.440 40.328 2.112 18327
4129 1 16 . 1 1 14 14 GLY N N 14 105.400 105.400 106.149 -0.749 18327
4130 1 16 . 1 1 14 14 GLY CA C 14 45.240 45.240 43.734 1.506 18327
4131 1 16 . 1 1 14 14 GLY H H 14 8.406 8.406 8.493 -0.087 18327
4132 1 16 . 1 1 15 15 VAL N N 15 118.900 118.900 121.659 -2.759 18327
4133 1 16 . 1 1 15 15 VAL HA H 15 5.330 5.330 4.966 0.364 18327
4134 1 16 . 1 1 15 15 VAL CA C 15 59.210 59.210 59.625 -0.415 18327
4135 1 16 . 1 1 15 15 VAL CB C 15 35.740 35.740 35.338 0.402 18327
4136 1 16 . 1 1 15 15 VAL H H 15 8.854 8.854 8.167 0.687 18327
4137 1 16 . 1 1 16 16 ALA N N 16 129.400 129.400 129.546 -0.146 18327
4138 1 16 . 1 1 16 16 ALA HA H 16 5.000 5.000 4.778 0.222 18327
4139 1 16 . 1 1 16 16 ALA CA C 16 52.000 52.000 51.666 0.334 18327
4140 1 16 . 1 1 16 16 ALA CB C 16 19.330 19.330 20.278 -0.948 18327
4141 1 16 . 1 1 16 16 ALA H H 16 9.112 9.112 9.066 0.046 18327
4142 1 16 . 1 1 17 17 PHE N N 17 123.900 123.900 123.762 0.138 18327
4143 1 16 . 1 1 17 17 PHE HA H 17 4.740 4.740 4.605 0.135 18327
4144 1 16 . 1 1 17 17 PHE CA C 17 56.230 56.230 57.163 -0.933 18327
4145 1 16 . 1 1 17 17 PHE CB C 17 40.000 40.000 40.756 -0.756 18327
4146 1 16 . 1 1 17 17 PHE H H 17 8.785 8.785 8.579 0.206 18327
4147 1 16 . 1 1 18 18 TYR N N 18 118.100 118.100 118.803 -0.703 18327
4148 1 16 . 1 1 18 18 TYR HA H 18 4.490 4.490 4.465 0.025 18327
4149 1 16 . 1 1 18 18 TYR CA C 18 55.300 55.300 57.549 -2.249 18327
4150 1 16 . 1 1 18 18 TYR CB C 18 42.810 42.810 41.111 1.699 18327
4151 1 16 . 1 1 18 18 TYR H H 18 7.288 7.288 7.721 -0.433 18327
4152 1 16 . 1 1 19 19 ASN N N 19 116.800 116.800 121.720 -4.920 18327
4153 1 16 . 1 1 19 19 ASN HA H 19 4.710 4.710 5.135 -0.425 18327
4154 1 16 . 1 1 19 19 ASN CA C 19 52.940 52.940 52.919 0.021 18327
4155 1 16 . 1 1 19 19 ASN CB C 19 39.060 39.060 38.001 1.059 18327
4156 1 16 . 1 1 19 19 ASN H H 19 8.122 8.122 8.808 -0.686 18327
4157 1 16 . 1 1 20 20 TYR N N 20 122.000 122.000 124.413 -2.413 18327
4158 1 16 . 1 1 20 20 TYR HA H 20 4.710 4.710 4.665 0.045 18327
4159 1 16 . 1 1 20 20 TYR CA C 20 57.720 57.720 58.347 -0.627 18327
4160 1 16 . 1 1 20 20 TYR CB C 20 42.250 42.250 41.762 0.488 18327
4161 1 16 . 1 1 20 20 TYR H H 20 8.994 8.994 8.513 0.481 18327
4162 1 16 . 1 1 21 21 ASP N N 21 128.500 128.500 122.063 6.437 18327
4163 1 16 . 1 1 21 21 ASP HA H 21 4.790 4.790 4.834 -0.044 18327
4164 1 16 . 1 1 21 21 ASP CA C 21 52.370 52.370 52.774 -0.404 18327
4165 1 16 . 1 1 21 21 ASP CB C 21 41.130 41.130 44.421 -3.291 18327
4166 1 16 . 1 1 21 21 ASP H H 21 7.839 7.839 7.495 0.344 18327
4167 1 16 . 1 1 22 22 ALA N N 22 125.200 125.200 123.106 2.094 18327
4168 1 16 . 1 1 22 22 ALA HA H 22 4.050 4.050 4.739 -0.689 18327
4169 1 16 . 1 1 22 22 ALA CA C 22 52.940 52.940 51.924 1.016 18327
4170 1 16 . 1 1 22 22 ALA CB C 22 20.450 20.450 19.313 1.137 18327
4171 1 16 . 1 1 22 22 ALA H H 22 8.107 8.107 8.437 -0.330 18327
4172 1 16 . 1 1 23 23 ARG N N 23 122.200 122.200 125.721 -3.521 18327
4173 1 16 . 1 1 23 23 ARG HA H 23 4.350 4.350 4.257 0.093 18327
4174 1 16 . 1 1 23 23 ARG CA C 23 55.490 55.490 56.926 -1.437 18327
4175 1 16 . 1 1 23 23 ARG CB C 23 30.700 30.700 30.771 -0.071 18327
4176 1 16 . 1 1 23 23 ARG H H 23 8.889 8.889 8.921 -0.032 18327
4177 1 16 . 1 1 24 24 GLY N N 24 105.200 105.200 105.915 -0.715 18327
4178 1 16 . 1 1 24 24 GLY CA C 24 44.500 44.500 43.868 0.632 18327
4179 1 16 . 1 1 24 24 GLY H H 24 7.267 7.267 7.654 -0.387 18327
4180 1 16 . 1 1 25 25 ALA N N 25 122.200 122.200 121.224 0.976 18327
4181 1 16 . 1 1 25 25 ALA HA H 25 4.160 4.160 4.249 -0.089 18327
4182 1 16 . 1 1 25 25 ALA CA C 25 54.440 54.440 53.802 0.638 18327
4183 1 16 . 1 1 25 25 ALA CB C 25 18.770 18.770 18.939 -0.169 18327
4184 1 16 . 1 1 25 25 ALA H H 25 8.621 8.621 8.400 0.221 18327
4185 1 16 . 1 1 26 26 ASP N N 26 114.700 114.700 116.436 -1.736 18327
4186 1 16 . 1 1 26 26 ASP HA H 26 4.700 4.700 4.569 0.131 18327
4187 1 16 . 1 1 26 26 ASP CA C 26 53.870 53.870 53.462 0.408 18327
4188 1 16 . 1 1 26 26 ASP CB C 26 40.390 40.390 40.115 0.275 18327
4189 1 16 . 1 1 26 26 ASP H H 26 8.949 8.949 8.383 0.566 18327
4190 1 16 . 1 1 27 27 GLU N N 27 118.800 118.800 118.912 -0.112 18327
4191 1 16 . 1 1 27 27 GLU HA H 27 5.220 5.220 5.003 0.217 18327
4192 1 16 . 1 1 27 27 GLU CA C 27 54.930 54.930 55.188 -0.258 18327
4193 1 16 . 1 1 27 27 GLU CB C 27 32.880 32.880 32.940 -0.060 18327
4194 1 16 . 1 1 27 27 GLU H H 27 7.542 7.542 7.689 -0.147 18327
4195 1 16 . 1 1 28 28 LEU N N 28 121.400 121.400 120.618 0.782 18327
4196 1 16 . 1 1 28 28 LEU HA H 28 4.760 4.760 4.733 0.027 18327
4197 1 16 . 1 1 28 28 LEU CA C 28 53.120 53.120 54.664 -1.544 18327
4198 1 16 . 1 1 28 28 LEU CB C 28 44.500 44.500 45.480 -0.980 18327
4199 1 16 . 1 1 28 28 LEU H H 28 8.897 8.897 8.158 0.739 18327
4200 1 16 . 1 1 29 29 SER N N 29 115.700 115.700 119.379 -3.679 18327
4201 1 16 . 1 1 29 29 SER HA H 29 5.030 5.030 4.536 0.494 18327
4202 1 16 . 1 1 29 29 SER CA C 29 58.470 58.470 59.784 -1.314 18327
4203 1 16 . 1 1 29 29 SER CB C 29 63.690 63.690 63.792 -0.102 18327
4204 1 16 . 1 1 29 29 SER H H 29 7.949 7.949 8.459 -0.510 18327
4205 1 16 . 1 1 30 30 LEU N N 30 121.300 121.300 122.021 -0.721 18327
4206 1 16 . 1 1 30 30 LEU HA H 30 4.800 4.800 4.667 0.133 18327
4207 1 16 . 1 1 30 30 LEU CA C 30 52.940 52.940 55.156 -2.216 18327
4208 1 16 . 1 1 30 30 LEU CB C 30 46.370 46.370 45.847 0.523 18327
4209 1 16 . 1 1 30 30 LEU H H 30 9.503 9.503 8.807 0.696 18327
4210 1 16 . 1 1 31 31 GLN N N 31 123.100 123.100 122.147 0.953 18327
4211 1 16 . 1 1 31 31 GLN HA H 31 5.070 5.070 4.920 0.150 18327
4212 1 16 . 1 1 31 31 GLN CA C 31 52.940 52.940 54.036 -1.096 18327
4213 1 16 . 1 1 31 31 GLN CB C 31 31.190 31.190 32.305 -1.115 18327
4214 1 16 . 1 1 31 31 GLN H H 31 9.152 9.152 8.341 0.811 18327
4215 1 16 . 1 1 32 32 ILE N N 32 120.800 120.800 120.515 0.285 18327
4216 1 16 . 1 1 32 32 ILE HA H 32 3.030 3.030 3.766 -0.736 18327
4217 1 16 . 1 1 32 32 ILE CA C 32 64.250 64.250 62.405 1.845 18327
4218 1 16 . 1 1 32 32 ILE CB C 32 37.940 37.940 37.475 0.465 18327
4219 1 16 . 1 1 32 32 ILE H H 32 8.019 8.019 8.142 -0.123 18327
4220 1 16 . 1 1 33 33 GLY N N 33 115.700 115.700 113.934 1.766 18327
4221 1 16 . 1 1 33 33 GLY CA C 33 44.500 44.500 44.950 -0.450 18327
4222 1 16 . 1 1 33 33 GLY H H 33 8.777 8.777 8.586 0.191 18327
4223 1 16 . 1 1 34 34 ASP N N 34 122.300 122.300 121.467 0.833 18327
4224 1 16 . 1 1 34 34 ASP HA H 34 4.640 4.640 5.001 -0.361 18327
4225 1 16 . 1 1 34 34 ASP CA C 34 55.860 55.860 53.902 1.958 18327
4226 1 16 . 1 1 34 34 ASP CB C 34 41.310 41.310 42.028 -0.717 18327
4227 1 16 . 1 1 34 34 ASP H H 34 8.690 8.690 7.626 1.064 18327
4228 1 16 . 1 1 35 35 THR N N 35 117.900 117.900 114.662 3.238 18327
4229 1 16 . 1 1 35 35 THR HA H 35 5.160 5.160 5.317 -0.157 18327
4230 1 16 . 1 1 35 35 THR CA C 35 61.450 61.450 60.839 0.611 18327
4231 1 16 . 1 1 35 35 THR CB C 35 69.090 69.090 70.878 -1.788 18327
4232 1 16 . 1 1 35 35 THR H H 35 8.389 8.389 8.241 0.148 18327
4233 1 16 . 1 1 36 36 VAL N N 36 118.200 118.200 116.101 2.099 18327
4234 1 16 . 1 1 36 36 VAL HA H 36 5.100 5.100 4.404 0.696 18327
4235 1 16 . 1 1 36 36 VAL CA C 36 57.910 57.910 60.095 -2.185 18327
4236 1 16 . 1 1 36 36 VAL CB C 36 34.190 34.190 34.702 -0.512 18327
4237 1 16 . 1 1 36 36 VAL H H 36 9.019 9.019 8.994 0.025 18327
4238 1 16 . 1 1 37 37 HIS N N 37 122.100 122.100 119.748 2.352 18327
4239 1 16 . 1 1 37 37 HIS HA H 37 4.840 4.840 4.950 -0.110 18327
4240 1 16 . 1 1 37 37 HIS CA C 37 52.560 52.560 54.275 -1.715 18327
4241 1 16 . 1 1 37 37 HIS CB C 37 31.260 31.260 33.227 -1.967 18327
4242 1 16 . 1 1 37 37 HIS H H 37 8.489 8.489 8.664 -0.175 18327
4243 1 16 . 1 1 38 38 ILE N N 38 126.400 126.400 126.615 -0.215 18327
4244 1 16 . 1 1 38 38 ILE HA H 38 3.780 3.780 4.369 -0.589 18327
4245 1 16 . 1 1 38 38 ILE CA C 38 61.640 61.640 61.499 0.141 18327
4246 1 16 . 1 1 38 38 ILE CB C 38 38.880 38.880 38.414 0.466 18327
4247 1 16 . 1 1 38 38 ILE H H 38 8.636 8.636 8.769 -0.133 18327
4248 1 16 . 1 1 39 39 LEU N N 39 126.000 126.000 126.204 -0.204 18327
4249 1 16 . 1 1 39 39 LEU HA H 39 4.400 4.400 4.977 -0.577 18327
4250 1 16 . 1 1 39 39 LEU CA C 39 55.490 55.490 55.619 -0.129 18327
4251 1 16 . 1 1 39 39 LEU CB C 39 43.750 43.750 44.422 -0.672 18327
4252 1 16 . 1 1 39 39 LEU H H 39 9.162 9.162 8.758 0.404 18327
4253 1 16 . 1 1 40 40 GLU N N 40 115.100 115.100 118.104 -3.004 18327
4254 1 16 . 1 1 40 40 GLU HA H 40 7.895 7.895 4.778 3.117 18327
4255 1 16 . 1 1 41 41 THR N N 41 116.400 116.400 113.190 3.210 18327
4256 1 16 . 1 1 41 41 THR HA H 41 4.270 4.270 5.037 -0.767 18327
4257 1 16 . 1 1 41 41 THR CA C 41 60.890 60.890 61.081 -0.191 18327
4258 1 16 . 1 1 41 41 THR CB C 41 69.650 69.650 70.510 -0.860 18327
4259 1 16 . 1 1 41 41 THR H H 41 8.162 8.162 8.523 -0.361 18327
4260 1 16 . 1 1 43 43 GLU N N 43 123.300 123.300 123.399 -0.099 18327
4261 1 16 . 1 1 43 43 GLU HA H 43 4.270 4.270 3.702 0.568 18327
4262 1 16 . 1 1 43 43 GLU CA C 43 57.350 57.350 56.883 0.467 18327
4263 1 16 . 1 1 43 43 GLU CB C 43 26.790 26.790 28.348 -1.558 18327
4264 1 16 . 1 1 43 43 GLU H H 43 8.108 8.108 8.941 -0.833 18327
4265 1 16 . 1 1 44 44 GLY CA C 44 45.440 45.440 45.373 0.067 18327
4266 1 16 . 1 1 45 45 TRP N N 45 124.100 124.100 118.406 5.694 18327
4267 1 16 . 1 1 45 45 TRP HA H 45 4.690 4.690 4.812 -0.122 18327
4268 1 16 . 1 1 45 45 TRP H H 45 8.590 8.590 7.250 1.340 18327
4269 1 16 . 1 1 46 46 TYR HA H 46 5.600 5.600 4.730 0.870 18327
4270 1 16 . 1 1 46 46 TYR CA C 46 54.060 54.060 56.608 -2.548 18327
4271 1 16 . 1 1 46 46 TYR CB C 46 42.060 42.060 39.379 2.682 18327
4272 1 16 . 1 1 47 47 ARG N N 47 118.100 118.100 122.390 -4.290 18327
4273 1 16 . 1 1 47 47 ARG HA H 47 5.070 5.070 4.854 0.216 18327
4274 1 16 . 1 1 47 47 ARG CA C 47 54.060 54.060 53.901 0.159 18327
4275 1 16 . 1 1 47 47 ARG CB C 47 33.250 33.250 34.622 -1.372 18327
4276 1 16 . 1 1 47 47 ARG H H 47 8.495 8.495 8.809 -0.314 18327
4277 1 16 . 1 1 48 48 GLY N N 48 114.000 114.000 111.842 2.158 18327
4278 1 16 . 1 1 48 48 GLY CA C 48 46.560 46.560 46.423 0.137 18327
4279 1 16 . 1 1 48 48 GLY H H 48 9.183 9.183 9.140 0.043 18327
4280 1 16 . 1 1 49 49 TYR N N 49 116.200 116.200 117.633 -1.433 18327
4281 1 16 . 1 1 49 49 TYR HA H 49 5.380 5.380 5.171 0.209 18327
4282 1 16 . 1 1 49 49 TYR CA C 49 55.110 55.110 56.883 -1.773 18327
4283 1 16 . 1 1 49 49 TYR CB C 49 40.750 40.750 39.899 0.851 18327
4284 1 16 . 1 1 49 49 TYR H H 49 8.199 8.199 8.408 -0.209 18327
4285 1 16 . 1 1 50 50 THR N N 50 112.200 112.200 111.106 1.094 18327
4286 1 16 . 1 1 50 50 THR HA H 50 5.120 5.120 4.257 0.863 18327
4287 1 16 . 1 1 50 50 THR CA C 50 59.770 59.770 61.181 -1.411 18327
4288 1 16 . 1 1 50 50 THR CB C 50 69.460 69.460 69.911 -0.451 18327
4289 1 16 . 1 1 50 50 THR H H 50 9.436 9.436 8.390 1.046 18327
4290 1 16 . 1 1 51 51 LEU N N 51 121.300 121.300 120.004 1.296 18327
4291 1 16 . 1 1 51 51 LEU HA H 51 4.230 4.230 4.345 -0.115 18327
4292 1 16 . 1 1 51 51 LEU CA C 51 56.790 56.790 55.446 1.344 18327
4293 1 16 . 1 1 51 51 LEU CB C 51 40.000 40.000 41.989 -1.989 18327
4294 1 16 . 1 1 51 51 LEU H H 51 8.313 8.313 8.294 0.019 18327
4295 1 16 . 1 1 52 52 ARG N N 52 116.600 116.600 118.370 -1.770 18327
4296 1 16 . 1 1 52 52 ARG HA H 52 4.250 4.250 4.128 0.122 18327
4297 1 16 . 1 1 52 52 ARG CA C 52 57.350 57.350 57.259 0.091 18327
4298 1 16 . 1 1 52 52 ARG CB C 52 30.510 30.510 30.635 -0.125 18327
4299 1 16 . 1 1 52 52 ARG H H 52 8.053 8.053 7.818 0.235 18327
4300 1 16 . 1 1 53 53 LYS N N 53 122.600 122.600 118.118 4.482 18327
4301 1 16 . 1 1 53 53 LYS HA H 53 4.620 4.620 4.481 0.139 18327
4302 1 16 . 1 1 53 53 LYS CA C 53 54.620 54.620 55.731 -1.111 18327
4303 1 16 . 1 1 53 53 LYS CB C 53 32.310 32.310 34.547 -2.236 18327
4304 1 16 . 1 1 53 53 LYS H H 53 7.655 7.655 7.499 0.156 18327
4305 1 16 . 1 1 54 54 LYS N N 54 124.900 124.900 123.899 1.001 18327
4306 1 16 . 1 1 54 54 LYS HA H 54 4.090 4.090 4.208 -0.118 18327
4307 1 16 . 1 1 54 54 LYS CA C 54 58.470 58.470 57.991 0.479 18327
4308 1 16 . 1 1 54 54 LYS CB C 54 32.130 32.130 32.690 -0.560 18327
4309 1 16 . 1 1 54 54 LYS H H 54 8.499 8.499 8.685 -0.186 18327
4310 1 16 . 1 1 55 55 SER N N 55 110.100 110.100 114.538 -4.438 18327
4311 1 16 . 1 1 55 55 SER HA H 55 4.140 4.140 4.282 -0.142 18327
4312 1 16 . 1 1 55 55 SER CA C 55 58.470 58.470 59.776 -1.306 18327
4313 1 16 . 1 1 55 55 SER CB C 55 63.310 63.310 63.161 0.149 18327
4314 1 16 . 1 1 55 55 SER H H 55 7.862 7.862 7.968 -0.106 18327
4315 1 16 . 1 1 56 56 LYS N N 56 124.000 124.000 120.805 3.195 18327
4316 1 16 . 1 1 56 56 LYS HA H 56 4.700 4.700 4.437 0.263 18327
4317 1 16 . 1 1 56 56 LYS CA C 56 54.810 54.810 55.787 -0.977 18327
4318 1 16 . 1 1 56 56 LYS CB C 56 33.250 33.250 33.344 -0.094 18327
4319 1 16 . 1 1 56 56 LYS H H 56 7.481 7.481 7.927 -0.446 18327
4320 1 16 . 1 1 57 57 LYS N N 57 125.700 125.700 121.853 3.847 18327
4321 1 16 . 1 1 57 57 LYS HA H 57 5.330 5.330 4.707 0.623 18327
4322 1 16 . 1 1 57 57 LYS CA C 57 54.620 54.620 54.871 -0.251 18327
4323 1 16 . 1 1 57 57 LYS CB C 57 34.240 34.240 36.798 -2.558 18327
4324 1 16 . 1 1 57 57 LYS H H 57 8.475 8.475 8.453 0.022 18327
4325 1 16 . 1 1 58 58 GLY N N 58 109.400 109.400 107.674 1.726 18327
4326 1 16 . 1 1 58 58 GLY CA C 58 45.620 45.620 45.353 0.266 18327
4327 1 16 . 1 1 58 58 GLY H H 58 9.073 9.073 8.486 0.587 18327
4328 1 16 . 1 1 59 59 ILE N N 59 113.900 113.900 120.259 -6.359 18327
4329 1 16 . 1 1 59 59 ILE HA H 59 6.000 6.000 5.041 0.959 18327
4330 1 16 . 1 1 59 59 ILE CA C 59 59.590 59.590 59.492 0.098 18327
4331 1 16 . 1 1 59 59 ILE CB C 59 41.140 41.140 42.464 -1.324 18327
4332 1 16 . 1 1 59 59 ILE H H 59 8.628 8.628 8.284 0.344 18327
4333 1 16 . 1 1 60 60 PHE N N 60 116.900 116.900 117.355 -0.455 18327
4334 1 16 . 1 1 60 60 PHE HA H 60 5.120 5.120 5.070 0.050 18327
4335 1 16 . 1 1 60 60 PHE CA C 60 54.060 54.060 55.035 -0.975 18327
4336 1 16 . 1 1 60 60 PHE CB C 60 37.190 37.190 39.934 -2.744 18327
4337 1 16 . 1 1 60 60 PHE H H 60 8.724 8.724 8.718 0.006 18327
4338 1 16 . 1 1 61 61 PRO HA H 61 3.480 3.480 3.278 0.202 18327
4339 1 16 . 1 1 61 61 PRO CA C 61 62.200 62.200 62.348 -0.148 18327
4340 1 16 . 1 1 61 61 PRO CB C 61 31.190 31.190 31.017 0.173 18327
4341 1 16 . 1 1 62 62 ALA N N 62 124.600 124.600 126.755 -2.155 18327
4342 1 16 . 1 1 62 62 ALA HA H 62 3.720 3.720 3.940 -0.220 18327
4343 1 16 . 1 1 62 62 ALA CA C 62 54.370 54.370 54.241 0.129 18327
4344 1 16 . 1 1 62 62 ALA CB C 62 17.650 17.650 17.888 -0.238 18327
4345 1 16 . 1 1 62 62 ALA H H 62 7.898 7.898 8.198 -0.300 18327
4346 1 16 . 1 1 63 63 SER N N 63 109.700 109.700 112.338 -2.638 18327
4347 1 16 . 1 1 63 63 SER HA H 63 4.200 4.200 4.240 -0.040 18327
4348 1 16 . 1 1 63 63 SER CA C 63 59.400 59.400 60.399 -0.999 18327
4349 1 16 . 1 1 63 63 SER CB C 63 62.380 62.380 63.239 -0.859 18327
4350 1 16 . 1 1 63 63 SER H H 63 8.030 8.030 7.886 0.144 18327
4351 1 16 . 1 1 64 64 TYR N N 64 120.300 120.300 118.584 1.716 18327
4352 1 16 . 1 1 64 64 TYR HA H 64 4.260 4.260 4.520 -0.260 18327
4353 1 16 . 1 1 64 64 TYR CA C 64 57.720 57.720 58.829 -1.109 18327
4354 1 16 . 1 1 64 64 TYR CB C 64 37.560 37.560 38.341 -0.781 18327
4355 1 16 . 1 1 64 64 TYR H H 64 7.124 7.124 7.717 -0.593 18327
4356 1 16 . 1 1 65 65 ILE N N 65 118.000 118.000 116.120 1.880 18327
4357 1 16 . 1 1 65 65 ILE HA H 65 4.830 4.830 4.887 -0.057 18327
4358 1 16 . 1 1 65 65 ILE CA C 65 56.980 56.980 59.121 -2.141 18327
4359 1 16 . 1 1 65 65 ILE CB C 65 39.630 39.630 39.017 0.614 18327
4360 1 16 . 1 1 65 65 ILE H H 65 7.671 7.671 7.469 0.202 18327
4361 1 16 . 1 1 66 66 HIS N N 66 124.500 124.500 123.070 1.430 18327
4362 1 16 . 1 1 66 66 HIS HA H 66 5.130 5.130 4.807 0.323 18327
4363 1 16 . 1 1 66 66 HIS CA C 66 53.060 53.060 54.851 -1.791 18327
4364 1 16 . 1 1 66 66 HIS CB C 66 30.510 30.510 32.898 -2.389 18327
4365 1 16 . 1 1 66 66 HIS H H 66 9.159 9.159 8.626 0.533 18327
4366 1 16 . 1 1 67 67 LEU N N 67 127.400 127.400 126.513 0.887 18327
4367 1 16 . 1 1 67 67 LEU HA H 67 4.560 4.560 4.720 -0.160 18327
4368 1 16 . 1 1 67 67 LEU CA C 67 55.300 55.300 55.339 -0.039 18327
4369 1 16 . 1 1 67 67 LEU CB C 67 42.060 42.060 42.979 -0.919 18327
4370 1 16 . 1 1 67 67 LEU H H 67 8.979 8.979 8.714 0.265 18327
4371 1 16 . 1 1 68 68 LYS N N 68 121.900 121.900 122.340 -0.440 18327
4372 1 16 . 1 1 68 68 LYS HA H 68 4.490 4.490 4.434 0.056 18327
4373 1 16 . 1 1 68 68 LYS CA C 68 55.110 55.110 55.220 -0.110 18327
4374 1 16 . 1 1 68 68 LYS CB C 68 34.610 34.610 34.485 0.125 18327
4375 1 16 . 1 1 68 68 LYS H H 68 8.499 8.499 9.093 -0.594 18327
4376 1 16 . 1 1 69 69 GLU N N 69 122.100 122.100 122.222 -0.122 18327
4377 1 16 . 1 1 69 69 GLU HA H 69 4.290 4.290 3.979 0.311 18327
4378 1 16 . 1 1 69 69 GLU CA C 69 56.610 56.610 57.095 -0.485 18327
4379 1 16 . 1 1 69 69 GLU CB C 69 30.330 30.330 28.036 2.294 18327
4380 1 16 . 1 1 69 69 GLU H H 69 8.569 8.569 8.638 -0.069 18327
4381 1 16 . 1 1 70 70 ALA N N 70 123.300 123.300 124.898 -1.598 18327
4382 1 16 . 1 1 70 70 ALA HA H 70 4.210 4.210 4.051 0.159 18327
4383 1 16 . 1 1 70 70 ALA CA C 70 51.810 51.810 52.426 -0.616 18327
4384 1 16 . 1 1 70 70 ALA CB C 70 19.700 19.700 18.839 0.861 18327
4385 1 16 . 1 1 70 70 ALA H H 70 8.181 8.181 7.871 0.310 18327
4386 1 16 . 1 1 71 71 ILE N N 71 120.000 120.000 122.585 -2.585 18327
4387 1 16 . 1 1 71 71 ILE HA H 71 4.070 4.070 4.155 -0.085 18327
4388 1 16 . 1 1 71 71 ILE CA C 71 60.330 60.330 61.407 -1.077 18327
4389 1 16 . 1 1 71 71 ILE CB C 71 38.690 38.690 38.831 -0.141 18327
4390 1 16 . 1 1 71 71 ILE H H 71 7.789 7.789 8.537 -0.748 18327
4391 1 16 . 1 1 72 72 VAL N N 72 124.400 124.400 120.147 4.253 18327
4392 1 16 . 1 1 72 72 VAL HA H 72 4.070 4.070 4.389 -0.319 18327
4393 1 16 . 1 1 72 72 VAL CA C 72 61.640 61.640 61.434 0.206 18327
4394 1 16 . 1 1 72 72 VAL CB C 72 32.690 32.690 33.618 -0.928 18327
4395 1 16 . 1 1 72 72 VAL H H 72 8.089 8.089 8.101 -0.012 18327
4396 1 16 . 1 1 73 73 GLU N N 73 125.940 125.940 120.006 5.934 18327
4397 1 16 . 1 1 73 73 GLU HA H 73 4.300 4.300 4.831 -0.531 18327
4398 1 16 . 1 1 73 73 GLU CA C 73 56.610 56.610 55.533 1.077 18327
4399 1 16 . 1 1 73 73 GLU CB C 73 30.710 30.710 33.143 -2.433 18327
4400 1 16 . 1 1 73 73 GLU H H 73 8.464 8.464 8.873 -0.409 18327
4401 1 17 . 1 1 13 13 TYR HA H 13 5.560 5.560 4.558 1.002 18327
4402 1 17 . 1 1 13 13 TYR CA C 13 55.860 55.860 57.350 -1.490 18327
4403 1 17 . 1 1 13 13 TYR CB C 13 42.440 42.440 43.120 -0.680 18327
4404 1 17 . 1 1 14 14 GLY N N 14 105.400 105.400 107.196 -1.796 18327
4405 1 17 . 1 1 14 14 GLY CA C 14 45.240 45.240 43.415 1.825 18327
4406 1 17 . 1 1 14 14 GLY H H 14 8.406 8.406 8.626 -0.220 18327
4407 1 17 . 1 1 15 15 VAL N N 15 118.900 118.900 120.796 -1.896 18327
4408 1 17 . 1 1 15 15 VAL HA H 15 5.330 5.330 4.790 0.540 18327
4409 1 17 . 1 1 15 15 VAL CA C 15 59.210 59.210 60.592 -1.382 18327
4410 1 17 . 1 1 15 15 VAL CB C 15 35.740 35.740 36.291 -0.551 18327
4411 1 17 . 1 1 15 15 VAL H H 15 8.854 8.854 8.271 0.583 18327
4412 1 17 . 1 1 16 16 ALA N N 16 129.400 129.400 127.300 2.100 18327
4413 1 17 . 1 1 16 16 ALA HA H 16 5.000 5.000 5.095 -0.095 18327
4414 1 17 . 1 1 16 16 ALA CA C 16 52.000 52.000 50.526 1.474 18327
4415 1 17 . 1 1 16 16 ALA CB C 16 19.330 19.330 21.071 -1.741 18327
4416 1 17 . 1 1 16 16 ALA H H 16 9.112 9.112 9.133 -0.021 18327
4417 1 17 . 1 1 17 17 PHE N N 17 123.900 123.900 124.232 -0.332 18327
4418 1 17 . 1 1 17 17 PHE HA H 17 4.740 4.740 4.725 0.015 18327
4419 1 17 . 1 1 17 17 PHE CA C 17 56.230 56.230 57.324 -1.094 18327
4420 1 17 . 1 1 17 17 PHE CB C 17 40.000 40.000 39.656 0.344 18327
4421 1 17 . 1 1 17 17 PHE H H 17 8.785 8.785 8.445 0.340 18327
4422 1 17 . 1 1 18 18 TYR N N 18 118.100 118.100 118.200 -0.100 18327
4423 1 17 . 1 1 18 18 TYR HA H 18 4.490 4.490 4.479 0.011 18327
4424 1 17 . 1 1 18 18 TYR CA C 18 55.300 55.300 57.334 -2.034 18327
4425 1 17 . 1 1 18 18 TYR CB C 18 42.810 42.810 42.191 0.619 18327
4426 1 17 . 1 1 18 18 TYR H H 18 7.288 7.288 7.526 -0.238 18327
4427 1 17 . 1 1 19 19 ASN N N 19 116.800 116.800 120.333 -3.533 18327
4428 1 17 . 1 1 19 19 ASN HA H 19 4.710 4.710 4.927 -0.217 18327
4429 1 17 . 1 1 19 19 ASN CA C 19 52.940 52.940 53.364 -0.424 18327
4430 1 17 . 1 1 19 19 ASN CB C 19 39.060 39.060 39.022 0.038 18327
4431 1 17 . 1 1 19 19 ASN H H 19 8.122 8.122 8.820 -0.698 18327
4432 1 17 . 1 1 20 20 TYR N N 20 122.000 122.000 123.898 -1.898 18327
4433 1 17 . 1 1 20 20 TYR HA H 20 4.710 4.710 4.520 0.190 18327
4434 1 17 . 1 1 20 20 TYR CA C 20 57.720 57.720 57.798 -0.078 18327
4435 1 17 . 1 1 20 20 TYR CB C 20 42.250 42.250 42.624 -0.374 18327
4436 1 17 . 1 1 20 20 TYR H H 20 8.994 8.994 8.627 0.367 18327
4437 1 17 . 1 1 21 21 ASP N N 21 128.500 128.500 120.767 7.733 18327
4438 1 17 . 1 1 21 21 ASP HA H 21 4.790 4.790 4.873 -0.083 18327
4439 1 17 . 1 1 21 21 ASP CA C 21 52.370 52.370 52.135 0.235 18327
4440 1 17 . 1 1 21 21 ASP CB C 21 41.130 41.130 43.937 -2.807 18327
4441 1 17 . 1 1 21 21 ASP H H 21 7.839 7.839 7.829 0.010 18327
4442 1 17 . 1 1 22 22 ALA N N 22 125.200 125.200 123.370 1.830 18327
4443 1 17 . 1 1 22 22 ALA HA H 22 4.050 4.050 4.460 -0.410 18327
4444 1 17 . 1 1 22 22 ALA CA C 22 52.940 52.940 53.204 -0.264 18327
4445 1 17 . 1 1 22 22 ALA CB C 22 20.450 20.450 19.642 0.808 18327
4446 1 17 . 1 1 22 22 ALA H H 22 8.107 8.107 8.374 -0.267 18327
4447 1 17 . 1 1 23 23 ARG N N 23 122.200 122.200 120.955 1.245 18327
4448 1 17 . 1 1 23 23 ARG HA H 23 4.350 4.350 4.522 -0.172 18327
4449 1 17 . 1 1 23 23 ARG CA C 23 55.490 55.490 55.464 0.026 18327
4450 1 17 . 1 1 23 23 ARG CB C 23 30.700 30.700 29.992 0.708 18327
4451 1 17 . 1 1 23 23 ARG H H 23 8.889 8.889 8.742 0.147 18327
4452 1 17 . 1 1 24 24 GLY N N 24 105.200 105.200 107.522 -2.322 18327
4453 1 17 . 1 1 24 24 GLY CA C 24 44.500 44.500 45.338 -0.838 18327
4454 1 17 . 1 1 24 24 GLY H H 24 7.267 7.267 7.562 -0.295 18327
4455 1 17 . 1 1 25 25 ALA N N 25 122.200 122.200 122.303 -0.103 18327
4456 1 17 . 1 1 25 25 ALA HA H 25 4.160 4.160 4.271 -0.111 18327
4457 1 17 . 1 1 25 25 ALA CA C 25 54.440 54.440 54.045 0.395 18327
4458 1 17 . 1 1 25 25 ALA CB C 25 18.770 18.770 18.878 -0.108 18327
4459 1 17 . 1 1 25 25 ALA H H 25 8.621 8.621 8.478 0.143 18327
4460 1 17 . 1 1 26 26 ASP N N 26 114.700 114.700 118.675 -3.975 18327
4461 1 17 . 1 1 26 26 ASP HA H 26 4.700 4.700 4.691 0.009 18327
4462 1 17 . 1 1 26 26 ASP CA C 26 53.870 53.870 53.917 -0.047 18327
4463 1 17 . 1 1 26 26 ASP CB C 26 40.390 40.390 40.445 -0.055 18327
4464 1 17 . 1 1 26 26 ASP H H 26 8.949 8.949 8.461 0.488 18327
4465 1 17 . 1 1 27 27 GLU N N 27 118.800 118.800 119.527 -0.727 18327
4466 1 17 . 1 1 27 27 GLU HA H 27 5.220 5.220 4.620 0.600 18327
4467 1 17 . 1 1 27 27 GLU CA C 27 54.930 54.930 55.009 -0.079 18327
4468 1 17 . 1 1 27 27 GLU CB C 27 32.880 32.880 31.671 1.209 18327
4469 1 17 . 1 1 27 27 GLU H H 27 7.542 7.542 7.529 0.013 18327
4470 1 17 . 1 1 28 28 LEU N N 28 121.400 121.400 120.807 0.593 18327
4471 1 17 . 1 1 28 28 LEU HA H 28 4.760 4.760 4.743 0.017 18327
4472 1 17 . 1 1 28 28 LEU CA C 28 53.120 53.120 54.126 -1.006 18327
4473 1 17 . 1 1 28 28 LEU CB C 28 44.500 44.500 46.070 -1.570 18327
4474 1 17 . 1 1 28 28 LEU H H 28 8.897 8.897 8.236 0.661 18327
4475 1 17 . 1 1 29 29 SER N N 29 115.700 115.700 118.468 -2.768 18327
4476 1 17 . 1 1 29 29 SER HA H 29 5.030 5.030 5.069 -0.039 18327
4477 1 17 . 1 1 29 29 SER CA C 29 58.470 58.470 58.049 0.421 18327
4478 1 17 . 1 1 29 29 SER CB C 29 63.690 63.690 63.970 -0.280 18327
4479 1 17 . 1 1 29 29 SER H H 29 7.949 7.949 8.454 -0.505 18327
4480 1 17 . 1 1 30 30 LEU N N 30 121.300 121.300 120.221 1.079 18327
4481 1 17 . 1 1 30 30 LEU HA H 30 4.800 4.800 4.688 0.112 18327
4482 1 17 . 1 1 30 30 LEU CA C 30 52.940 52.940 55.203 -2.263 18327
4483 1 17 . 1 1 30 30 LEU CB C 30 46.370 46.370 45.452 0.918 18327
4484 1 17 . 1 1 30 30 LEU H H 30 9.503 9.503 8.831 0.672 18327
4485 1 17 . 1 1 31 31 GLN N N 31 123.100 123.100 121.172 1.928 18327
4486 1 17 . 1 1 31 31 GLN HA H 31 5.070 5.070 4.628 0.442 18327
4487 1 17 . 1 1 31 31 GLN CA C 31 52.940 52.940 54.335 -1.395 18327
4488 1 17 . 1 1 31 31 GLN CB C 31 31.190 31.190 33.585 -2.395 18327
4489 1 17 . 1 1 31 31 GLN H H 31 9.152 9.152 8.433 0.719 18327
4490 1 17 . 1 1 32 32 ILE N N 32 120.800 120.800 121.044 -0.244 18327
4491 1 17 . 1 1 32 32 ILE HA H 32 3.030 3.030 4.034 -1.004 18327
4492 1 17 . 1 1 32 32 ILE CA C 32 64.250 64.250 61.754 2.496 18327
4493 1 17 . 1 1 32 32 ILE CB C 32 37.940 37.940 37.587 0.353 18327
4494 1 17 . 1 1 32 32 ILE H H 32 8.019 8.019 8.635 -0.616 18327
4495 1 17 . 1 1 33 33 GLY N N 33 115.700 115.700 113.955 1.745 18327
4496 1 17 . 1 1 33 33 GLY CA C 33 44.500 44.500 44.912 -0.412 18327
4497 1 17 . 1 1 33 33 GLY H H 33 8.777 8.777 8.614 0.163 18327
4498 1 17 . 1 1 34 34 ASP N N 34 122.300 122.300 122.230 0.070 18327
4499 1 17 . 1 1 34 34 ASP HA H 34 4.640 4.640 4.925 -0.285 18327
4500 1 17 . 1 1 34 34 ASP CA C 34 55.860 55.860 53.452 2.408 18327
4501 1 17 . 1 1 34 34 ASP CB C 34 41.310 41.310 42.151 -0.841 18327
4502 1 17 . 1 1 34 34 ASP H H 34 8.690 8.690 7.670 1.020 18327
4503 1 17 . 1 1 35 35 THR N N 35 117.900 117.900 115.886 2.014 18327
4504 1 17 . 1 1 35 35 THR HA H 35 5.160 5.160 5.176 -0.016 18327
4505 1 17 . 1 1 35 35 THR CA C 35 61.450 61.450 61.663 -0.214 18327
4506 1 17 . 1 1 35 35 THR CB C 35 69.090 69.090 70.697 -1.607 18327
4507 1 17 . 1 1 35 35 THR H H 35 8.389 8.389 8.348 0.041 18327
4508 1 17 . 1 1 36 36 VAL N N 36 118.200 118.200 116.443 1.757 18327
4509 1 17 . 1 1 36 36 VAL HA H 36 5.100 5.100 4.785 0.315 18327
4510 1 17 . 1 1 36 36 VAL CA C 36 57.910 57.910 59.625 -1.715 18327
4511 1 17 . 1 1 36 36 VAL CB C 36 34.190 34.190 35.346 -1.156 18327
4512 1 17 . 1 1 36 36 VAL H H 36 9.019 9.019 8.886 0.133 18327
4513 1 17 . 1 1 37 37 HIS N N 37 122.100 122.100 119.148 2.952 18327
4514 1 17 . 1 1 37 37 HIS HA H 37 4.840 4.840 4.993 -0.153 18327
4515 1 17 . 1 1 37 37 HIS CA C 37 52.560 52.560 53.962 -1.402 18327
4516 1 17 . 1 1 37 37 HIS CB C 37 31.260 31.260 33.103 -1.843 18327
4517 1 17 . 1 1 37 37 HIS H H 37 8.489 8.489 8.220 0.269 18327
4518 1 17 . 1 1 38 38 ILE N N 38 126.400 126.400 126.020 0.380 18327
4519 1 17 . 1 1 38 38 ILE HA H 38 3.780 3.780 4.466 -0.686 18327
4520 1 17 . 1 1 38 38 ILE CA C 38 61.640 61.640 60.730 0.910 18327
4521 1 17 . 1 1 38 38 ILE CB C 38 38.880 38.880 39.134 -0.254 18327
4522 1 17 . 1 1 38 38 ILE H H 38 8.636 8.636 8.941 -0.305 18327
4523 1 17 . 1 1 39 39 LEU N N 39 126.000 126.000 124.366 1.634 18327
4524 1 17 . 1 1 39 39 LEU HA H 39 4.400 4.400 4.733 -0.333 18327
4525 1 17 . 1 1 39 39 LEU CA C 39 55.490 55.490 55.155 0.335 18327
4526 1 17 . 1 1 39 39 LEU CB C 39 43.750 43.750 44.376 -0.625 18327
4527 1 17 . 1 1 39 39 LEU H H 39 9.162 9.162 8.995 0.167 18327
4528 1 17 . 1 1 40 40 GLU N N 40 115.100 115.100 117.654 -2.554 18327
4529 1 17 . 1 1 40 40 GLU HA H 40 7.895 7.895 4.680 3.215 18327
4530 1 17 . 1 1 41 41 THR N N 41 116.400 116.400 111.523 4.877 18327
4531 1 17 . 1 1 41 41 THR HA H 41 4.270 4.270 4.655 -0.385 18327
4532 1 17 . 1 1 41 41 THR CA C 41 60.890 60.890 60.276 0.614 18327
4533 1 17 . 1 1 41 41 THR CB C 41 69.650 69.650 70.274 -0.624 18327
4534 1 17 . 1 1 41 41 THR H H 41 8.162 8.162 8.221 -0.059 18327
4535 1 17 . 1 1 43 43 GLU N N 43 123.300 123.300 120.020 3.280 18327
4536 1 17 . 1 1 43 43 GLU HA H 43 4.270 4.270 4.339 -0.069 18327
4537 1 17 . 1 1 43 43 GLU CA C 43 57.350 57.350 55.597 1.753 18327
4538 1 17 . 1 1 43 43 GLU CB C 43 26.790 26.790 29.086 -2.296 18327
4539 1 17 . 1 1 43 43 GLU H H 43 8.108 8.108 8.345 -0.237 18327
4540 1 17 . 1 1 44 44 GLY CA C 44 45.440 45.440 45.238 0.202 18327
4541 1 17 . 1 1 45 45 TRP N N 45 124.100 124.100 121.314 2.786 18327
4542 1 17 . 1 1 45 45 TRP HA H 45 4.690 4.690 4.610 0.080 18327
4543 1 17 . 1 1 45 45 TRP H H 45 8.590 8.590 7.221 1.369 18327
4544 1 17 . 1 1 46 46 TYR HA H 46 5.600 5.600 4.688 0.912 18327
4545 1 17 . 1 1 46 46 TYR CA C 46 54.060 54.060 57.213 -3.153 18327
4546 1 17 . 1 1 46 46 TYR CB C 46 42.060 42.060 39.795 2.265 18327
4547 1 17 . 1 1 47 47 ARG N N 47 118.100 118.100 122.540 -4.440 18327
4548 1 17 . 1 1 47 47 ARG HA H 47 5.070 5.070 4.861 0.209 18327
4549 1 17 . 1 1 47 47 ARG CA C 47 54.060 54.060 54.243 -0.183 18327
4550 1 17 . 1 1 47 47 ARG CB C 47 33.250 33.250 34.435 -1.185 18327
4551 1 17 . 1 1 47 47 ARG H H 47 8.495 8.495 9.005 -0.510 18327
4552 1 17 . 1 1 48 48 GLY N N 48 114.000 114.000 111.867 2.133 18327
4553 1 17 . 1 1 48 48 GLY CA C 48 46.560 46.560 46.129 0.431 18327
4554 1 17 . 1 1 48 48 GLY H H 48 9.183 9.183 9.104 0.079 18327
4555 1 17 . 1 1 49 49 TYR N N 49 116.200 116.200 117.171 -0.971 18327
4556 1 17 . 1 1 49 49 TYR HA H 49 5.380 5.380 5.124 0.256 18327
4557 1 17 . 1 1 49 49 TYR CA C 49 55.110 55.110 56.934 -1.824 18327
4558 1 17 . 1 1 49 49 TYR CB C 49 40.750 40.750 39.681 1.069 18327
4559 1 17 . 1 1 49 49 TYR H H 49 8.199 8.199 8.423 -0.224 18327
4560 1 17 . 1 1 50 50 THR N N 50 112.200 112.200 112.350 -0.150 18327
4561 1 17 . 1 1 50 50 THR HA H 50 5.120 5.120 4.184 0.936 18327
4562 1 17 . 1 1 50 50 THR CA C 50 59.770 59.770 61.928 -2.158 18327
4563 1 17 . 1 1 50 50 THR CB C 50 69.460 69.460 69.788 -0.328 18327
4564 1 17 . 1 1 50 50 THR H H 50 9.436 9.436 8.669 0.767 18327
4565 1 17 . 1 1 51 51 LEU N N 51 121.300 121.300 120.105 1.195 18327
4566 1 17 . 1 1 51 51 LEU HA H 51 4.230 4.230 4.303 -0.073 18327
4567 1 17 . 1 1 51 51 LEU CA C 51 56.790 56.790 55.633 1.157 18327
4568 1 17 . 1 1 51 51 LEU CB C 51 40.000 40.000 41.986 -1.986 18327
4569 1 17 . 1 1 51 51 LEU H H 51 8.313 8.313 8.084 0.229 18327
4570 1 17 . 1 1 52 52 ARG N N 52 116.600 116.600 117.925 -1.325 18327
4571 1 17 . 1 1 52 52 ARG HA H 52 4.250 4.250 4.134 0.116 18327
4572 1 17 . 1 1 52 52 ARG CA C 52 57.350 57.350 57.555 -0.205 18327
4573 1 17 . 1 1 52 52 ARG CB C 52 30.510 30.510 30.585 -0.075 18327
4574 1 17 . 1 1 52 52 ARG H H 52 8.053 8.053 7.768 0.285 18327
4575 1 17 . 1 1 53 53 LYS N N 53 122.600 122.600 117.654 4.946 18327
4576 1 17 . 1 1 53 53 LYS HA H 53 4.620 4.620 4.571 0.049 18327
4577 1 17 . 1 1 53 53 LYS CA C 53 54.620 54.620 55.123 -0.503 18327
4578 1 17 . 1 1 53 53 LYS CB C 53 32.310 32.310 33.498 -1.188 18327
4579 1 17 . 1 1 53 53 LYS H H 53 7.655 7.655 7.450 0.205 18327
4580 1 17 . 1 1 54 54 LYS N N 54 124.900 124.900 123.788 1.112 18327
4581 1 17 . 1 1 54 54 LYS HA H 54 4.090 4.090 4.483 -0.393 18327
4582 1 17 . 1 1 54 54 LYS CA C 54 58.470 58.470 57.910 0.560 18327
4583 1 17 . 1 1 54 54 LYS CB C 54 32.130 32.130 32.589 -0.459 18327
4584 1 17 . 1 1 54 54 LYS H H 54 8.499 8.499 8.708 -0.209 18327
4585 1 17 . 1 1 55 55 SER N N 55 110.100 110.100 113.277 -3.177 18327
4586 1 17 . 1 1 55 55 SER HA H 55 4.140 4.140 4.326 -0.186 18327
4587 1 17 . 1 1 55 55 SER CA C 55 58.470 58.470 59.820 -1.350 18327
4588 1 17 . 1 1 55 55 SER CB C 55 63.310 63.310 63.311 -0.001 18327
4589 1 17 . 1 1 55 55 SER H H 55 7.862 7.862 8.018 -0.156 18327
4590 1 17 . 1 1 56 56 LYS N N 56 124.000 124.000 122.105 1.895 18327
4591 1 17 . 1 1 56 56 LYS HA H 56 4.700 4.700 4.481 0.219 18327
4592 1 17 . 1 1 56 56 LYS CA C 56 54.810 54.810 55.153 -0.343 18327
4593 1 17 . 1 1 56 56 LYS CB C 56 33.250 33.250 32.991 0.259 18327
4594 1 17 . 1 1 56 56 LYS H H 56 7.481 7.481 7.379 0.102 18327
4595 1 17 . 1 1 57 57 LYS N N 57 125.700 125.700 123.220 2.480 18327
4596 1 17 . 1 1 57 57 LYS HA H 57 5.330 5.330 4.497 0.833 18327
4597 1 17 . 1 1 57 57 LYS CA C 57 54.620 54.620 55.928 -1.308 18327
4598 1 17 . 1 1 57 57 LYS CB C 57 34.240 34.240 34.022 0.218 18327
4599 1 17 . 1 1 57 57 LYS H H 57 8.475 8.475 8.295 0.180 18327
4600 1 17 . 1 1 58 58 GLY N N 58 109.400 109.400 106.959 2.441 18327
4601 1 17 . 1 1 58 58 GLY CA C 58 45.620 45.620 45.479 0.141 18327
4602 1 17 . 1 1 58 58 GLY H H 58 9.073 9.073 8.759 0.314 18327
4603 1 17 . 1 1 59 59 ILE N N 59 113.900 113.900 116.788 -2.888 18327
4604 1 17 . 1 1 59 59 ILE HA H 59 6.000 6.000 5.111 0.889 18327
4605 1 17 . 1 1 59 59 ILE CA C 59 59.590 59.590 59.039 0.551 18327
4606 1 17 . 1 1 59 59 ILE CB C 59 41.140 41.140 42.223 -1.083 18327
4607 1 17 . 1 1 59 59 ILE H H 59 8.628 8.628 8.306 0.322 18327
4608 1 17 . 1 1 60 60 PHE N N 60 116.900 116.900 113.995 2.905 18327
4609 1 17 . 1 1 60 60 PHE HA H 60 5.120 5.120 5.251 -0.131 18327
4610 1 17 . 1 1 60 60 PHE CA C 60 54.060 54.060 55.083 -1.023 18327
4611 1 17 . 1 1 60 60 PHE CB C 60 37.190 37.190 39.979 -2.789 18327
4612 1 17 . 1 1 60 60 PHE H H 60 8.724 8.724 8.698 0.026 18327
4613 1 17 . 1 1 61 61 PRO HA H 61 3.480 3.480 3.453 0.027 18327
4614 1 17 . 1 1 61 61 PRO CA C 61 62.200 62.200 62.598 -0.398 18327
4615 1 17 . 1 1 61 61 PRO CB C 61 31.190 31.190 31.157 0.033 18327
4616 1 17 . 1 1 62 62 ALA N N 62 124.600 124.600 126.571 -1.971 18327
4617 1 17 . 1 1 62 62 ALA HA H 62 3.720 3.720 4.199 -0.479 18327
4618 1 17 . 1 1 62 62 ALA CA C 62 54.370 54.370 54.618 -0.248 18327
4619 1 17 . 1 1 62 62 ALA CB C 62 17.650 17.650 18.423 -0.773 18327
4620 1 17 . 1 1 62 62 ALA H H 62 7.898 7.898 8.160 -0.262 18327
4621 1 17 . 1 1 63 63 SER N N 63 109.700 109.700 112.878 -3.178 18327
4622 1 17 . 1 1 63 63 SER HA H 63 4.200 4.200 4.330 -0.130 18327
4623 1 17 . 1 1 63 63 SER CA C 63 59.400 59.400 59.765 -0.365 18327
4624 1 17 . 1 1 63 63 SER CB C 63 62.380 62.380 63.022 -0.641 18327
4625 1 17 . 1 1 63 63 SER H H 63 8.030 8.030 8.375 -0.345 18327
4626 1 17 . 1 1 64 64 TYR N N 64 120.300 120.300 119.043 1.257 18327
4627 1 17 . 1 1 64 64 TYR HA H 64 4.260 4.260 4.688 -0.428 18327
4628 1 17 . 1 1 64 64 TYR CA C 64 57.720 57.720 56.926 0.794 18327
4629 1 17 . 1 1 64 64 TYR CB C 64 37.560 37.560 37.834 -0.274 18327
4630 1 17 . 1 1 64 64 TYR H H 64 7.124 7.124 7.460 -0.336 18327
4631 1 17 . 1 1 65 65 ILE N N 65 118.000 118.000 118.061 -0.061 18327
4632 1 17 . 1 1 65 65 ILE HA H 65 4.830 4.830 5.198 -0.368 18327
4633 1 17 . 1 1 65 65 ILE CA C 65 56.980 56.980 59.036 -2.056 18327
4634 1 17 . 1 1 65 65 ILE CB C 65 39.630 39.630 42.455 -2.825 18327
4635 1 17 . 1 1 65 65 ILE H H 65 7.671 7.671 7.402 0.269 18327
4636 1 17 . 1 1 66 66 HIS N N 66 124.500 124.500 121.978 2.522 18327
4637 1 17 . 1 1 66 66 HIS HA H 66 5.130 5.130 4.898 0.232 18327
4638 1 17 . 1 1 66 66 HIS CA C 66 53.060 53.060 54.802 -1.742 18327
4639 1 17 . 1 1 66 66 HIS CB C 66 30.510 30.510 33.736 -3.226 18327
4640 1 17 . 1 1 66 66 HIS H H 66 9.159 9.159 8.956 0.203 18327
4641 1 17 . 1 1 67 67 LEU N N 67 127.400 127.400 126.249 1.151 18327
4642 1 17 . 1 1 67 67 LEU HA H 67 4.560 4.560 4.730 -0.170 18327
4643 1 17 . 1 1 67 67 LEU CA C 67 55.300 55.300 54.838 0.462 18327
4644 1 17 . 1 1 67 67 LEU CB C 67 42.060 42.060 42.934 -0.875 18327
4645 1 17 . 1 1 67 67 LEU H H 67 8.979 8.979 8.664 0.315 18327
4646 1 17 . 1 1 68 68 LYS N N 68 121.900 121.900 124.459 -2.559 18327
4647 1 17 . 1 1 68 68 LYS HA H 68 4.490 4.490 4.571 -0.081 18327
4648 1 17 . 1 1 68 68 LYS CA C 68 55.110 55.110 55.313 -0.203 18327
4649 1 17 . 1 1 68 68 LYS CB C 68 34.610 34.610 33.419 1.191 18327
4650 1 17 . 1 1 68 68 LYS H H 68 8.499 8.499 8.782 -0.283 18327
4651 1 17 . 1 1 69 69 GLU N N 69 122.100 122.100 121.575 0.525 18327
4652 1 17 . 1 1 69 69 GLU HA H 69 4.290 4.290 4.021 0.269 18327
4653 1 17 . 1 1 69 69 GLU CA C 69 56.610 56.610 56.997 -0.387 18327
4654 1 17 . 1 1 69 69 GLU CB C 69 30.330 30.330 29.545 0.785 18327
4655 1 17 . 1 1 69 69 GLU H H 69 8.569 8.569 8.135 0.434 18327
4656 1 17 . 1 1 70 70 ALA N N 70 123.300 123.300 122.832 0.468 18327
4657 1 17 . 1 1 70 70 ALA HA H 70 4.210 4.210 4.048 0.162 18327
4658 1 17 . 1 1 70 70 ALA CA C 70 51.810 51.810 52.450 -0.640 18327
4659 1 17 . 1 1 70 70 ALA CB C 70 19.700 19.700 17.891 1.809 18327
4660 1 17 . 1 1 70 70 ALA H H 70 8.181 8.181 8.606 -0.425 18327
4661 1 17 . 1 1 71 71 ILE N N 71 120.000 120.000 115.702 4.298 18327
4662 1 17 . 1 1 71 71 ILE HA H 71 4.070 4.070 4.138 -0.068 18327
4663 1 17 . 1 1 71 71 ILE CA C 71 60.330 60.330 61.787 -1.457 18327
4664 1 17 . 1 1 71 71 ILE CB C 71 38.690 38.690 38.247 0.443 18327
4665 1 17 . 1 1 71 71 ILE H H 71 7.789 7.789 8.029 -0.240 18327
4666 1 17 . 1 1 72 72 VAL N N 72 124.400 124.400 125.991 -1.591 18327
4667 1 17 . 1 1 72 72 VAL HA H 72 4.070 4.070 4.158 -0.088 18327
4668 1 17 . 1 1 72 72 VAL CA C 72 61.640 61.640 62.183 -0.543 18327
4669 1 17 . 1 1 72 72 VAL CB C 72 32.690 32.690 32.649 0.041 18327
4670 1 17 . 1 1 72 72 VAL H H 72 8.089 8.089 8.136 -0.047 18327
4671 1 17 . 1 1 73 73 GLU N N 73 125.940 125.940 122.262 3.678 18327
4672 1 17 . 1 1 73 73 GLU HA H 73 4.300 4.300 4.541 -0.241 18327
4673 1 17 . 1 1 73 73 GLU CA C 73 56.610 56.610 55.258 1.352 18327
4674 1 17 . 1 1 73 73 GLU CB C 73 30.710 30.710 31.159 -0.449 18327
4675 1 17 . 1 1 73 73 GLU H H 73 8.464 8.464 8.585 -0.121 18327
4676 1 18 . 1 1 13 13 TYR HA H 13 5.560 5.560 4.711 0.849 18327
4677 1 18 . 1 1 13 13 TYR CA C 13 55.860 55.860 55.267 0.593 18327
4678 1 18 . 1 1 13 13 TYR CB C 13 42.440 42.440 42.429 0.011 18327
4679 1 18 . 1 1 14 14 GLY N N 14 105.400 105.400 106.603 -1.203 18327
4680 1 18 . 1 1 14 14 GLY CA C 14 45.240 45.240 43.520 1.720 18327
4681 1 18 . 1 1 14 14 GLY H H 14 8.406 8.406 8.513 -0.107 18327
4682 1 18 . 1 1 15 15 VAL N N 15 118.900 118.900 119.442 -0.542 18327
4683 1 18 . 1 1 15 15 VAL HA H 15 5.330 5.330 4.874 0.456 18327
4684 1 18 . 1 1 15 15 VAL CA C 15 59.210 59.210 60.032 -0.822 18327
4685 1 18 . 1 1 15 15 VAL CB C 15 35.740 35.740 36.023 -0.283 18327
4686 1 18 . 1 1 15 15 VAL H H 15 8.854 8.854 8.216 0.638 18327
4687 1 18 . 1 1 16 16 ALA N N 16 129.400 129.400 126.250 3.150 18327
4688 1 18 . 1 1 16 16 ALA HA H 16 5.000 5.000 4.883 0.117 18327
4689 1 18 . 1 1 16 16 ALA CA C 16 52.000 52.000 50.757 1.243 18327
4690 1 18 . 1 1 16 16 ALA CB C 16 19.330 19.330 20.872 -1.542 18327
4691 1 18 . 1 1 16 16 ALA H H 16 9.112 9.112 8.955 0.157 18327
4692 1 18 . 1 1 17 17 PHE N N 17 123.900 123.900 123.755 0.145 18327
4693 1 18 . 1 1 17 17 PHE HA H 17 4.740 4.740 4.665 0.075 18327
4694 1 18 . 1 1 17 17 PHE CA C 17 56.230 56.230 57.633 -1.403 18327
4695 1 18 . 1 1 17 17 PHE CB C 17 40.000 40.000 40.390 -0.390 18327
4696 1 18 . 1 1 17 17 PHE H H 17 8.785 8.785 8.744 0.041 18327
4697 1 18 . 1 1 18 18 TYR N N 18 118.100 118.100 118.404 -0.304 18327
4698 1 18 . 1 1 18 18 TYR HA H 18 4.490 4.490 4.503 -0.013 18327
4699 1 18 . 1 1 18 18 TYR CA C 18 55.300 55.300 57.260 -1.960 18327
4700 1 18 . 1 1 18 18 TYR CB C 18 42.810 42.810 41.665 1.145 18327
4701 1 18 . 1 1 18 18 TYR H H 18 7.288 7.288 7.342 -0.054 18327
4702 1 18 . 1 1 19 19 ASN N N 19 116.800 116.800 121.326 -4.526 18327
4703 1 18 . 1 1 19 19 ASN HA H 19 4.710 4.710 4.756 -0.046 18327
4704 1 18 . 1 1 19 19 ASN CA C 19 52.940 52.940 53.385 -0.445 18327
4705 1 18 . 1 1 19 19 ASN CB C 19 39.060 39.060 39.767 -0.706 18327
4706 1 18 . 1 1 19 19 ASN H H 19 8.122 8.122 8.541 -0.419 18327
4707 1 18 . 1 1 20 20 TYR N N 20 122.000 122.000 125.684 -3.684 18327
4708 1 18 . 1 1 20 20 TYR HA H 20 4.710 4.710 4.689 0.021 18327
4709 1 18 . 1 1 20 20 TYR CA C 20 57.720 57.720 57.817 -0.097 18327
4710 1 18 . 1 1 20 20 TYR CB C 20 42.250 42.250 42.336 -0.086 18327
4711 1 18 . 1 1 20 20 TYR H H 20 8.994 8.994 8.408 0.586 18327
4712 1 18 . 1 1 21 21 ASP N N 21 128.500 128.500 119.994 8.506 18327
4713 1 18 . 1 1 21 21 ASP HA H 21 4.790 4.790 4.780 0.010 18327
4714 1 18 . 1 1 21 21 ASP CA C 21 52.370 52.370 52.198 0.172 18327
4715 1 18 . 1 1 21 21 ASP CB C 21 41.130 41.130 43.706 -2.576 18327
4716 1 18 . 1 1 21 21 ASP H H 21 7.839 7.839 7.872 -0.033 18327
4717 1 18 . 1 1 22 22 ALA N N 22 125.200 125.200 121.669 3.531 18327
4718 1 18 . 1 1 22 22 ALA HA H 22 4.050 4.050 4.581 -0.531 18327
4719 1 18 . 1 1 22 22 ALA CA C 22 52.940 52.940 51.956 0.984 18327
4720 1 18 . 1 1 22 22 ALA CB C 22 20.450 20.450 19.898 0.552 18327
4721 1 18 . 1 1 22 22 ALA H H 22 8.107 8.107 8.285 -0.178 18327
4722 1 18 . 1 1 23 23 ARG N N 23 122.200 122.200 122.584 -0.384 18327
4723 1 18 . 1 1 23 23 ARG HA H 23 4.350 4.350 4.190 0.160 18327
4724 1 18 . 1 1 23 23 ARG CA C 23 55.490 55.490 56.657 -1.167 18327
4725 1 18 . 1 1 23 23 ARG CB C 23 30.700 30.700 30.912 -0.212 18327
4726 1 18 . 1 1 23 23 ARG H H 23 8.889 8.889 8.769 0.120 18327
4727 1 18 . 1 1 24 24 GLY N N 24 105.200 105.200 105.705 -0.505 18327
4728 1 18 . 1 1 24 24 GLY CA C 24 44.500 44.500 44.333 0.167 18327
4729 1 18 . 1 1 24 24 GLY H H 24 7.267 7.267 7.600 -0.333 18327
4730 1 18 . 1 1 25 25 ALA N N 25 122.200 122.200 121.571 0.629 18327
4731 1 18 . 1 1 25 25 ALA HA H 25 4.160 4.160 4.224 -0.064 18327
4732 1 18 . 1 1 25 25 ALA CA C 25 54.440 54.440 54.240 0.200 18327
4733 1 18 . 1 1 25 25 ALA CB C 25 18.770 18.770 18.997 -0.227 18327
4734 1 18 . 1 1 25 25 ALA H H 25 8.621 8.621 8.530 0.091 18327
4735 1 18 . 1 1 26 26 ASP N N 26 114.700 114.700 116.682 -1.982 18327
4736 1 18 . 1 1 26 26 ASP HA H 26 4.700 4.700 4.567 0.133 18327
4737 1 18 . 1 1 26 26 ASP CA C 26 53.870 53.870 55.462 -1.592 18327
4738 1 18 . 1 1 26 26 ASP CB C 26 40.390 40.390 40.873 -0.484 18327
4739 1 18 . 1 1 26 26 ASP H H 26 8.949 8.949 8.503 0.446 18327
4740 1 18 . 1 1 27 27 GLU N N 27 118.800 118.800 117.879 0.921 18327
4741 1 18 . 1 1 27 27 GLU HA H 27 5.220 5.220 4.887 0.333 18327
4742 1 18 . 1 1 27 27 GLU CA C 27 54.930 54.930 55.735 -0.805 18327
4743 1 18 . 1 1 27 27 GLU CB C 27 32.880 32.880 31.599 1.282 18327
4744 1 18 . 1 1 27 27 GLU H H 27 7.542 7.542 7.566 -0.024 18327
4745 1 18 . 1 1 28 28 LEU N N 28 121.400 121.400 120.212 1.188 18327
4746 1 18 . 1 1 28 28 LEU HA H 28 4.760 4.760 4.778 -0.018 18327
4747 1 18 . 1 1 28 28 LEU CA C 28 53.120 53.120 53.652 -0.532 18327
4748 1 18 . 1 1 28 28 LEU CB C 28 44.500 44.500 46.536 -2.036 18327
4749 1 18 . 1 1 28 28 LEU H H 28 8.897 8.897 8.525 0.372 18327
4750 1 18 . 1 1 29 29 SER N N 29 115.700 115.700 118.479 -2.779 18327
4751 1 18 . 1 1 29 29 SER HA H 29 5.030 5.030 4.610 0.420 18327
4752 1 18 . 1 1 29 29 SER CA C 29 58.470 58.470 58.303 0.168 18327
4753 1 18 . 1 1 29 29 SER CB C 29 63.690 63.690 64.003 -0.313 18327
4754 1 18 . 1 1 29 29 SER H H 29 7.949 7.949 8.352 -0.403 18327
4755 1 18 . 1 1 30 30 LEU N N 30 121.300 121.300 120.644 0.656 18327
4756 1 18 . 1 1 30 30 LEU HA H 30 4.800 4.800 4.539 0.261 18327
4757 1 18 . 1 1 30 30 LEU CA C 30 52.940 52.940 55.310 -2.370 18327
4758 1 18 . 1 1 30 30 LEU CB C 30 46.370 46.370 46.298 0.071 18327
4759 1 18 . 1 1 30 30 LEU H H 30 9.503 9.503 8.545 0.958 18327
4760 1 18 . 1 1 31 31 GLN N N 31 123.100 123.100 121.782 1.318 18327
4761 1 18 . 1 1 31 31 GLN HA H 31 5.070 5.070 4.642 0.428 18327
4762 1 18 . 1 1 31 31 GLN CA C 31 52.940 52.940 53.832 -0.892 18327
4763 1 18 . 1 1 31 31 GLN CB C 31 31.190 31.190 31.509 -0.319 18327
4764 1 18 . 1 1 31 31 GLN H H 31 9.152 9.152 8.546 0.606 18327
4765 1 18 . 1 1 32 32 ILE N N 32 120.800 120.800 122.255 -1.455 18327
4766 1 18 . 1 1 32 32 ILE HA H 32 3.030 3.030 3.870 -0.840 18327
4767 1 18 . 1 1 32 32 ILE CA C 32 64.250 64.250 62.561 1.689 18327
4768 1 18 . 1 1 32 32 ILE CB C 32 37.940 37.940 37.593 0.347 18327
4769 1 18 . 1 1 32 32 ILE H H 32 8.019 8.019 8.529 -0.510 18327
4770 1 18 . 1 1 33 33 GLY N N 33 115.700 115.700 114.136 1.564 18327
4771 1 18 . 1 1 33 33 GLY CA C 33 44.500 44.500 44.777 -0.277 18327
4772 1 18 . 1 1 33 33 GLY H H 33 8.777 8.777 8.493 0.284 18327
4773 1 18 . 1 1 34 34 ASP N N 34 122.300 122.300 121.626 0.674 18327
4774 1 18 . 1 1 34 34 ASP HA H 34 4.640 4.640 4.872 -0.232 18327
4775 1 18 . 1 1 34 34 ASP CA C 34 55.860 55.860 53.733 2.127 18327
4776 1 18 . 1 1 34 34 ASP CB C 34 41.310 41.310 42.895 -1.585 18327
4777 1 18 . 1 1 34 34 ASP H H 34 8.690 8.690 7.630 1.060 18327
4778 1 18 . 1 1 35 35 THR N N 35 117.900 117.900 116.165 1.735 18327
4779 1 18 . 1 1 35 35 THR HA H 35 5.160 5.160 5.279 -0.119 18327
4780 1 18 . 1 1 35 35 THR CA C 35 61.450 61.450 61.137 0.313 18327
4781 1 18 . 1 1 35 35 THR CB C 35 69.090 69.090 70.561 -1.471 18327
4782 1 18 . 1 1 35 35 THR H H 35 8.389 8.389 8.247 0.142 18327
4783 1 18 . 1 1 36 36 VAL N N 36 118.200 118.200 115.748 2.452 18327
4784 1 18 . 1 1 36 36 VAL HA H 36 5.100 5.100 4.370 0.730 18327
4785 1 18 . 1 1 36 36 VAL CA C 36 57.910 57.910 60.229 -2.319 18327
4786 1 18 . 1 1 36 36 VAL CB C 36 34.190 34.190 34.691 -0.502 18327
4787 1 18 . 1 1 36 36 VAL H H 36 9.019 9.019 8.926 0.093 18327
4788 1 18 . 1 1 37 37 HIS N N 37 122.100 122.100 120.693 1.407 18327
4789 1 18 . 1 1 37 37 HIS HA H 37 4.840 4.840 4.986 -0.146 18327
4790 1 18 . 1 1 37 37 HIS CA C 37 52.560 52.560 54.272 -1.712 18327
4791 1 18 . 1 1 37 37 HIS CB C 37 31.260 31.260 32.587 -1.327 18327
4792 1 18 . 1 1 37 37 HIS H H 37 8.489 8.489 8.693 -0.204 18327
4793 1 18 . 1 1 38 38 ILE N N 38 126.400 126.400 125.239 1.161 18327
4794 1 18 . 1 1 38 38 ILE HA H 38 3.780 3.780 4.535 -0.755 18327
4795 1 18 . 1 1 38 38 ILE CA C 38 61.640 61.640 59.476 2.164 18327
4796 1 18 . 1 1 38 38 ILE CB C 38 38.880 38.880 38.419 0.461 18327
4797 1 18 . 1 1 38 38 ILE H H 38 8.636 8.636 8.972 -0.336 18327
4798 1 18 . 1 1 39 39 LEU N N 39 126.000 126.000 122.914 3.086 18327
4799 1 18 . 1 1 39 39 LEU HA H 39 4.400 4.400 4.840 -0.440 18327
4800 1 18 . 1 1 39 39 LEU CA C 39 55.490 55.490 55.343 0.147 18327
4801 1 18 . 1 1 39 39 LEU CB C 39 43.750 43.750 44.737 -0.987 18327
4802 1 18 . 1 1 39 39 LEU H H 39 9.162 9.162 8.645 0.517 18327
4803 1 18 . 1 1 40 40 GLU N N 40 115.100 115.100 117.934 -2.834 18327
4804 1 18 . 1 1 40 40 GLU HA H 40 7.895 7.895 4.817 3.078 18327
4805 1 18 . 1 1 41 41 THR N N 41 116.400 116.400 109.135 7.265 18327
4806 1 18 . 1 1 41 41 THR HA H 41 4.270 4.270 4.776 -0.506 18327
4807 1 18 . 1 1 41 41 THR CA C 41 60.890 60.890 60.344 0.546 18327
4808 1 18 . 1 1 41 41 THR CB C 41 69.650 69.650 71.312 -1.662 18327
4809 1 18 . 1 1 41 41 THR H H 41 8.162 8.162 8.423 -0.261 18327
4810 1 18 . 1 1 43 43 GLU N N 43 123.300 123.300 120.543 2.757 18327
4811 1 18 . 1 1 43 43 GLU HA H 43 4.270 4.270 4.401 -0.131 18327
4812 1 18 . 1 1 43 43 GLU CA C 43 57.350 57.350 55.465 1.885 18327
4813 1 18 . 1 1 43 43 GLU CB C 43 26.790 26.790 29.887 -3.096 18327
4814 1 18 . 1 1 43 43 GLU H H 43 8.108 8.108 8.525 -0.417 18327
4815 1 18 . 1 1 44 44 GLY CA C 44 45.440 45.440 45.301 0.139 18327
4816 1 18 . 1 1 45 45 TRP N N 45 124.100 124.100 120.853 3.247 18327
4817 1 18 . 1 1 45 45 TRP HA H 45 4.690 4.690 4.687 0.003 18327
4818 1 18 . 1 1 45 45 TRP H H 45 8.590 8.590 6.821 1.769 18327
4819 1 18 . 1 1 46 46 TYR HA H 46 5.600 5.600 4.674 0.926 18327
4820 1 18 . 1 1 46 46 TYR CA C 46 54.060 54.060 57.580 -3.520 18327
4821 1 18 . 1 1 46 46 TYR CB C 46 42.060 42.060 39.755 2.305 18327
4822 1 18 . 1 1 47 47 ARG N N 47 118.100 118.100 122.773 -4.673 18327
4823 1 18 . 1 1 47 47 ARG HA H 47 5.070 5.070 5.053 0.017 18327
4824 1 18 . 1 1 47 47 ARG CA C 47 54.060 54.060 54.048 0.012 18327
4825 1 18 . 1 1 47 47 ARG CB C 47 33.250 33.250 34.092 -0.842 18327
4826 1 18 . 1 1 47 47 ARG H H 47 8.495 8.495 9.025 -0.530 18327
4827 1 18 . 1 1 48 48 GLY N N 48 114.000 114.000 112.670 1.330 18327
4828 1 18 . 1 1 48 48 GLY CA C 48 46.560 46.560 46.037 0.523 18327
4829 1 18 . 1 1 48 48 GLY H H 48 9.183 9.183 9.081 0.102 18327
4830 1 18 . 1 1 49 49 TYR N N 49 116.200 116.200 118.130 -1.930 18327
4831 1 18 . 1 1 49 49 TYR HA H 49 5.380 5.380 5.022 0.358 18327
4832 1 18 . 1 1 49 49 TYR CA C 49 55.110 55.110 57.035 -1.925 18327
4833 1 18 . 1 1 49 49 TYR CB C 49 40.750 40.750 39.113 1.637 18327
4834 1 18 . 1 1 49 49 TYR H H 49 8.199 8.199 8.448 -0.249 18327
4835 1 18 . 1 1 50 50 THR N N 50 112.200 112.200 111.677 0.523 18327
4836 1 18 . 1 1 50 50 THR HA H 50 5.120 5.120 4.232 0.888 18327
4837 1 18 . 1 1 50 50 THR CA C 50 59.770 59.770 61.425 -1.655 18327
4838 1 18 . 1 1 50 50 THR CB C 50 69.460 69.460 69.852 -0.392 18327
4839 1 18 . 1 1 50 50 THR H H 50 9.436 9.436 8.530 0.906 18327
4840 1 18 . 1 1 51 51 LEU N N 51 121.300 121.300 119.625 1.675 18327
4841 1 18 . 1 1 51 51 LEU HA H 51 4.230 4.230 4.387 -0.157 18327
4842 1 18 . 1 1 51 51 LEU CA C 51 56.790 56.790 54.078 2.712 18327
4843 1 18 . 1 1 51 51 LEU CB C 51 40.000 40.000 41.569 -1.569 18327
4844 1 18 . 1 1 51 51 LEU H H 51 8.313 8.313 8.211 0.102 18327
4845 1 18 . 1 1 52 52 ARG N N 52 116.600 116.600 119.045 -2.445 18327
4846 1 18 . 1 1 52 52 ARG HA H 52 4.250 4.250 4.266 -0.016 18327
4847 1 18 . 1 1 52 52 ARG CA C 52 57.350 57.350 57.053 0.297 18327
4848 1 18 . 1 1 52 52 ARG CB C 52 30.510 30.510 31.479 -0.969 18327
4849 1 18 . 1 1 52 52 ARG H H 52 8.053 8.053 8.310 -0.257 18327
4850 1 18 . 1 1 53 53 LYS N N 53 122.600 122.600 116.867 5.733 18327
4851 1 18 . 1 1 53 53 LYS HA H 53 4.620 4.620 4.476 0.144 18327
4852 1 18 . 1 1 53 53 LYS CA C 53 54.620 54.620 55.325 -0.705 18327
4853 1 18 . 1 1 53 53 LYS CB C 53 32.310 32.310 34.698 -2.388 18327
4854 1 18 . 1 1 53 53 LYS H H 53 7.655 7.655 7.609 0.046 18327
4855 1 18 . 1 1 54 54 LYS N N 54 124.900 124.900 124.347 0.553 18327
4856 1 18 . 1 1 54 54 LYS HA H 54 4.090 4.090 4.240 -0.150 18327
4857 1 18 . 1 1 54 54 LYS CA C 54 58.470 58.470 58.129 0.341 18327
4858 1 18 . 1 1 54 54 LYS CB C 54 32.130 32.130 32.462 -0.332 18327
4859 1 18 . 1 1 54 54 LYS H H 54 8.499 8.499 8.759 -0.260 18327
4860 1 18 . 1 1 55 55 SER N N 55 110.100 110.100 113.023 -2.923 18327
4861 1 18 . 1 1 55 55 SER HA H 55 4.140 4.140 4.244 -0.104 18327
4862 1 18 . 1 1 55 55 SER CA C 55 58.470 58.470 60.150 -1.680 18327
4863 1 18 . 1 1 55 55 SER CB C 55 63.310 63.310 63.325 -0.015 18327
4864 1 18 . 1 1 55 55 SER H H 55 7.862 7.862 8.009 -0.147 18327
4865 1 18 . 1 1 56 56 LYS N N 56 124.000 124.000 121.727 2.273 18327
4866 1 18 . 1 1 56 56 LYS HA H 56 4.700 4.700 4.438 0.262 18327
4867 1 18 . 1 1 56 56 LYS CA C 56 54.810 54.810 55.323 -0.513 18327
4868 1 18 . 1 1 56 56 LYS CB C 56 33.250 33.250 33.653 -0.403 18327
4869 1 18 . 1 1 56 56 LYS H H 56 7.481 7.481 7.365 0.116 18327
4870 1 18 . 1 1 57 57 LYS N N 57 125.700 125.700 123.718 1.982 18327
4871 1 18 . 1 1 57 57 LYS HA H 57 5.330 5.330 4.800 0.530 18327
4872 1 18 . 1 1 57 57 LYS CA C 57 54.620 54.620 54.824 -0.204 18327
4873 1 18 . 1 1 57 57 LYS CB C 57 34.240 34.240 36.448 -2.208 18327
4874 1 18 . 1 1 57 57 LYS H H 57 8.475 8.475 8.399 0.076 18327
4875 1 18 . 1 1 58 58 GLY N N 58 109.400 109.400 108.822 0.578 18327
4876 1 18 . 1 1 58 58 GLY CA C 58 45.620 45.620 45.526 0.094 18327
4877 1 18 . 1 1 58 58 GLY H H 58 9.073 9.073 8.397 0.676 18327
4878 1 18 . 1 1 59 59 ILE N N 59 113.900 113.900 119.987 -6.087 18327
4879 1 18 . 1 1 59 59 ILE HA H 59 6.000 6.000 5.019 0.981 18327
4880 1 18 . 1 1 59 59 ILE CA C 59 59.590 59.590 59.021 0.569 18327
4881 1 18 . 1 1 59 59 ILE CB C 59 41.140 41.140 42.803 -1.663 18327
4882 1 18 . 1 1 59 59 ILE H H 59 8.628 8.628 8.058 0.570 18327
4883 1 18 . 1 1 60 60 PHE N N 60 116.900 116.900 117.243 -0.343 18327
4884 1 18 . 1 1 60 60 PHE HA H 60 5.120 5.120 5.334 -0.214 18327
4885 1 18 . 1 1 60 60 PHE CA C 60 54.060 54.060 54.889 -0.829 18327
4886 1 18 . 1 1 60 60 PHE CB C 60 37.190 37.190 39.843 -2.653 18327
4887 1 18 . 1 1 60 60 PHE H H 60 8.724 8.724 8.660 0.064 18327
4888 1 18 . 1 1 61 61 PRO HA H 61 3.480 3.480 3.494 -0.014 18327
4889 1 18 . 1 1 61 61 PRO CA C 61 62.200 62.200 63.045 -0.845 18327
4890 1 18 . 1 1 61 61 PRO CB C 61 31.190 31.190 31.547 -0.357 18327
4891 1 18 . 1 1 62 62 ALA N N 62 124.600 124.600 128.454 -3.854 18327
4892 1 18 . 1 1 62 62 ALA HA H 62 3.720 3.720 4.391 -0.671 18327
4893 1 18 . 1 1 62 62 ALA CA C 62 54.370 54.370 54.517 -0.148 18327
4894 1 18 . 1 1 62 62 ALA CB C 62 17.650 17.650 18.229 -0.579 18327
4895 1 18 . 1 1 62 62 ALA H H 62 7.898 7.898 8.505 -0.607 18327
4896 1 18 . 1 1 63 63 SER N N 63 109.700 109.700 112.400 -2.700 18327
4897 1 18 . 1 1 63 63 SER HA H 63 4.200 4.200 4.080 0.120 18327
4898 1 18 . 1 1 63 63 SER CA C 63 59.400 59.400 60.729 -1.329 18327
4899 1 18 . 1 1 63 63 SER CB C 63 62.380 62.380 62.642 -0.262 18327
4900 1 18 . 1 1 63 63 SER H H 63 8.030 8.030 8.111 -0.081 18327
4901 1 18 . 1 1 64 64 TYR N N 64 120.300 120.300 117.449 2.851 18327
4902 1 18 . 1 1 64 64 TYR HA H 64 4.260 4.260 4.452 -0.192 18327
4903 1 18 . 1 1 64 64 TYR CA C 64 57.720 57.720 58.867 -1.147 18327
4904 1 18 . 1 1 64 64 TYR CB C 64 37.560 37.560 38.104 -0.544 18327
4905 1 18 . 1 1 64 64 TYR H H 64 7.124 7.124 7.132 -0.008 18327
4906 1 18 . 1 1 65 65 ILE N N 65 118.000 118.000 116.399 1.601 18327
4907 1 18 . 1 1 65 65 ILE HA H 65 4.830 4.830 4.727 0.103 18327
4908 1 18 . 1 1 65 65 ILE CA C 65 56.980 56.980 59.126 -2.146 18327
4909 1 18 . 1 1 65 65 ILE CB C 65 39.630 39.630 39.305 0.325 18327
4910 1 18 . 1 1 65 65 ILE H H 65 7.671 7.671 7.071 0.600 18327
4911 1 18 . 1 1 66 66 HIS N N 66 124.500 124.500 121.754 2.746 18327
4912 1 18 . 1 1 66 66 HIS HA H 66 5.130 5.130 4.954 0.176 18327
4913 1 18 . 1 1 66 66 HIS CA C 66 53.060 53.060 54.929 -1.869 18327
4914 1 18 . 1 1 66 66 HIS CB C 66 30.510 30.510 32.243 -1.733 18327
4915 1 18 . 1 1 66 66 HIS H H 66 9.159 9.159 8.538 0.621 18327
4916 1 18 . 1 1 67 67 LEU N N 67 127.400 127.400 127.284 0.116 18327
4917 1 18 . 1 1 67 67 LEU HA H 67 4.560 4.560 4.927 -0.367 18327
4918 1 18 . 1 1 67 67 LEU CA C 67 55.300 55.300 54.397 0.903 18327
4919 1 18 . 1 1 67 67 LEU CB C 67 42.060 42.060 43.972 -1.912 18327
4920 1 18 . 1 1 67 67 LEU H H 67 8.979 8.979 8.872 0.107 18327
4921 1 18 . 1 1 68 68 LYS N N 68 121.900 121.900 122.251 -0.351 18327
4922 1 18 . 1 1 68 68 LYS HA H 68 4.490 4.490 4.438 0.052 18327
4923 1 18 . 1 1 68 68 LYS CA C 68 55.110 55.110 55.868 -0.758 18327
4924 1 18 . 1 1 68 68 LYS CB C 68 34.610 34.610 32.723 1.887 18327
4925 1 18 . 1 1 68 68 LYS H H 68 8.499 8.499 8.800 -0.301 18327
4926 1 18 . 1 1 69 69 GLU N N 69 122.100 122.100 118.754 3.346 18327
4927 1 18 . 1 1 69 69 GLU HA H 69 4.290 4.290 4.011 0.279 18327
4928 1 18 . 1 1 69 69 GLU CA C 69 56.610 56.610 57.425 -0.815 18327
4929 1 18 . 1 1 69 69 GLU CB C 69 30.330 30.330 28.744 1.586 18327
4930 1 18 . 1 1 69 69 GLU H H 69 8.569 8.569 8.325 0.244 18327
4931 1 18 . 1 1 70 70 ALA N N 70 123.300 123.300 122.339 0.961 18327
4932 1 18 . 1 1 70 70 ALA HA H 70 4.210 4.210 3.967 0.243 18327
4933 1 18 . 1 1 70 70 ALA CA C 70 51.810 51.810 53.158 -1.349 18327
4934 1 18 . 1 1 70 70 ALA CB C 70 19.700 19.700 19.033 0.667 18327
4935 1 18 . 1 1 70 70 ALA H H 70 8.181 8.181 7.866 0.315 18327
4936 1 18 . 1 1 71 71 ILE N N 71 120.000 120.000 120.485 -0.485 18327
4937 1 18 . 1 1 71 71 ILE HA H 71 4.070 4.070 4.299 -0.229 18327
4938 1 18 . 1 1 71 71 ILE CA C 71 60.330 60.330 60.262 0.068 18327
4939 1 18 . 1 1 71 71 ILE CB C 71 38.690 38.690 40.107 -1.417 18327
4940 1 18 . 1 1 71 71 ILE H H 71 7.789 7.789 8.467 -0.678 18327
4941 1 18 . 1 1 72 72 VAL N N 72 124.400 124.400 120.242 4.158 18327
4942 1 18 . 1 1 72 72 VAL HA H 72 4.070 4.070 4.366 -0.296 18327
4943 1 18 . 1 1 72 72 VAL CA C 72 61.640 61.640 60.986 0.654 18327
4944 1 18 . 1 1 72 72 VAL CB C 72 32.690 32.690 34.001 -1.311 18327
4945 1 18 . 1 1 72 72 VAL H H 72 8.089 8.089 8.051 0.038 18327
4946 1 18 . 1 1 73 73 GLU N N 73 125.940 125.940 122.300 3.640 18327
4947 1 18 . 1 1 73 73 GLU HA H 73 4.300 4.300 4.688 -0.388 18327
4948 1 18 . 1 1 73 73 GLU CA C 73 56.610 56.610 55.786 0.824 18327
4949 1 18 . 1 1 73 73 GLU CB C 73 30.710 30.710 31.011 -0.301 18327
4950 1 18 . 1 1 73 73 GLU H H 73 8.464 8.464 8.555 -0.091 18327
4951 1 19 . 1 1 13 13 TYR HA H 13 5.560 5.560 4.332 1.228 18327
4952 1 19 . 1 1 13 13 TYR CA C 13 55.860 55.860 57.869 -2.009 18327
4953 1 19 . 1 1 13 13 TYR CB C 13 42.440 42.440 41.249 1.191 18327
4954 1 19 . 1 1 14 14 GLY N N 14 105.400 105.400 106.326 -0.926 18327
4955 1 19 . 1 1 14 14 GLY CA C 14 45.240 45.240 43.736 1.504 18327
4956 1 19 . 1 1 14 14 GLY H H 14 8.406 8.406 8.391 0.015 18327
4957 1 19 . 1 1 15 15 VAL N N 15 118.900 118.900 121.422 -2.522 18327
4958 1 19 . 1 1 15 15 VAL HA H 15 5.330 5.330 4.767 0.563 18327
4959 1 19 . 1 1 15 15 VAL CA C 15 59.210 59.210 61.136 -1.927 18327
4960 1 19 . 1 1 15 15 VAL CB C 15 35.740 35.740 36.564 -0.824 18327
4961 1 19 . 1 1 15 15 VAL H H 15 8.854 8.854 8.179 0.675 18327
4962 1 19 . 1 1 16 16 ALA N N 16 129.400 129.400 128.142 1.258 18327
4963 1 19 . 1 1 16 16 ALA HA H 16 5.000 5.000 4.590 0.410 18327
4964 1 19 . 1 1 16 16 ALA CA C 16 52.000 52.000 51.319 0.681 18327
4965 1 19 . 1 1 16 16 ALA CB C 16 19.330 19.330 20.223 -0.893 18327
4966 1 19 . 1 1 16 16 ALA H H 16 9.112 9.112 8.915 0.197 18327
4967 1 19 . 1 1 17 17 PHE N N 17 123.900 123.900 123.876 0.024 18327
4968 1 19 . 1 1 17 17 PHE HA H 17 4.740 4.740 4.529 0.211 18327
4969 1 19 . 1 1 17 17 PHE CA C 17 56.230 56.230 57.014 -0.784 18327
4970 1 19 . 1 1 17 17 PHE CB C 17 40.000 40.000 40.804 -0.804 18327
4971 1 19 . 1 1 17 17 PHE H H 17 8.785 8.785 8.115 0.670 18327
4972 1 19 . 1 1 18 18 TYR N N 18 118.100 118.100 118.271 -0.171 18327
4973 1 19 . 1 1 18 18 TYR HA H 18 4.490 4.490 4.444 0.046 18327
4974 1 19 . 1 1 18 18 TYR CA C 18 55.300 55.300 57.199 -1.899 18327
4975 1 19 . 1 1 18 18 TYR CB C 18 42.810 42.810 40.678 2.131 18327
4976 1 19 . 1 1 18 18 TYR H H 18 7.288 7.288 7.582 -0.294 18327
4977 1 19 . 1 1 19 19 ASN N N 19 116.800 116.800 120.810 -4.010 18327
4978 1 19 . 1 1 19 19 ASN HA H 19 4.710 4.710 4.766 -0.056 18327
4979 1 19 . 1 1 19 19 ASN CA C 19 52.940 52.940 53.347 -0.407 18327
4980 1 19 . 1 1 19 19 ASN CB C 19 39.060 39.060 39.398 -0.338 18327
4981 1 19 . 1 1 19 19 ASN H H 19 8.122 8.122 8.652 -0.530 18327
4982 1 19 . 1 1 20 20 TYR N N 20 122.000 122.000 122.800 -0.800 18327
4983 1 19 . 1 1 20 20 TYR HA H 20 4.710 4.710 4.552 0.158 18327
4984 1 19 . 1 1 20 20 TYR CA C 20 57.720 57.720 58.099 -0.379 18327
4985 1 19 . 1 1 20 20 TYR CB C 20 42.250 42.250 42.099 0.151 18327
4986 1 19 . 1 1 20 20 TYR H H 20 8.994 8.994 8.539 0.455 18327
4987 1 19 . 1 1 21 21 ASP N N 21 128.500 128.500 119.674 8.826 18327
4988 1 19 . 1 1 21 21 ASP HA H 21 4.790 4.790 5.042 -0.252 18327
4989 1 19 . 1 1 21 21 ASP CA C 21 52.370 52.370 52.317 0.053 18327
4990 1 19 . 1 1 21 21 ASP CB C 21 41.130 41.130 44.047 -2.917 18327
4991 1 19 . 1 1 21 21 ASP H H 21 7.839 7.839 7.750 0.089 18327
4992 1 19 . 1 1 22 22 ALA N N 22 125.200 125.200 121.831 3.369 18327
4993 1 19 . 1 1 22 22 ALA HA H 22 4.050 4.050 4.409 -0.359 18327
4994 1 19 . 1 1 22 22 ALA CA C 22 52.940 52.940 52.793 0.147 18327
4995 1 19 . 1 1 22 22 ALA CB C 22 20.450 20.450 19.787 0.663 18327
4996 1 19 . 1 1 22 22 ALA H H 22 8.107 8.107 8.405 -0.298 18327
4997 1 19 . 1 1 23 23 ARG N N 23 122.200 122.200 121.281 0.919 18327
4998 1 19 . 1 1 23 23 ARG HA H 23 4.350 4.350 4.438 -0.088 18327
4999 1 19 . 1 1 23 23 ARG CA C 23 55.490 55.490 55.622 -0.132 18327
5000 1 19 . 1 1 23 23 ARG CB C 23 30.700 30.700 31.098 -0.397 18327
5001 1 19 . 1 1 23 23 ARG H H 23 8.889 8.889 8.586 0.303 18327
5002 1 19 . 1 1 24 24 GLY N N 24 105.200 105.200 107.815 -2.615 18327
5003 1 19 . 1 1 24 24 GLY CA C 24 44.500 44.500 45.334 -0.834 18327
5004 1 19 . 1 1 24 24 GLY H H 24 7.267 7.267 7.521 -0.254 18327
5005 1 19 . 1 1 25 25 ALA N N 25 122.200 122.200 122.732 -0.532 18327
5006 1 19 . 1 1 25 25 ALA HA H 25 4.160 4.160 4.274 -0.114 18327
5007 1 19 . 1 1 25 25 ALA CA C 25 54.440 54.440 54.151 0.289 18327
5008 1 19 . 1 1 25 25 ALA CB C 25 18.770 18.770 18.900 -0.130 18327
5009 1 19 . 1 1 25 25 ALA H H 25 8.621 8.621 8.545 0.076 18327
5010 1 19 . 1 1 26 26 ASP N N 26 114.700 114.700 119.250 -4.550 18327
5011 1 19 . 1 1 26 26 ASP HA H 26 4.700 4.700 4.701 -0.001 18327
5012 1 19 . 1 1 26 26 ASP CA C 26 53.870 53.870 54.070 -0.200 18327
5013 1 19 . 1 1 26 26 ASP CB C 26 40.390 40.390 40.276 0.114 18327
5014 1 19 . 1 1 26 26 ASP H H 26 8.949 8.949 8.564 0.385 18327
5015 1 19 . 1 1 27 27 GLU N N 27 118.800 118.800 119.336 -0.536 18327
5016 1 19 . 1 1 27 27 GLU HA H 27 5.220 5.220 4.986 0.234 18327
5017 1 19 . 1 1 27 27 GLU CA C 27 54.930 54.930 55.071 -0.141 18327
5018 1 19 . 1 1 27 27 GLU CB C 27 32.880 32.880 31.678 1.202 18327
5019 1 19 . 1 1 27 27 GLU H H 27 7.542 7.542 7.550 -0.008 18327
5020 1 19 . 1 1 28 28 LEU N N 28 121.400 121.400 120.236 1.164 18327
5021 1 19 . 1 1 28 28 LEU HA H 28 4.760 4.760 4.720 0.040 18327
5022 1 19 . 1 1 28 28 LEU CA C 28 53.120 53.120 54.102 -0.982 18327
5023 1 19 . 1 1 28 28 LEU CB C 28 44.500 44.500 45.690 -1.190 18327
5024 1 19 . 1 1 28 28 LEU H H 28 8.897 8.897 8.429 0.468 18327
5025 1 19 . 1 1 29 29 SER N N 29 115.700 115.700 116.111 -0.411 18327
5026 1 19 . 1 1 29 29 SER HA H 29 5.030 5.030 5.225 -0.195 18327
5027 1 19 . 1 1 29 29 SER CA C 29 58.470 58.470 58.760 -0.290 18327
5028 1 19 . 1 1 29 29 SER CB C 29 63.690 63.690 64.069 -0.379 18327
5029 1 19 . 1 1 29 29 SER H H 29 7.949 7.949 8.281 -0.332 18327
5030 1 19 . 1 1 30 30 LEU N N 30 121.300 121.300 120.124 1.176 18327
5031 1 19 . 1 1 30 30 LEU HA H 30 4.800 4.800 4.551 0.249 18327
5032 1 19 . 1 1 30 30 LEU CA C 30 52.940 52.940 55.539 -2.599 18327
5033 1 19 . 1 1 30 30 LEU CB C 30 46.370 46.370 46.505 -0.135 18327
5034 1 19 . 1 1 30 30 LEU H H 30 9.503 9.503 8.565 0.938 18327
5035 1 19 . 1 1 31 31 GLN N N 31 123.100 123.100 120.688 2.412 18327
5036 1 19 . 1 1 31 31 GLN HA H 31 5.070 5.070 4.549 0.521 18327
5037 1 19 . 1 1 31 31 GLN CA C 31 52.940 52.940 54.126 -1.186 18327
5038 1 19 . 1 1 31 31 GLN CB C 31 31.190 31.190 32.462 -1.272 18327
5039 1 19 . 1 1 31 31 GLN H H 31 9.152 9.152 8.249 0.903 18327
5040 1 19 . 1 1 32 32 ILE N N 32 120.800 120.800 121.340 -0.540 18327
5041 1 19 . 1 1 32 32 ILE HA H 32 3.030 3.030 3.870 -0.840 18327
5042 1 19 . 1 1 32 32 ILE CA C 32 64.250 64.250 62.400 1.850 18327
5043 1 19 . 1 1 32 32 ILE CB C 32 37.940 37.940 37.462 0.478 18327
5044 1 19 . 1 1 32 32 ILE H H 32 8.019 8.019 8.459 -0.440 18327
5045 1 19 . 1 1 33 33 GLY N N 33 115.700 115.700 114.310 1.390 18327
5046 1 19 . 1 1 33 33 GLY CA C 33 44.500 44.500 44.974 -0.474 18327
5047 1 19 . 1 1 33 33 GLY H H 33 8.777 8.777 8.534 0.243 18327
5048 1 19 . 1 1 34 34 ASP N N 34 122.300 122.300 121.739 0.561 18327
5049 1 19 . 1 1 34 34 ASP HA H 34 4.640 4.640 4.896 -0.256 18327
5050 1 19 . 1 1 34 34 ASP CA C 34 55.860 55.860 53.505 2.355 18327
5051 1 19 . 1 1 34 34 ASP CB C 34 41.310 41.310 42.585 -1.275 18327
5052 1 19 . 1 1 34 34 ASP H H 34 8.690 8.690 7.546 1.144 18327
5053 1 19 . 1 1 35 35 THR N N 35 117.900 117.900 115.824 2.076 18327
5054 1 19 . 1 1 35 35 THR HA H 35 5.160 5.160 5.104 0.056 18327
5055 1 19 . 1 1 35 35 THR CA C 35 61.450 61.450 61.321 0.129 18327
5056 1 19 . 1 1 35 35 THR CB C 35 69.090 69.090 70.763 -1.673 18327
5057 1 19 . 1 1 35 35 THR H H 35 8.389 8.389 8.274 0.115 18327
5058 1 19 . 1 1 36 36 VAL N N 36 118.200 118.200 117.121 1.079 18327
5059 1 19 . 1 1 36 36 VAL HA H 36 5.100 5.100 4.792 0.308 18327
5060 1 19 . 1 1 36 36 VAL CA C 36 57.910 57.910 60.246 -2.336 18327
5061 1 19 . 1 1 36 36 VAL CB C 36 34.190 34.190 35.237 -1.047 18327
5062 1 19 . 1 1 36 36 VAL H H 36 9.019 9.019 8.959 0.060 18327
5063 1 19 . 1 1 37 37 HIS N N 37 122.100 122.100 119.574 2.526 18327
5064 1 19 . 1 1 37 37 HIS HA H 37 4.840 4.840 5.001 -0.161 18327
5065 1 19 . 1 1 37 37 HIS CA C 37 52.560 52.560 54.310 -1.750 18327
5066 1 19 . 1 1 37 37 HIS CB C 37 31.260 31.260 33.135 -1.875 18327
5067 1 19 . 1 1 37 37 HIS H H 37 8.489 8.489 8.769 -0.280 18327
5068 1 19 . 1 1 38 38 ILE N N 38 126.400 126.400 126.273 0.127 18327
5069 1 19 . 1 1 38 38 ILE HA H 38 3.780 3.780 4.160 -0.380 18327
5070 1 19 . 1 1 38 38 ILE CA C 38 61.640 61.640 61.144 0.496 18327
5071 1 19 . 1 1 38 38 ILE CB C 38 38.880 38.880 38.635 0.245 18327
5072 1 19 . 1 1 38 38 ILE H H 38 8.636 8.636 8.697 -0.061 18327
5073 1 19 . 1 1 39 39 LEU N N 39 126.000 126.000 126.699 -0.699 18327
5074 1 19 . 1 1 39 39 LEU HA H 39 4.400 4.400 4.777 -0.377 18327
5075 1 19 . 1 1 39 39 LEU CA C 39 55.490 55.490 55.353 0.137 18327
5076 1 19 . 1 1 39 39 LEU CB C 39 43.750 43.750 43.678 0.072 18327
5077 1 19 . 1 1 39 39 LEU H H 39 9.162 9.162 8.634 0.528 18327
5078 1 19 . 1 1 40 40 GLU N N 40 115.100 115.100 116.967 -1.867 18327
5079 1 19 . 1 1 40 40 GLU HA H 40 7.895 7.895 4.584 3.311 18327
5080 1 19 . 1 1 41 41 THR N N 41 116.400 116.400 113.344 3.056 18327
5081 1 19 . 1 1 41 41 THR HA H 41 4.270 4.270 4.756 -0.486 18327
5082 1 19 . 1 1 41 41 THR CA C 41 60.890 60.890 61.203 -0.313 18327
5083 1 19 . 1 1 41 41 THR CB C 41 69.650 69.650 69.625 0.025 18327
5084 1 19 . 1 1 41 41 THR H H 41 8.162 8.162 8.518 -0.356 18327
5085 1 19 . 1 1 43 43 GLU N N 43 123.300 123.300 121.319 1.981 18327
5086 1 19 . 1 1 43 43 GLU HA H 43 4.270 4.270 4.461 -0.191 18327
5087 1 19 . 1 1 43 43 GLU CA C 43 57.350 57.350 55.453 1.897 18327
5088 1 19 . 1 1 43 43 GLU CB C 43 26.790 26.790 29.403 -2.613 18327
5089 1 19 . 1 1 43 43 GLU H H 43 8.108 8.108 8.362 -0.254 18327
5090 1 19 . 1 1 44 44 GLY CA C 44 45.440 45.440 45.770 -0.330 18327
5091 1 19 . 1 1 45 45 TRP N N 45 124.100 124.100 120.062 4.038 18327
5092 1 19 . 1 1 45 45 TRP HA H 45 4.690 4.690 4.789 -0.099 18327
5093 1 19 . 1 1 45 45 TRP H H 45 8.590 8.590 7.447 1.143 18327
5094 1 19 . 1 1 46 46 TYR HA H 46 5.600 5.600 4.639 0.961 18327
5095 1 19 . 1 1 46 46 TYR CA C 46 54.060 54.060 57.062 -3.002 18327
5096 1 19 . 1 1 46 46 TYR CB C 46 42.060 42.060 42.161 -0.101 18327
5097 1 19 . 1 1 47 47 ARG N N 47 118.100 118.100 121.738 -3.638 18327
5098 1 19 . 1 1 47 47 ARG HA H 47 5.070 5.070 4.884 0.186 18327
5099 1 19 . 1 1 47 47 ARG CA C 47 54.060 54.060 54.261 -0.201 18327
5100 1 19 . 1 1 47 47 ARG CB C 47 33.250 33.250 34.803 -1.553 18327
5101 1 19 . 1 1 47 47 ARG H H 47 8.495 8.495 9.189 -0.694 18327
5102 1 19 . 1 1 48 48 GLY N N 48 114.000 114.000 113.673 0.327 18327
5103 1 19 . 1 1 48 48 GLY CA C 48 46.560 46.560 46.493 0.067 18327
5104 1 19 . 1 1 48 48 GLY H H 48 9.183 9.183 8.916 0.267 18327
5105 1 19 . 1 1 49 49 TYR N N 49 116.200 116.200 116.020 0.180 18327
5106 1 19 . 1 1 49 49 TYR HA H 49 5.380 5.380 5.102 0.278 18327
5107 1 19 . 1 1 49 49 TYR CA C 49 55.110 55.110 56.995 -1.885 18327
5108 1 19 . 1 1 49 49 TYR CB C 49 40.750 40.750 39.709 1.041 18327
5109 1 19 . 1 1 49 49 TYR H H 49 8.199 8.199 8.258 -0.059 18327
5110 1 19 . 1 1 50 50 THR N N 50 112.200 112.200 110.970 1.230 18327
5111 1 19 . 1 1 50 50 THR HA H 50 5.120 5.120 4.398 0.722 18327
5112 1 19 . 1 1 50 50 THR CA C 50 59.770 59.770 61.023 -1.254 18327
5113 1 19 . 1 1 50 50 THR CB C 50 69.460 69.460 70.088 -0.628 18327
5114 1 19 . 1 1 50 50 THR H H 50 9.436 9.436 8.401 1.035 18327
5115 1 19 . 1 1 51 51 LEU N N 51 121.300 121.300 120.183 1.117 18327
5116 1 19 . 1 1 51 51 LEU HA H 51 4.230 4.230 4.404 -0.174 18327
5117 1 19 . 1 1 51 51 LEU CA C 51 56.790 56.790 56.489 0.301 18327
5118 1 19 . 1 1 51 51 LEU CB C 51 40.000 40.000 42.044 -2.044 18327
5119 1 19 . 1 1 51 51 LEU H H 51 8.313 8.313 8.051 0.262 18327
5120 1 19 . 1 1 52 52 ARG N N 52 116.600 116.600 117.943 -1.343 18327
5121 1 19 . 1 1 52 52 ARG HA H 52 4.250 4.250 4.163 0.087 18327
5122 1 19 . 1 1 52 52 ARG CA C 52 57.350 57.350 56.825 0.525 18327
5123 1 19 . 1 1 52 52 ARG CB C 52 30.510 30.510 30.549 -0.039 18327
5124 1 19 . 1 1 52 52 ARG H H 52 8.053 8.053 8.255 -0.202 18327
5125 1 19 . 1 1 53 53 LYS N N 53 122.600 122.600 117.560 5.040 18327
5126 1 19 . 1 1 53 53 LYS HA H 53 4.620 4.620 4.546 0.074 18327
5127 1 19 . 1 1 53 53 LYS CA C 53 54.620 54.620 55.195 -0.575 18327
5128 1 19 . 1 1 53 53 LYS CB C 53 32.310 32.310 33.487 -1.177 18327
5129 1 19 . 1 1 53 53 LYS H H 53 7.655 7.655 7.453 0.202 18327
5130 1 19 . 1 1 54 54 LYS N N 54 124.900 124.900 124.741 0.159 18327
5131 1 19 . 1 1 54 54 LYS HA H 54 4.090 4.090 4.194 -0.104 18327
5132 1 19 . 1 1 54 54 LYS CA C 54 58.470 58.470 58.213 0.257 18327
5133 1 19 . 1 1 54 54 LYS CB C 54 32.130 32.130 32.512 -0.382 18327
5134 1 19 . 1 1 54 54 LYS H H 54 8.499 8.499 8.693 -0.194 18327
5135 1 19 . 1 1 55 55 SER N N 55 110.100 110.100 111.464 -1.364 18327
5136 1 19 . 1 1 55 55 SER HA H 55 4.140 4.140 4.304 -0.164 18327
5137 1 19 . 1 1 55 55 SER CA C 55 58.470 58.470 59.601 -1.131 18327
5138 1 19 . 1 1 55 55 SER CB C 55 63.310 63.310 62.854 0.456 18327
5139 1 19 . 1 1 55 55 SER H H 55 7.862 7.862 7.924 -0.062 18327
5140 1 19 . 1 1 56 56 LYS N N 56 124.000 124.000 122.607 1.393 18327
5141 1 19 . 1 1 56 56 LYS HA H 56 4.700 4.700 4.500 0.200 18327
5142 1 19 . 1 1 56 56 LYS CA C 56 54.810 54.810 54.985 -0.175 18327
5143 1 19 . 1 1 56 56 LYS CB C 56 33.250 33.250 32.470 0.780 18327
5144 1 19 . 1 1 56 56 LYS H H 56 7.481 7.481 7.464 0.017 18327
5145 1 19 . 1 1 57 57 LYS N N 57 125.700 125.700 122.017 3.683 18327
5146 1 19 . 1 1 57 57 LYS HA H 57 5.330 5.330 4.473 0.857 18327
5147 1 19 . 1 1 57 57 LYS CA C 57 54.620 54.620 55.945 -1.325 18327
5148 1 19 . 1 1 57 57 LYS CB C 57 34.240 34.240 33.929 0.311 18327
5149 1 19 . 1 1 57 57 LYS H H 57 8.475 8.475 8.079 0.396 18327
5150 1 19 . 1 1 58 58 GLY N N 58 109.400 109.400 106.731 2.669 18327
5151 1 19 . 1 1 58 58 GLY CA C 58 45.620 45.620 45.342 0.278 18327
5152 1 19 . 1 1 58 58 GLY H H 58 9.073 9.073 8.311 0.762 18327
5153 1 19 . 1 1 59 59 ILE N N 59 113.900 113.900 116.456 -2.556 18327
5154 1 19 . 1 1 59 59 ILE HA H 59 6.000 6.000 4.952 1.048 18327
5155 1 19 . 1 1 59 59 ILE CA C 59 59.590 59.590 59.431 0.159 18327
5156 1 19 . 1 1 59 59 ILE CB C 59 41.140 41.140 42.080 -0.940 18327
5157 1 19 . 1 1 59 59 ILE H H 59 8.628 8.628 8.326 0.302 18327
5158 1 19 . 1 1 60 60 PHE N N 60 116.900 116.900 114.132 2.768 18327
5159 1 19 . 1 1 60 60 PHE HA H 60 5.120 5.120 5.183 -0.063 18327
5160 1 19 . 1 1 60 60 PHE CA C 60 54.060 54.060 55.218 -1.158 18327
5161 1 19 . 1 1 60 60 PHE CB C 60 37.190 37.190 40.196 -3.006 18327
5162 1 19 . 1 1 60 60 PHE H H 60 8.724 8.724 8.455 0.269 18327
5163 1 19 . 1 1 61 61 PRO HA H 61 3.480 3.480 4.106 -0.626 18327
5164 1 19 . 1 1 61 61 PRO CA C 61 62.200 62.200 62.174 0.026 18327
5165 1 19 . 1 1 61 61 PRO CB C 61 31.190 31.190 32.595 -1.405 18327
5166 1 19 . 1 1 62 62 ALA N N 62 124.600 124.600 127.561 -2.961 18327
5167 1 19 . 1 1 62 62 ALA HA H 62 3.720 3.720 4.468 -0.748 18327
5168 1 19 . 1 1 62 62 ALA CA C 62 54.370 54.370 55.172 -0.802 18327
5169 1 19 . 1 1 62 62 ALA CB C 62 17.650 17.650 18.087 -0.438 18327
5170 1 19 . 1 1 62 62 ALA H H 62 7.898 7.898 8.591 -0.693 18327
5171 1 19 . 1 1 63 63 SER N N 63 109.700 109.700 111.756 -2.056 18327
5172 1 19 . 1 1 63 63 SER HA H 63 4.200 4.200 4.230 -0.030 18327
5173 1 19 . 1 1 63 63 SER CA C 63 59.400 59.400 60.765 -1.365 18327
5174 1 19 . 1 1 63 63 SER CB C 63 62.380 62.380 62.848 -0.468 18327
5175 1 19 . 1 1 63 63 SER H H 63 8.030 8.030 8.298 -0.268 18327
5176 1 19 . 1 1 64 64 TYR N N 64 120.300 120.300 117.338 2.962 18327
5177 1 19 . 1 1 64 64 TYR HA H 64 4.260 4.260 4.587 -0.327 18327
5178 1 19 . 1 1 64 64 TYR CA C 64 57.720 57.720 59.068 -1.348 18327
5179 1 19 . 1 1 64 64 TYR CB C 64 37.560 37.560 39.199 -1.639 18327
5180 1 19 . 1 1 64 64 TYR H H 64 7.124 7.124 7.262 -0.138 18327
5181 1 19 . 1 1 65 65 ILE N N 65 118.000 118.000 118.360 -0.360 18327
5182 1 19 . 1 1 65 65 ILE HA H 65 4.830 4.830 4.634 0.196 18327
5183 1 19 . 1 1 65 65 ILE CA C 65 56.980 56.980 59.858 -2.878 18327
5184 1 19 . 1 1 65 65 ILE CB C 65 39.630 39.630 38.034 1.596 18327
5185 1 19 . 1 1 65 65 ILE H H 65 7.671 7.671 7.461 0.210 18327
5186 1 19 . 1 1 66 66 HIS N N 66 124.500 124.500 124.707 -0.207 18327
5187 1 19 . 1 1 66 66 HIS HA H 66 5.130 5.130 4.900 0.230 18327
5188 1 19 . 1 1 66 66 HIS CA C 66 53.060 53.060 54.110 -1.050 18327
5189 1 19 . 1 1 66 66 HIS CB C 66 30.510 30.510 32.986 -2.476 18327
5190 1 19 . 1 1 66 66 HIS H H 66 9.159 9.159 9.104 0.055 18327
5191 1 19 . 1 1 67 67 LEU N N 67 127.400 127.400 124.538 2.862 18327
5192 1 19 . 1 1 67 67 LEU HA H 67 4.560 4.560 4.929 -0.369 18327
5193 1 19 . 1 1 67 67 LEU CA C 67 55.300 55.300 55.195 0.105 18327
5194 1 19 . 1 1 67 67 LEU CB C 67 42.060 42.060 43.095 -1.035 18327
5195 1 19 . 1 1 67 67 LEU H H 67 8.979 8.979 8.768 0.211 18327
5196 1 19 . 1 1 68 68 LYS N N 68 121.900 121.900 122.553 -0.653 18327
5197 1 19 . 1 1 68 68 LYS HA H 68 4.490 4.490 4.466 0.024 18327
5198 1 19 . 1 1 68 68 LYS CA C 68 55.110 55.110 55.694 -0.584 18327
5199 1 19 . 1 1 68 68 LYS CB C 68 34.610 34.610 35.126 -0.516 18327
5200 1 19 . 1 1 68 68 LYS H H 68 8.499 8.499 8.691 -0.192 18327
5201 1 19 . 1 1 69 69 GLU N N 69 122.100 122.100 125.160 -3.060 18327
5202 1 19 . 1 1 69 69 GLU HA H 69 4.290 4.290 4.234 0.056 18327
5203 1 19 . 1 1 69 69 GLU CA C 69 56.610 56.610 57.393 -0.783 18327
5204 1 19 . 1 1 69 69 GLU CB C 69 30.330 30.330 29.217 1.113 18327
5205 1 19 . 1 1 69 69 GLU H H 69 8.569 8.569 8.710 -0.141 18327
5206 1 19 . 1 1 70 70 ALA N N 70 123.300 123.300 127.399 -4.099 18327
5207 1 19 . 1 1 70 70 ALA HA H 70 4.210 4.210 4.161 0.049 18327
5208 1 19 . 1 1 70 70 ALA CA C 70 51.810 51.810 52.727 -0.917 18327
5209 1 19 . 1 1 70 70 ALA CB C 70 19.700 19.700 18.462 1.238 18327
5210 1 19 . 1 1 70 70 ALA H H 70 8.181 8.181 8.417 -0.236 18327
5211 1 19 . 1 1 71 71 ILE N N 71 120.000 120.000 121.715 -1.715 18327
5212 1 19 . 1 1 71 71 ILE HA H 71 4.070 4.070 4.078 -0.008 18327
5213 1 19 . 1 1 71 71 ILE CA C 71 60.330 60.330 60.875 -0.545 18327
5214 1 19 . 1 1 71 71 ILE CB C 71 38.690 38.690 39.001 -0.311 18327
5215 1 19 . 1 1 71 71 ILE H H 71 7.789 7.789 8.050 -0.261 18327
5216 1 19 . 1 1 72 72 VAL N N 72 124.400 124.400 120.659 3.741 18327
5217 1 19 . 1 1 72 72 VAL HA H 72 4.070 4.070 4.068 0.002 18327
5218 1 19 . 1 1 72 72 VAL CA C 72 61.640 61.640 62.934 -1.294 18327
5219 1 19 . 1 1 72 72 VAL CB C 72 32.690 32.690 32.414 0.276 18327
5220 1 19 . 1 1 72 72 VAL H H 72 8.089 8.089 8.286 -0.197 18327
5221 1 19 . 1 1 73 73 GLU N N 73 125.940 125.940 122.955 2.985 18327
5222 1 19 . 1 1 73 73 GLU HA H 73 4.300 4.300 4.432 -0.132 18327
5223 1 19 . 1 1 73 73 GLU CA C 73 56.610 56.610 55.843 0.767 18327
5224 1 19 . 1 1 73 73 GLU CB C 73 30.710 30.710 29.354 1.356 18327
5225 1 19 . 1 1 73 73 GLU H H 73 8.464 8.464 8.672 -0.208 18327
5226 1 20 . 1 1 13 13 TYR HA H 13 5.560 5.560 4.636 0.924 18327
5227 1 20 . 1 1 13 13 TYR CA C 13 55.860 55.860 56.445 -0.585 18327
5228 1 20 . 1 1 13 13 TYR CB C 13 42.440 42.440 41.322 1.118 18327
5229 1 20 . 1 1 14 14 GLY N N 14 105.400 105.400 106.883 -1.483 18327
5230 1 20 . 1 1 14 14 GLY CA C 14 45.240 45.240 43.390 1.850 18327
5231 1 20 . 1 1 14 14 GLY H H 14 8.406 8.406 8.627 -0.221 18327
5232 1 20 . 1 1 15 15 VAL N N 15 118.900 118.900 121.424 -2.524 18327
5233 1 20 . 1 1 15 15 VAL HA H 15 5.330 5.330 4.824 0.506 18327
5234 1 20 . 1 1 15 15 VAL CA C 15 59.210 59.210 60.412 -1.202 18327
5235 1 20 . 1 1 15 15 VAL CB C 15 35.740 35.740 35.754 -0.014 18327
5236 1 20 . 1 1 15 15 VAL H H 15 8.854 8.854 8.564 0.290 18327
5237 1 20 . 1 1 16 16 ALA N N 16 129.400 129.400 127.900 1.500 18327
5238 1 20 . 1 1 16 16 ALA HA H 16 5.000 5.000 4.965 0.035 18327
5239 1 20 . 1 1 16 16 ALA CA C 16 52.000 52.000 50.644 1.356 18327
5240 1 20 . 1 1 16 16 ALA CB C 16 19.330 19.330 20.403 -1.073 18327
5241 1 20 . 1 1 16 16 ALA H H 16 9.112 9.112 9.033 0.079 18327
5242 1 20 . 1 1 17 17 PHE N N 17 123.900 123.900 124.986 -1.086 18327
5243 1 20 . 1 1 17 17 PHE HA H 17 4.740 4.740 4.681 0.059 18327
5244 1 20 . 1 1 17 17 PHE CA C 17 56.230 56.230 57.553 -1.323 18327
5245 1 20 . 1 1 17 17 PHE CB C 17 40.000 40.000 39.442 0.558 18327
5246 1 20 . 1 1 17 17 PHE H H 17 8.785 8.785 8.541 0.244 18327
5247 1 20 . 1 1 18 18 TYR N N 18 118.100 118.100 117.655 0.445 18327
5248 1 20 . 1 1 18 18 TYR HA H 18 4.490 4.490 4.447 0.043 18327
5249 1 20 . 1 1 18 18 TYR CA C 18 55.300 55.300 57.029 -1.729 18327
5250 1 20 . 1 1 18 18 TYR CB C 18 42.810 42.810 41.516 1.294 18327
5251 1 20 . 1 1 18 18 TYR H H 18 7.288 7.288 7.527 -0.239 18327
5252 1 20 . 1 1 19 19 ASN N N 19 116.800 116.800 120.883 -4.083 18327
5253 1 20 . 1 1 19 19 ASN HA H 19 4.710 4.710 4.952 -0.242 18327
5254 1 20 . 1 1 19 19 ASN CA C 19 52.940 52.940 54.086 -1.146 18327
5255 1 20 . 1 1 19 19 ASN CB C 19 39.060 39.060 39.671 -0.611 18327
5256 1 20 . 1 1 19 19 ASN H H 19 8.122 8.122 8.878 -0.756 18327
5257 1 20 . 1 1 20 20 TYR N N 20 122.000 122.000 123.457 -1.457 18327
5258 1 20 . 1 1 20 20 TYR HA H 20 4.710 4.710 4.690 0.020 18327
5259 1 20 . 1 1 20 20 TYR CA C 20 57.720 57.720 58.119 -0.399 18327
5260 1 20 . 1 1 20 20 TYR CB C 20 42.250 42.250 42.689 -0.439 18327
5261 1 20 . 1 1 20 20 TYR H H 20 8.994 8.994 8.550 0.444 18327
5262 1 20 . 1 1 21 21 ASP N N 21 128.500 128.500 121.608 6.892 18327
5263 1 20 . 1 1 21 21 ASP HA H 21 4.790 4.790 5.192 -0.402 18327
5264 1 20 . 1 1 21 21 ASP CA C 21 52.370 52.370 51.869 0.501 18327
5265 1 20 . 1 1 21 21 ASP CB C 21 41.130 41.130 43.594 -2.464 18327
5266 1 20 . 1 1 21 21 ASP H H 21 7.839 7.839 7.735 0.104 18327
5267 1 20 . 1 1 22 22 ALA N N 22 125.200 125.200 124.347 0.853 18327
5268 1 20 . 1 1 22 22 ALA HA H 22 4.050 4.050 4.482 -0.432 18327
5269 1 20 . 1 1 22 22 ALA CA C 22 52.940 52.940 52.404 0.536 18327
5270 1 20 . 1 1 22 22 ALA CB C 22 20.450 20.450 19.864 0.586 18327
5271 1 20 . 1 1 22 22 ALA H H 22 8.107 8.107 8.125 -0.018 18327
5272 1 20 . 1 1 23 23 ARG N N 23 122.200 122.200 120.509 1.691 18327
5273 1 20 . 1 1 23 23 ARG HA H 23 4.350 4.350 4.287 0.063 18327
5274 1 20 . 1 1 23 23 ARG CA C 23 55.490 55.490 57.053 -1.562 18327
5275 1 20 . 1 1 23 23 ARG CB C 23 30.700 30.700 30.883 -0.183 18327
5276 1 20 . 1 1 23 23 ARG H H 23 8.889 8.889 8.749 0.140 18327
5277 1 20 . 1 1 24 24 GLY N N 24 105.200 105.200 104.853 0.347 18327
5278 1 20 . 1 1 24 24 GLY CA C 24 44.500 44.500 44.883 -0.383 18327
5279 1 20 . 1 1 24 24 GLY H H 24 7.267 7.267 7.542 -0.275 18327
5280 1 20 . 1 1 25 25 ALA N N 25 122.200 122.200 121.115 1.085 18327
5281 1 20 . 1 1 25 25 ALA HA H 25 4.160 4.160 4.225 -0.065 18327
5282 1 20 . 1 1 25 25 ALA CA C 25 54.440 54.440 53.927 0.513 18327
5283 1 20 . 1 1 25 25 ALA CB C 25 18.770 18.770 18.865 -0.095 18327
5284 1 20 . 1 1 25 25 ALA H H 25 8.621 8.621 8.243 0.378 18327
5285 1 20 . 1 1 26 26 ASP N N 26 114.700 114.700 117.941 -3.241 18327
5286 1 20 . 1 1 26 26 ASP HA H 26 4.700 4.700 4.840 -0.140 18327
5287 1 20 . 1 1 26 26 ASP CA C 26 53.870 53.870 54.047 -0.177 18327
5288 1 20 . 1 1 26 26 ASP CB C 26 40.390 40.390 40.859 -0.469 18327
5289 1 20 . 1 1 26 26 ASP H H 26 8.949 8.949 8.334 0.615 18327
5290 1 20 . 1 1 27 27 GLU N N 27 118.800 118.800 117.578 1.222 18327
5291 1 20 . 1 1 27 27 GLU HA H 27 5.220 5.220 4.916 0.304 18327
5292 1 20 . 1 1 27 27 GLU CA C 27 54.930 54.930 54.575 0.354 18327
5293 1 20 . 1 1 27 27 GLU CB C 27 32.880 32.880 33.155 -0.275 18327
5294 1 20 . 1 1 27 27 GLU H H 27 7.542 7.542 7.610 -0.068 18327
5295 1 20 . 1 1 28 28 LEU N N 28 121.400 121.400 120.571 0.829 18327
5296 1 20 . 1 1 28 28 LEU HA H 28 4.760 4.760 4.796 -0.036 18327
5297 1 20 . 1 1 28 28 LEU CA C 28 53.120 53.120 54.483 -1.363 18327
5298 1 20 . 1 1 28 28 LEU CB C 28 44.500 44.500 45.629 -1.129 18327
5299 1 20 . 1 1 28 28 LEU H H 28 8.897 8.897 8.208 0.689 18327
5300 1 20 . 1 1 29 29 SER N N 29 115.700 115.700 118.412 -2.712 18327
5301 1 20 . 1 1 29 29 SER HA H 29 5.030 5.030 5.073 -0.043 18327
5302 1 20 . 1 1 29 29 SER CA C 29 58.470 58.470 59.116 -0.646 18327
5303 1 20 . 1 1 29 29 SER CB C 29 63.690 63.690 64.016 -0.326 18327
5304 1 20 . 1 1 29 29 SER H H 29 7.949 7.949 8.472 -0.523 18327
5305 1 20 . 1 1 30 30 LEU N N 30 121.300 121.300 119.136 2.164 18327
5306 1 20 . 1 1 30 30 LEU HA H 30 4.800 4.800 4.774 0.026 18327
5307 1 20 . 1 1 30 30 LEU CA C 30 52.940 52.940 55.002 -2.062 18327
5308 1 20 . 1 1 30 30 LEU CB C 30 46.370 46.370 45.733 0.637 18327
5309 1 20 . 1 1 30 30 LEU H H 30 9.503 9.503 8.584 0.919 18327
5310 1 20 . 1 1 31 31 GLN N N 31 123.100 123.100 121.343 1.757 18327
5311 1 20 . 1 1 31 31 GLN HA H 31 5.070 5.070 4.769 0.301 18327
5312 1 20 . 1 1 31 31 GLN CA C 31 52.940 52.940 53.965 -1.025 18327
5313 1 20 . 1 1 31 31 GLN CB C 31 31.190 31.190 32.549 -1.359 18327
5314 1 20 . 1 1 31 31 GLN H H 31 9.152 9.152 8.621 0.531 18327
5315 1 20 . 1 1 32 32 ILE N N 32 120.800 120.800 121.154 -0.354 18327
5316 1 20 . 1 1 32 32 ILE HA H 32 3.030 3.030 3.992 -0.962 18327
5317 1 20 . 1 1 32 32 ILE CA C 32 64.250 64.250 62.130 2.120 18327
5318 1 20 . 1 1 32 32 ILE CB C 32 37.940 37.940 37.701 0.239 18327
5319 1 20 . 1 1 32 32 ILE H H 32 8.019 8.019 8.611 -0.592 18327
5320 1 20 . 1 1 33 33 GLY N N 33 115.700 115.700 114.404 1.296 18327
5321 1 20 . 1 1 33 33 GLY CA C 33 44.500 44.500 44.851 -0.351 18327
5322 1 20 . 1 1 33 33 GLY H H 33 8.777 8.777 8.890 -0.113 18327
5323 1 20 . 1 1 34 34 ASP N N 34 122.300 122.300 121.259 1.041 18327
5324 1 20 . 1 1 34 34 ASP HA H 34 4.640 4.640 4.811 -0.171 18327
5325 1 20 . 1 1 34 34 ASP CA C 34 55.860 55.860 53.939 1.921 18327
5326 1 20 . 1 1 34 34 ASP CB C 34 41.310 41.310 43.390 -2.080 18327
5327 1 20 . 1 1 34 34 ASP H H 34 8.690 8.690 7.505 1.185 18327
5328 1 20 . 1 1 35 35 THR N N 35 117.900 117.900 114.964 2.936 18327
5329 1 20 . 1 1 35 35 THR HA H 35 5.160 5.160 5.421 -0.261 18327
5330 1 20 . 1 1 35 35 THR CA C 35 61.450 61.450 61.182 0.268 18327
5331 1 20 . 1 1 35 35 THR CB C 35 69.090 69.090 71.564 -2.474 18327
5332 1 20 . 1 1 35 35 THR H H 35 8.389 8.389 8.347 0.042 18327
5333 1 20 . 1 1 36 36 VAL N N 36 118.200 118.200 116.235 1.965 18327
5334 1 20 . 1 1 36 36 VAL HA H 36 5.100 5.100 4.422 0.678 18327
5335 1 20 . 1 1 36 36 VAL CA C 36 57.910 57.910 60.304 -2.394 18327
5336 1 20 . 1 1 36 36 VAL CB C 36 34.190 34.190 34.853 -0.663 18327
5337 1 20 . 1 1 36 36 VAL H H 36 9.019 9.019 9.025 -0.006 18327
5338 1 20 . 1 1 37 37 HIS N N 37 122.100 122.100 119.480 2.620 18327
5339 1 20 . 1 1 37 37 HIS HA H 37 4.840 4.840 4.955 -0.115 18327
5340 1 20 . 1 1 37 37 HIS CA C 37 52.560 52.560 54.278 -1.718 18327
5341 1 20 . 1 1 37 37 HIS CB C 37 31.260 31.260 33.667 -2.407 18327
5342 1 20 . 1 1 37 37 HIS H H 37 8.489 8.489 8.676 -0.187 18327
5343 1 20 . 1 1 38 38 ILE N N 38 126.400 126.400 123.946 2.454 18327
5344 1 20 . 1 1 38 38 ILE HA H 38 3.780 3.780 4.155 -0.375 18327
5345 1 20 . 1 1 38 38 ILE CA C 38 61.640 61.640 60.745 0.895 18327
5346 1 20 . 1 1 38 38 ILE CB C 38 38.880 38.880 39.324 -0.444 18327
5347 1 20 . 1 1 38 38 ILE H H 38 8.636 8.636 8.156 0.480 18327
5348 1 20 . 1 1 39 39 LEU N N 39 126.000 126.000 125.957 0.043 18327
5349 1 20 . 1 1 39 39 LEU HA H 39 4.400 4.400 4.799 -0.399 18327
5350 1 20 . 1 1 39 39 LEU CA C 39 55.490 55.490 55.332 0.158 18327
5351 1 20 . 1 1 39 39 LEU CB C 39 43.750 43.750 43.685 0.065 18327
5352 1 20 . 1 1 39 39 LEU H H 39 9.162 9.162 8.703 0.459 18327
5353 1 20 . 1 1 40 40 GLU N N 40 115.100 115.100 117.348 -2.248 18327
5354 1 20 . 1 1 40 40 GLU HA H 40 7.895 7.895 4.733 3.162 18327
5355 1 20 . 1 1 41 41 THR N N 41 116.400 116.400 112.756 3.644 18327
5356 1 20 . 1 1 41 41 THR HA H 41 4.270 4.270 5.087 -0.817 18327
5357 1 20 . 1 1 41 41 THR CA C 41 60.890 60.890 60.702 0.188 18327
5358 1 20 . 1 1 41 41 THR CB C 41 69.650 69.650 70.849 -1.199 18327
5359 1 20 . 1 1 41 41 THR H H 41 8.162 8.162 8.513 -0.351 18327
5360 1 20 . 1 1 43 43 GLU N N 43 123.300 123.300 122.785 0.515 18327
5361 1 20 . 1 1 43 43 GLU HA H 43 4.270 4.270 3.910 0.360 18327
5362 1 20 . 1 1 43 43 GLU CA C 43 57.350 57.350 56.951 0.399 18327
5363 1 20 . 1 1 43 43 GLU CB C 43 26.790 26.790 28.731 -1.941 18327
5364 1 20 . 1 1 43 43 GLU H H 43 8.108 8.108 9.034 -0.926 18327
5365 1 20 . 1 1 44 44 GLY CA C 44 45.440 45.440 45.186 0.254 18327
5366 1 20 . 1 1 45 45 TRP N N 45 124.100 124.100 118.854 5.246 18327
5367 1 20 . 1 1 45 45 TRP HA H 45 4.690 4.690 4.639 0.051 18327
5368 1 20 . 1 1 45 45 TRP H H 45 8.590 8.590 7.411 1.179 18327
5369 1 20 . 1 1 46 46 TYR HA H 46 5.600 5.600 4.682 0.918 18327
5370 1 20 . 1 1 46 46 TYR CA C 46 54.060 54.060 57.194 -3.134 18327
5371 1 20 . 1 1 46 46 TYR CB C 46 42.060 42.060 40.129 1.931 18327
5372 1 20 . 1 1 47 47 ARG N N 47 118.100 118.100 122.482 -4.382 18327
5373 1 20 . 1 1 47 47 ARG HA H 47 5.070 5.070 4.590 0.480 18327
5374 1 20 . 1 1 47 47 ARG CA C 47 54.060 54.060 54.448 -0.388 18327
5375 1 20 . 1 1 47 47 ARG CB C 47 33.250 33.250 33.838 -0.588 18327
5376 1 20 . 1 1 47 47 ARG H H 47 8.495 8.495 8.831 -0.336 18327
5377 1 20 . 1 1 48 48 GLY N N 48 114.000 114.000 114.301 -0.301 18327
5378 1 20 . 1 1 48 48 GLY CA C 48 46.560 46.560 46.612 -0.052 18327
5379 1 20 . 1 1 48 48 GLY H H 48 9.183 9.183 9.100 0.083 18327
5380 1 20 . 1 1 49 49 TYR N N 49 116.200 116.200 116.508 -0.308 18327
5381 1 20 . 1 1 49 49 TYR HA H 49 5.380 5.380 5.067 0.313 18327
5382 1 20 . 1 1 49 49 TYR CA C 49 55.110 55.110 56.864 -1.754 18327
5383 1 20 . 1 1 49 49 TYR CB C 49 40.750 40.750 39.707 1.043 18327
5384 1 20 . 1 1 49 49 TYR H H 49 8.199 8.199 8.365 -0.166 18327
5385 1 20 . 1 1 50 50 THR N N 50 112.200 112.200 111.363 0.837 18327
5386 1 20 . 1 1 50 50 THR HA H 50 5.120 5.120 4.298 0.822 18327
5387 1 20 . 1 1 50 50 THR CA C 50 59.770 59.770 61.410 -1.641 18327
5388 1 20 . 1 1 50 50 THR CB C 50 69.460 69.460 70.221 -0.761 18327
5389 1 20 . 1 1 50 50 THR H H 50 9.436 9.436 8.268 1.168 18327
5390 1 20 . 1 1 51 51 LEU N N 51 121.300 121.300 120.743 0.557 18327
5391 1 20 . 1 1 51 51 LEU HA H 51 4.230 4.230 4.274 -0.044 18327
5392 1 20 . 1 1 51 51 LEU CA C 51 56.790 56.790 55.950 0.841 18327
5393 1 20 . 1 1 51 51 LEU CB C 51 40.000 40.000 42.009 -2.009 18327
5394 1 20 . 1 1 51 51 LEU H H 51 8.313 8.313 8.174 0.139 18327
5395 1 20 . 1 1 52 52 ARG N N 52 116.600 116.600 118.799 -2.199 18327
5396 1 20 . 1 1 52 52 ARG HA H 52 4.250 4.250 4.010 0.240 18327
5397 1 20 . 1 1 52 52 ARG CA C 52 57.350 57.350 57.877 -0.527 18327
5398 1 20 . 1 1 52 52 ARG CB C 52 30.510 30.510 30.430 0.080 18327
5399 1 20 . 1 1 52 52 ARG H H 52 8.053 8.053 7.571 0.482 18327
5400 1 20 . 1 1 53 53 LYS N N 53 122.600 122.600 116.000 6.600 18327
5401 1 20 . 1 1 53 53 LYS HA H 53 4.620 4.620 4.493 0.127 18327
5402 1 20 . 1 1 53 53 LYS CA C 53 54.620 54.620 55.746 -1.126 18327
5403 1 20 . 1 1 53 53 LYS CB C 53 32.310 32.310 33.691 -1.381 18327
5404 1 20 . 1 1 53 53 LYS H H 53 7.655 7.655 7.795 -0.140 18327
5405 1 20 . 1 1 54 54 LYS N N 54 124.900 124.900 125.365 -0.465 18327
5406 1 20 . 1 1 54 54 LYS HA H 54 4.090 4.090 4.307 -0.217 18327
5407 1 20 . 1 1 54 54 LYS CA C 54 58.470 58.470 58.467 0.003 18327
5408 1 20 . 1 1 54 54 LYS CB C 54 32.130 32.130 32.388 -0.258 18327
5409 1 20 . 1 1 54 54 LYS H H 54 8.499 8.499 8.749 -0.250 18327
5410 1 20 . 1 1 55 55 SER N N 55 110.100 110.100 114.333 -4.233 18327
5411 1 20 . 1 1 55 55 SER HA H 55 4.140 4.140 4.299 -0.159 18327
5412 1 20 . 1 1 55 55 SER CA C 55 58.470 58.470 60.070 -1.600 18327
5413 1 20 . 1 1 55 55 SER CB C 55 63.310 63.310 63.407 -0.097 18327
5414 1 20 . 1 1 55 55 SER H H 55 7.862 7.862 8.029 -0.167 18327
5415 1 20 . 1 1 56 56 LYS N N 56 124.000 124.000 121.330 2.670 18327
5416 1 20 . 1 1 56 56 LYS HA H 56 4.700 4.700 4.313 0.387 18327
5417 1 20 . 1 1 56 56 LYS CA C 56 54.810 54.810 56.074 -1.264 18327
5418 1 20 . 1 1 56 56 LYS CB C 56 33.250 33.250 31.195 2.055 18327
5419 1 20 . 1 1 56 56 LYS H H 56 7.481 7.481 8.247 -0.766 18327
5420 1 20 . 1 1 57 57 LYS N N 57 125.700 125.700 122.213 3.487 18327
5421 1 20 . 1 1 57 57 LYS HA H 57 5.330 5.330 4.617 0.713 18327
5422 1 20 . 1 1 57 57 LYS CA C 57 54.620 54.620 55.126 -0.506 18327
5423 1 20 . 1 1 57 57 LYS CB C 57 34.240 34.240 35.254 -1.014 18327
5424 1 20 . 1 1 57 57 LYS H H 57 8.475 8.475 7.797 0.678 18327
5425 1 20 . 1 1 58 58 GLY N N 58 109.400 109.400 106.672 2.728 18327
5426 1 20 . 1 1 58 58 GLY CA C 58 45.620 45.620 44.882 0.738 18327
5427 1 20 . 1 1 58 58 GLY H H 58 9.073 9.073 8.834 0.239 18327
5428 1 20 . 1 1 59 59 ILE N N 59 113.900 113.900 117.648 -3.748 18327
5429 1 20 . 1 1 59 59 ILE HA H 59 6.000 6.000 5.279 0.721 18327
5430 1 20 . 1 1 59 59 ILE CA C 59 59.590 59.590 58.948 0.642 18327
5431 1 20 . 1 1 59 59 ILE CB C 59 41.140 41.140 41.756 -0.616 18327
5432 1 20 . 1 1 59 59 ILE H H 59 8.628 8.628 8.329 0.299 18327
5433 1 20 . 1 1 60 60 PHE N N 60 116.900 116.900 115.561 1.339 18327
5434 1 20 . 1 1 60 60 PHE HA H 60 5.120 5.120 5.145 -0.025 18327
5435 1 20 . 1 1 60 60 PHE CA C 60 54.060 54.060 55.002 -0.942 18327
5436 1 20 . 1 1 60 60 PHE CB C 60 37.190 37.190 40.126 -2.936 18327
5437 1 20 . 1 1 60 60 PHE H H 60 8.724 8.724 8.755 -0.031 18327
5438 1 20 . 1 1 61 61 PRO HA H 61 3.480 3.480 3.344 0.136 18327
5439 1 20 . 1 1 61 61 PRO CA C 61 62.200 62.200 62.380 -0.180 18327
5440 1 20 . 1 1 61 61 PRO CB C 61 31.190 31.190 30.843 0.347 18327
5441 1 20 . 1 1 62 62 ALA N N 62 124.600 124.600 127.827 -3.227 18327
5442 1 20 . 1 1 62 62 ALA HA H 62 3.720 3.720 4.351 -0.631 18327
5443 1 20 . 1 1 62 62 ALA CA C 62 54.370 54.370 54.756 -0.386 18327
5444 1 20 . 1 1 62 62 ALA CB C 62 17.650 17.650 18.532 -0.882 18327
5445 1 20 . 1 1 62 62 ALA H H 62 7.898 7.898 8.692 -0.794 18327
5446 1 20 . 1 1 63 63 SER N N 63 109.700 109.700 113.069 -3.369 18327
5447 1 20 . 1 1 63 63 SER HA H 63 4.200 4.200 4.346 -0.146 18327
5448 1 20 . 1 1 63 63 SER CA C 63 59.400 59.400 60.979 -1.579 18327
5449 1 20 . 1 1 63 63 SER CB C 63 62.380 62.380 62.992 -0.612 18327
5450 1 20 . 1 1 63 63 SER H H 63 8.030 8.030 8.415 -0.385 18327
5451 1 20 . 1 1 64 64 TYR N N 64 120.300 120.300 118.903 1.397 18327
5452 1 20 . 1 1 64 64 TYR HA H 64 4.260 4.260 4.721 -0.461 18327
5453 1 20 . 1 1 64 64 TYR CA C 64 57.720 57.720 56.751 0.969 18327
5454 1 20 . 1 1 64 64 TYR CB C 64 37.560 37.560 37.767 -0.207 18327
5455 1 20 . 1 1 64 64 TYR H H 64 7.124 7.124 7.403 -0.279 18327
5456 1 20 . 1 1 65 65 ILE N N 65 118.000 118.000 117.453 0.547 18327
5457 1 20 . 1 1 65 65 ILE HA H 65 4.830 4.830 5.113 -0.283 18327
5458 1 20 . 1 1 65 65 ILE CA C 65 56.980 56.980 59.115 -2.135 18327
5459 1 20 . 1 1 65 65 ILE CB C 65 39.630 39.630 42.537 -2.907 18327
5460 1 20 . 1 1 65 65 ILE H H 65 7.671 7.671 7.648 0.023 18327
5461 1 20 . 1 1 66 66 HIS N N 66 124.500 124.500 122.222 2.278 18327
5462 1 20 . 1 1 66 66 HIS HA H 66 5.130 5.130 4.855 0.275 18327
5463 1 20 . 1 1 66 66 HIS CA C 66 53.060 53.060 55.012 -1.952 18327
5464 1 20 . 1 1 66 66 HIS CB C 66 30.510 30.510 34.087 -3.577 18327
5465 1 20 . 1 1 66 66 HIS H H 66 9.159 9.159 8.942 0.217 18327
5466 1 20 . 1 1 67 67 LEU N N 67 127.400 127.400 127.112 0.288 18327
5467 1 20 . 1 1 67 67 LEU HA H 67 4.560 4.560 4.480 0.080 18327
5468 1 20 . 1 1 67 67 LEU CA C 67 55.300 55.300 56.118 -0.818 18327
5469 1 20 . 1 1 67 67 LEU CB C 67 42.060 42.060 42.604 -0.544 18327
5470 1 20 . 1 1 67 67 LEU H H 67 8.979 8.979 8.703 0.276 18327
5471 1 20 . 1 1 68 68 LYS N N 68 121.900 121.900 123.180 -1.280 18327
5472 1 20 . 1 1 68 68 LYS HA H 68 4.490 4.490 4.595 -0.105 18327
5473 1 20 . 1 1 68 68 LYS CA C 68 55.110 55.110 55.446 -0.336 18327
5474 1 20 . 1 1 68 68 LYS CB C 68 34.610 34.610 33.126 1.484 18327
5475 1 20 . 1 1 68 68 LYS H H 68 8.499 8.499 8.860 -0.361 18327
5476 1 20 . 1 1 69 69 GLU N N 69 122.100 122.100 117.658 4.442 18327
5477 1 20 . 1 1 69 69 GLU HA H 69 4.290 4.290 3.931 0.359 18327
5478 1 20 . 1 1 69 69 GLU CA C 69 56.610 56.610 57.181 -0.570 18327
5479 1 20 . 1 1 69 69 GLU CB C 69 30.330 30.330 30.216 0.114 18327
5480 1 20 . 1 1 69 69 GLU H H 69 8.569 8.569 8.223 0.346 18327
5481 1 20 . 1 1 70 70 ALA N N 70 123.300 123.300 123.092 0.208 18327
5482 1 20 . 1 1 70 70 ALA HA H 70 4.210 4.210 4.397 -0.187 18327
5483 1 20 . 1 1 70 70 ALA CA C 70 51.810 51.810 52.282 -0.472 18327
5484 1 20 . 1 1 70 70 ALA CB C 70 19.700 19.700 19.167 0.533 18327
5485 1 20 . 1 1 70 70 ALA H H 70 8.181 8.181 8.358 -0.177 18327
5486 1 20 . 1 1 71 71 ILE N N 71 120.000 120.000 123.635 -3.635 18327
5487 1 20 . 1 1 71 71 ILE HA H 71 4.070 4.070 4.176 -0.106 18327
5488 1 20 . 1 1 71 71 ILE CA C 71 60.330 60.330 60.927 -0.597 18327
5489 1 20 . 1 1 71 71 ILE CB C 71 38.690 38.690 39.350 -0.660 18327
5490 1 20 . 1 1 71 71 ILE H H 71 7.789 7.789 8.552 -0.763 18327
5491 1 20 . 1 1 72 72 VAL N N 72 124.400 124.400 120.618 3.782 18327
5492 1 20 . 1 1 72 72 VAL HA H 72 4.070 4.070 4.419 -0.349 18327
5493 1 20 . 1 1 72 72 VAL CA C 72 61.640 61.640 61.065 0.576 18327
5494 1 20 . 1 1 72 72 VAL CB C 72 32.690 32.690 34.399 -1.709 18327
5495 1 20 . 1 1 72 72 VAL H H 72 8.089 8.089 8.156 -0.067 18327
5496 1 20 . 1 1 73 73 GLU N N 73 125.940 125.940 122.226 3.714 18327
5497 1 20 . 1 1 73 73 GLU HA H 73 4.300 4.300 4.699 -0.399 18327
5498 1 20 . 1 1 73 73 GLU CA C 73 56.610 56.610 56.611 -0.001 18327
5499 1 20 . 1 1 73 73 GLU CB C 73 30.710 30.710 31.065 -0.355 18327
5500 1 20 . 1 1 73 73 GLU H H 73 8.464 8.464 8.762 -0.298 18327
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 56 3.011 -0.708 2.953 18327
2 1 1 "Average Difference" HA 54 0.601 -0.120 0.595 18327
3 1 1 "Average Difference" C 0 0.000 0.000 0.000 18327
4 1 1 "Average Difference" CA 58 1.225 0.387 1.172 18327
5 1 1 "Average Difference" CB 52 1.319 0.525 1.222 18327
6 1 1 "Average Difference" HN 55 0.449 -0.149 0.427 18327
7 1 2 "Average Difference" N 56 2.587 -0.262 2.597 18327
8 1 2 "Average Difference" HA 54 0.598 -0.093 0.597 18327
9 1 2 "Average Difference" C 0 0.000 0.000 0.000 18327
10 1 2 "Average Difference" CA 58 1.277 0.314 1.249 18327
11 1 2 "Average Difference" CB 52 1.279 0.568 1.158 18327
12 1 2 "Average Difference" HN 55 0.442 -0.076 0.439 18327
13 1 3 "Average Difference" N 56 2.717 -0.385 2.713 18327
14 1 3 "Average Difference" HA 54 0.578 -0.072 0.579 18327
15 1 3 "Average Difference" C 0 0.000 0.000 0.000 18327
16 1 3 "Average Difference" CA 58 1.150 0.284 1.124 18327
17 1 3 "Average Difference" CB 52 1.313 0.525 1.216 18327
18 1 3 "Average Difference" HN 55 0.429 -0.068 0.427 18327
19 1 4 "Average Difference" N 56 3.024 -0.215 3.044 18327
20 1 4 "Average Difference" HA 54 0.555 -0.118 0.548 18327
21 1 4 "Average Difference" C 0 0.000 0.000 0.000 18327
22 1 4 "Average Difference" CA 58 1.198 0.431 1.128 18327
23 1 4 "Average Difference" CB 52 1.275 0.391 1.225 18327
24 1 4 "Average Difference" HN 55 0.444 -0.051 0.446 18327
25 1 5 "Average Difference" N 56 2.656 -0.421 2.646 18327
26 1 5 "Average Difference" HA 54 0.566 -0.063 0.567 18327
27 1 5 "Average Difference" C 0 0.000 0.000 0.000 18327
28 1 5 "Average Difference" CA 58 1.156 0.355 1.110 18327
29 1 5 "Average Difference" CB 52 1.191 0.618 1.028 18327
30 1 5 "Average Difference" HN 55 0.445 -0.035 0.447 18327
31 1 6 "Average Difference" N 56 2.761 -0.528 2.735 18327
32 1 6 "Average Difference" HA 54 0.588 -0.103 0.584 18327
33 1 6 "Average Difference" C 0 0.000 0.000 0.000 18327
34 1 6 "Average Difference" CA 58 1.145 0.483 1.047 18327
35 1 6 "Average Difference" CB 52 1.166 0.453 1.084 18327
36 1 6 "Average Difference" HN 55 0.479 -0.055 0.481 18327
37 1 7 "Average Difference" N 56 2.732 -0.745 2.653 18327
38 1 7 "Average Difference" HA 54 0.584 -0.109 0.579 18327
39 1 7 "Average Difference" C 0 0.000 0.000 0.000 18327
40 1 7 "Average Difference" CA 58 1.098 0.369 1.043 18327
41 1 7 "Average Difference" CB 52 1.161 0.375 1.110 18327
42 1 7 "Average Difference" HN 55 0.464 -0.086 0.460 18327
43 1 8 "Average Difference" N 56 2.834 -0.504 2.814 18327
44 1 8 "Average Difference" HA 54 0.600 -0.139 0.589 18327
45 1 8 "Average Difference" C 0 0.000 0.000 0.000 18327
46 1 8 "Average Difference" CA 58 1.212 0.417 1.148 18327
47 1 8 "Average Difference" CB 52 1.060 0.349 1.011 18327
48 1 8 "Average Difference" HN 55 0.512 -0.092 0.508 18327
49 1 9 "Average Difference" N 56 2.480 -0.370 2.474 18327
50 1 9 "Average Difference" HA 54 0.598 -0.093 0.596 18327
51 1 9 "Average Difference" C 0 0.000 0.000 0.000 18327
52 1 9 "Average Difference" CA 58 1.265 0.364 1.222 18327
53 1 9 "Average Difference" CB 52 1.264 0.464 1.188 18327
54 1 9 "Average Difference" HN 55 0.457 -0.084 0.453 18327
55 1 10 "Average Difference" N 56 2.881 -0.257 2.895 18327
56 1 10 "Average Difference" HA 54 0.592 -0.119 0.586 18327
57 1 10 "Average Difference" C 0 0.000 0.000 0.000 18327
58 1 10 "Average Difference" CA 58 1.199 0.521 1.089 18327
59 1 10 "Average Difference" CB 52 1.081 0.339 1.037 18327
60 1 10 "Average Difference" HN 55 0.437 -0.060 0.437 18327
61 1 11 "Average Difference" N 56 2.771 -0.487 2.752 18327
62 1 11 "Average Difference" HA 54 0.582 -0.124 0.574 18327
63 1 11 "Average Difference" C 0 0.000 0.000 0.000 18327
64 1 11 "Average Difference" CA 58 1.308 0.521 1.211 18327
65 1 11 "Average Difference" CB 52 1.183 0.415 1.118 18327
66 1 11 "Average Difference" HN 55 0.463 -0.143 0.444 18327
67 1 12 "Average Difference" N 56 2.723 -0.260 2.735 18327
68 1 12 "Average Difference" HA 54 0.579 -0.138 0.567 18327
69 1 12 "Average Difference" C 0 0.000 0.000 0.000 18327
70 1 12 "Average Difference" CA 58 1.219 0.509 1.118 18327
71 1 12 "Average Difference" CB 52 1.235 0.344 1.198 18327
72 1 12 "Average Difference" HN 55 0.449 -0.110 0.439 18327
73 1 13 "Average Difference" N 56 2.774 -0.366 2.775 18327
74 1 13 "Average Difference" HA 54 0.600 -0.085 0.600 18327
75 1 13 "Average Difference" C 0 0.000 0.000 0.000 18327
76 1 13 "Average Difference" CA 58 1.200 0.271 1.179 18327
77 1 13 "Average Difference" CB 52 1.391 0.565 1.284 18327
78 1 13 "Average Difference" HN 55 0.458 -0.074 0.456 18327
79 1 14 "Average Difference" N 56 2.581 -0.337 2.582 18327
80 1 14 "Average Difference" HA 54 0.607 -0.143 0.595 18327
81 1 14 "Average Difference" C 0 0.000 0.000 0.000 18327
82 1 14 "Average Difference" CA 58 1.273 0.474 1.192 18327
83 1 14 "Average Difference" CB 52 1.160 0.391 1.102 18327
84 1 14 "Average Difference" HN 55 0.432 -0.111 0.422 18327
85 1 15 "Average Difference" N 56 2.747 -0.165 2.767 18327
86 1 15 "Average Difference" HA 54 0.608 -0.115 0.602 18327
87 1 15 "Average Difference" C 0 0.000 0.000 0.000 18327
88 1 15 "Average Difference" CA 58 1.317 0.483 1.236 18327
89 1 15 "Average Difference" CB 52 1.186 0.436 1.113 18327
90 1 15 "Average Difference" HN 55 0.493 -0.057 0.494 18327
91 1 16 "Average Difference" N 56 2.730 -0.210 2.747 18327
92 1 16 "Average Difference" HA 54 0.587 -0.112 0.581 18327
93 1 16 "Average Difference" C 0 0.000 0.000 0.000 18327
94 1 16 "Average Difference" CA 58 1.107 0.383 1.047 18327
95 1 16 "Average Difference" CB 52 1.339 0.410 1.287 18327
96 1 16 "Average Difference" HN 55 0.472 -0.067 0.471 18327
97 1 17 "Average Difference" N 56 2.532 -0.472 2.510 18327
98 1 17 "Average Difference" HA 54 0.591 -0.088 0.590 18327
99 1 17 "Average Difference" C 0 0.000 0.000 0.000 18327
100 1 17 "Average Difference" CA 58 1.206 0.305 1.177 18327
101 1 17 "Average Difference" CB 52 1.291 0.478 1.211 18327
102 1 17 "Average Difference" HN 55 0.411 -0.080 0.407 18327
103 1 18 "Average Difference" N 56 2.871 -0.598 2.833 18327
104 1 18 "Average Difference" HA 54 0.577 -0.102 0.573 18327
105 1 18 "Average Difference" C 0 0.000 0.000 0.000 18327
106 1 18 "Average Difference" CA 58 1.290 0.286 1.269 18327
107 1 18 "Average Difference" CB 52 1.307 0.565 1.190 18327
108 1 18 "Average Difference" HN 55 0.471 -0.109 0.463 18327
109 1 19 "Average Difference" N 56 2.553 -0.409 2.543 18327
110 1 19 "Average Difference" HA 54 0.608 -0.106 0.604 18327
111 1 19 "Average Difference" C 0 0.000 0.000 0.000 18327
112 1 19 "Average Difference" CA 58 1.206 0.504 1.106 18327
113 1 19 "Average Difference" CB 52 1.228 0.413 1.168 18327
114 1 19 "Average Difference" HN 55 0.448 -0.104 0.440 18327
115 1 20 "Average Difference" N 56 2.696 -0.519 2.670 18327
116 1 20 "Average Difference" HA 54 0.590 -0.084 0.589 18327
117 1 20 "Average Difference" C 0 0.000 0.000 0.000 18327
118 1 20 "Average Difference" CA 58 1.180 0.430 1.109 18327
119 1 20 "Average Difference" CB 52 1.332 0.551 1.225 18327
120 1 20 "Average Difference" HN 55 0.489 -0.045 0.491 18327
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 18327
_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 13 13 TYR HA H 13 5.560 5.560 4.643 0.917 18327
2 1 . 1 1 13 13 TYR CA C 13 55.860 55.860 56.697 -0.837 18327
3 1 . 1 1 13 13 TYR CB C 13 42.440 42.440 41.227 1.213 18327
4 1 . 1 1 14 14 GLY N N 14 105.400 105.400 106.661 -1.261 18327
5 1 . 1 1 14 14 GLY CA C 14 45.240 45.240 43.711 1.529 18327
6 1 . 1 1 14 14 GLY H H 14 8.406 8.406 8.549 -0.143 18327
7 1 . 1 1 15 15 VAL N N 15 118.900 118.900 121.629 -2.729 18327
8 1 . 1 1 15 15 VAL HA H 15 5.330 5.330 4.823 0.507 18327
9 1 . 1 1 15 15 VAL CA C 15 59.210 59.210 60.349 -1.139 18327
10 1 . 1 1 15 15 VAL CB C 15 35.740 35.740 35.638 0.102 18327
11 1 . 1 1 15 15 VAL H H 15 8.854 8.854 8.371 0.483 18327
12 1 . 1 1 16 16 ALA N N 16 129.400 129.400 127.838 1.562 18327
13 1 . 1 1 16 16 ALA HA H 16 5.000 5.000 4.813 0.188 18327
14 1 . 1 1 16 16 ALA CA C 16 52.000 52.000 51.192 0.808 18327
15 1 . 1 1 16 16 ALA CB C 16 19.330 19.330 20.376 -1.046 18327
16 1 . 1 1 16 16 ALA H H 16 9.112 9.112 9.069 0.043 18327
17 1 . 1 1 17 17 PHE N N 17 123.900 123.900 124.066 -0.166 18327
18 1 . 1 1 17 17 PHE HA H 17 4.740 4.740 4.684 0.056 18327
19 1 . 1 1 17 17 PHE CA C 17 56.230 56.230 57.178 -0.948 18327
20 1 . 1 1 17 17 PHE CB C 17 40.000 40.000 40.394 -0.394 18327
21 1 . 1 1 17 17 PHE H H 17 8.785 8.785 8.485 0.300 18327
22 1 . 1 1 18 18 TYR N N 18 118.100 118.100 118.645 -0.545 18327
23 1 . 1 1 18 18 TYR HA H 18 4.490 4.490 4.469 0.021 18327
24 1 . 1 1 18 18 TYR CA C 18 55.300 55.300 57.484 -2.184 18327
25 1 . 1 1 18 18 TYR CB C 18 42.810 42.810 41.502 1.308 18327
26 1 . 1 1 18 18 TYR H H 18 7.288 7.288 7.579 -0.290 18327
27 1 . 1 1 19 19 ASN N N 19 116.800 116.800 121.014 -4.214 18327
28 1 . 1 1 19 19 ASN HA H 19 4.710 4.710 4.866 -0.156 18327
29 1 . 1 1 19 19 ASN CA C 19 52.940 52.940 53.498 -0.558 18327
30 1 . 1 1 19 19 ASN CB C 19 39.060 39.060 39.448 -0.388 18327
31 1 . 1 1 19 19 ASN H H 19 8.122 8.122 8.619 -0.497 18327
32 1 . 1 1 20 20 TYR N N 20 122.000 122.000 123.809 -1.809 18327
33 1 . 1 1 20 20 TYR HA H 20 4.710 4.710 4.679 0.031 18327
34 1 . 1 1 20 20 TYR CA C 20 57.720 57.720 57.943 -0.223 18327
35 1 . 1 1 20 20 TYR CB C 20 42.250 42.250 42.615 -0.365 18327
36 1 . 1 1 20 20 TYR H H 20 8.994 8.994 8.683 0.311 18327
37 1 . 1 1 21 21 ASP N N 21 128.500 128.500 121.697 6.803 18327
38 1 . 1 1 21 21 ASP HA H 21 4.790 4.790 4.898 -0.108 18327
39 1 . 1 1 21 21 ASP CA C 21 52.370 52.370 52.274 0.096 18327
40 1 . 1 1 21 21 ASP CB C 21 41.130 41.130 43.656 -2.526 18327
41 1 . 1 1 21 21 ASP H H 21 7.839 7.839 7.723 0.116 18327
42 1 . 1 1 22 22 ALA N N 22 125.200 125.200 122.986 2.214 18327
43 1 . 1 1 22 22 ALA HA H 22 4.050 4.050 4.450 -0.400 18327
44 1 . 1 1 22 22 ALA CA C 22 52.940 52.940 52.740 0.200 18327
45 1 . 1 1 22 22 ALA CB C 22 20.450 20.450 19.556 0.894 18327
46 1 . 1 1 22 22 ALA H H 22 8.107 8.107 8.326 -0.219 18327
47 1 . 1 1 23 23 ARG N N 23 122.200 122.200 121.810 0.390 18327
48 1 . 1 1 23 23 ARG HA H 23 4.350 4.350 4.322 0.028 18327
49 1 . 1 1 23 23 ARG CA C 23 55.490 55.490 56.471 -0.981 18327
50 1 . 1 1 23 23 ARG CB C 23 30.700 30.700 30.804 -0.104 18327
51 1 . 1 1 23 23 ARG H H 23 8.889 8.889 8.743 0.146 18327
52 1 . 1 1 24 24 GLY N N 24 105.200 105.200 106.259 -1.059 18327
53 1 . 1 1 24 24 GLY CA C 24 44.500 44.500 44.685 -0.185 18327
54 1 . 1 1 24 24 GLY H H 24 7.267 7.267 7.580 -0.313 18327
55 1 . 1 1 25 25 ALA N N 25 122.200 122.200 121.665 0.535 18327
56 1 . 1 1 25 25 ALA HA H 25 4.160 4.160 4.285 -0.125 18327
57 1 . 1 1 25 25 ALA CA C 25 54.440 54.440 53.996 0.443 18327
58 1 . 1 1 25 25 ALA CB C 25 18.770 18.770 19.010 -0.240 18327
59 1 . 1 1 25 25 ALA H H 25 8.621 8.621 8.414 0.207 18327
60 1 . 1 1 26 26 ASP N N 26 114.700 114.700 118.652 -3.952 18327
61 1 . 1 1 26 26 ASP HA H 26 4.700 4.700 4.699 0.001 18327
62 1 . 1 1 26 26 ASP CA C 26 53.870 53.870 53.914 -0.044 18327
63 1 . 1 1 26 26 ASP CB C 26 40.390 40.390 40.535 -0.145 18327
64 1 . 1 1 26 26 ASP H H 26 8.949 8.949 8.485 0.464 18327
65 1 . 1 1 27 27 GLU N N 27 118.800 118.800 118.418 0.382 18327
66 1 . 1 1 27 27 GLU HA H 27 5.220 5.220 4.843 0.377 18327
67 1 . 1 1 27 27 GLU CA C 27 54.930 54.930 54.895 0.035 18327
68 1 . 1 1 27 27 GLU CB C 27 32.880 32.880 32.158 0.722 18327
69 1 . 1 1 27 27 GLU H H 27 7.542 7.542 7.567 -0.025 18327
70 1 . 1 1 28 28 LEU N N 28 121.400 121.400 120.351 1.049 18327
71 1 . 1 1 28 28 LEU HA H 28 4.760 4.760 4.748 0.012 18327
72 1 . 1 1 28 28 LEU CA C 28 53.120 53.120 54.201 -1.081 18327
73 1 . 1 1 28 28 LEU CB C 28 44.500 44.500 45.571 -1.071 18327
74 1 . 1 1 28 28 LEU H H 28 8.897 8.897 8.289 0.608 18327
75 1 . 1 1 29 29 SER N N 29 115.700 115.700 118.655 -2.955 18327
76 1 . 1 1 29 29 SER HA H 29 5.030 5.030 4.851 0.179 18327
77 1 . 1 1 29 29 SER CA C 29 58.470 58.470 58.704 -0.234 18327
78 1 . 1 1 29 29 SER CB C 29 63.690 63.690 64.083 -0.394 18327
79 1 . 1 1 29 29 SER H H 29 7.949 7.949 8.423 -0.474 18327
80 1 . 1 1 30 30 LEU N N 30 121.300 121.300 120.315 0.985 18327
81 1 . 1 1 30 30 LEU HA H 30 4.800 4.800 4.672 0.128 18327
82 1 . 1 1 30 30 LEU CA C 30 52.940 52.940 55.370 -2.430 18327
83 1 . 1 1 30 30 LEU CB C 30 46.370 46.370 46.055 0.315 18327
84 1 . 1 1 30 30 LEU H H 30 9.503 9.503 8.632 0.871 18327
85 1 . 1 1 31 31 GLN N N 31 123.100 123.100 120.940 2.160 18327
86 1 . 1 1 31 31 GLN HA H 31 5.070 5.070 4.712 0.359 18327
87 1 . 1 1 31 31 GLN CA C 31 52.940 52.940 54.163 -1.223 18327
88 1 . 1 1 31 31 GLN CB C 31 31.190 31.190 32.534 -1.344 18327
89 1 . 1 1 31 31 GLN H H 31 9.152 9.152 8.419 0.733 18327
90 1 . 1 1 32 32 ILE N N 32 120.800 120.800 121.102 -0.302 18327
91 1 . 1 1 32 32 ILE HA H 32 3.030 3.030 3.880 -0.850 18327
92 1 . 1 1 32 32 ILE CA C 32 64.250 64.250 62.278 1.972 18327
93 1 . 1 1 32 32 ILE CB C 32 37.940 37.940 37.518 0.422 18327
94 1 . 1 1 32 32 ILE H H 32 8.019 8.019 8.506 -0.487 18327
95 1 . 1 1 33 33 GLY N N 33 115.700 115.700 114.264 1.436 18327
96 1 . 1 1 33 33 GLY CA C 33 44.500 44.500 44.911 -0.411 18327
97 1 . 1 1 33 33 GLY H H 33 8.777 8.777 8.712 0.065 18327
98 1 . 1 1 34 34 ASP N N 34 122.300 122.300 121.603 0.697 18327
99 1 . 1 1 34 34 ASP HA H 34 4.640 4.640 4.911 -0.271 18327
100 1 . 1 1 34 34 ASP CA C 34 55.860 55.860 53.658 2.202 18327
101 1 . 1 1 34 34 ASP CB C 34 41.310 41.310 42.518 -1.208 18327
102 1 . 1 1 34 34 ASP H H 34 8.690 8.690 7.634 1.056 18327
103 1 . 1 1 35 35 THR N N 35 117.900 117.900 115.692 2.208 18327
104 1 . 1 1 35 35 THR HA H 35 5.160 5.160 5.195 -0.035 18327
105 1 . 1 1 35 35 THR CA C 35 61.450 61.450 61.475 -0.025 18327
106 1 . 1 1 35 35 THR CB C 35 69.090 69.090 70.680 -1.590 18327
107 1 . 1 1 35 35 THR H H 35 8.389 8.389 8.328 0.061 18327
108 1 . 1 1 36 36 VAL N N 36 118.200 118.200 116.898 1.302 18327
109 1 . 1 1 36 36 VAL HA H 36 5.100 5.100 4.558 0.542 18327
110 1 . 1 1 36 36 VAL CA C 36 57.910 57.910 60.189 -2.279 18327
111 1 . 1 1 36 36 VAL CB C 36 34.190 34.190 34.811 -0.621 18327
112 1 . 1 1 36 36 VAL H H 36 9.019 9.019 9.019 0.000 18327
113 1 . 1 1 37 37 HIS N N 37 122.100 122.100 119.466 2.634 18327
114 1 . 1 1 37 37 HIS HA H 37 4.840 4.840 4.952 -0.112 18327
115 1 . 1 1 37 37 HIS CA C 37 52.560 52.560 54.305 -1.745 18327
116 1 . 1 1 37 37 HIS CB C 37 31.260 31.260 33.193 -1.933 18327
117 1 . 1 1 37 37 HIS H H 37 8.489 8.489 8.453 0.036 18327
118 1 . 1 1 38 38 ILE N N 38 126.400 126.400 125.443 0.957 18327
119 1 . 1 1 38 38 ILE HA H 38 3.780 3.780 4.295 -0.515 18327
120 1 . 1 1 38 38 ILE CA C 38 61.640 61.640 60.876 0.764 18327
121 1 . 1 1 38 38 ILE CB C 38 38.880 38.880 38.879 0.001 18327
122 1 . 1 1 38 38 ILE H H 38 8.636 8.636 8.556 0.080 18327
123 1 . 1 1 39 39 LEU N N 39 126.000 126.000 124.890 1.110 18327
124 1 . 1 1 39 39 LEU HA H 39 4.400 4.400 4.780 -0.380 18327
125 1 . 1 1 39 39 LEU CA C 39 55.490 55.490 55.204 0.286 18327
126 1 . 1 1 39 39 LEU CB C 39 43.750 43.750 44.181 -0.431 18327
127 1 . 1 1 39 39 LEU H H 39 9.162 9.162 8.666 0.496 18327
128 1 . 1 1 40 40 GLU N N 40 115.100 115.100 117.409 -2.309 18327
129 1 . 1 1 40 40 GLU HA H 40 7.895 7.895 4.711 3.184 18327
130 1 . 1 1 41 41 THR N N 41 116.400 116.400 111.586 4.814 18327
131 1 . 1 1 41 41 THR HA H 41 4.270 4.270 4.778 -0.508 18327
132 1 . 1 1 41 41 THR CA C 41 60.890 60.890 60.814 0.076 18327
133 1 . 1 1 41 41 THR CB C 41 69.650 69.650 70.659 -1.009 18327
134 1 . 1 1 41 41 THR H H 41 8.162 8.162 8.411 -0.249 18327
135 1 . 1 1 43 43 GLU N N 43 123.300 123.300 121.299 2.001 18327
136 1 . 1 1 43 43 GLU HA H 43 4.270 4.270 4.238 0.032 18327
137 1 . 1 1 43 43 GLU CA C 43 57.350 57.350 55.953 1.397 18327
138 1 . 1 1 43 43 GLU CB C 43 26.790 26.790 29.355 -2.565 18327
139 1 . 1 1 43 43 GLU H H 43 8.108 8.108 8.481 -0.373 18327
140 1 . 1 1 44 44 GLY CA C 44 45.440 45.440 45.320 0.120 18327
141 1 . 1 1 45 45 TRP N N 45 124.100 124.100 119.770 4.330 18327
142 1 . 1 1 45 45 TRP HA H 45 4.690 4.690 4.671 0.019 18327
143 1 . 1 1 45 45 TRP H H 45 8.590 8.590 7.276 1.314 18327
144 1 . 1 1 46 46 TYR HA H 46 5.600 5.600 4.637 0.963 18327
145 1 . 1 1 46 46 TYR CA C 46 54.060 54.060 57.049 -2.989 18327
146 1 . 1 1 46 46 TYR CB C 46 42.060 42.060 41.207 0.853 18327
147 1 . 1 1 47 47 ARG N N 47 118.100 118.100 122.405 -4.306 18327
148 1 . 1 1 47 47 ARG HA H 47 5.070 5.070 4.855 0.215 18327
149 1 . 1 1 47 47 ARG CA C 47 54.060 54.060 54.298 -0.238 18327
150 1 . 1 1 47 47 ARG CB C 47 33.250 33.250 34.210 -0.960 18327
151 1 . 1 1 47 47 ARG H H 47 8.495 8.495 9.007 -0.512 18327
152 1 . 1 1 48 48 GLY N N 48 114.000 114.000 113.377 0.623 18327
153 1 . 1 1 48 48 GLY CA C 48 46.560 46.560 46.366 0.194 18327
154 1 . 1 1 48 48 GLY H H 48 9.183 9.183 9.000 0.183 18327
155 1 . 1 1 49 49 TYR N N 49 116.200 116.200 116.881 -0.681 18327
156 1 . 1 1 49 49 TYR HA H 49 5.380 5.380 5.113 0.267 18327
157 1 . 1 1 49 49 TYR CA C 49 55.110 55.110 56.914 -1.804 18327
158 1 . 1 1 49 49 TYR CB C 49 40.750 40.750 39.696 1.054 18327
159 1 . 1 1 49 49 TYR H H 49 8.199 8.199 8.454 -0.255 18327
160 1 . 1 1 50 50 THR N N 50 112.200 112.200 111.934 0.266 18327
161 1 . 1 1 50 50 THR HA H 50 5.120 5.120 4.225 0.895 18327
162 1 . 1 1 50 50 THR CA C 50 59.770 59.770 61.248 -1.478 18327
163 1 . 1 1 50 50 THR CB C 50 69.460 69.460 69.898 -0.438 18327
164 1 . 1 1 50 50 THR H H 50 9.436 9.436 8.496 0.940 18327
165 1 . 1 1 51 51 LEU N N 51 121.300 121.300 120.121 1.179 18327
166 1 . 1 1 51 51 LEU HA H 51 4.230 4.230 4.322 -0.092 18327
167 1 . 1 1 51 51 LEU CA C 51 56.790 56.790 55.550 1.240 18327
168 1 . 1 1 51 51 LEU CB C 51 40.000 40.000 41.891 -1.891 18327
169 1 . 1 1 51 51 LEU H H 51 8.313 8.313 8.127 0.186 18327
170 1 . 1 1 52 52 ARG N N 52 116.600 116.600 118.294 -1.694 18327
171 1 . 1 1 52 52 ARG HA H 52 4.250 4.250 4.158 0.092 18327
172 1 . 1 1 52 52 ARG CA C 52 57.350 57.350 57.359 -0.009 18327
173 1 . 1 1 52 52 ARG CB C 52 30.510 30.510 30.791 -0.281 18327
174 1 . 1 1 52 52 ARG H H 52 8.053 8.053 7.974 0.079 18327
175 1 . 1 1 53 53 LYS N N 53 122.600 122.600 117.673 4.928 18327
176 1 . 1 1 53 53 LYS HA H 53 4.620 4.620 4.520 0.100 18327
177 1 . 1 1 53 53 LYS CA C 53 54.620 54.620 55.441 -0.821 18327
178 1 . 1 1 53 53 LYS CB C 53 32.310 32.310 33.731 -1.421 18327
179 1 . 1 1 53 53 LYS H H 53 7.655 7.655 7.603 0.052 18327
180 1 . 1 1 54 54 LYS N N 54 124.900 124.900 124.403 0.497 18327
181 1 . 1 1 54 54 LYS HA H 54 4.090 4.090 4.318 -0.228 18327
182 1 . 1 1 54 54 LYS CA C 54 58.470 58.470 58.316 0.154 18327
183 1 . 1 1 54 54 LYS CB C 54 32.130 32.130 32.547 -0.417 18327
184 1 . 1 1 54 54 LYS H H 54 8.499 8.499 8.738 -0.239 18327
185 1 . 1 1 55 55 SER N N 55 110.100 110.100 113.486 -3.386 18327
186 1 . 1 1 55 55 SER HA H 55 4.140 4.140 4.292 -0.152 18327
187 1 . 1 1 55 55 SER CA C 55 58.470 58.470 59.953 -1.483 18327
188 1 . 1 1 55 55 SER CB C 55 63.310 63.310 63.207 0.103 18327
189 1 . 1 1 55 55 SER H H 55 7.862 7.862 8.042 -0.180 18327
190 1 . 1 1 56 56 LYS N N 56 124.000 124.000 122.239 1.761 18327
191 1 . 1 1 56 56 LYS HA H 56 4.700 4.700 4.425 0.275 18327
192 1 . 1 1 56 56 LYS CA C 56 54.810 54.810 55.452 -0.642 18327
193 1 . 1 1 56 56 LYS CB C 56 33.250 33.250 32.522 0.728 18327
194 1 . 1 1 56 56 LYS H H 56 7.481 7.481 7.792 -0.311 18327
195 1 . 1 1 57 57 LYS N N 57 125.700 125.700 122.232 3.468 18327
196 1 . 1 1 57 57 LYS HA H 57 5.330 5.330 4.621 0.709 18327
197 1 . 1 1 57 57 LYS CA C 57 54.620 54.620 55.318 -0.698 18327
198 1 . 1 1 57 57 LYS CB C 57 34.240 34.240 35.211 -0.971 18327
199 1 . 1 1 57 57 LYS H H 57 8.475 8.475 8.047 0.428 18327
200 1 . 1 1 58 58 GLY N N 58 109.400 109.400 107.416 1.984 18327
201 1 . 1 1 58 58 GLY CA C 58 45.620 45.620 45.398 0.221 18327
202 1 . 1 1 58 58 GLY H H 58 9.073 9.073 8.629 0.444 18327
203 1 . 1 1 59 59 ILE N N 59 113.900 113.900 118.082 -4.182 18327
204 1 . 1 1 59 59 ILE HA H 59 6.000 6.000 5.045 0.955 18327
205 1 . 1 1 59 59 ILE CA C 59 59.590 59.590 59.249 0.341 18327
206 1 . 1 1 59 59 ILE CB C 59 41.140 41.140 42.171 -1.032 18327
207 1 . 1 1 59 59 ILE H H 59 8.628 8.628 8.247 0.381 18327
208 1 . 1 1 60 60 PHE N N 60 116.900 116.900 115.368 1.532 18327
209 1 . 1 1 60 60 PHE HA H 60 5.120 5.120 5.135 -0.015 18327
210 1 . 1 1 60 60 PHE CA C 60 54.060 54.060 55.113 -1.053 18327
211 1 . 1 1 60 60 PHE CB C 60 37.190 37.190 39.940 -2.750 18327
212 1 . 1 1 60 60 PHE H H 60 8.724 8.724 8.575 0.149 18327
213 1 . 1 1 61 61 PRO HA H 61 3.480 3.480 3.739 -0.259 18327
214 1 . 1 1 61 61 PRO CA C 61 62.200 62.200 62.233 -0.033 18327
215 1 . 1 1 61 61 PRO CB C 61 31.190 31.190 31.466 -0.276 18327
216 1 . 1 1 62 62 ALA N N 62 124.600 124.600 127.560 -2.960 18327
217 1 . 1 1 62 62 ALA HA H 62 3.720 3.720 4.281 -0.561 18327
218 1 . 1 1 62 62 ALA CA C 62 54.370 54.370 54.875 -0.505 18327
219 1 . 1 1 62 62 ALA CB C 62 17.650 17.650 18.217 -0.567 18327
220 1 . 1 1 62 62 ALA H H 62 7.898 7.898 8.397 -0.499 18327
221 1 . 1 1 63 63 SER N N 63 109.700 109.700 112.624 -2.924 18327
222 1 . 1 1 63 63 SER HA H 63 4.200 4.200 4.222 -0.022 18327
223 1 . 1 1 63 63 SER CA C 63 59.400 59.400 60.540 -1.140 18327
224 1 . 1 1 63 63 SER CB C 63 62.380 62.380 62.866 -0.486 18327
225 1 . 1 1 63 63 SER H H 63 8.030 8.030 8.139 -0.109 18327
226 1 . 1 1 64 64 TYR N N 64 120.300 120.300 117.979 2.321 18327
227 1 . 1 1 64 64 TYR HA H 64 4.260 4.260 4.506 -0.246 18327
228 1 . 1 1 64 64 TYR CA C 64 57.720 57.720 58.352 -0.632 18327
229 1 . 1 1 64 64 TYR CB C 64 37.560 37.560 38.219 -0.659 18327
230 1 . 1 1 64 64 TYR H H 64 7.124 7.124 7.497 -0.373 18327
231 1 . 1 1 65 65 ILE N N 65 118.000 118.000 117.037 0.963 18327
232 1 . 1 1 65 65 ILE HA H 65 4.830 4.830 4.936 -0.106 18327
233 1 . 1 1 65 65 ILE CA C 65 56.980 56.980 59.299 -2.318 18327
234 1 . 1 1 65 65 ILE CB C 65 39.630 39.630 40.333 -0.703 18327
235 1 . 1 1 65 65 ILE H H 65 7.671 7.671 7.473 0.198 18327
236 1 . 1 1 66 66 HIS N N 66 124.500 124.500 122.889 1.611 18327
237 1 . 1 1 66 66 HIS HA H 66 5.130 5.130 4.912 0.218 18327
238 1 . 1 1 66 66 HIS CA C 66 53.060 53.060 54.510 -1.450 18327
239 1 . 1 1 66 66 HIS CB C 66 30.510 30.510 33.094 -2.584 18327
240 1 . 1 1 66 66 HIS H H 66 9.159 9.159 8.860 0.299 18327
241 1 . 1 1 67 67 LEU N N 67 127.400 127.400 126.715 0.685 18327
242 1 . 1 1 67 67 LEU HA H 67 4.560 4.560 4.743 -0.183 18327
243 1 . 1 1 67 67 LEU CA C 67 55.300 55.300 55.319 -0.019 18327
244 1 . 1 1 67 67 LEU CB C 67 42.060 42.060 42.951 -0.891 18327
245 1 . 1 1 67 67 LEU H H 67 8.979 8.979 8.817 0.162 18327
246 1 . 1 1 68 68 LYS N N 68 121.900 121.900 122.823 -0.923 18327
247 1 . 1 1 68 68 LYS HA H 68 4.490 4.490 4.473 0.017 18327
248 1 . 1 1 68 68 LYS CA C 68 55.110 55.110 55.462 -0.352 18327
249 1 . 1 1 68 68 LYS CB C 68 34.610 34.610 33.946 0.664 18327
250 1 . 1 1 68 68 LYS H H 68 8.499 8.499 8.829 -0.330 18327
251 1 . 1 1 69 69 GLU N N 69 122.100 122.100 121.552 0.548 18327
252 1 . 1 1 69 69 GLU HA H 69 4.290 4.290 4.062 0.228 18327
253 1 . 1 1 69 69 GLU CA C 69 56.610 56.610 57.276 -0.666 18327
254 1 . 1 1 69 69 GLU CB C 69 30.330 30.330 29.376 0.954 18327
255 1 . 1 1 69 69 GLU H H 69 8.569 8.569 8.411 0.158 18327
256 1 . 1 1 70 70 ALA N N 70 123.300 123.300 124.612 -1.312 18327
257 1 . 1 1 70 70 ALA HA H 70 4.210 4.210 4.134 0.075 18327
258 1 . 1 1 70 70 ALA CA C 70 51.810 51.810 52.422 -0.612 18327
259 1 . 1 1 70 70 ALA CB C 70 19.700 19.700 18.623 1.077 18327
260 1 . 1 1 70 70 ALA H H 70 8.181 8.181 8.297 -0.116 18327
261 1 . 1 1 71 71 ILE N N 71 120.000 120.000 120.233 -0.233 18327
262 1 . 1 1 71 71 ILE HA H 71 4.070 4.070 4.149 -0.079 18327
263 1 . 1 1 71 71 ILE CA C 71 60.330 60.330 61.048 -0.718 18327
264 1 . 1 1 71 71 ILE CB C 71 38.690 38.690 38.900 -0.210 18327
265 1 . 1 1 71 71 ILE H H 71 7.789 7.789 8.161 -0.372 18327
266 1 . 1 1 72 72 VAL N N 72 124.400 124.400 121.580 2.820 18327
267 1 . 1 1 72 72 VAL HA H 72 4.070 4.070 4.292 -0.222 18327
268 1 . 1 1 72 72 VAL CA C 72 61.640 61.640 61.630 0.010 18327
269 1 . 1 1 72 72 VAL CB C 72 32.690 32.690 32.965 -0.276 18327
270 1 . 1 1 72 72 VAL H H 72 8.089 8.089 8.125 -0.036 18327
271 1 . 1 1 73 73 GLU N N 73 125.940 125.940 121.774 4.166 18327
272 1 . 1 1 73 73 GLU HA H 73 4.300 4.300 4.524 -0.224 18327
273 1 . 1 1 73 73 GLU CA C 73 56.610 56.610 55.970 0.640 18327
274 1 . 1 1 73 73 GLU CB C 73 30.710 30.710 30.793 -0.083 18327
275 1 . 1 1 73 73 GLU H H 73 8.464 8.464 8.556 -0.092 18327
stop_
save_