data_18832
save_entry_information
_Entry.Sf_category entry_information
_Entry.NMR_STAR_version 3.0.9.13
_Entry.Entry_ID 18832
_Entry.PDB_ID 2M0Y
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 18832
_Entity_delta_chem_shifts.ID 1
loop_
_Delta_CS.Atom_chem_shift_ID
_Delta_CS.Entity_delta_chem_shifts_ID
_Delta_CS.Conformer_ID
_Delta_CS.Assembly_atom_ID
_Delta_CS.Entity_assembly_ID
_Delta_CS.Entity_ID
_Delta_CS.Comp_index_ID
_Delta_CS.Seq_ID
_Delta_CS.Comp_ID
_Delta_CS.Atom_ID
_Delta_CS.Atom_type
_Delta_CS.Auth_seq_ID
_Delta_CS.Original_CS_value
_Delta_CS.Corrected_CS_value
_Delta_CS.Sparta_CS_value
_Delta_CS.Delta_CS_value
_Delta_CS.Entry_ID
1 1 1 . 1 1 2 2 THR N N 2 116.400 116.400 116.313 0.087 18832
2 1 1 . 1 1 2 2 THR HA H 2 4.120 4.120 4.626 -0.506 18832
3 1 1 . 1 1 2 2 THR CA C 2 62.100 62.100 61.382 0.718 18832
4 1 1 . 1 1 2 2 THR CB C 2 69.440 69.440 69.749 -0.309 18832
5 1 1 . 1 1 2 2 THR H H 2 8.150 8.150 7.993 0.157 18832
6 1 1 . 1 1 3 3 ARG HA H 3 4.310 4.310 4.634 -0.324 18832
7 1 1 . 1 1 3 3 ARG CA C 3 55.750 55.750 55.618 0.132 18832
8 1 1 . 1 1 3 3 ARG CB C 3 30.620 30.620 31.030 -0.410 18832
9 1 1 . 1 1 4 4 TRP N N 4 123.300 123.300 124.784 -1.484 18832
10 1 1 . 1 1 4 4 TRP HA H 4 4.480 4.480 4.761 -0.281 18832
11 1 1 . 1 1 4 4 TRP CA C 4 57.560 57.560 55.728 1.832 18832
12 1 1 . 1 1 4 4 TRP CB C 4 29.490 29.490 30.297 -0.807 18832
13 1 1 . 1 1 4 4 TRP H H 4 8.108 8.108 8.659 -0.551 18832
14 1 1 . 1 1 5 5 VAL HA H 5 4.570 4.570 4.290 0.280 18832
15 1 1 . 1 1 5 5 VAL CB C 5 30.840 30.840 32.418 -1.578 18832
16 1 1 . 1 1 6 6 PRO HA H 6 4.810 4.810 4.692 0.118 18832
17 1 1 . 1 1 6 6 PRO CB C 6 32.210 32.210 31.332 0.878 18832
18 1 1 . 1 1 7 7 THR HA H 7 4.270 4.270 3.821 0.449 18832
19 1 1 . 1 1 7 7 THR CA C 7 60.890 60.890 63.130 -2.240 18832
20 1 1 . 1 1 7 7 THR CB C 7 70.140 70.140 68.408 1.732 18832
21 1 1 . 1 1 8 8 LYS HA H 8 4.440 4.440 4.411 0.029 18832
22 1 1 . 1 1 8 8 LYS CA C 8 55.980 55.980 55.237 0.743 18832
23 1 1 . 1 1 8 8 LYS CB C 8 35.050 35.050 33.699 1.351 18832
24 1 1 . 1 1 10 10 GLU HA H 10 4.580 4.580 4.383 0.197 18832
25 1 1 . 1 1 10 10 GLU CA C 10 55.570 55.570 55.400 0.170 18832
26 1 1 . 1 1 10 10 GLU CB C 10 30.780 30.780 30.630 0.151 18832
27 1 1 . 1 1 11 11 GLU N N 11 122.500 122.500 123.502 -1.002 18832
28 1 1 . 1 1 11 11 GLU HA H 11 4.340 4.340 4.260 0.080 18832
29 1 1 . 1 1 11 11 GLU CA C 11 57.140 57.140 58.231 -1.091 18832
30 1 1 . 1 1 11 11 GLU CB C 11 29.400 29.400 30.358 -0.958 18832
31 1 1 . 1 1 11 11 GLU H H 11 8.271 8.271 8.708 -0.437 18832
32 1 1 . 1 1 12 12 LYS HA H 12 4.380 4.380 4.154 0.226 18832
33 1 1 . 1 1 12 12 LYS CA C 12 55.790 55.790 56.807 -1.017 18832
34 1 1 . 1 1 12 12 LYS CB C 12 33.600 33.600 33.784 -0.184 18832
35 1 1 . 1 1 13 13 TYR HA H 13 5.560 5.560 4.614 0.946 18832
36 1 1 . 1 1 13 13 TYR CA C 13 55.860 55.860 55.816 0.044 18832
37 1 1 . 1 1 13 13 TYR CB C 13 42.440 42.440 40.141 2.299 18832
38 1 1 . 1 1 14 14 GLY N N 14 105.320 105.320 106.719 -1.399 18832
39 1 1 . 1 1 14 14 GLY CA C 14 45.240 45.240 44.843 0.397 18832
40 1 1 . 1 1 14 14 GLY H H 14 8.401 8.401 8.839 -0.438 18832
41 1 1 . 1 1 15 15 VAL N N 15 118.900 118.900 118.804 0.096 18832
42 1 1 . 1 1 15 15 VAL HA H 15 5.341 5.341 4.654 0.687 18832
43 1 1 . 1 1 15 15 VAL CA C 15 59.210 59.210 61.264 -2.054 18832
44 1 1 . 1 1 15 15 VAL CB C 15 35.740 35.740 36.647 -0.907 18832
45 1 1 . 1 1 15 15 VAL H H 15 8.851 8.851 8.557 0.294 18832
46 1 1 . 1 1 16 16 ALA N N 16 129.460 129.460 126.118 3.342 18832
47 1 1 . 1 1 16 16 ALA HA H 16 5.000 5.000 5.355 -0.355 18832
48 1 1 . 1 1 16 16 ALA CA C 16 52.000 52.000 50.103 1.897 18832
49 1 1 . 1 1 16 16 ALA CB C 16 19.330 19.330 21.081 -1.751 18832
50 1 1 . 1 1 16 16 ALA H H 16 9.113 9.113 8.478 0.635 18832
51 1 1 . 1 1 17 17 PHE N N 17 124.070 124.070 120.378 3.692 18832
52 1 1 . 1 1 17 17 PHE HA H 17 4.801 4.801 4.960 -0.159 18832
53 1 1 . 1 1 17 17 PHE CA C 17 56.230 56.230 55.788 0.442 18832
54 1 1 . 1 1 17 17 PHE CB C 17 40.000 40.000 38.891 1.109 18832
55 1 1 . 1 1 17 17 PHE H H 17 8.787 8.787 7.937 0.850 18832
56 1 1 . 1 1 18 18 TYR N N 18 118.210 118.210 123.461 -5.251 18832
57 1 1 . 1 1 18 18 TYR HA H 18 4.483 4.483 4.377 0.106 18832
58 1 1 . 1 1 18 18 TYR CA C 18 55.300 55.300 57.313 -2.013 18832
59 1 1 . 1 1 18 18 TYR CB C 18 42.810 42.810 41.876 0.934 18832
60 1 1 . 1 1 18 18 TYR H H 18 7.281 7.281 7.735 -0.454 18832
61 1 1 . 1 1 19 19 ASN N N 19 116.800 116.800 119.327 -2.527 18832
62 1 1 . 1 1 19 19 ASN HA H 19 4.710 4.710 4.813 -0.103 18832
63 1 1 . 1 1 19 19 ASN CA C 19 52.940 52.940 52.820 0.120 18832
64 1 1 . 1 1 19 19 ASN CB C 19 39.060 39.060 38.628 0.432 18832
65 1 1 . 1 1 19 19 ASN H H 19 8.134 8.134 8.183 -0.049 18832
66 1 1 . 1 1 20 20 TYR N N 20 122.190 122.190 122.531 -0.341 18832
67 1 1 . 1 1 20 20 TYR HA H 20 4.687 4.687 4.458 0.229 18832
68 1 1 . 1 1 20 20 TYR CA C 20 57.720 57.720 58.775 -1.055 18832
69 1 1 . 1 1 20 20 TYR CB C 20 42.250 42.250 39.718 2.532 18832
70 1 1 . 1 1 20 20 TYR H H 20 8.993 8.993 7.944 1.049 18832
71 1 1 . 1 1 21 21 ASP N N 21 128.520 128.520 127.691 0.829 18832
72 1 1 . 1 1 21 21 ASP HA H 21 4.790 4.790 4.823 -0.033 18832
73 1 1 . 1 1 21 21 ASP CA C 21 52.370 52.370 52.425 -0.055 18832
74 1 1 . 1 1 21 21 ASP CB C 21 41.130 41.130 42.496 -1.366 18832
75 1 1 . 1 1 21 21 ASP H H 21 7.838 7.838 8.271 -0.433 18832
76 1 1 . 1 1 22 22 ALA N N 22 125.240 125.240 125.430 -0.190 18832
77 1 1 . 1 1 22 22 ALA HA H 22 4.051 4.051 4.681 -0.630 18832
78 1 1 . 1 1 22 22 ALA CA C 22 52.940 52.940 53.099 -0.159 18832
79 1 1 . 1 1 22 22 ALA CB C 22 20.450 20.450 19.709 0.741 18832
80 1 1 . 1 1 22 22 ALA H H 22 8.103 8.103 8.420 -0.317 18832
81 1 1 . 1 1 23 23 ARG N N 23 122.190 122.190 121.005 1.185 18832
82 1 1 . 1 1 23 23 ARG HA H 23 4.346 4.346 4.467 -0.121 18832
83 1 1 . 1 1 23 23 ARG CA C 23 55.490 55.490 55.855 -0.365 18832
84 1 1 . 1 1 23 23 ARG CB C 23 30.700 30.700 31.053 -0.353 18832
85 1 1 . 1 1 23 23 ARG H H 23 8.887 8.887 8.608 0.279 18832
86 1 1 . 1 1 24 24 GLY N N 24 105.320 105.320 106.198 -0.878 18832
87 1 1 . 1 1 24 24 GLY CA C 24 44.500 44.500 44.928 -0.428 18832
88 1 1 . 1 1 24 24 GLY H H 24 7.258 7.258 7.516 -0.258 18832
89 1 1 . 1 1 25 25 ALA N N 25 122.190 122.190 121.527 0.663 18832
90 1 1 . 1 1 25 25 ALA HA H 25 4.166 4.166 4.256 -0.090 18832
91 1 1 . 1 1 25 25 ALA CA C 25 54.440 54.440 53.904 0.536 18832
92 1 1 . 1 1 25 25 ALA CB C 25 18.770 18.770 19.423 -0.653 18832
93 1 1 . 1 1 25 25 ALA H H 25 8.627 8.627 8.348 0.279 18832
94 1 1 . 1 1 26 26 ASP N N 26 114.690 114.690 117.571 -2.881 18832
95 1 1 . 1 1 26 26 ASP HA H 26 4.700 4.700 4.471 0.229 18832
96 1 1 . 1 1 26 26 ASP CA C 26 53.870 53.870 55.994 -2.124 18832
97 1 1 . 1 1 26 26 ASP CB C 26 40.390 40.390 40.965 -0.576 18832
98 1 1 . 1 1 26 26 ASP H H 26 8.955 8.955 8.628 0.327 18832
99 1 1 . 1 1 27 27 GLU N N 27 118.910 118.910 117.716 1.194 18832
100 1 1 . 1 1 27 27 GLU HA H 27 5.202 5.202 4.378 0.824 18832
101 1 1 . 1 1 27 27 GLU CA C 27 54.930 54.930 56.168 -1.238 18832
102 1 1 . 1 1 27 27 GLU CB C 27 32.880 32.880 31.672 1.208 18832
103 1 1 . 1 1 27 27 GLU H H 27 7.537 7.537 7.928 -0.391 18832
104 1 1 . 1 1 28 28 LEU N N 28 121.490 121.490 120.066 1.424 18832
105 1 1 . 1 1 28 28 LEU HA H 28 4.756 4.756 4.626 0.130 18832
106 1 1 . 1 1 28 28 LEU CA C 28 53.120 53.120 53.755 -0.635 18832
107 1 1 . 1 1 28 28 LEU CB C 28 44.500 44.500 45.740 -1.240 18832
108 1 1 . 1 1 28 28 LEU H H 28 8.890 8.890 8.454 0.436 18832
109 1 1 . 1 1 29 29 SER N N 29 115.870 115.870 118.966 -3.096 18832
110 1 1 . 1 1 29 29 SER HA H 29 5.009 5.009 4.710 0.299 18832
111 1 1 . 1 1 29 29 SER CA C 29 58.470 58.470 58.694 -0.223 18832
112 1 1 . 1 1 29 29 SER CB C 29 63.690 63.690 63.407 0.283 18832
113 1 1 . 1 1 29 29 SER H H 29 7.948 7.948 8.465 -0.517 18832
114 1 1 . 1 1 30 30 LEU N N 30 121.260 121.260 128.340 -7.080 18832
115 1 1 . 1 1 30 30 LEU HA H 30 4.776 4.776 4.759 0.017 18832
116 1 1 . 1 1 30 30 LEU CA C 30 52.940 52.940 54.104 -1.164 18832
117 1 1 . 1 1 30 30 LEU CB C 30 46.370 46.370 45.441 0.929 18832
118 1 1 . 1 1 30 30 LEU H H 30 9.500 9.500 8.124 1.376 18832
119 1 1 . 1 1 31 31 GLN N N 31 123.130 123.130 119.060 4.070 18832
120 1 1 . 1 1 31 31 GLN HA H 31 5.065 5.065 5.298 -0.233 18832
121 1 1 . 1 1 31 31 GLN CA C 31 52.940 52.940 53.949 -1.009 18832
122 1 1 . 1 1 31 31 GLN CB C 31 31.190 31.190 33.113 -1.923 18832
123 1 1 . 1 1 31 31 GLN H H 31 9.147 9.147 8.439 0.708 18832
124 1 1 . 1 1 32 32 ILE N N 32 120.790 120.790 120.959 -0.169 18832
125 1 1 . 1 1 32 32 ILE HA H 32 3.032 3.032 4.083 -1.051 18832
126 1 1 . 1 1 32 32 ILE CA C 32 64.250 64.250 63.341 0.909 18832
127 1 1 . 1 1 32 32 ILE CB C 32 37.940 37.940 37.886 0.053 18832
128 1 1 . 1 1 32 32 ILE H H 32 8.016 8.016 8.361 -0.345 18832
129 1 1 . 1 1 33 33 GLY N N 33 115.870 115.870 115.242 0.628 18832
130 1 1 . 1 1 33 33 GLY CA C 33 44.500 44.500 44.681 -0.181 18832
131 1 1 . 1 1 33 33 GLY H H 33 8.775 8.775 9.029 -0.254 18832
132 1 1 . 1 1 34 34 ASP N N 34 122.430 122.430 122.172 0.258 18832
133 1 1 . 1 1 34 34 ASP HA H 34 4.634 4.634 4.921 -0.287 18832
134 1 1 . 1 1 34 34 ASP CA C 34 55.860 55.860 54.177 1.683 18832
135 1 1 . 1 1 34 34 ASP CB C 34 41.310 41.310 42.599 -1.289 18832
136 1 1 . 1 1 34 34 ASP H H 34 8.686 8.686 7.871 0.815 18832
137 1 1 . 1 1 35 35 THR N N 35 117.980 117.980 116.530 1.450 18832
138 1 1 . 1 1 35 35 THR HA H 35 5.154 5.154 4.874 0.280 18832
139 1 1 . 1 1 35 35 THR CA C 35 61.450 61.450 61.853 -0.403 18832
140 1 1 . 1 1 35 35 THR CB C 35 69.090 69.090 70.100 -1.010 18832
141 1 1 . 1 1 35 35 THR H H 35 8.392 8.392 8.505 -0.113 18832
142 1 1 . 1 1 36 36 VAL N N 36 118.200 118.200 118.655 -0.455 18832
143 1 1 . 1 1 36 36 VAL HA H 36 5.152 5.152 4.707 0.445 18832
144 1 1 . 1 1 36 36 VAL CA C 36 57.910 57.910 59.800 -1.890 18832
145 1 1 . 1 1 36 36 VAL CB C 36 34.190 34.190 34.798 -0.608 18832
146 1 1 . 1 1 36 36 VAL H H 36 9.016 9.016 8.511 0.505 18832
147 1 1 . 1 1 37 37 HIS N N 37 122.190 122.190 125.837 -3.647 18832
148 1 1 . 1 1 37 37 HIS HA H 37 4.811 4.811 4.967 -0.156 18832
149 1 1 . 1 1 37 37 HIS CA C 37 52.560 52.560 53.911 -1.351 18832
150 1 1 . 1 1 37 37 HIS CB C 37 31.260 31.260 30.780 0.480 18832
151 1 1 . 1 1 37 37 HIS H H 37 8.491 8.491 8.767 -0.276 18832
152 1 1 . 1 1 38 38 ILE N N 38 126.650 126.650 127.252 -0.602 18832
153 1 1 . 1 1 38 38 ILE HA H 38 3.750 3.750 4.147 -0.397 18832
154 1 1 . 1 1 38 38 ILE CA C 38 61.640 61.640 62.478 -0.838 18832
155 1 1 . 1 1 38 38 ILE CB C 38 38.880 38.880 38.103 0.777 18832
156 1 1 . 1 1 38 38 ILE H H 38 8.638 8.638 8.480 0.158 18832
157 1 1 . 1 1 39 39 LEU N N 39 126.180 126.180 123.722 2.458 18832
158 1 1 . 1 1 39 39 LEU HA H 39 4.380 4.380 4.904 -0.524 18832
159 1 1 . 1 1 39 39 LEU CA C 39 55.490 55.490 55.090 0.401 18832
160 1 1 . 1 1 39 39 LEU CB C 39 43.750 43.750 44.019 -0.269 18832
161 1 1 . 1 1 39 39 LEU H H 39 9.163 9.163 8.992 0.171 18832
162 1 1 . 1 1 40 40 GLU N N 40 115.160 115.160 117.066 -1.906 18832
163 1 1 . 1 1 40 40 GLU HA H 40 5.020 5.020 4.842 0.178 18832
164 1 1 . 1 1 40 40 GLU CA C 40 55.090 55.090 54.680 0.410 18832
165 1 1 . 1 1 40 40 GLU CB C 40 35.730 35.730 34.246 1.484 18832
166 1 1 . 1 1 40 40 GLU H H 40 7.852 7.852 7.717 0.135 18832
167 1 1 . 1 1 41 41 THR HA H 41 4.270 4.270 4.481 -0.211 18832
168 1 1 . 1 1 41 41 THR CA C 41 61.250 61.250 60.464 0.786 18832
169 1 1 . 1 1 41 41 THR CB C 41 71.410 71.410 70.459 0.951 18832
170 1 1 . 1 1 42 42 TYR HA H 42 4.550 4.550 4.292 0.258 18832
171 1 1 . 1 1 43 43 GLU N N 43 124.100 124.100 120.354 3.746 18832
172 1 1 . 1 1 43 43 GLU HA H 43 3.740 3.740 4.145 -0.405 18832
173 1 1 . 1 1 43 43 GLU H H 43 8.590 8.590 7.878 0.712 18832
174 1 1 . 1 1 44 44 GLY N N 44 110.789 110.789 110.305 0.484 18832
175 1 1 . 1 1 44 44 GLY CA C 44 45.440 45.440 45.258 0.182 18832
176 1 1 . 1 1 44 44 GLY H H 44 8.432 8.432 8.296 0.136 18832
177 1 1 . 1 1 45 45 TRP HA H 45 4.690 4.690 4.580 0.110 18832
178 1 1 . 1 1 45 45 TRP CA C 45 57.550 57.550 56.133 1.417 18832
179 1 1 . 1 1 46 46 TYR HA H 46 5.600 5.600 4.562 1.038 18832
180 1 1 . 1 1 46 46 TYR CA C 46 54.060 54.060 54.726 -0.666 18832
181 1 1 . 1 1 46 46 TYR CB C 46 42.650 42.650 41.237 1.413 18832
182 1 1 . 1 1 47 47 ARG N N 47 118.100 118.100 119.566 -1.466 18832
183 1 1 . 1 1 47 47 ARG HA H 47 5.094 5.094 4.944 0.150 18832
184 1 1 . 1 1 47 47 ARG CA C 47 54.060 54.060 54.164 -0.104 18832
185 1 1 . 1 1 47 47 ARG CB C 47 33.250 33.250 34.490 -1.240 18832
186 1 1 . 1 1 47 47 ARG H H 47 8.492 8.492 8.123 0.369 18832
187 1 1 . 1 1 48 48 GLY N N 48 114.000 114.000 110.516 3.484 18832
188 1 1 . 1 1 48 48 GLY CA C 48 46.560 46.560 46.167 0.393 18832
189 1 1 . 1 1 48 48 GLY H H 48 9.183 9.183 8.975 0.208 18832
190 1 1 . 1 1 49 49 TYR N N 49 116.100 116.100 115.133 0.967 18832
191 1 1 . 1 1 49 49 TYR HA H 49 5.373 5.373 5.303 0.070 18832
192 1 1 . 1 1 49 49 TYR CA C 49 55.110 55.110 55.999 -0.889 18832
193 1 1 . 1 1 49 49 TYR CB C 49 40.750 40.750 40.874 -0.124 18832
194 1 1 . 1 1 49 49 TYR H H 49 8.194 8.194 8.140 0.054 18832
195 1 1 . 1 1 50 50 THR N N 50 112.350 112.350 115.228 -2.878 18832
196 1 1 . 1 1 50 50 THR HA H 50 5.105 5.105 4.608 0.497 18832
197 1 1 . 1 1 50 50 THR CA C 50 59.770 59.770 61.487 -1.717 18832
198 1 1 . 1 1 50 50 THR CB C 50 69.460 69.460 69.596 -0.136 18832
199 1 1 . 1 1 50 50 THR H H 50 9.441 9.441 8.810 0.631 18832
200 1 1 . 1 1 51 51 LEU N N 51 121.260 121.260 121.446 -0.186 18832
201 1 1 . 1 1 51 51 LEU HA H 51 4.236 4.236 4.037 0.199 18832
202 1 1 . 1 1 51 51 LEU CA C 51 56.790 56.790 57.480 -0.690 18832
203 1 1 . 1 1 51 51 LEU CB C 51 40.000 40.000 41.183 -1.183 18832
204 1 1 . 1 1 51 51 LEU H H 51 8.310 8.310 8.299 0.011 18832
205 1 1 . 1 1 52 52 ARG N N 52 116.570 116.570 117.250 -0.680 18832
206 1 1 . 1 1 52 52 ARG HA H 52 4.250 4.250 4.222 0.028 18832
207 1 1 . 1 1 52 52 ARG CA C 52 57.350 57.350 57.167 0.183 18832
208 1 1 . 1 1 52 52 ARG CB C 52 30.510 30.510 30.482 0.028 18832
209 1 1 . 1 1 52 52 ARG H H 52 8.047 8.047 8.261 -0.214 18832
210 1 1 . 1 1 53 53 LYS N N 53 122.660 122.660 119.716 2.944 18832
211 1 1 . 1 1 53 53 LYS HA H 53 4.616 4.616 4.528 0.088 18832
212 1 1 . 1 1 53 53 LYS CA C 53 54.620 54.620 55.331 -0.711 18832
213 1 1 . 1 1 53 53 LYS CB C 53 32.860 32.860 31.625 1.235 18832
214 1 1 . 1 1 53 53 LYS H H 53 7.649 7.649 8.044 -0.395 18832
215 1 1 . 1 1 54 54 LYS N N 54 125.010 125.010 120.108 4.902 18832
216 1 1 . 1 1 54 54 LYS HA H 54 4.090 4.090 4.175 -0.085 18832
217 1 1 . 1 1 54 54 LYS CA C 54 58.470 58.470 58.551 -0.081 18832
218 1 1 . 1 1 54 54 LYS CB C 54 32.130 32.130 32.581 -0.451 18832
219 1 1 . 1 1 54 54 LYS H H 54 8.496 8.496 8.240 0.256 18832
220 1 1 . 1 1 55 55 SER N N 55 110.240 110.240 112.659 -2.419 18832
221 1 1 . 1 1 55 55 SER HA H 55 4.122 4.122 4.258 -0.136 18832
222 1 1 . 1 1 55 55 SER CA C 55 58.960 58.960 60.007 -1.047 18832
223 1 1 . 1 1 55 55 SER CB C 55 63.310 63.310 63.367 -0.057 18832
224 1 1 . 1 1 55 55 SER H H 55 7.857 7.857 8.243 -0.386 18832
225 1 1 . 1 1 56 56 LYS N N 56 124.070 124.070 120.102 3.968 18832
226 1 1 . 1 1 56 56 LYS HA H 56 4.668 4.668 4.410 0.258 18832
227 1 1 . 1 1 56 56 LYS CA C 56 54.810 54.810 55.748 -0.938 18832
228 1 1 . 1 1 56 56 LYS CB C 56 33.250 33.250 33.643 -0.393 18832
229 1 1 . 1 1 56 56 LYS H H 56 7.473 7.473 7.825 -0.352 18832
230 1 1 . 1 1 57 57 LYS N N 57 125.940 125.940 122.433 3.507 18832
231 1 1 . 1 1 57 57 LYS HA H 57 5.341 5.341 5.030 0.311 18832
232 1 1 . 1 1 57 57 LYS CA C 57 54.620 54.620 54.577 0.043 18832
233 1 1 . 1 1 57 57 LYS CB C 57 34.240 34.240 35.443 -1.202 18832
234 1 1 . 1 1 57 57 LYS H H 57 8.474 8.474 8.239 0.235 18832
235 1 1 . 1 1 58 58 GLY N N 58 109.540 109.540 111.133 -1.593 18832
236 1 1 . 1 1 58 58 GLY CA C 58 45.620 45.620 45.291 0.329 18832
237 1 1 . 1 1 58 58 GLY H H 58 9.075 9.075 8.904 0.171 18832
238 1 1 . 1 1 59 59 ILE N N 59 113.900 113.900 115.201 -1.301 18832
239 1 1 . 1 1 59 59 ILE HA H 59 6.000 6.000 5.030 0.970 18832
240 1 1 . 1 1 59 59 ILE CA C 59 59.590 59.590 58.418 1.172 18832
241 1 1 . 1 1 59 59 ILE CB C 59 41.140 41.140 40.650 0.490 18832
242 1 1 . 1 1 59 59 ILE H H 59 8.628 8.628 7.573 1.055 18832
243 1 1 . 1 1 60 60 PHE N N 60 117.040 117.040 115.686 1.354 18832
244 1 1 . 1 1 60 60 PHE HA H 60 5.120 5.120 5.275 -0.155 18832
245 1 1 . 1 1 60 60 PHE CA C 60 54.060 54.060 54.821 -0.760 18832
246 1 1 . 1 1 60 60 PHE CB C 60 37.190 37.190 39.525 -2.334 18832
247 1 1 . 1 1 60 60 PHE H H 60 8.724 8.724 8.529 0.195 18832
248 1 1 . 1 1 61 61 PRO HA H 61 3.480 3.480 4.521 -1.041 18832
249 1 1 . 1 1 61 61 PRO CA C 61 62.200 62.200 62.360 -0.160 18832
250 1 1 . 1 1 61 61 PRO CB C 61 31.190 31.190 32.411 -1.221 18832
251 1 1 . 1 1 62 62 ALA N N 62 124.770 124.770 127.394 -2.624 18832
252 1 1 . 1 1 62 62 ALA HA H 62 3.710 3.710 3.882 -0.172 18832
253 1 1 . 1 1 62 62 ALA CA C 62 54.370 54.370 54.319 0.051 18832
254 1 1 . 1 1 62 62 ALA CB C 62 17.650 17.650 17.726 -0.076 18832
255 1 1 . 1 1 62 62 ALA H H 62 7.898 7.898 8.356 -0.458 18832
256 1 1 . 1 1 63 63 SER N N 63 109.700 109.700 115.316 -5.616 18832
257 1 1 . 1 1 63 63 SER HA H 63 4.200 4.200 4.179 0.021 18832
258 1 1 . 1 1 63 63 SER CA C 63 59.400 59.400 60.606 -1.206 18832
259 1 1 . 1 1 63 63 SER CB C 63 62.380 62.380 62.930 -0.550 18832
260 1 1 . 1 1 63 63 SER H H 63 8.030 8.030 8.572 -0.542 18832
261 1 1 . 1 1 64 64 TYR N N 64 120.300 120.300 112.596 7.704 18832
262 1 1 . 1 1 64 64 TYR HA H 64 4.250 4.250 4.471 -0.221 18832
263 1 1 . 1 1 64 64 TYR CA C 64 57.720 57.720 54.947 2.773 18832
264 1 1 . 1 1 64 64 TYR CB C 64 37.560 37.560 37.290 0.270 18832
265 1 1 . 1 1 64 64 TYR H H 64 7.128 7.128 6.971 0.157 18832
266 1 1 . 1 1 65 65 ILE N N 65 118.000 118.000 121.248 -3.248 18832
267 1 1 . 1 1 65 65 ILE HA H 65 4.810 4.810 4.720 0.090 18832
268 1 1 . 1 1 65 65 ILE CA C 65 56.980 56.980 59.260 -2.280 18832
269 1 1 . 1 1 65 65 ILE CB C 65 39.630 39.630 38.987 0.643 18832
270 1 1 . 1 1 65 65 ILE H H 65 7.671 7.671 7.464 0.207 18832
271 1 1 . 1 1 66 66 HIS N N 66 124.300 124.300 126.966 -2.666 18832
272 1 1 . 1 1 66 66 HIS HA H 66 5.130 5.130 4.961 0.169 18832
273 1 1 . 1 1 66 66 HIS CA C 66 53.060 53.060 54.482 -1.422 18832
274 1 1 . 1 1 66 66 HIS CB C 66 30.510 30.510 33.301 -2.791 18832
275 1 1 . 1 1 66 66 HIS H H 66 9.159 9.159 8.855 0.304 18832
276 1 1 . 1 1 67 67 LEU N N 67 127.580 127.580 127.929 -0.349 18832
277 1 1 . 1 1 67 67 LEU HA H 67 4.570 4.570 4.348 0.222 18832
278 1 1 . 1 1 67 67 LEU CA C 67 55.300 55.300 56.031 -0.731 18832
279 1 1 . 1 1 67 67 LEU CB C 67 42.060 42.060 42.486 -0.426 18832
280 1 1 . 1 1 67 67 LEU H H 67 8.992 8.992 8.783 0.209 18832
281 1 1 . 1 1 68 68 LYS N N 68 121.900 121.900 123.270 -1.370 18832
282 1 1 . 1 1 68 68 LYS HA H 68 4.490 4.490 4.649 -0.159 18832
283 1 1 . 1 1 68 68 LYS CA C 68 55.110 55.110 54.189 0.921 18832
284 1 1 . 1 1 68 68 LYS CB C 68 34.610 34.610 34.133 0.477 18832
285 1 1 . 1 1 68 68 LYS H H 68 8.499 8.499 8.063 0.436 18832
286 1 1 . 1 1 69 69 GLU N N 69 122.190 122.190 120.406 1.784 18832
287 1 1 . 1 1 69 69 GLU HA H 69 4.280 4.280 4.314 -0.034 18832
288 1 1 . 1 1 69 69 GLU CA C 69 56.610 56.610 55.039 1.571 18832
289 1 1 . 1 1 69 69 GLU CB C 69 30.330 30.330 28.918 1.412 18832
290 1 1 . 1 1 69 69 GLU H H 69 8.569 8.569 8.487 0.082 18832
291 1 1 . 1 1 70 70 ALA N N 70 123.370 123.370 121.004 2.366 18832
292 1 1 . 1 1 70 70 ALA HA H 70 4.200 4.200 3.810 0.390 18832
293 1 1 . 1 1 70 70 ALA CA C 70 51.810 51.810 52.909 -1.099 18832
294 1 1 . 1 1 70 70 ALA CB C 70 19.700 19.700 18.836 0.864 18832
295 1 1 . 1 1 70 70 ALA H H 70 8.181 8.181 7.947 0.234 18832
296 1 1 . 1 1 71 71 ILE N N 71 120.080 120.080 119.476 0.604 18832
297 1 1 . 1 1 71 71 ILE HA H 71 4.070 4.070 4.678 -0.608 18832
298 1 1 . 1 1 71 71 ILE CA C 71 60.330 60.330 60.287 0.043 18832
299 1 1 . 1 1 71 71 ILE CB C 71 38.690 38.690 39.745 -1.055 18832
300 1 1 . 1 1 71 71 ILE H H 71 7.776 7.776 8.260 -0.484 18832
301 1 1 . 1 1 72 72 VAL N N 72 124.540 124.540 118.946 5.594 18832
302 1 1 . 1 1 72 72 VAL HA H 72 4.070 4.070 4.556 -0.486 18832
303 1 1 . 1 1 72 72 VAL CA C 72 61.640 61.640 61.407 0.233 18832
304 1 1 . 1 1 72 72 VAL CB C 72 32.690 32.690 33.819 -1.129 18832
305 1 1 . 1 1 72 72 VAL H H 72 8.089 8.089 8.022 0.067 18832
306 1 1 . 1 1 73 73 GLU N N 73 125.940 125.940 124.914 1.026 18832
307 1 1 . 1 1 73 73 GLU HA H 73 4.280 4.280 4.426 -0.146 18832
308 1 1 . 1 1 73 73 GLU CA C 73 56.610 56.610 56.748 -0.138 18832
309 1 1 . 1 1 73 73 GLU CB C 73 30.710 30.710 30.089 0.621 18832
310 1 1 . 1 1 73 73 GLU H H 73 8.464 8.464 8.782 -0.318 18832
311 1 2 . 1 1 2 2 THR N N 2 116.400 116.400 116.025 0.375 18832
312 1 2 . 1 1 2 2 THR HA H 2 4.120 4.120 4.686 -0.566 18832
313 1 2 . 1 1 2 2 THR CA C 2 62.100 62.100 61.559 0.541 18832
314 1 2 . 1 1 2 2 THR CB C 2 69.440 69.440 69.430 0.010 18832
315 1 2 . 1 1 2 2 THR H H 2 8.150 8.150 8.285 -0.135 18832
316 1 2 . 1 1 3 3 ARG HA H 3 4.310 4.310 4.224 0.086 18832
317 1 2 . 1 1 3 3 ARG CA C 3 55.750 55.750 56.078 -0.327 18832
318 1 2 . 1 1 3 3 ARG CB C 3 30.620 30.620 30.889 -0.268 18832
319 1 2 . 1 1 4 4 TRP N N 4 123.300 123.300 122.299 1.001 18832
320 1 2 . 1 1 4 4 TRP HA H 4 4.480 4.480 4.541 -0.061 18832
321 1 2 . 1 1 4 4 TRP CA C 4 57.560 57.560 56.525 1.035 18832
322 1 2 . 1 1 4 4 TRP CB C 4 29.490 29.490 29.789 -0.299 18832
323 1 2 . 1 1 4 4 TRP H H 4 8.108 8.108 8.355 -0.247 18832
324 1 2 . 1 1 5 5 VAL HA H 5 4.570 4.570 4.586 -0.016 18832
325 1 2 . 1 1 5 5 VAL CB C 5 30.840 30.840 34.113 -3.273 18832
326 1 2 . 1 1 6 6 PRO HA H 6 4.810 4.810 5.250 -0.440 18832
327 1 2 . 1 1 6 6 PRO CB C 6 32.210 32.210 32.408 -0.198 18832
328 1 2 . 1 1 7 7 THR HA H 7 4.270 4.270 4.377 -0.107 18832
329 1 2 . 1 1 7 7 THR CA C 7 60.890 60.890 60.675 0.215 18832
330 1 2 . 1 1 7 7 THR CB C 7 70.140 70.140 69.773 0.367 18832
331 1 2 . 1 1 8 8 LYS HA H 8 4.440 4.440 4.468 -0.028 18832
332 1 2 . 1 1 8 8 LYS CA C 8 55.980 55.980 55.164 0.816 18832
333 1 2 . 1 1 8 8 LYS CB C 8 35.050 35.050 33.692 1.358 18832
334 1 2 . 1 1 10 10 GLU HA H 10 4.580 4.580 4.220 0.360 18832
335 1 2 . 1 1 10 10 GLU CA C 10 55.570 55.570 55.670 -0.101 18832
336 1 2 . 1 1 10 10 GLU CB C 10 30.780 30.780 30.051 0.729 18832
337 1 2 . 1 1 11 11 GLU N N 11 122.500 122.500 118.490 4.010 18832
338 1 2 . 1 1 11 11 GLU HA H 11 4.340 4.340 3.890 0.450 18832
339 1 2 . 1 1 11 11 GLU CA C 11 57.140 57.140 59.178 -2.038 18832
340 1 2 . 1 1 11 11 GLU CB C 11 29.400 29.400 28.772 0.628 18832
341 1 2 . 1 1 11 11 GLU H H 11 8.271 8.271 8.467 -0.196 18832
342 1 2 . 1 1 12 12 LYS HA H 12 4.380 4.380 4.319 0.061 18832
343 1 2 . 1 1 12 12 LYS CA C 12 55.790 55.790 56.654 -0.864 18832
344 1 2 . 1 1 12 12 LYS CB C 12 33.600 33.600 35.201 -1.601 18832
345 1 2 . 1 1 13 13 TYR HA H 13 5.560 5.560 4.561 0.999 18832
346 1 2 . 1 1 13 13 TYR CA C 13 55.860 55.860 55.947 -0.087 18832
347 1 2 . 1 1 13 13 TYR CB C 13 42.440 42.440 39.449 2.991 18832
348 1 2 . 1 1 14 14 GLY N N 14 105.320 105.320 106.175 -0.855 18832
349 1 2 . 1 1 14 14 GLY CA C 14 45.240 45.240 43.851 1.389 18832
350 1 2 . 1 1 14 14 GLY H H 14 8.401 8.401 8.986 -0.585 18832
351 1 2 . 1 1 15 15 VAL N N 15 118.900 118.900 118.498 0.402 18832
352 1 2 . 1 1 15 15 VAL HA H 15 5.341 5.341 4.605 0.736 18832
353 1 2 . 1 1 15 15 VAL CA C 15 59.210 59.210 60.751 -1.541 18832
354 1 2 . 1 1 15 15 VAL CB C 15 35.740 35.740 36.188 -0.448 18832
355 1 2 . 1 1 15 15 VAL H H 15 8.851 8.851 8.816 0.035 18832
356 1 2 . 1 1 16 16 ALA N N 16 129.460 129.460 126.168 3.292 18832
357 1 2 . 1 1 16 16 ALA HA H 16 5.000 5.000 5.526 -0.526 18832
358 1 2 . 1 1 16 16 ALA CA C 16 52.000 52.000 50.096 1.904 18832
359 1 2 . 1 1 16 16 ALA CB C 16 19.330 19.330 21.590 -2.260 18832
360 1 2 . 1 1 16 16 ALA H H 16 9.113 9.113 8.653 0.460 18832
361 1 2 . 1 1 17 17 PHE N N 17 124.070 124.070 120.828 3.242 18832
362 1 2 . 1 1 17 17 PHE HA H 17 4.801 4.801 5.138 -0.337 18832
363 1 2 . 1 1 17 17 PHE CA C 17 56.230 56.230 55.605 0.625 18832
364 1 2 . 1 1 17 17 PHE CB C 17 40.000 40.000 38.838 1.162 18832
365 1 2 . 1 1 17 17 PHE H H 17 8.787 8.787 8.286 0.501 18832
366 1 2 . 1 1 18 18 TYR N N 18 118.210 118.210 123.391 -5.181 18832
367 1 2 . 1 1 18 18 TYR HA H 18 4.483 4.483 4.293 0.190 18832
368 1 2 . 1 1 18 18 TYR CA C 18 55.300 55.300 57.216 -1.916 18832
369 1 2 . 1 1 18 18 TYR CB C 18 42.810 42.810 41.883 0.927 18832
370 1 2 . 1 1 18 18 TYR H H 18 7.281 7.281 7.693 -0.412 18832
371 1 2 . 1 1 19 19 ASN N N 19 116.800 116.800 119.345 -2.545 18832
372 1 2 . 1 1 19 19 ASN HA H 19 4.710 4.710 4.821 -0.111 18832
373 1 2 . 1 1 19 19 ASN CA C 19 52.940 52.940 52.669 0.271 18832
374 1 2 . 1 1 19 19 ASN CB C 19 39.060 39.060 38.198 0.862 18832
375 1 2 . 1 1 19 19 ASN H H 19 8.134 8.134 8.328 -0.194 18832
376 1 2 . 1 1 20 20 TYR N N 20 122.190 122.190 122.202 -0.012 18832
377 1 2 . 1 1 20 20 TYR HA H 20 4.687 4.687 4.462 0.225 18832
378 1 2 . 1 1 20 20 TYR CA C 20 57.720 57.720 59.008 -1.288 18832
379 1 2 . 1 1 20 20 TYR CB C 20 42.250 42.250 39.801 2.449 18832
380 1 2 . 1 1 20 20 TYR H H 20 8.993 8.993 7.912 1.081 18832
381 1 2 . 1 1 21 21 ASP N N 21 128.520 128.520 128.265 0.255 18832
382 1 2 . 1 1 21 21 ASP HA H 21 4.790 4.790 4.825 -0.035 18832
383 1 2 . 1 1 21 21 ASP CA C 21 52.370 52.370 52.921 -0.551 18832
384 1 2 . 1 1 21 21 ASP CB C 21 41.130 41.130 43.028 -1.898 18832
385 1 2 . 1 1 21 21 ASP H H 21 7.838 7.838 7.979 -0.141 18832
386 1 2 . 1 1 22 22 ALA N N 22 125.240 125.240 128.062 -2.822 18832
387 1 2 . 1 1 22 22 ALA HA H 22 4.051 4.051 4.510 -0.459 18832
388 1 2 . 1 1 22 22 ALA CA C 22 52.940 52.940 53.327 -0.387 18832
389 1 2 . 1 1 22 22 ALA CB C 22 20.450 20.450 19.715 0.735 18832
390 1 2 . 1 1 22 22 ALA H H 22 8.103 8.103 8.546 -0.443 18832
391 1 2 . 1 1 23 23 ARG N N 23 122.190 122.190 122.064 0.126 18832
392 1 2 . 1 1 23 23 ARG HA H 23 4.346 4.346 4.325 0.021 18832
393 1 2 . 1 1 23 23 ARG CA C 23 55.490 55.490 56.865 -1.375 18832
394 1 2 . 1 1 23 23 ARG CB C 23 30.700 30.700 30.913 -0.213 18832
395 1 2 . 1 1 23 23 ARG H H 23 8.887 8.887 8.651 0.236 18832
396 1 2 . 1 1 24 24 GLY N N 24 105.320 105.320 106.541 -1.221 18832
397 1 2 . 1 1 24 24 GLY CA C 24 44.500 44.500 44.379 0.121 18832
398 1 2 . 1 1 24 24 GLY H H 24 7.258 7.258 7.611 -0.353 18832
399 1 2 . 1 1 25 25 ALA N N 25 122.190 122.190 121.902 0.288 18832
400 1 2 . 1 1 25 25 ALA HA H 25 4.166 4.166 4.279 -0.113 18832
401 1 2 . 1 1 25 25 ALA CA C 25 54.440 54.440 53.868 0.572 18832
402 1 2 . 1 1 25 25 ALA CB C 25 18.770 18.770 19.284 -0.514 18832
403 1 2 . 1 1 25 25 ALA H H 25 8.627 8.627 8.343 0.284 18832
404 1 2 . 1 1 26 26 ASP N N 26 114.690 114.690 116.664 -1.974 18832
405 1 2 . 1 1 26 26 ASP HA H 26 4.700 4.700 4.419 0.281 18832
406 1 2 . 1 1 26 26 ASP CA C 26 53.870 53.870 56.327 -2.457 18832
407 1 2 . 1 1 26 26 ASP CB C 26 40.390 40.390 41.085 -0.695 18832
408 1 2 . 1 1 26 26 ASP H H 26 8.955 8.955 8.488 0.467 18832
409 1 2 . 1 1 27 27 GLU N N 27 118.910 118.910 116.990 1.920 18832
410 1 2 . 1 1 27 27 GLU HA H 27 5.202 5.202 4.617 0.585 18832
411 1 2 . 1 1 27 27 GLU CA C 27 54.930 54.930 55.607 -0.677 18832
412 1 2 . 1 1 27 27 GLU CB C 27 32.880 32.880 31.542 1.338 18832
413 1 2 . 1 1 27 27 GLU H H 27 7.537 7.537 7.532 0.005 18832
414 1 2 . 1 1 28 28 LEU N N 28 121.490 121.490 120.250 1.240 18832
415 1 2 . 1 1 28 28 LEU HA H 28 4.756 4.756 4.645 0.111 18832
416 1 2 . 1 1 28 28 LEU CA C 28 53.120 53.120 54.219 -1.099 18832
417 1 2 . 1 1 28 28 LEU CB C 28 44.500 44.500 44.847 -0.347 18832
418 1 2 . 1 1 28 28 LEU H H 28 8.890 8.890 8.602 0.288 18832
419 1 2 . 1 1 29 29 SER N N 29 115.870 115.870 120.396 -4.526 18832
420 1 2 . 1 1 29 29 SER HA H 29 5.009 5.009 4.834 0.175 18832
421 1 2 . 1 1 29 29 SER CA C 29 58.470 58.470 59.210 -0.740 18832
422 1 2 . 1 1 29 29 SER CB C 29 63.690 63.690 63.755 -0.065 18832
423 1 2 . 1 1 29 29 SER H H 29 7.948 7.948 8.514 -0.566 18832
424 1 2 . 1 1 30 30 LEU N N 30 121.260 121.260 127.431 -6.171 18832
425 1 2 . 1 1 30 30 LEU HA H 30 4.776 4.776 4.719 0.057 18832
426 1 2 . 1 1 30 30 LEU CA C 30 52.940 52.940 53.664 -0.724 18832
427 1 2 . 1 1 30 30 LEU CB C 30 46.370 46.370 44.494 1.876 18832
428 1 2 . 1 1 30 30 LEU H H 30 9.500 9.500 7.888 1.612 18832
429 1 2 . 1 1 31 31 GLN N N 31 123.130 123.130 119.942 3.188 18832
430 1 2 . 1 1 31 31 GLN HA H 31 5.065 5.065 5.153 -0.088 18832
431 1 2 . 1 1 31 31 GLN CA C 31 52.940 52.940 54.023 -1.083 18832
432 1 2 . 1 1 31 31 GLN CB C 31 31.190 31.190 33.059 -1.869 18832
433 1 2 . 1 1 31 31 GLN H H 31 9.147 9.147 8.452 0.695 18832
434 1 2 . 1 1 32 32 ILE N N 32 120.790 120.790 120.703 0.087 18832
435 1 2 . 1 1 32 32 ILE HA H 32 3.032 3.032 4.155 -1.123 18832
436 1 2 . 1 1 32 32 ILE CA C 32 64.250 64.250 63.166 1.084 18832
437 1 2 . 1 1 32 32 ILE CB C 32 37.940 37.940 38.087 -0.147 18832
438 1 2 . 1 1 32 32 ILE H H 32 8.016 8.016 8.363 -0.347 18832
439 1 2 . 1 1 33 33 GLY N N 33 115.870 115.870 114.258 1.612 18832
440 1 2 . 1 1 33 33 GLY CA C 33 44.500 44.500 44.837 -0.337 18832
441 1 2 . 1 1 33 33 GLY H H 33 8.775 8.775 9.005 -0.230 18832
442 1 2 . 1 1 34 34 ASP N N 34 122.430 122.430 121.961 0.469 18832
443 1 2 . 1 1 34 34 ASP HA H 34 4.634 4.634 4.873 -0.239 18832
444 1 2 . 1 1 34 34 ASP CA C 34 55.860 55.860 54.198 1.662 18832
445 1 2 . 1 1 34 34 ASP CB C 34 41.310 41.310 42.639 -1.329 18832
446 1 2 . 1 1 34 34 ASP H H 34 8.686 8.686 7.796 0.889 18832
447 1 2 . 1 1 35 35 THR N N 35 117.980 117.980 117.798 0.182 18832
448 1 2 . 1 1 35 35 THR HA H 35 5.154 5.154 4.855 0.299 18832
449 1 2 . 1 1 35 35 THR CA C 35 61.450 61.450 61.992 -0.542 18832
450 1 2 . 1 1 35 35 THR CB C 35 69.090 69.090 69.822 -0.732 18832
451 1 2 . 1 1 35 35 THR H H 35 8.392 8.392 8.509 -0.117 18832
452 1 2 . 1 1 36 36 VAL N N 36 118.200 118.200 120.341 -2.141 18832
453 1 2 . 1 1 36 36 VAL HA H 36 5.152 5.152 4.513 0.639 18832
454 1 2 . 1 1 36 36 VAL CA C 36 57.910 57.910 59.448 -1.538 18832
455 1 2 . 1 1 36 36 VAL CB C 36 34.190 34.190 33.954 0.236 18832
456 1 2 . 1 1 36 36 VAL H H 36 9.016 9.016 8.488 0.528 18832
457 1 2 . 1 1 37 37 HIS N N 37 122.190 122.190 126.022 -3.832 18832
458 1 2 . 1 1 37 37 HIS HA H 37 4.811 4.811 4.850 -0.039 18832
459 1 2 . 1 1 37 37 HIS CA C 37 52.560 52.560 53.797 -1.237 18832
460 1 2 . 1 1 37 37 HIS CB C 37 31.260 31.260 30.392 0.868 18832
461 1 2 . 1 1 37 37 HIS H H 37 8.491 8.491 8.314 0.177 18832
462 1 2 . 1 1 38 38 ILE N N 38 126.650 126.650 127.761 -1.111 18832
463 1 2 . 1 1 38 38 ILE HA H 38 3.750 3.750 4.017 -0.267 18832
464 1 2 . 1 1 38 38 ILE CA C 38 61.640 61.640 60.374 1.266 18832
465 1 2 . 1 1 38 38 ILE CB C 38 38.880 38.880 35.439 3.441 18832
466 1 2 . 1 1 38 38 ILE H H 38 8.638 8.638 8.486 0.152 18832
467 1 2 . 1 1 39 39 LEU N N 39 126.180 126.180 127.579 -1.399 18832
468 1 2 . 1 1 39 39 LEU HA H 39 4.380 4.380 4.623 -0.243 18832
469 1 2 . 1 1 39 39 LEU CA C 39 55.490 55.490 55.898 -0.408 18832
470 1 2 . 1 1 39 39 LEU CB C 39 43.750 43.750 43.870 -0.120 18832
471 1 2 . 1 1 39 39 LEU H H 39 9.163 9.163 8.031 1.132 18832
472 1 2 . 1 1 40 40 GLU N N 40 115.160 115.160 116.456 -1.296 18832
473 1 2 . 1 1 40 40 GLU HA H 40 5.020 5.020 4.738 0.282 18832
474 1 2 . 1 1 40 40 GLU CA C 40 55.090 55.090 55.795 -0.705 18832
475 1 2 . 1 1 40 40 GLU CB C 40 35.730 35.730 34.113 1.617 18832
476 1 2 . 1 1 40 40 GLU H H 40 7.852 7.852 8.145 -0.293 18832
477 1 2 . 1 1 41 41 THR HA H 41 4.270 4.270 4.560 -0.290 18832
478 1 2 . 1 1 41 41 THR CA C 41 61.250 61.250 59.406 1.844 18832
479 1 2 . 1 1 41 41 THR CB C 41 71.410 71.410 70.076 1.334 18832
480 1 2 . 1 1 42 42 TYR HA H 42 4.550 4.550 4.381 0.169 18832
481 1 2 . 1 1 43 43 GLU N N 43 124.100 124.100 120.751 3.349 18832
482 1 2 . 1 1 43 43 GLU HA H 43 3.740 3.740 4.549 -0.809 18832
483 1 2 . 1 1 43 43 GLU H H 43 8.590 8.590 8.451 0.139 18832
484 1 2 . 1 1 44 44 GLY N N 44 110.789 110.789 112.566 -1.777 18832
485 1 2 . 1 1 44 44 GLY CA C 44 45.440 45.440 45.559 -0.119 18832
486 1 2 . 1 1 44 44 GLY H H 44 8.432 8.432 8.402 0.030 18832
487 1 2 . 1 1 45 45 TRP HA H 45 4.690 4.690 4.544 0.146 18832
488 1 2 . 1 1 45 45 TRP CA C 45 57.550 57.550 55.904 1.645 18832
489 1 2 . 1 1 46 46 TYR HA H 46 5.600 5.600 4.782 0.818 18832
490 1 2 . 1 1 46 46 TYR CA C 46 54.060 54.060 54.486 -0.426 18832
491 1 2 . 1 1 46 46 TYR CB C 46 42.650 42.650 41.333 1.317 18832
492 1 2 . 1 1 47 47 ARG N N 47 118.100 118.100 122.364 -4.264 18832
493 1 2 . 1 1 47 47 ARG HA H 47 5.094 5.094 5.002 0.092 18832
494 1 2 . 1 1 47 47 ARG CA C 47 54.060 54.060 54.507 -0.447 18832
495 1 2 . 1 1 47 47 ARG CB C 47 33.250 33.250 33.459 -0.209 18832
496 1 2 . 1 1 47 47 ARG H H 47 8.492 8.492 8.821 -0.329 18832
497 1 2 . 1 1 48 48 GLY N N 48 114.000 114.000 113.468 0.532 18832
498 1 2 . 1 1 48 48 GLY CA C 48 46.560 46.560 44.347 2.213 18832
499 1 2 . 1 1 48 48 GLY H H 48 9.183 9.183 8.679 0.504 18832
500 1 2 . 1 1 49 49 TYR N N 49 116.100 116.100 115.322 0.778 18832
501 1 2 . 1 1 49 49 TYR HA H 49 5.373 5.373 5.204 0.169 18832
502 1 2 . 1 1 49 49 TYR CA C 49 55.110 55.110 55.594 -0.485 18832
503 1 2 . 1 1 49 49 TYR CB C 49 40.750 40.750 40.344 0.406 18832
504 1 2 . 1 1 49 49 TYR H H 49 8.194 8.194 7.981 0.213 18832
505 1 2 . 1 1 50 50 THR N N 50 112.350 112.350 116.188 -3.838 18832
506 1 2 . 1 1 50 50 THR HA H 50 5.105 5.105 4.534 0.571 18832
507 1 2 . 1 1 50 50 THR CA C 50 59.770 59.770 61.467 -1.697 18832
508 1 2 . 1 1 50 50 THR CB C 50 69.460 69.460 69.845 -0.385 18832
509 1 2 . 1 1 50 50 THR H H 50 9.441 9.441 8.845 0.596 18832
510 1 2 . 1 1 51 51 LEU N N 51 121.260 121.260 120.835 0.425 18832
511 1 2 . 1 1 51 51 LEU HA H 51 4.236 4.236 4.092 0.144 18832
512 1 2 . 1 1 51 51 LEU CA C 51 56.790 56.790 57.355 -0.565 18832
513 1 2 . 1 1 51 51 LEU CB C 51 40.000 40.000 40.950 -0.950 18832
514 1 2 . 1 1 51 51 LEU H H 51 8.310 8.310 8.135 0.175 18832
515 1 2 . 1 1 52 52 ARG N N 52 116.570 116.570 117.607 -1.037 18832
516 1 2 . 1 1 52 52 ARG HA H 52 4.250 4.250 4.168 0.082 18832
517 1 2 . 1 1 52 52 ARG CA C 52 57.350 57.350 57.678 -0.328 18832
518 1 2 . 1 1 52 52 ARG CB C 52 30.510 30.510 30.270 0.240 18832
519 1 2 . 1 1 52 52 ARG H H 52 8.047 8.047 8.457 -0.410 18832
520 1 2 . 1 1 53 53 LYS N N 53 122.660 122.660 119.299 3.361 18832
521 1 2 . 1 1 53 53 LYS HA H 53 4.616 4.616 4.627 -0.011 18832
522 1 2 . 1 1 53 53 LYS CA C 53 54.620 54.620 55.289 -0.669 18832
523 1 2 . 1 1 53 53 LYS CB C 53 32.860 32.860 31.811 1.049 18832
524 1 2 . 1 1 53 53 LYS H H 53 7.649 7.649 7.896 -0.247 18832
525 1 2 . 1 1 54 54 LYS N N 54 125.010 125.010 122.507 2.503 18832
526 1 2 . 1 1 54 54 LYS HA H 54 4.090 4.090 4.190 -0.100 18832
527 1 2 . 1 1 54 54 LYS CA C 54 58.470 58.470 59.112 -0.642 18832
528 1 2 . 1 1 54 54 LYS CB C 54 32.130 32.130 32.169 -0.039 18832
529 1 2 . 1 1 54 54 LYS H H 54 8.496 8.496 8.427 0.069 18832
530 1 2 . 1 1 55 55 SER N N 55 110.240 110.240 112.422 -2.182 18832
531 1 2 . 1 1 55 55 SER HA H 55 4.122 4.122 4.210 -0.088 18832
532 1 2 . 1 1 55 55 SER CA C 55 58.960 58.960 60.096 -1.136 18832
533 1 2 . 1 1 55 55 SER CB C 55 63.310 63.310 63.330 -0.020 18832
534 1 2 . 1 1 55 55 SER H H 55 7.857 7.857 8.185 -0.328 18832
535 1 2 . 1 1 56 56 LYS N N 56 124.070 124.070 120.316 3.754 18832
536 1 2 . 1 1 56 56 LYS HA H 56 4.668 4.668 4.388 0.280 18832
537 1 2 . 1 1 56 56 LYS CA C 56 54.810 54.810 55.998 -1.188 18832
538 1 2 . 1 1 56 56 LYS CB C 56 33.250 33.250 33.836 -0.586 18832
539 1 2 . 1 1 56 56 LYS H H 56 7.473 7.473 7.238 0.235 18832
540 1 2 . 1 1 57 57 LYS N N 57 125.940 125.940 119.875 6.065 18832
541 1 2 . 1 1 57 57 LYS HA H 57 5.341 5.341 5.030 0.311 18832
542 1 2 . 1 1 57 57 LYS CA C 57 54.620 54.620 54.932 -0.312 18832
543 1 2 . 1 1 57 57 LYS CB C 57 34.240 34.240 36.526 -2.286 18832
544 1 2 . 1 1 57 57 LYS H H 57 8.474 8.474 8.185 0.289 18832
545 1 2 . 1 1 58 58 GLY N N 58 109.540 109.540 109.676 -0.136 18832
546 1 2 . 1 1 58 58 GLY CA C 58 45.620 45.620 44.390 1.230 18832
547 1 2 . 1 1 58 58 GLY H H 58 9.075 9.075 8.920 0.155 18832
548 1 2 . 1 1 59 59 ILE N N 59 113.900 113.900 115.756 -1.856 18832
549 1 2 . 1 1 59 59 ILE HA H 59 6.000 6.000 4.940 1.060 18832
550 1 2 . 1 1 59 59 ILE CA C 59 59.590 59.590 58.822 0.768 18832
551 1 2 . 1 1 59 59 ILE CB C 59 41.140 41.140 40.759 0.381 18832
552 1 2 . 1 1 59 59 ILE H H 59 8.628 8.628 7.977 0.651 18832
553 1 2 . 1 1 60 60 PHE N N 60 117.040 117.040 117.255 -0.215 18832
554 1 2 . 1 1 60 60 PHE HA H 60 5.120 5.120 5.242 -0.122 18832
555 1 2 . 1 1 60 60 PHE CA C 60 54.060 54.060 54.883 -0.823 18832
556 1 2 . 1 1 60 60 PHE CB C 60 37.190 37.190 39.699 -2.509 18832
557 1 2 . 1 1 60 60 PHE H H 60 8.724 8.724 8.551 0.173 18832
558 1 2 . 1 1 61 61 PRO HA H 61 3.480 3.480 4.498 -1.018 18832
559 1 2 . 1 1 61 61 PRO CA C 61 62.200 62.200 62.143 0.057 18832
560 1 2 . 1 1 61 61 PRO CB C 61 31.190 31.190 32.541 -1.351 18832
561 1 2 . 1 1 62 62 ALA N N 62 124.770 124.770 126.381 -1.611 18832
562 1 2 . 1 1 62 62 ALA HA H 62 3.710 3.710 3.986 -0.276 18832
563 1 2 . 1 1 62 62 ALA CA C 62 54.370 54.370 54.356 0.014 18832
564 1 2 . 1 1 62 62 ALA CB C 62 17.650 17.650 18.108 -0.458 18832
565 1 2 . 1 1 62 62 ALA H H 62 7.898 7.898 8.266 -0.368 18832
566 1 2 . 1 1 63 63 SER N N 63 109.700 109.700 115.400 -5.700 18832
567 1 2 . 1 1 63 63 SER HA H 63 4.200 4.200 4.264 -0.064 18832
568 1 2 . 1 1 63 63 SER CA C 63 59.400 59.400 60.382 -0.982 18832
569 1 2 . 1 1 63 63 SER CB C 63 62.380 62.380 62.987 -0.607 18832
570 1 2 . 1 1 63 63 SER H H 63 8.030 8.030 8.488 -0.458 18832
571 1 2 . 1 1 64 64 TYR N N 64 120.300 120.300 112.093 8.207 18832
572 1 2 . 1 1 64 64 TYR HA H 64 4.250 4.250 4.519 -0.269 18832
573 1 2 . 1 1 64 64 TYR CA C 64 57.720 57.720 54.516 3.204 18832
574 1 2 . 1 1 64 64 TYR CB C 64 37.560 37.560 37.464 0.096 18832
575 1 2 . 1 1 64 64 TYR H H 64 7.128 7.128 7.085 0.043 18832
576 1 2 . 1 1 65 65 ILE N N 65 118.000 118.000 121.560 -3.560 18832
577 1 2 . 1 1 65 65 ILE HA H 65 4.810 4.810 4.909 -0.099 18832
578 1 2 . 1 1 65 65 ILE CA C 65 56.980 56.980 59.379 -2.399 18832
579 1 2 . 1 1 65 65 ILE CB C 65 39.630 39.630 38.856 0.774 18832
580 1 2 . 1 1 65 65 ILE H H 65 7.671 7.671 7.495 0.176 18832
581 1 2 . 1 1 66 66 HIS N N 66 124.300 124.300 126.932 -2.632 18832
582 1 2 . 1 1 66 66 HIS HA H 66 5.130 5.130 4.950 0.180 18832
583 1 2 . 1 1 66 66 HIS CA C 66 53.060 53.060 55.053 -1.993 18832
584 1 2 . 1 1 66 66 HIS CB C 66 30.510 30.510 32.907 -2.397 18832
585 1 2 . 1 1 66 66 HIS H H 66 9.159 9.159 8.905 0.254 18832
586 1 2 . 1 1 67 67 LEU N N 67 127.580 127.580 127.693 -0.113 18832
587 1 2 . 1 1 67 67 LEU HA H 67 4.570 4.570 4.281 0.289 18832
588 1 2 . 1 1 67 67 LEU CA C 67 55.300 55.300 56.162 -0.862 18832
589 1 2 . 1 1 67 67 LEU CB C 67 42.060 42.060 42.154 -0.094 18832
590 1 2 . 1 1 67 67 LEU H H 67 8.992 8.992 8.541 0.451 18832
591 1 2 . 1 1 68 68 LYS N N 68 121.900 121.900 122.172 -0.272 18832
592 1 2 . 1 1 68 68 LYS HA H 68 4.490 4.490 4.802 -0.312 18832
593 1 2 . 1 1 68 68 LYS CA C 68 55.110 55.110 54.446 0.664 18832
594 1 2 . 1 1 68 68 LYS CB C 68 34.610 34.610 36.045 -1.435 18832
595 1 2 . 1 1 68 68 LYS H H 68 8.499 8.499 8.146 0.353 18832
596 1 2 . 1 1 69 69 GLU N N 69 122.190 122.190 117.910 4.280 18832
597 1 2 . 1 1 69 69 GLU HA H 69 4.280 4.280 4.492 -0.212 18832
598 1 2 . 1 1 69 69 GLU CA C 69 56.610 56.610 55.572 1.038 18832
599 1 2 . 1 1 69 69 GLU CB C 69 30.330 30.330 28.547 1.783 18832
600 1 2 . 1 1 69 69 GLU H H 69 8.569 8.569 8.544 0.025 18832
601 1 2 . 1 1 70 70 ALA N N 70 123.370 123.370 122.260 1.110 18832
602 1 2 . 1 1 70 70 ALA HA H 70 4.200 4.200 4.250 -0.050 18832
603 1 2 . 1 1 70 70 ALA CA C 70 51.810 51.810 53.035 -1.225 18832
604 1 2 . 1 1 70 70 ALA CB C 70 19.700 19.700 19.130 0.570 18832
605 1 2 . 1 1 70 70 ALA H H 70 8.181 8.181 8.164 0.017 18832
606 1 2 . 1 1 71 71 ILE N N 71 120.080 120.080 123.163 -3.083 18832
607 1 2 . 1 1 71 71 ILE HA H 71 4.070 4.070 4.404 -0.334 18832
608 1 2 . 1 1 71 71 ILE CA C 71 60.330 60.330 60.761 -0.431 18832
609 1 2 . 1 1 71 71 ILE CB C 71 38.690 38.690 40.101 -1.411 18832
610 1 2 . 1 1 71 71 ILE H H 71 7.776 7.776 8.478 -0.702 18832
611 1 2 . 1 1 72 72 VAL N N 72 124.540 124.540 124.977 -0.437 18832
612 1 2 . 1 1 72 72 VAL HA H 72 4.070 4.070 4.234 -0.164 18832
613 1 2 . 1 1 72 72 VAL CA C 72 61.640 61.640 61.658 -0.018 18832
614 1 2 . 1 1 72 72 VAL CB C 72 32.690 32.690 34.423 -1.733 18832
615 1 2 . 1 1 72 72 VAL H H 72 8.089 8.089 8.199 -0.110 18832
616 1 2 . 1 1 73 73 GLU N N 73 125.940 125.940 125.948 -0.008 18832
617 1 2 . 1 1 73 73 GLU HA H 73 4.280 4.280 4.828 -0.548 18832
618 1 2 . 1 1 73 73 GLU CA C 73 56.610 56.610 56.252 0.358 18832
619 1 2 . 1 1 73 73 GLU CB C 73 30.710 30.710 30.731 -0.021 18832
620 1 2 . 1 1 73 73 GLU H H 73 8.464 8.464 8.715 -0.251 18832
621 1 3 . 1 1 2 2 THR N N 2 116.400 116.400 119.177 -2.777 18832
622 1 3 . 1 1 2 2 THR HA H 2 4.120 4.120 4.468 -0.348 18832
623 1 3 . 1 1 2 2 THR CA C 2 62.100 62.100 62.429 -0.329 18832
624 1 3 . 1 1 2 2 THR CB C 2 69.440 69.440 68.680 0.760 18832
625 1 3 . 1 1 2 2 THR H H 2 8.150 8.150 8.420 -0.270 18832
626 1 3 . 1 1 3 3 ARG HA H 3 4.310 4.310 4.586 -0.276 18832
627 1 3 . 1 1 3 3 ARG CA C 3 55.750 55.750 55.530 0.220 18832
628 1 3 . 1 1 3 3 ARG CB C 3 30.620 30.620 31.219 -0.599 18832
629 1 3 . 1 1 4 4 TRP N N 4 123.300 123.300 125.746 -2.446 18832
630 1 3 . 1 1 4 4 TRP HA H 4 4.480 4.480 4.125 0.355 18832
631 1 3 . 1 1 4 4 TRP CA C 4 57.560 57.560 57.075 0.485 18832
632 1 3 . 1 1 4 4 TRP CB C 4 29.490 29.490 29.683 -0.193 18832
633 1 3 . 1 1 4 4 TRP H H 4 8.108 8.108 8.466 -0.358 18832
634 1 3 . 1 1 5 5 VAL HA H 5 4.570 4.570 4.233 0.337 18832
635 1 3 . 1 1 5 5 VAL CB C 5 30.840 30.840 32.359 -1.519 18832
636 1 3 . 1 1 6 6 PRO HA H 6 4.810 4.810 4.652 0.158 18832
637 1 3 . 1 1 6 6 PRO CB C 6 32.210 32.210 31.303 0.907 18832
638 1 3 . 1 1 7 7 THR HA H 7 4.270 4.270 3.806 0.464 18832
639 1 3 . 1 1 7 7 THR CA C 7 60.890 60.890 62.754 -1.864 18832
640 1 3 . 1 1 7 7 THR CB C 7 70.140 70.140 68.160 1.980 18832
641 1 3 . 1 1 8 8 LYS HA H 8 4.440 4.440 4.078 0.362 18832
642 1 3 . 1 1 8 8 LYS CA C 8 55.980 55.980 57.558 -1.578 18832
643 1 3 . 1 1 8 8 LYS CB C 8 35.050 35.050 32.901 2.149 18832
644 1 3 . 1 1 10 10 GLU HA H 10 4.580 4.580 4.449 0.131 18832
645 1 3 . 1 1 10 10 GLU CA C 10 55.570 55.570 56.185 -0.615 18832
646 1 3 . 1 1 10 10 GLU CB C 10 30.780 30.780 30.753 0.027 18832
647 1 3 . 1 1 11 11 GLU N N 11 122.500 122.500 120.070 2.430 18832
648 1 3 . 1 1 11 11 GLU HA H 11 4.340 4.340 4.404 -0.064 18832
649 1 3 . 1 1 11 11 GLU CA C 11 57.140 57.140 56.220 0.920 18832
650 1 3 . 1 1 11 11 GLU CB C 11 29.400 29.400 29.451 -0.051 18832
651 1 3 . 1 1 11 11 GLU H H 11 8.271 8.271 8.358 -0.087 18832
652 1 3 . 1 1 12 12 LYS HA H 12 4.380 4.380 4.350 0.030 18832
653 1 3 . 1 1 12 12 LYS CA C 12 55.790 55.790 54.742 1.048 18832
654 1 3 . 1 1 12 12 LYS CB C 12 33.600 33.600 34.560 -0.960 18832
655 1 3 . 1 1 13 13 TYR HA H 13 5.560 5.560 4.992 0.568 18832
656 1 3 . 1 1 13 13 TYR CA C 13 55.860 55.860 55.158 0.702 18832
657 1 3 . 1 1 13 13 TYR CB C 13 42.440 42.440 40.463 1.977 18832
658 1 3 . 1 1 14 14 GLY N N 14 105.320 105.320 107.259 -1.939 18832
659 1 3 . 1 1 14 14 GLY CA C 14 45.240 45.240 43.961 1.279 18832
660 1 3 . 1 1 14 14 GLY H H 14 8.401 8.401 8.915 -0.514 18832
661 1 3 . 1 1 15 15 VAL N N 15 118.900 118.900 118.374 0.526 18832
662 1 3 . 1 1 15 15 VAL HA H 15 5.341 5.341 4.524 0.817 18832
663 1 3 . 1 1 15 15 VAL CA C 15 59.210 59.210 60.828 -1.618 18832
664 1 3 . 1 1 15 15 VAL CB C 15 35.740 35.740 36.581 -0.841 18832
665 1 3 . 1 1 15 15 VAL H H 15 8.851 8.851 8.734 0.117 18832
666 1 3 . 1 1 16 16 ALA N N 16 129.460 129.460 126.113 3.347 18832
667 1 3 . 1 1 16 16 ALA HA H 16 5.000 5.000 5.295 -0.295 18832
668 1 3 . 1 1 16 16 ALA CA C 16 52.000 52.000 49.905 2.095 18832
669 1 3 . 1 1 16 16 ALA CB C 16 19.330 19.330 20.998 -1.668 18832
670 1 3 . 1 1 16 16 ALA H H 16 9.113 9.113 8.494 0.619 18832
671 1 3 . 1 1 17 17 PHE N N 17 124.070 124.070 120.487 3.583 18832
672 1 3 . 1 1 17 17 PHE HA H 17 4.801 4.801 4.922 -0.121 18832
673 1 3 . 1 1 17 17 PHE CA C 17 56.230 56.230 55.977 0.253 18832
674 1 3 . 1 1 17 17 PHE CB C 17 40.000 40.000 38.677 1.323 18832
675 1 3 . 1 1 17 17 PHE H H 17 8.787 8.787 7.704 1.083 18832
676 1 3 . 1 1 18 18 TYR N N 18 118.210 118.210 123.249 -5.039 18832
677 1 3 . 1 1 18 18 TYR HA H 18 4.483 4.483 4.373 0.110 18832
678 1 3 . 1 1 18 18 TYR CA C 18 55.300 55.300 57.395 -2.095 18832
679 1 3 . 1 1 18 18 TYR CB C 18 42.810 42.810 42.243 0.567 18832
680 1 3 . 1 1 18 18 TYR H H 18 7.281 7.281 7.735 -0.454 18832
681 1 3 . 1 1 19 19 ASN N N 19 116.800 116.800 119.221 -2.421 18832
682 1 3 . 1 1 19 19 ASN HA H 19 4.710 4.710 4.879 -0.169 18832
683 1 3 . 1 1 19 19 ASN CA C 19 52.940 52.940 52.932 0.007 18832
684 1 3 . 1 1 19 19 ASN CB C 19 39.060 39.060 38.838 0.222 18832
685 1 3 . 1 1 19 19 ASN H H 19 8.134 8.134 8.443 -0.309 18832
686 1 3 . 1 1 20 20 TYR N N 20 122.190 122.190 122.777 -0.587 18832
687 1 3 . 1 1 20 20 TYR HA H 20 4.687 4.687 4.637 0.050 18832
688 1 3 . 1 1 20 20 TYR CA C 20 57.720 57.720 57.047 0.673 18832
689 1 3 . 1 1 20 20 TYR CB C 20 42.250 42.250 40.554 1.696 18832
690 1 3 . 1 1 20 20 TYR H H 20 8.993 8.993 8.153 0.840 18832
691 1 3 . 1 1 21 21 ASP N N 21 128.520 128.520 126.297 2.223 18832
692 1 3 . 1 1 21 21 ASP HA H 21 4.790 4.790 4.661 0.129 18832
693 1 3 . 1 1 21 21 ASP CA C 21 52.370 52.370 53.006 -0.636 18832
694 1 3 . 1 1 21 21 ASP CB C 21 41.130 41.130 43.801 -2.671 18832
695 1 3 . 1 1 21 21 ASP H H 21 7.838 7.838 8.299 -0.461 18832
696 1 3 . 1 1 22 22 ALA N N 22 125.240 125.240 124.504 0.736 18832
697 1 3 . 1 1 22 22 ALA HA H 22 4.051 4.051 4.011 0.040 18832
698 1 3 . 1 1 22 22 ALA CA C 22 52.940 52.940 52.782 0.158 18832
699 1 3 . 1 1 22 22 ALA CB C 22 20.450 20.450 19.398 1.052 18832
700 1 3 . 1 1 22 22 ALA H H 22 8.103 8.103 8.256 -0.153 18832
701 1 3 . 1 1 23 23 ARG N N 23 122.190 122.190 121.610 0.580 18832
702 1 3 . 1 1 23 23 ARG HA H 23 4.346 4.346 4.534 -0.188 18832
703 1 3 . 1 1 23 23 ARG CA C 23 55.490 55.490 55.712 -0.222 18832
704 1 3 . 1 1 23 23 ARG CB C 23 30.700 30.700 30.006 0.694 18832
705 1 3 . 1 1 23 23 ARG H H 23 8.887 8.887 8.631 0.256 18832
706 1 3 . 1 1 24 24 GLY N N 24 105.320 105.320 106.476 -1.156 18832
707 1 3 . 1 1 24 24 GLY CA C 24 44.500 44.500 45.294 -0.794 18832
708 1 3 . 1 1 24 24 GLY H H 24 7.258 7.258 7.303 -0.045 18832
709 1 3 . 1 1 25 25 ALA N N 25 122.190 122.190 121.468 0.722 18832
710 1 3 . 1 1 25 25 ALA HA H 25 4.166 4.166 4.330 -0.164 18832
711 1 3 . 1 1 25 25 ALA CA C 25 54.440 54.440 53.669 0.770 18832
712 1 3 . 1 1 25 25 ALA CB C 25 18.770 18.770 19.387 -0.617 18832
713 1 3 . 1 1 25 25 ALA H H 25 8.627 8.627 8.286 0.341 18832
714 1 3 . 1 1 26 26 ASP N N 26 114.690 114.690 116.552 -1.862 18832
715 1 3 . 1 1 26 26 ASP HA H 26 4.700 4.700 4.474 0.226 18832
716 1 3 . 1 1 26 26 ASP CA C 26 53.870 53.870 56.086 -2.216 18832
717 1 3 . 1 1 26 26 ASP CB C 26 40.390 40.390 41.146 -0.756 18832
718 1 3 . 1 1 26 26 ASP H H 26 8.955 8.955 8.535 0.420 18832
719 1 3 . 1 1 27 27 GLU N N 27 118.910 118.910 116.236 2.674 18832
720 1 3 . 1 1 27 27 GLU HA H 27 5.202 5.202 4.750 0.452 18832
721 1 3 . 1 1 27 27 GLU CA C 27 54.930 54.930 55.371 -0.441 18832
722 1 3 . 1 1 27 27 GLU CB C 27 32.880 32.880 32.538 0.342 18832
723 1 3 . 1 1 27 27 GLU H H 27 7.537 7.537 7.357 0.180 18832
724 1 3 . 1 1 28 28 LEU N N 28 121.490 121.490 119.971 1.519 18832
725 1 3 . 1 1 28 28 LEU HA H 28 4.756 4.756 4.699 0.057 18832
726 1 3 . 1 1 28 28 LEU CA C 28 53.120 53.120 53.974 -0.854 18832
727 1 3 . 1 1 28 28 LEU CB C 28 44.500 44.500 45.355 -0.855 18832
728 1 3 . 1 1 28 28 LEU H H 28 8.890 8.890 8.519 0.371 18832
729 1 3 . 1 1 29 29 SER N N 29 115.870 115.870 118.350 -2.480 18832
730 1 3 . 1 1 29 29 SER HA H 29 5.009 5.009 4.452 0.557 18832
731 1 3 . 1 1 29 29 SER CA C 29 58.470 58.470 58.190 0.280 18832
732 1 3 . 1 1 29 29 SER CB C 29 63.690 63.690 64.070 -0.380 18832
733 1 3 . 1 1 29 29 SER H H 29 7.948 7.948 8.325 -0.377 18832
734 1 3 . 1 1 30 30 LEU N N 30 121.260 121.260 124.689 -3.429 18832
735 1 3 . 1 1 30 30 LEU HA H 30 4.776 4.776 4.804 -0.028 18832
736 1 3 . 1 1 30 30 LEU CA C 30 52.940 52.940 54.489 -1.549 18832
737 1 3 . 1 1 30 30 LEU CB C 30 46.370 46.370 46.082 0.288 18832
738 1 3 . 1 1 30 30 LEU H H 30 9.500 9.500 8.605 0.895 18832
739 1 3 . 1 1 31 31 GLN N N 31 123.130 123.130 119.084 4.046 18832
740 1 3 . 1 1 31 31 GLN HA H 31 5.065 5.065 5.307 -0.242 18832
741 1 3 . 1 1 31 31 GLN CA C 31 52.940 52.940 53.716 -0.776 18832
742 1 3 . 1 1 31 31 GLN CB C 31 31.190 31.190 32.855 -1.665 18832
743 1 3 . 1 1 31 31 GLN H H 31 9.147 9.147 8.444 0.703 18832
744 1 3 . 1 1 32 32 ILE N N 32 120.790 120.790 120.114 0.676 18832
745 1 3 . 1 1 32 32 ILE HA H 32 3.032 3.032 4.129 -1.097 18832
746 1 3 . 1 1 32 32 ILE CA C 32 64.250 64.250 63.126 1.124 18832
747 1 3 . 1 1 32 32 ILE CB C 32 37.940 37.940 37.919 0.021 18832
748 1 3 . 1 1 32 32 ILE H H 32 8.016 8.016 8.360 -0.344 18832
749 1 3 . 1 1 33 33 GLY N N 33 115.870 115.870 115.399 0.471 18832
750 1 3 . 1 1 33 33 GLY CA C 33 44.500 44.500 44.884 -0.384 18832
751 1 3 . 1 1 33 33 GLY H H 33 8.775 8.775 9.085 -0.310 18832
752 1 3 . 1 1 34 34 ASP N N 34 122.430 122.430 122.168 0.262 18832
753 1 3 . 1 1 34 34 ASP HA H 34 4.634 4.634 4.983 -0.349 18832
754 1 3 . 1 1 34 34 ASP CA C 34 55.860 55.860 53.842 2.018 18832
755 1 3 . 1 1 34 34 ASP CB C 34 41.310 41.310 42.361 -1.051 18832
756 1 3 . 1 1 34 34 ASP H H 34 8.686 8.686 7.712 0.974 18832
757 1 3 . 1 1 35 35 THR N N 35 117.980 117.980 117.193 0.787 18832
758 1 3 . 1 1 35 35 THR HA H 35 5.154 5.154 4.787 0.367 18832
759 1 3 . 1 1 35 35 THR CA C 35 61.450 61.450 61.978 -0.528 18832
760 1 3 . 1 1 35 35 THR CB C 35 69.090 69.090 69.904 -0.814 18832
761 1 3 . 1 1 35 35 THR H H 35 8.392 8.392 8.460 -0.068 18832
762 1 3 . 1 1 36 36 VAL N N 36 118.200 118.200 116.672 1.528 18832
763 1 3 . 1 1 36 36 VAL HA H 36 5.152 5.152 4.721 0.431 18832
764 1 3 . 1 1 36 36 VAL CA C 36 57.910 57.910 60.361 -2.451 18832
765 1 3 . 1 1 36 36 VAL CB C 36 34.190 34.190 34.995 -0.805 18832
766 1 3 . 1 1 36 36 VAL H H 36 9.016 9.016 8.800 0.216 18832
767 1 3 . 1 1 37 37 HIS N N 37 122.190 122.190 126.162 -3.972 18832
768 1 3 . 1 1 37 37 HIS HA H 37 4.811 4.811 4.973 -0.162 18832
769 1 3 . 1 1 37 37 HIS CA C 37 52.560 52.560 53.883 -1.323 18832
770 1 3 . 1 1 37 37 HIS CB C 37 31.260 31.260 31.176 0.084 18832
771 1 3 . 1 1 37 37 HIS H H 37 8.491 8.491 8.771 -0.280 18832
772 1 3 . 1 1 38 38 ILE N N 38 126.650 126.650 126.390 0.260 18832
773 1 3 . 1 1 38 38 ILE HA H 38 3.750 3.750 3.939 -0.189 18832
774 1 3 . 1 1 38 38 ILE CA C 38 61.640 61.640 62.116 -0.476 18832
775 1 3 . 1 1 38 38 ILE CB C 38 38.880 38.880 38.071 0.809 18832
776 1 3 . 1 1 38 38 ILE H H 38 8.638 8.638 8.568 0.070 18832
777 1 3 . 1 1 39 39 LEU N N 39 126.180 126.180 122.976 3.204 18832
778 1 3 . 1 1 39 39 LEU HA H 39 4.380 4.380 4.684 -0.304 18832
779 1 3 . 1 1 39 39 LEU CA C 39 55.490 55.490 54.962 0.528 18832
780 1 3 . 1 1 39 39 LEU CB C 39 43.750 43.750 43.561 0.189 18832
781 1 3 . 1 1 39 39 LEU H H 39 9.163 9.163 8.899 0.264 18832
782 1 3 . 1 1 40 40 GLU N N 40 115.160 115.160 116.993 -1.833 18832
783 1 3 . 1 1 40 40 GLU HA H 40 5.020 5.020 4.823 0.197 18832
784 1 3 . 1 1 40 40 GLU CA C 40 55.090 55.090 55.684 -0.594 18832
785 1 3 . 1 1 40 40 GLU CB C 40 35.730 35.730 34.047 1.683 18832
786 1 3 . 1 1 40 40 GLU H H 40 7.852 7.852 7.726 0.126 18832
787 1 3 . 1 1 41 41 THR HA H 41 4.270 4.270 4.346 -0.076 18832
788 1 3 . 1 1 41 41 THR CA C 41 61.250 61.250 59.442 1.808 18832
789 1 3 . 1 1 41 41 THR CB C 41 71.410 71.410 70.255 1.155 18832
790 1 3 . 1 1 42 42 TYR HA H 42 4.550 4.550 4.321 0.229 18832
791 1 3 . 1 1 43 43 GLU N N 43 124.100 124.100 120.794 3.306 18832
792 1 3 . 1 1 43 43 GLU HA H 43 3.740 3.740 4.525 -0.785 18832
793 1 3 . 1 1 43 43 GLU H H 43 8.590 8.590 8.447 0.143 18832
794 1 3 . 1 1 44 44 GLY N N 44 110.789 110.789 112.464 -1.675 18832
795 1 3 . 1 1 44 44 GLY CA C 44 45.440 45.440 45.559 -0.119 18832
796 1 3 . 1 1 44 44 GLY H H 44 8.432 8.432 8.292 0.140 18832
797 1 3 . 1 1 45 45 TRP HA H 45 4.690 4.690 4.662 0.028 18832
798 1 3 . 1 1 45 45 TRP CA C 45 57.550 57.550 55.823 1.727 18832
799 1 3 . 1 1 46 46 TYR HA H 46 5.600 5.600 4.625 0.975 18832
800 1 3 . 1 1 46 46 TYR CA C 46 54.060 54.060 54.771 -0.711 18832
801 1 3 . 1 1 46 46 TYR CB C 46 42.650 42.650 41.460 1.190 18832
802 1 3 . 1 1 47 47 ARG N N 47 118.100 118.100 120.998 -2.898 18832
803 1 3 . 1 1 47 47 ARG HA H 47 5.094 5.094 4.979 0.115 18832
804 1 3 . 1 1 47 47 ARG CA C 47 54.060 54.060 54.489 -0.429 18832
805 1 3 . 1 1 47 47 ARG CB C 47 33.250 33.250 33.670 -0.420 18832
806 1 3 . 1 1 47 47 ARG H H 47 8.492 8.492 8.228 0.264 18832
807 1 3 . 1 1 48 48 GLY N N 48 114.000 114.000 113.172 0.828 18832
808 1 3 . 1 1 48 48 GLY CA C 48 46.560 46.560 45.696 0.864 18832
809 1 3 . 1 1 48 48 GLY H H 48 9.183 9.183 9.137 0.046 18832
810 1 3 . 1 1 49 49 TYR N N 49 116.100 116.100 114.938 1.162 18832
811 1 3 . 1 1 49 49 TYR HA H 49 5.373 5.373 5.083 0.290 18832
812 1 3 . 1 1 49 49 TYR CA C 49 55.110 55.110 56.026 -0.916 18832
813 1 3 . 1 1 49 49 TYR CB C 49 40.750 40.750 40.627 0.123 18832
814 1 3 . 1 1 49 49 TYR H H 49 8.194 8.194 8.307 -0.113 18832
815 1 3 . 1 1 50 50 THR N N 50 112.350 112.350 113.739 -1.389 18832
816 1 3 . 1 1 50 50 THR HA H 50 5.105 5.105 4.786 0.319 18832
817 1 3 . 1 1 50 50 THR CA C 50 59.770 59.770 60.182 -0.412 18832
818 1 3 . 1 1 50 50 THR CB C 50 69.460 69.460 69.736 -0.275 18832
819 1 3 . 1 1 50 50 THR H H 50 9.441 9.441 8.908 0.533 18832
820 1 3 . 1 1 51 51 LEU N N 51 121.260 121.260 123.927 -2.667 18832
821 1 3 . 1 1 51 51 LEU HA H 51 4.236 4.236 4.001 0.235 18832
822 1 3 . 1 1 51 51 LEU CA C 51 56.790 56.790 58.359 -1.569 18832
823 1 3 . 1 1 51 51 LEU CB C 51 40.000 40.000 41.810 -1.810 18832
824 1 3 . 1 1 51 51 LEU H H 51 8.310 8.310 8.188 0.122 18832
825 1 3 . 1 1 52 52 ARG N N 52 116.570 116.570 117.441 -0.871 18832
826 1 3 . 1 1 52 52 ARG HA H 52 4.250 4.250 4.135 0.115 18832
827 1 3 . 1 1 52 52 ARG CA C 52 57.350 57.350 58.251 -0.901 18832
828 1 3 . 1 1 52 52 ARG CB C 52 30.510 30.510 30.469 0.041 18832
829 1 3 . 1 1 52 52 ARG H H 52 8.047 8.047 8.495 -0.448 18832
830 1 3 . 1 1 53 53 LYS N N 53 122.660 122.660 116.904 5.756 18832
831 1 3 . 1 1 53 53 LYS HA H 53 4.616 4.616 4.645 -0.029 18832
832 1 3 . 1 1 53 53 LYS CA C 53 54.620 54.620 55.785 -1.165 18832
833 1 3 . 1 1 53 53 LYS CB C 53 32.860 32.860 31.997 0.863 18832
834 1 3 . 1 1 53 53 LYS H H 53 7.649 7.649 7.556 0.093 18832
835 1 3 . 1 1 54 54 LYS N N 54 125.010 125.010 122.772 2.238 18832
836 1 3 . 1 1 54 54 LYS HA H 54 4.090 4.090 4.371 -0.281 18832
837 1 3 . 1 1 54 54 LYS CA C 54 58.470 58.470 58.295 0.175 18832
838 1 3 . 1 1 54 54 LYS CB C 54 32.130 32.130 32.182 -0.052 18832
839 1 3 . 1 1 54 54 LYS H H 54 8.496 8.496 8.953 -0.457 18832
840 1 3 . 1 1 55 55 SER N N 55 110.240 110.240 113.813 -3.573 18832
841 1 3 . 1 1 55 55 SER HA H 55 4.122 4.122 4.230 -0.108 18832
842 1 3 . 1 1 55 55 SER CA C 55 58.960 58.960 60.526 -1.566 18832
843 1 3 . 1 1 55 55 SER CB C 55 63.310 63.310 63.373 -0.063 18832
844 1 3 . 1 1 55 55 SER H H 55 7.857 7.857 7.979 -0.122 18832
845 1 3 . 1 1 56 56 LYS N N 56 124.070 124.070 121.437 2.633 18832
846 1 3 . 1 1 56 56 LYS HA H 56 4.668 4.668 4.339 0.329 18832
847 1 3 . 1 1 56 56 LYS CA C 56 54.810 54.810 56.184 -1.375 18832
848 1 3 . 1 1 56 56 LYS CB C 56 33.250 33.250 33.851 -0.601 18832
849 1 3 . 1 1 56 56 LYS H H 56 7.473 7.473 7.490 -0.017 18832
850 1 3 . 1 1 57 57 LYS N N 57 125.940 125.940 120.396 5.544 18832
851 1 3 . 1 1 57 57 LYS HA H 57 5.341 5.341 4.909 0.432 18832
852 1 3 . 1 1 57 57 LYS CA C 57 54.620 54.620 54.990 -0.370 18832
853 1 3 . 1 1 57 57 LYS CB C 57 34.240 34.240 36.273 -2.033 18832
854 1 3 . 1 1 57 57 LYS H H 57 8.474 8.474 8.188 0.286 18832
855 1 3 . 1 1 58 58 GLY N N 58 109.540 109.540 108.980 0.560 18832
856 1 3 . 1 1 58 58 GLY CA C 58 45.620 45.620 44.882 0.738 18832
857 1 3 . 1 1 58 58 GLY H H 58 9.075 9.075 8.906 0.169 18832
858 1 3 . 1 1 59 59 ILE N N 59 113.900 113.900 115.389 -1.489 18832
859 1 3 . 1 1 59 59 ILE HA H 59 6.000 6.000 5.105 0.895 18832
860 1 3 . 1 1 59 59 ILE CA C 59 59.590 59.590 58.435 1.155 18832
861 1 3 . 1 1 59 59 ILE CB C 59 41.140 41.140 41.450 -0.310 18832
862 1 3 . 1 1 59 59 ILE H H 59 8.628 8.628 8.185 0.443 18832
863 1 3 . 1 1 60 60 PHE N N 60 117.040 117.040 117.105 -0.065 18832
864 1 3 . 1 1 60 60 PHE HA H 60 5.120 5.120 5.503 -0.383 18832
865 1 3 . 1 1 60 60 PHE CA C 60 54.060 54.060 54.824 -0.764 18832
866 1 3 . 1 1 60 60 PHE CB C 60 37.190 37.190 39.588 -2.398 18832
867 1 3 . 1 1 60 60 PHE H H 60 8.724 8.724 8.472 0.252 18832
868 1 3 . 1 1 61 61 PRO HA H 61 3.480 3.480 4.714 -1.234 18832
869 1 3 . 1 1 61 61 PRO CA C 61 62.200 62.200 62.270 -0.070 18832
870 1 3 . 1 1 61 61 PRO CB C 61 31.190 31.190 32.407 -1.217 18832
871 1 3 . 1 1 62 62 ALA N N 62 124.770 124.770 127.096 -2.326 18832
872 1 3 . 1 1 62 62 ALA HA H 62 3.710 3.710 4.029 -0.319 18832
873 1 3 . 1 1 62 62 ALA CA C 62 54.370 54.370 54.101 0.269 18832
874 1 3 . 1 1 62 62 ALA CB C 62 17.650 17.650 18.214 -0.564 18832
875 1 3 . 1 1 62 62 ALA H H 62 7.898 7.898 8.193 -0.295 18832
876 1 3 . 1 1 63 63 SER N N 63 109.700 109.700 114.022 -4.322 18832
877 1 3 . 1 1 63 63 SER HA H 63 4.200 4.200 4.177 0.023 18832
878 1 3 . 1 1 63 63 SER CA C 63 59.400 59.400 60.144 -0.744 18832
879 1 3 . 1 1 63 63 SER CB C 63 62.380 62.380 62.910 -0.530 18832
880 1 3 . 1 1 63 63 SER H H 63 8.030 8.030 8.425 -0.396 18832
881 1 3 . 1 1 64 64 TYR N N 64 120.300 120.300 114.694 5.606 18832
882 1 3 . 1 1 64 64 TYR HA H 64 4.250 4.250 4.508 -0.258 18832
883 1 3 . 1 1 64 64 TYR CA C 64 57.720 57.720 55.722 1.998 18832
884 1 3 . 1 1 64 64 TYR CB C 64 37.560 37.560 37.671 -0.111 18832
885 1 3 . 1 1 64 64 TYR H H 64 7.128 7.128 6.873 0.255 18832
886 1 3 . 1 1 65 65 ILE N N 65 118.000 118.000 121.241 -3.241 18832
887 1 3 . 1 1 65 65 ILE HA H 65 4.810 4.810 4.882 -0.072 18832
888 1 3 . 1 1 65 65 ILE CA C 65 56.980 56.980 59.264 -2.284 18832
889 1 3 . 1 1 65 65 ILE CB C 65 39.630 39.630 39.422 0.208 18832
890 1 3 . 1 1 65 65 ILE H H 65 7.671 7.671 7.526 0.145 18832
891 1 3 . 1 1 66 66 HIS N N 66 124.300 124.300 127.042 -2.742 18832
892 1 3 . 1 1 66 66 HIS HA H 66 5.130 5.130 5.001 0.129 18832
893 1 3 . 1 1 66 66 HIS CA C 66 53.060 53.060 54.329 -1.269 18832
894 1 3 . 1 1 66 66 HIS CB C 66 30.510 30.510 33.244 -2.734 18832
895 1 3 . 1 1 66 66 HIS H H 66 9.159 9.159 8.674 0.485 18832
896 1 3 . 1 1 67 67 LEU N N 67 127.580 127.580 127.833 -0.253 18832
897 1 3 . 1 1 67 67 LEU HA H 67 4.570 4.570 4.480 0.090 18832
898 1 3 . 1 1 67 67 LEU CA C 67 55.300 55.300 55.571 -0.271 18832
899 1 3 . 1 1 67 67 LEU CB C 67 42.060 42.060 42.343 -0.283 18832
900 1 3 . 1 1 67 67 LEU H H 67 8.992 8.992 8.776 0.216 18832
901 1 3 . 1 1 68 68 LYS N N 68 121.900 121.900 123.712 -1.812 18832
902 1 3 . 1 1 68 68 LYS HA H 68 4.490 4.490 4.725 -0.235 18832
903 1 3 . 1 1 68 68 LYS CA C 68 55.110 55.110 54.503 0.607 18832
904 1 3 . 1 1 68 68 LYS CB C 68 34.610 34.610 34.328 0.282 18832
905 1 3 . 1 1 68 68 LYS H H 68 8.499 8.499 8.368 0.131 18832
906 1 3 . 1 1 69 69 GLU N N 69 122.190 122.190 119.398 2.792 18832
907 1 3 . 1 1 69 69 GLU HA H 69 4.280 4.280 4.324 -0.044 18832
908 1 3 . 1 1 69 69 GLU CA C 69 56.610 56.610 56.162 0.448 18832
909 1 3 . 1 1 69 69 GLU CB C 69 30.330 30.330 28.211 2.119 18832
910 1 3 . 1 1 69 69 GLU H H 69 8.569 8.569 8.591 -0.022 18832
911 1 3 . 1 1 70 70 ALA N N 70 123.370 123.370 129.005 -5.635 18832
912 1 3 . 1 1 70 70 ALA HA H 70 4.200 4.200 4.359 -0.159 18832
913 1 3 . 1 1 70 70 ALA CA C 70 51.810 51.810 51.512 0.298 18832
914 1 3 . 1 1 70 70 ALA CB C 70 19.700 19.700 19.168 0.532 18832
915 1 3 . 1 1 70 70 ALA H H 70 8.181 8.181 7.886 0.295 18832
916 1 3 . 1 1 71 71 ILE N N 71 120.080 120.080 124.381 -4.301 18832
917 1 3 . 1 1 71 71 ILE HA H 71 4.070 4.070 3.923 0.147 18832
918 1 3 . 1 1 71 71 ILE CA C 71 60.330 60.330 61.735 -1.405 18832
919 1 3 . 1 1 71 71 ILE CB C 71 38.690 38.690 38.742 -0.052 18832
920 1 3 . 1 1 71 71 ILE H H 71 7.776 7.776 8.272 -0.496 18832
921 1 3 . 1 1 72 72 VAL N N 72 124.540 124.540 121.804 2.736 18832
922 1 3 . 1 1 72 72 VAL HA H 72 4.070 4.070 4.335 -0.265 18832
923 1 3 . 1 1 72 72 VAL CA C 72 61.640 61.640 61.709 -0.069 18832
924 1 3 . 1 1 72 72 VAL CB C 72 32.690 32.690 32.339 0.351 18832
925 1 3 . 1 1 72 72 VAL H H 72 8.089 8.089 8.183 -0.094 18832
926 1 3 . 1 1 73 73 GLU N N 73 125.940 125.940 121.718 4.222 18832
927 1 3 . 1 1 73 73 GLU HA H 73 4.280 4.280 4.625 -0.345 18832
928 1 3 . 1 1 73 73 GLU CA C 73 56.610 56.610 55.741 0.869 18832
929 1 3 . 1 1 73 73 GLU CB C 73 30.710 30.710 30.731 -0.021 18832
930 1 3 . 1 1 73 73 GLU H H 73 8.464 8.464 7.990 0.474 18832
931 1 4 . 1 1 2 2 THR N N 2 116.400 116.400 113.736 2.664 18832
932 1 4 . 1 1 2 2 THR HA H 2 4.120 4.120 4.706 -0.586 18832
933 1 4 . 1 1 2 2 THR CA C 2 62.100 62.100 61.634 0.466 18832
934 1 4 . 1 1 2 2 THR CB C 2 69.440 69.440 69.518 -0.078 18832
935 1 4 . 1 1 2 2 THR H H 2 8.150 8.150 8.156 -0.006 18832
936 1 4 . 1 1 3 3 ARG HA H 3 4.310 4.310 4.373 -0.063 18832
937 1 4 . 1 1 3 3 ARG CA C 3 55.750 55.750 57.471 -1.721 18832
938 1 4 . 1 1 3 3 ARG CB C 3 30.620 30.620 30.727 -0.107 18832
939 1 4 . 1 1 4 4 TRP N N 4 123.300 123.300 120.187 3.113 18832
940 1 4 . 1 1 4 4 TRP HA H 4 4.480 4.480 4.759 -0.279 18832
941 1 4 . 1 1 4 4 TRP CA C 4 57.560 57.560 56.994 0.566 18832
942 1 4 . 1 1 4 4 TRP CB C 4 29.490 29.490 30.100 -0.610 18832
943 1 4 . 1 1 4 4 TRP H H 4 8.108 8.108 8.121 -0.013 18832
944 1 4 . 1 1 5 5 VAL HA H 5 4.570 4.570 4.266 0.304 18832
945 1 4 . 1 1 5 5 VAL CB C 5 30.840 30.840 32.807 -1.967 18832
946 1 4 . 1 1 6 6 PRO HA H 6 4.810 4.810 4.467 0.343 18832
947 1 4 . 1 1 6 6 PRO CB C 6 32.210 32.210 32.687 -0.477 18832
948 1 4 . 1 1 7 7 THR HA H 7 4.270 4.270 3.939 0.331 18832
949 1 4 . 1 1 7 7 THR CA C 7 60.890 60.890 63.543 -2.653 18832
950 1 4 . 1 1 7 7 THR CB C 7 70.140 70.140 68.855 1.285 18832
951 1 4 . 1 1 8 8 LYS HA H 8 4.440 4.440 4.327 0.113 18832
952 1 4 . 1 1 8 8 LYS CA C 8 55.980 55.980 55.614 0.366 18832
953 1 4 . 1 1 8 8 LYS CB C 8 35.050 35.050 33.574 1.476 18832
954 1 4 . 1 1 10 10 GLU HA H 10 4.580 4.580 4.334 0.246 18832
955 1 4 . 1 1 10 10 GLU CA C 10 55.570 55.570 55.746 -0.176 18832
956 1 4 . 1 1 10 10 GLU CB C 10 30.780 30.780 30.487 0.293 18832
957 1 4 . 1 1 11 11 GLU N N 11 122.500 122.500 121.371 1.129 18832
958 1 4 . 1 1 11 11 GLU HA H 11 4.340 4.340 4.053 0.287 18832
959 1 4 . 1 1 11 11 GLU CA C 11 57.140 57.140 58.969 -1.829 18832
960 1 4 . 1 1 11 11 GLU CB C 11 29.400 29.400 29.764 -0.364 18832
961 1 4 . 1 1 11 11 GLU H H 11 8.271 8.271 8.707 -0.436 18832
962 1 4 . 1 1 12 12 LYS HA H 12 4.380 4.380 4.024 0.356 18832
963 1 4 . 1 1 12 12 LYS CA C 12 55.790 55.790 56.682 -0.892 18832
964 1 4 . 1 1 12 12 LYS CB C 12 33.600 33.600 32.760 0.840 18832
965 1 4 . 1 1 13 13 TYR HA H 13 5.560 5.560 4.788 0.772 18832
966 1 4 . 1 1 13 13 TYR CA C 13 55.860 55.860 56.477 -0.617 18832
967 1 4 . 1 1 13 13 TYR CB C 13 42.440 42.440 41.780 0.660 18832
968 1 4 . 1 1 14 14 GLY N N 14 105.320 105.320 106.429 -1.109 18832
969 1 4 . 1 1 14 14 GLY CA C 14 45.240 45.240 45.190 0.050 18832
970 1 4 . 1 1 14 14 GLY H H 14 8.401 8.401 8.480 -0.079 18832
971 1 4 . 1 1 15 15 VAL N N 15 118.900 118.900 122.471 -3.571 18832
972 1 4 . 1 1 15 15 VAL HA H 15 5.341 5.341 4.543 0.798 18832
973 1 4 . 1 1 15 15 VAL CA C 15 59.210 59.210 60.897 -1.687 18832
974 1 4 . 1 1 15 15 VAL CB C 15 35.740 35.740 34.190 1.550 18832
975 1 4 . 1 1 15 15 VAL H H 15 8.851 8.851 8.878 -0.027 18832
976 1 4 . 1 1 16 16 ALA N N 16 129.460 129.460 126.219 3.241 18832
977 1 4 . 1 1 16 16 ALA HA H 16 5.000 5.000 5.083 -0.083 18832
978 1 4 . 1 1 16 16 ALA CA C 16 52.000 52.000 49.808 2.192 18832
979 1 4 . 1 1 16 16 ALA CB C 16 19.330 19.330 21.754 -2.424 18832
980 1 4 . 1 1 16 16 ALA H H 16 9.113 9.113 8.306 0.807 18832
981 1 4 . 1 1 17 17 PHE N N 17 124.070 124.070 122.117 1.953 18832
982 1 4 . 1 1 17 17 PHE HA H 17 4.801 4.801 5.059 -0.258 18832
983 1 4 . 1 1 17 17 PHE CA C 17 56.230 56.230 55.829 0.401 18832
984 1 4 . 1 1 17 17 PHE CB C 17 40.000 40.000 38.429 1.571 18832
985 1 4 . 1 1 17 17 PHE H H 17 8.787 8.787 7.491 1.296 18832
986 1 4 . 1 1 18 18 TYR N N 18 118.210 118.210 121.286 -3.076 18832
987 1 4 . 1 1 18 18 TYR HA H 18 4.483 4.483 4.412 0.071 18832
988 1 4 . 1 1 18 18 TYR CA C 18 55.300 55.300 57.627 -2.328 18832
989 1 4 . 1 1 18 18 TYR CB C 18 42.810 42.810 42.289 0.521 18832
990 1 4 . 1 1 18 18 TYR H H 18 7.281 7.281 7.688 -0.407 18832
991 1 4 . 1 1 19 19 ASN N N 19 116.800 116.800 119.255 -2.455 18832
992 1 4 . 1 1 19 19 ASN HA H 19 4.710 4.710 4.839 -0.129 18832
993 1 4 . 1 1 19 19 ASN CA C 19 52.940 52.940 52.686 0.254 18832
994 1 4 . 1 1 19 19 ASN CB C 19 39.060 39.060 38.471 0.590 18832
995 1 4 . 1 1 19 19 ASN H H 19 8.134 8.134 8.288 -0.154 18832
996 1 4 . 1 1 20 20 TYR N N 20 122.190 122.190 121.972 0.218 18832
997 1 4 . 1 1 20 20 TYR HA H 20 4.687 4.687 4.583 0.104 18832
998 1 4 . 1 1 20 20 TYR CA C 20 57.720 57.720 58.264 -0.544 18832
999 1 4 . 1 1 20 20 TYR CB C 20 42.250 42.250 39.895 2.354 18832
1000 1 4 . 1 1 20 20 TYR H H 20 8.993 8.993 7.908 1.085 18832
1001 1 4 . 1 1 21 21 ASP N N 21 128.520 128.520 123.352 5.168 18832
1002 1 4 . 1 1 21 21 ASP HA H 21 4.790 4.790 4.634 0.156 18832
1003 1 4 . 1 1 21 21 ASP CA C 21 52.370 52.370 51.868 0.502 18832
1004 1 4 . 1 1 21 21 ASP CB C 21 41.130 41.130 44.298 -3.168 18832
1005 1 4 . 1 1 21 21 ASP H H 21 7.838 7.838 7.934 -0.096 18832
1006 1 4 . 1 1 22 22 ALA N N 22 125.240 125.240 123.719 1.521 18832
1007 1 4 . 1 1 22 22 ALA HA H 22 4.051 4.051 4.254 -0.203 18832
1008 1 4 . 1 1 22 22 ALA CA C 22 52.940 52.940 51.519 1.421 18832
1009 1 4 . 1 1 22 22 ALA CB C 22 20.450 20.450 20.237 0.213 18832
1010 1 4 . 1 1 22 22 ALA H H 22 8.103 8.103 8.173 -0.070 18832
1011 1 4 . 1 1 23 23 ARG N N 23 122.190 122.190 120.751 1.439 18832
1012 1 4 . 1 1 23 23 ARG HA H 23 4.346 4.346 4.397 -0.051 18832
1013 1 4 . 1 1 23 23 ARG CA C 23 55.490 55.490 56.013 -0.523 18832
1014 1 4 . 1 1 23 23 ARG CB C 23 30.700 30.700 31.358 -0.658 18832
1015 1 4 . 1 1 23 23 ARG H H 23 8.887 8.887 8.650 0.237 18832
1016 1 4 . 1 1 24 24 GLY N N 24 105.320 105.320 106.301 -0.981 18832
1017 1 4 . 1 1 24 24 GLY CA C 24 44.500 44.500 44.803 -0.303 18832
1018 1 4 . 1 1 24 24 GLY H H 24 7.258 7.258 7.457 -0.199 18832
1019 1 4 . 1 1 25 25 ALA N N 25 122.190 122.190 121.575 0.615 18832
1020 1 4 . 1 1 25 25 ALA HA H 25 4.166 4.166 4.344 -0.178 18832
1021 1 4 . 1 1 25 25 ALA CA C 25 54.440 54.440 53.826 0.614 18832
1022 1 4 . 1 1 25 25 ALA CB C 25 18.770 18.770 19.349 -0.579 18832
1023 1 4 . 1 1 25 25 ALA H H 25 8.627 8.627 8.254 0.373 18832
1024 1 4 . 1 1 26 26 ASP N N 26 114.690 114.690 116.631 -1.941 18832
1025 1 4 . 1 1 26 26 ASP HA H 26 4.700 4.700 4.453 0.247 18832
1026 1 4 . 1 1 26 26 ASP CA C 26 53.870 53.870 56.164 -2.294 18832
1027 1 4 . 1 1 26 26 ASP CB C 26 40.390 40.390 41.194 -0.804 18832
1028 1 4 . 1 1 26 26 ASP H H 26 8.955 8.955 8.649 0.306 18832
1029 1 4 . 1 1 27 27 GLU N N 27 118.910 118.910 116.299 2.611 18832
1030 1 4 . 1 1 27 27 GLU HA H 27 5.202 5.202 4.828 0.374 18832
1031 1 4 . 1 1 27 27 GLU CA C 27 54.930 54.930 55.283 -0.353 18832
1032 1 4 . 1 1 27 27 GLU CB C 27 32.880 32.880 33.166 -0.285 18832
1033 1 4 . 1 1 27 27 GLU H H 27 7.537 7.537 7.479 0.058 18832
1034 1 4 . 1 1 28 28 LEU N N 28 121.490 121.490 119.663 1.827 18832
1035 1 4 . 1 1 28 28 LEU HA H 28 4.756 4.756 4.687 0.069 18832
1036 1 4 . 1 1 28 28 LEU CA C 28 53.120 53.120 54.094 -0.974 18832
1037 1 4 . 1 1 28 28 LEU CB C 28 44.500 44.500 45.517 -1.017 18832
1038 1 4 . 1 1 28 28 LEU H H 28 8.890 8.890 8.629 0.261 18832
1039 1 4 . 1 1 29 29 SER N N 29 115.870 115.870 118.798 -2.928 18832
1040 1 4 . 1 1 29 29 SER HA H 29 5.009 5.009 4.247 0.762 18832
1041 1 4 . 1 1 29 29 SER CA C 29 58.470 58.470 58.889 -0.419 18832
1042 1 4 . 1 1 29 29 SER CB C 29 63.690 63.690 63.523 0.167 18832
1043 1 4 . 1 1 29 29 SER H H 29 7.948 7.948 8.363 -0.415 18832
1044 1 4 . 1 1 30 30 LEU N N 30 121.260 121.260 128.166 -6.906 18832
1045 1 4 . 1 1 30 30 LEU HA H 30 4.776 4.776 4.652 0.124 18832
1046 1 4 . 1 1 30 30 LEU CA C 30 52.940 52.940 53.594 -0.655 18832
1047 1 4 . 1 1 30 30 LEU CB C 30 46.370 46.370 44.779 1.591 18832
1048 1 4 . 1 1 30 30 LEU H H 30 9.500 9.500 8.380 1.120 18832
1049 1 4 . 1 1 31 31 GLN N N 31 123.130 123.130 119.770 3.360 18832
1050 1 4 . 1 1 31 31 GLN HA H 31 5.065 5.065 5.131 -0.066 18832
1051 1 4 . 1 1 31 31 GLN CA C 31 52.940 52.940 53.808 -0.868 18832
1052 1 4 . 1 1 31 31 GLN CB C 31 31.190 31.190 33.600 -2.410 18832
1053 1 4 . 1 1 31 31 GLN H H 31 9.147 9.147 8.420 0.727 18832
1054 1 4 . 1 1 32 32 ILE N N 32 120.790 120.790 120.311 0.479 18832
1055 1 4 . 1 1 32 32 ILE HA H 32 3.032 3.032 4.132 -1.100 18832
1056 1 4 . 1 1 32 32 ILE CA C 32 64.250 64.250 63.261 0.989 18832
1057 1 4 . 1 1 32 32 ILE CB C 32 37.940 37.940 37.967 -0.027 18832
1058 1 4 . 1 1 32 32 ILE H H 32 8.016 8.016 8.261 -0.245 18832
1059 1 4 . 1 1 33 33 GLY N N 33 115.870 115.870 114.473 1.397 18832
1060 1 4 . 1 1 33 33 GLY CA C 33 44.500 44.500 44.795 -0.295 18832
1061 1 4 . 1 1 33 33 GLY H H 33 8.775 8.775 8.927 -0.152 18832
1062 1 4 . 1 1 34 34 ASP N N 34 122.430 122.430 121.971 0.459 18832
1063 1 4 . 1 1 34 34 ASP HA H 34 4.634 4.634 4.907 -0.273 18832
1064 1 4 . 1 1 34 34 ASP CA C 34 55.860 55.860 54.274 1.586 18832
1065 1 4 . 1 1 34 34 ASP CB C 34 41.310 41.310 42.400 -1.090 18832
1066 1 4 . 1 1 34 34 ASP H H 34 8.686 8.686 7.790 0.896 18832
1067 1 4 . 1 1 35 35 THR N N 35 117.980 117.980 117.286 0.694 18832
1068 1 4 . 1 1 35 35 THR HA H 35 5.154 5.154 4.862 0.292 18832
1069 1 4 . 1 1 35 35 THR CA C 35 61.450 61.450 62.240 -0.790 18832
1070 1 4 . 1 1 35 35 THR CB C 35 69.090 69.090 70.161 -1.071 18832
1071 1 4 . 1 1 35 35 THR H H 35 8.392 8.392 8.579 -0.187 18832
1072 1 4 . 1 1 36 36 VAL N N 36 118.200 118.200 117.431 0.769 18832
1073 1 4 . 1 1 36 36 VAL HA H 36 5.152 5.152 4.693 0.459 18832
1074 1 4 . 1 1 36 36 VAL CA C 36 57.910 57.910 59.998 -2.088 18832
1075 1 4 . 1 1 36 36 VAL CB C 36 34.190 34.190 34.780 -0.590 18832
1076 1 4 . 1 1 36 36 VAL H H 36 9.016 9.016 9.102 -0.086 18832
1077 1 4 . 1 1 37 37 HIS N N 37 122.190 122.190 125.058 -2.868 18832
1078 1 4 . 1 1 37 37 HIS HA H 37 4.811 4.811 4.825 -0.014 18832
1079 1 4 . 1 1 37 37 HIS CA C 37 52.560 52.560 53.944 -1.384 18832
1080 1 4 . 1 1 37 37 HIS CB C 37 31.260 31.260 29.952 1.308 18832
1081 1 4 . 1 1 37 37 HIS H H 37 8.491 8.491 8.744 -0.253 18832
1082 1 4 . 1 1 38 38 ILE N N 38 126.650 126.650 127.781 -1.131 18832
1083 1 4 . 1 1 38 38 ILE HA H 38 3.750 3.750 3.974 -0.224 18832
1084 1 4 . 1 1 38 38 ILE CA C 38 61.640 61.640 62.542 -0.902 18832
1085 1 4 . 1 1 38 38 ILE CB C 38 38.880 38.880 37.056 1.824 18832
1086 1 4 . 1 1 38 38 ILE H H 38 8.638 8.638 8.557 0.081 18832
1087 1 4 . 1 1 39 39 LEU N N 39 126.180 126.180 129.749 -3.569 18832
1088 1 4 . 1 1 39 39 LEU HA H 39 4.380 4.380 4.574 -0.194 18832
1089 1 4 . 1 1 39 39 LEU CA C 39 55.490 55.490 55.448 0.042 18832
1090 1 4 . 1 1 39 39 LEU CB C 39 43.750 43.750 43.501 0.249 18832
1091 1 4 . 1 1 39 39 LEU H H 39 9.163 9.163 8.327 0.836 18832
1092 1 4 . 1 1 40 40 GLU N N 40 115.160 115.160 116.366 -1.206 18832
1093 1 4 . 1 1 40 40 GLU HA H 40 5.020 5.020 4.491 0.529 18832
1094 1 4 . 1 1 40 40 GLU CA C 40 55.090 55.090 55.198 -0.108 18832
1095 1 4 . 1 1 40 40 GLU CB C 40 35.730 35.730 33.634 2.096 18832
1096 1 4 . 1 1 40 40 GLU H H 40 7.852 7.852 8.013 -0.161 18832
1097 1 4 . 1 1 41 41 THR HA H 41 4.270 4.270 4.537 -0.267 18832
1098 1 4 . 1 1 41 41 THR CA C 41 61.250 61.250 61.386 -0.136 18832
1099 1 4 . 1 1 41 41 THR CB C 41 71.410 71.410 70.957 0.453 18832
1100 1 4 . 1 1 42 42 TYR HA H 42 4.550 4.550 4.156 0.394 18832
1101 1 4 . 1 1 43 43 GLU N N 43 124.100 124.100 118.917 5.183 18832
1102 1 4 . 1 1 43 43 GLU HA H 43 3.740 3.740 4.120 -0.380 18832
1103 1 4 . 1 1 43 43 GLU H H 43 8.590 8.590 8.456 0.134 18832
1104 1 4 . 1 1 44 44 GLY N N 44 110.789 110.789 108.083 2.706 18832
1105 1 4 . 1 1 44 44 GLY CA C 44 45.440 45.440 45.387 0.053 18832
1106 1 4 . 1 1 44 44 GLY H H 44 8.432 8.432 8.675 -0.243 18832
1107 1 4 . 1 1 45 45 TRP HA H 45 4.690 4.690 4.595 0.095 18832
1108 1 4 . 1 1 45 45 TRP CA C 45 57.550 57.550 55.491 2.059 18832
1109 1 4 . 1 1 46 46 TYR HA H 46 5.600 5.600 4.574 1.026 18832
1110 1 4 . 1 1 46 46 TYR CA C 46 54.060 54.060 54.693 -0.633 18832
1111 1 4 . 1 1 46 46 TYR CB C 46 42.650 42.650 41.132 1.518 18832
1112 1 4 . 1 1 47 47 ARG N N 47 118.100 118.100 123.010 -4.910 18832
1113 1 4 . 1 1 47 47 ARG HA H 47 5.094 5.094 4.883 0.211 18832
1114 1 4 . 1 1 47 47 ARG CA C 47 54.060 54.060 54.995 -0.935 18832
1115 1 4 . 1 1 47 47 ARG CB C 47 33.250 33.250 32.030 1.220 18832
1116 1 4 . 1 1 47 47 ARG H H 47 8.492 8.492 8.107 0.385 18832
1117 1 4 . 1 1 48 48 GLY N N 48 114.000 114.000 113.922 0.078 18832
1118 1 4 . 1 1 48 48 GLY CA C 48 46.560 46.560 43.905 2.655 18832
1119 1 4 . 1 1 48 48 GLY H H 48 9.183 9.183 8.158 1.025 18832
1120 1 4 . 1 1 49 49 TYR N N 49 116.100 116.100 116.925 -0.825 18832
1121 1 4 . 1 1 49 49 TYR HA H 49 5.373 5.373 5.089 0.284 18832
1122 1 4 . 1 1 49 49 TYR CA C 49 55.110 55.110 55.196 -0.086 18832
1123 1 4 . 1 1 49 49 TYR CB C 49 40.750 40.750 39.855 0.895 18832
1124 1 4 . 1 1 49 49 TYR H H 49 8.194 8.194 8.244 -0.050 18832
1125 1 4 . 1 1 50 50 THR N N 50 112.350 112.350 116.712 -4.362 18832
1126 1 4 . 1 1 50 50 THR HA H 50 5.105 5.105 4.486 0.619 18832
1127 1 4 . 1 1 50 50 THR CA C 50 59.770 59.770 62.161 -2.391 18832
1128 1 4 . 1 1 50 50 THR CB C 50 69.460 69.460 69.760 -0.299 18832
1129 1 4 . 1 1 50 50 THR H H 50 9.441 9.441 8.848 0.593 18832
1130 1 4 . 1 1 51 51 LEU N N 51 121.260 121.260 122.783 -1.523 18832
1131 1 4 . 1 1 51 51 LEU HA H 51 4.236 4.236 4.161 0.075 18832
1132 1 4 . 1 1 51 51 LEU CA C 51 56.790 56.790 58.069 -1.279 18832
1133 1 4 . 1 1 51 51 LEU CB C 51 40.000 40.000 41.171 -1.171 18832
1134 1 4 . 1 1 51 51 LEU H H 51 8.310 8.310 8.247 0.063 18832
1135 1 4 . 1 1 52 52 ARG N N 52 116.570 116.570 119.340 -2.770 18832
1136 1 4 . 1 1 52 52 ARG HA H 52 4.250 4.250 4.186 0.064 18832
1137 1 4 . 1 1 52 52 ARG CA C 52 57.350 57.350 57.675 -0.326 18832
1138 1 4 . 1 1 52 52 ARG CB C 52 30.510 30.510 29.779 0.732 18832
1139 1 4 . 1 1 52 52 ARG H H 52 8.047 8.047 8.446 -0.399 18832
1140 1 4 . 1 1 53 53 LYS N N 53 122.660 122.660 119.361 3.299 18832
1141 1 4 . 1 1 53 53 LYS HA H 53 4.616 4.616 4.600 0.016 18832
1142 1 4 . 1 1 53 53 LYS CA C 53 54.620 54.620 55.368 -0.748 18832
1143 1 4 . 1 1 53 53 LYS CB C 53 32.860 32.860 31.782 1.077 18832
1144 1 4 . 1 1 53 53 LYS H H 53 7.649 7.649 8.096 -0.447 18832
1145 1 4 . 1 1 54 54 LYS N N 54 125.010 125.010 121.517 3.493 18832
1146 1 4 . 1 1 54 54 LYS HA H 54 4.090 4.090 4.413 -0.323 18832
1147 1 4 . 1 1 54 54 LYS CA C 54 58.470 58.470 57.983 0.487 18832
1148 1 4 . 1 1 54 54 LYS CB C 54 32.130 32.130 32.478 -0.348 18832
1149 1 4 . 1 1 54 54 LYS H H 54 8.496 8.496 8.754 -0.258 18832
1150 1 4 . 1 1 55 55 SER N N 55 110.240 110.240 113.145 -2.905 18832
1151 1 4 . 1 1 55 55 SER HA H 55 4.122 4.122 4.360 -0.238 18832
1152 1 4 . 1 1 55 55 SER CA C 55 58.960 58.960 59.667 -0.707 18832
1153 1 4 . 1 1 55 55 SER CB C 55 63.310 63.310 63.676 -0.366 18832
1154 1 4 . 1 1 55 55 SER H H 55 7.857 7.857 7.927 -0.070 18832
1155 1 4 . 1 1 56 56 LYS N N 56 124.070 124.070 122.080 1.990 18832
1156 1 4 . 1 1 56 56 LYS HA H 56 4.668 4.668 4.447 0.221 18832
1157 1 4 . 1 1 56 56 LYS CA C 56 54.810 54.810 55.902 -1.092 18832
1158 1 4 . 1 1 56 56 LYS CB C 56 33.250 33.250 34.865 -1.615 18832
1159 1 4 . 1 1 56 56 LYS H H 56 7.473 7.473 7.506 -0.033 18832
1160 1 4 . 1 1 57 57 LYS N N 57 125.940 125.940 121.352 4.588 18832
1161 1 4 . 1 1 57 57 LYS HA H 57 5.341 5.341 4.528 0.813 18832
1162 1 4 . 1 1 57 57 LYS CA C 57 54.620 54.620 55.208 -0.588 18832
1163 1 4 . 1 1 57 57 LYS CB C 57 34.240 34.240 34.964 -0.724 18832
1164 1 4 . 1 1 57 57 LYS H H 57 8.474 8.474 8.339 0.135 18832
1165 1 4 . 1 1 58 58 GLY N N 58 109.540 109.540 109.642 -0.102 18832
1166 1 4 . 1 1 58 58 GLY CA C 58 45.620 45.620 44.036 1.583 18832
1167 1 4 . 1 1 58 58 GLY H H 58 9.075 9.075 8.582 0.493 18832
1168 1 4 . 1 1 59 59 ILE N N 59 113.900 113.900 114.612 -0.712 18832
1169 1 4 . 1 1 59 59 ILE HA H 59 6.000 6.000 5.118 0.882 18832
1170 1 4 . 1 1 59 59 ILE CA C 59 59.590 59.590 58.604 0.986 18832
1171 1 4 . 1 1 59 59 ILE CB C 59 41.140 41.140 41.613 -0.473 18832
1172 1 4 . 1 1 59 59 ILE H H 59 8.628 8.628 8.122 0.506 18832
1173 1 4 . 1 1 60 60 PHE N N 60 117.040 117.040 116.937 0.103 18832
1174 1 4 . 1 1 60 60 PHE HA H 60 5.120 5.120 5.412 -0.292 18832
1175 1 4 . 1 1 60 60 PHE CA C 60 54.060 54.060 55.334 -1.274 18832
1176 1 4 . 1 1 60 60 PHE CB C 60 37.190 37.190 40.050 -2.860 18832
1177 1 4 . 1 1 60 60 PHE H H 60 8.724 8.724 8.684 0.040 18832
1178 1 4 . 1 1 61 61 PRO HA H 61 3.480 3.480 4.686 -1.206 18832
1179 1 4 . 1 1 61 61 PRO CA C 61 62.200 62.200 62.148 0.052 18832
1180 1 4 . 1 1 61 61 PRO CB C 61 31.190 31.190 32.958 -1.768 18832
1181 1 4 . 1 1 62 62 ALA N N 62 124.770 124.770 126.043 -1.273 18832
1182 1 4 . 1 1 62 62 ALA HA H 62 3.710 3.710 4.015 -0.305 18832
1183 1 4 . 1 1 62 62 ALA CA C 62 54.370 54.370 54.207 0.163 18832
1184 1 4 . 1 1 62 62 ALA CB C 62 17.650 17.650 18.161 -0.511 18832
1185 1 4 . 1 1 62 62 ALA H H 62 7.898 7.898 8.201 -0.303 18832
1186 1 4 . 1 1 63 63 SER N N 63 109.700 109.700 114.703 -5.003 18832
1187 1 4 . 1 1 63 63 SER HA H 63 4.200 4.200 4.161 0.039 18832
1188 1 4 . 1 1 63 63 SER CA C 63 59.400 59.400 60.535 -1.135 18832
1189 1 4 . 1 1 63 63 SER CB C 63 62.380 62.380 62.854 -0.474 18832
1190 1 4 . 1 1 63 63 SER H H 63 8.030 8.030 8.379 -0.349 18832
1191 1 4 . 1 1 64 64 TYR N N 64 120.300 120.300 112.917 7.383 18832
1192 1 4 . 1 1 64 64 TYR HA H 64 4.250 4.250 5.163 -0.913 18832
1193 1 4 . 1 1 64 64 TYR CA C 64 57.720 57.720 55.113 2.607 18832
1194 1 4 . 1 1 64 64 TYR CB C 64 37.560 37.560 38.235 -0.675 18832
1195 1 4 . 1 1 64 64 TYR H H 64 7.128 7.128 7.040 0.088 18832
1196 1 4 . 1 1 65 65 ILE N N 65 118.000 118.000 121.186 -3.186 18832
1197 1 4 . 1 1 65 65 ILE HA H 65 4.810 4.810 4.683 0.127 18832
1198 1 4 . 1 1 65 65 ILE CA C 65 56.980 56.980 59.277 -2.297 18832
1199 1 4 . 1 1 65 65 ILE CB C 65 39.630 39.630 39.431 0.200 18832
1200 1 4 . 1 1 65 65 ILE H H 65 7.671 7.671 7.494 0.177 18832
1201 1 4 . 1 1 66 66 HIS N N 66 124.300 124.300 125.623 -1.323 18832
1202 1 4 . 1 1 66 66 HIS HA H 66 5.130 5.130 4.860 0.270 18832
1203 1 4 . 1 1 66 66 HIS CA C 66 53.060 53.060 55.322 -2.262 18832
1204 1 4 . 1 1 66 66 HIS CB C 66 30.510 30.510 32.672 -2.162 18832
1205 1 4 . 1 1 66 66 HIS H H 66 9.159 9.159 8.688 0.471 18832
1206 1 4 . 1 1 67 67 LEU N N 67 127.580 127.580 127.190 0.390 18832
1207 1 4 . 1 1 67 67 LEU HA H 67 4.570 4.570 4.420 0.150 18832
1208 1 4 . 1 1 67 67 LEU CA C 67 55.300 55.300 55.733 -0.433 18832
1209 1 4 . 1 1 67 67 LEU CB C 67 42.060 42.060 42.276 -0.216 18832
1210 1 4 . 1 1 67 67 LEU H H 67 8.992 8.992 8.470 0.522 18832
1211 1 4 . 1 1 68 68 LYS N N 68 121.900 121.900 123.078 -1.178 18832
1212 1 4 . 1 1 68 68 LYS HA H 68 4.490 4.490 4.413 0.077 18832
1213 1 4 . 1 1 68 68 LYS CA C 68 55.110 55.110 55.458 -0.348 18832
1214 1 4 . 1 1 68 68 LYS CB C 68 34.610 34.610 33.404 1.206 18832
1215 1 4 . 1 1 68 68 LYS H H 68 8.499 8.499 7.984 0.515 18832
1216 1 4 . 1 1 69 69 GLU N N 69 122.190 122.190 119.650 2.540 18832
1217 1 4 . 1 1 69 69 GLU HA H 69 4.280 4.280 4.532 -0.252 18832
1218 1 4 . 1 1 69 69 GLU CA C 69 56.610 56.610 55.723 0.887 18832
1219 1 4 . 1 1 69 69 GLU CB C 69 30.330 30.330 29.525 0.805 18832
1220 1 4 . 1 1 69 69 GLU H H 69 8.569 8.569 8.506 0.063 18832
1221 1 4 . 1 1 70 70 ALA N N 70 123.370 123.370 122.681 0.689 18832
1222 1 4 . 1 1 70 70 ALA HA H 70 4.200 4.200 4.279 -0.079 18832
1223 1 4 . 1 1 70 70 ALA CA C 70 51.810 51.810 52.442 -0.632 18832
1224 1 4 . 1 1 70 70 ALA CB C 70 19.700 19.700 18.002 1.698 18832
1225 1 4 . 1 1 70 70 ALA H H 70 8.181 8.181 8.333 -0.152 18832
1226 1 4 . 1 1 71 71 ILE N N 71 120.080 120.080 115.326 4.754 18832
1227 1 4 . 1 1 71 71 ILE HA H 71 4.070 4.070 3.904 0.166 18832
1228 1 4 . 1 1 71 71 ILE CA C 71 60.330 60.330 60.944 -0.613 18832
1229 1 4 . 1 1 71 71 ILE CB C 71 38.690 38.690 37.938 0.752 18832
1230 1 4 . 1 1 71 71 ILE H H 71 7.776 7.776 7.926 -0.150 18832
1231 1 4 . 1 1 72 72 VAL N N 72 124.540 124.540 121.853 2.687 18832
1232 1 4 . 1 1 72 72 VAL HA H 72 4.070 4.070 4.396 -0.326 18832
1233 1 4 . 1 1 72 72 VAL CA C 72 61.640 61.640 62.192 -0.552 18832
1234 1 4 . 1 1 72 72 VAL CB C 72 32.690 32.690 32.047 0.643 18832
1235 1 4 . 1 1 72 72 VAL H H 72 8.089 8.089 8.266 -0.177 18832
1236 1 4 . 1 1 73 73 GLU N N 73 125.940 125.940 126.960 -1.020 18832
1237 1 4 . 1 1 73 73 GLU HA H 73 4.280 4.280 4.665 -0.385 18832
1238 1 4 . 1 1 73 73 GLU CA C 73 56.610 56.610 56.554 0.056 18832
1239 1 4 . 1 1 73 73 GLU CB C 73 30.710 30.710 31.733 -1.023 18832
1240 1 4 . 1 1 73 73 GLU H H 73 8.464 8.464 8.796 -0.332 18832
1241 1 5 . 1 1 2 2 THR N N 2 116.400 116.400 114.194 2.206 18832
1242 1 5 . 1 1 2 2 THR HA H 2 4.120 4.120 4.703 -0.583 18832
1243 1 5 . 1 1 2 2 THR CA C 2 62.100 62.100 61.646 0.454 18832
1244 1 5 . 1 1 2 2 THR CB C 2 69.440 69.440 70.296 -0.856 18832
1245 1 5 . 1 1 2 2 THR H H 2 8.150 8.150 8.065 0.085 18832
1246 1 5 . 1 1 3 3 ARG HA H 3 4.310 4.310 4.529 -0.219 18832
1247 1 5 . 1 1 3 3 ARG CA C 3 55.750 55.750 56.151 -0.401 18832
1248 1 5 . 1 1 3 3 ARG CB C 3 30.620 30.620 30.196 0.424 18832
1249 1 5 . 1 1 4 4 TRP N N 4 123.300 123.300 122.028 1.272 18832
1250 1 5 . 1 1 4 4 TRP HA H 4 4.480 4.480 4.549 -0.069 18832
1251 1 5 . 1 1 4 4 TRP CA C 4 57.560 57.560 56.368 1.192 18832
1252 1 5 . 1 1 4 4 TRP CB C 4 29.490 29.490 30.318 -0.828 18832
1253 1 5 . 1 1 4 4 TRP H H 4 8.108 8.108 7.530 0.578 18832
1254 1 5 . 1 1 5 5 VAL HA H 5 4.570 4.570 4.612 -0.042 18832
1255 1 5 . 1 1 5 5 VAL CB C 5 30.840 30.840 33.236 -2.396 18832
1256 1 5 . 1 1 6 6 PRO HA H 6 4.810 4.810 5.230 -0.420 18832
1257 1 5 . 1 1 6 6 PRO CB C 6 32.210 32.210 32.571 -0.361 18832
1258 1 5 . 1 1 7 7 THR HA H 7 4.270 4.270 4.417 -0.147 18832
1259 1 5 . 1 1 7 7 THR CA C 7 60.890 60.890 60.989 -0.099 18832
1260 1 5 . 1 1 7 7 THR CB C 7 70.140 70.140 68.823 1.317 18832
1261 1 5 . 1 1 8 8 LYS HA H 8 4.440 4.440 4.353 0.087 18832
1262 1 5 . 1 1 8 8 LYS CA C 8 55.980 55.980 56.609 -0.629 18832
1263 1 5 . 1 1 8 8 LYS CB C 8 35.050 35.050 31.310 3.740 18832
1264 1 5 . 1 1 10 10 GLU HA H 10 4.580 4.580 4.019 0.561 18832
1265 1 5 . 1 1 10 10 GLU CA C 10 55.570 55.570 56.970 -1.400 18832
1266 1 5 . 1 1 10 10 GLU CB C 10 30.780 30.780 30.173 0.607 18832
1267 1 5 . 1 1 11 11 GLU N N 11 122.500 122.500 122.721 -0.221 18832
1268 1 5 . 1 1 11 11 GLU HA H 11 4.340 4.340 4.079 0.261 18832
1269 1 5 . 1 1 11 11 GLU CA C 11 57.140 57.140 58.869 -1.729 18832
1270 1 5 . 1 1 11 11 GLU CB C 11 29.400 29.400 30.096 -0.696 18832
1271 1 5 . 1 1 11 11 GLU H H 11 8.271 8.271 8.830 -0.559 18832
1272 1 5 . 1 1 12 12 LYS HA H 12 4.380 4.380 4.124 0.256 18832
1273 1 5 . 1 1 12 12 LYS CA C 12 55.790 55.790 56.560 -0.770 18832
1274 1 5 . 1 1 12 12 LYS CB C 12 33.600 33.600 35.192 -1.592 18832
1275 1 5 . 1 1 13 13 TYR HA H 13 5.560 5.560 4.753 0.807 18832
1276 1 5 . 1 1 13 13 TYR CA C 13 55.860 55.860 55.332 0.528 18832
1277 1 5 . 1 1 13 13 TYR CB C 13 42.440 42.440 39.627 2.813 18832
1278 1 5 . 1 1 14 14 GLY N N 14 105.320 105.320 106.163 -0.843 18832
1279 1 5 . 1 1 14 14 GLY CA C 14 45.240 45.240 44.197 1.043 18832
1280 1 5 . 1 1 14 14 GLY H H 14 8.401 8.401 8.384 0.017 18832
1281 1 5 . 1 1 15 15 VAL N N 15 118.900 118.900 119.424 -0.524 18832
1282 1 5 . 1 1 15 15 VAL HA H 15 5.341 5.341 4.476 0.865 18832
1283 1 5 . 1 1 15 15 VAL CA C 15 59.210 59.210 61.069 -1.859 18832
1284 1 5 . 1 1 15 15 VAL CB C 15 35.740 35.740 33.310 2.430 18832
1285 1 5 . 1 1 15 15 VAL H H 15 8.851 8.851 8.715 0.136 18832
1286 1 5 . 1 1 16 16 ALA N N 16 129.460 129.460 127.718 1.742 18832
1287 1 5 . 1 1 16 16 ALA HA H 16 5.000 5.000 4.617 0.383 18832
1288 1 5 . 1 1 16 16 ALA CA C 16 52.000 52.000 50.218 1.782 18832
1289 1 5 . 1 1 16 16 ALA CB C 16 19.330 19.330 20.270 -0.940 18832
1290 1 5 . 1 1 16 16 ALA H H 16 9.113 9.113 8.626 0.487 18832
1291 1 5 . 1 1 17 17 PHE N N 17 124.070 124.070 121.664 2.406 18832
1292 1 5 . 1 1 17 17 PHE HA H 17 4.801 4.801 4.991 -0.190 18832
1293 1 5 . 1 1 17 17 PHE CA C 17 56.230 56.230 55.811 0.419 18832
1294 1 5 . 1 1 17 17 PHE CB C 17 40.000 40.000 38.025 1.975 18832
1295 1 5 . 1 1 17 17 PHE H H 17 8.787 8.787 7.104 1.683 18832
1296 1 5 . 1 1 18 18 TYR N N 18 118.210 118.210 124.208 -5.998 18832
1297 1 5 . 1 1 18 18 TYR HA H 18 4.483 4.483 4.497 -0.014 18832
1298 1 5 . 1 1 18 18 TYR CA C 18 55.300 55.300 57.872 -2.572 18832
1299 1 5 . 1 1 18 18 TYR CB C 18 42.810 42.810 43.046 -0.236 18832
1300 1 5 . 1 1 18 18 TYR H H 18 7.281 7.281 7.606 -0.325 18832
1301 1 5 . 1 1 19 19 ASN N N 19 116.800 116.800 119.813 -3.013 18832
1302 1 5 . 1 1 19 19 ASN HA H 19 4.710 4.710 4.786 -0.076 18832
1303 1 5 . 1 1 19 19 ASN CA C 19 52.940 52.940 52.292 0.648 18832
1304 1 5 . 1 1 19 19 ASN CB C 19 39.060 39.060 38.730 0.330 18832
1305 1 5 . 1 1 19 19 ASN H H 19 8.134 8.134 7.628 0.506 18832
1306 1 5 . 1 1 20 20 TYR N N 20 122.190 122.190 122.216 -0.026 18832
1307 1 5 . 1 1 20 20 TYR HA H 20 4.687 4.687 4.604 0.083 18832
1308 1 5 . 1 1 20 20 TYR CA C 20 57.720 57.720 59.176 -1.456 18832
1309 1 5 . 1 1 20 20 TYR CB C 20 42.250 42.250 40.124 2.126 18832
1310 1 5 . 1 1 20 20 TYR H H 20 8.993 8.993 8.102 0.891 18832
1311 1 5 . 1 1 21 21 ASP N N 21 128.520 128.520 127.485 1.035 18832
1312 1 5 . 1 1 21 21 ASP HA H 21 4.790 4.790 4.938 -0.148 18832
1313 1 5 . 1 1 21 21 ASP CA C 21 52.370 52.370 53.170 -0.800 18832
1314 1 5 . 1 1 21 21 ASP CB C 21 41.130 41.130 42.254 -1.124 18832
1315 1 5 . 1 1 21 21 ASP H H 21 7.838 7.838 8.198 -0.360 18832
1316 1 5 . 1 1 22 22 ALA N N 22 125.240 125.240 123.901 1.339 18832
1317 1 5 . 1 1 22 22 ALA HA H 22 4.051 4.051 4.434 -0.383 18832
1318 1 5 . 1 1 22 22 ALA CA C 22 52.940 52.940 53.126 -0.186 18832
1319 1 5 . 1 1 22 22 ALA CB C 22 20.450 20.450 19.666 0.784 18832
1320 1 5 . 1 1 22 22 ALA H H 22 8.103 8.103 8.543 -0.440 18832
1321 1 5 . 1 1 23 23 ARG N N 23 122.190 122.190 122.263 -0.073 18832
1322 1 5 . 1 1 23 23 ARG HA H 23 4.346 4.346 4.586 -0.240 18832
1323 1 5 . 1 1 23 23 ARG CA C 23 55.490 55.490 56.312 -0.822 18832
1324 1 5 . 1 1 23 23 ARG CB C 23 30.700 30.700 31.304 -0.604 18832
1325 1 5 . 1 1 23 23 ARG H H 23 8.887 8.887 9.110 -0.223 18832
1326 1 5 . 1 1 24 24 GLY N N 24 105.320 105.320 106.378 -1.058 18832
1327 1 5 . 1 1 24 24 GLY CA C 24 44.500 44.500 44.876 -0.376 18832
1328 1 5 . 1 1 24 24 GLY H H 24 7.258 7.258 7.575 -0.317 18832
1329 1 5 . 1 1 25 25 ALA N N 25 122.190 122.190 121.467 0.723 18832
1330 1 5 . 1 1 25 25 ALA HA H 25 4.166 4.166 4.272 -0.106 18832
1331 1 5 . 1 1 25 25 ALA CA C 25 54.440 54.440 53.900 0.540 18832
1332 1 5 . 1 1 25 25 ALA CB C 25 18.770 18.770 19.118 -0.348 18832
1333 1 5 . 1 1 25 25 ALA H H 25 8.627 8.627 8.476 0.151 18832
1334 1 5 . 1 1 26 26 ASP N N 26 114.690 114.690 115.816 -1.126 18832
1335 1 5 . 1 1 26 26 ASP HA H 26 4.700 4.700 4.390 0.310 18832
1336 1 5 . 1 1 26 26 ASP CA C 26 53.870 53.870 56.044 -2.174 18832
1337 1 5 . 1 1 26 26 ASP CB C 26 40.390 40.390 41.114 -0.724 18832
1338 1 5 . 1 1 26 26 ASP H H 26 8.955 8.955 8.632 0.323 18832
1339 1 5 . 1 1 27 27 GLU N N 27 118.910 118.910 115.834 3.076 18832
1340 1 5 . 1 1 27 27 GLU HA H 27 5.202 5.202 4.688 0.514 18832
1341 1 5 . 1 1 27 27 GLU CA C 27 54.930 54.930 55.117 -0.187 18832
1342 1 5 . 1 1 27 27 GLU CB C 27 32.880 32.880 33.410 -0.530 18832
1343 1 5 . 1 1 27 27 GLU H H 27 7.537 7.537 7.597 -0.060 18832
1344 1 5 . 1 1 28 28 LEU N N 28 121.490 121.490 119.799 1.691 18832
1345 1 5 . 1 1 28 28 LEU HA H 28 4.756 4.756 4.711 0.045 18832
1346 1 5 . 1 1 28 28 LEU CA C 28 53.120 53.120 54.072 -0.952 18832
1347 1 5 . 1 1 28 28 LEU CB C 28 44.500 44.500 44.878 -0.378 18832
1348 1 5 . 1 1 28 28 LEU H H 28 8.890 8.890 8.487 0.403 18832
1349 1 5 . 1 1 29 29 SER N N 29 115.870 115.870 118.897 -3.027 18832
1350 1 5 . 1 1 29 29 SER HA H 29 5.009 5.009 4.678 0.331 18832
1351 1 5 . 1 1 29 29 SER CA C 29 58.470 58.470 59.350 -0.880 18832
1352 1 5 . 1 1 29 29 SER CB C 29 63.690 63.690 63.676 0.014 18832
1353 1 5 . 1 1 29 29 SER H H 29 7.948 7.948 8.475 -0.527 18832
1354 1 5 . 1 1 30 30 LEU N N 30 121.260 121.260 128.122 -6.862 18832
1355 1 5 . 1 1 30 30 LEU HA H 30 4.776 4.776 4.740 0.036 18832
1356 1 5 . 1 1 30 30 LEU CA C 30 52.940 52.940 54.027 -1.087 18832
1357 1 5 . 1 1 30 30 LEU CB C 30 46.370 46.370 45.408 0.962 18832
1358 1 5 . 1 1 30 30 LEU H H 30 9.500 9.500 8.336 1.164 18832
1359 1 5 . 1 1 31 31 GLN N N 31 123.130 123.130 122.254 0.876 18832
1360 1 5 . 1 1 31 31 GLN HA H 31 5.065 5.065 4.776 0.289 18832
1361 1 5 . 1 1 31 31 GLN CA C 31 52.940 52.940 53.905 -0.965 18832
1362 1 5 . 1 1 31 31 GLN CB C 31 31.190 31.190 32.741 -1.551 18832
1363 1 5 . 1 1 31 31 GLN H H 31 9.147 9.147 8.484 0.663 18832
1364 1 5 . 1 1 32 32 ILE N N 32 120.790 120.790 120.674 0.116 18832
1365 1 5 . 1 1 32 32 ILE HA H 32 3.032 3.032 4.196 -1.164 18832
1366 1 5 . 1 1 32 32 ILE CA C 32 64.250 64.250 63.157 1.093 18832
1367 1 5 . 1 1 32 32 ILE CB C 32 37.940 37.940 37.925 0.015 18832
1368 1 5 . 1 1 32 32 ILE H H 32 8.016 8.016 8.622 -0.606 18832
1369 1 5 . 1 1 33 33 GLY N N 33 115.870 115.870 114.933 0.937 18832
1370 1 5 . 1 1 33 33 GLY CA C 33 44.500 44.500 44.841 -0.341 18832
1371 1 5 . 1 1 33 33 GLY H H 33 8.775 8.775 8.929 -0.154 18832
1372 1 5 . 1 1 34 34 ASP N N 34 122.430 122.430 122.187 0.243 18832
1373 1 5 . 1 1 34 34 ASP HA H 34 4.634 4.634 4.923 -0.289 18832
1374 1 5 . 1 1 34 34 ASP CA C 34 55.860 55.860 53.646 2.214 18832
1375 1 5 . 1 1 34 34 ASP CB C 34 41.310 41.310 42.187 -0.877 18832
1376 1 5 . 1 1 34 34 ASP H H 34 8.686 8.686 7.728 0.958 18832
1377 1 5 . 1 1 35 35 THR N N 35 117.980 117.980 116.622 1.358 18832
1378 1 5 . 1 1 35 35 THR HA H 35 5.154 5.154 5.038 0.116 18832
1379 1 5 . 1 1 35 35 THR CA C 35 61.450 61.450 61.801 -0.351 18832
1380 1 5 . 1 1 35 35 THR CB C 35 69.090 69.090 70.071 -0.981 18832
1381 1 5 . 1 1 35 35 THR H H 35 8.392 8.392 8.357 0.035 18832
1382 1 5 . 1 1 36 36 VAL N N 36 118.200 118.200 116.868 1.332 18832
1383 1 5 . 1 1 36 36 VAL HA H 36 5.152 5.152 4.582 0.570 18832
1384 1 5 . 1 1 36 36 VAL CA C 36 57.910 57.910 60.379 -2.469 18832
1385 1 5 . 1 1 36 36 VAL CB C 36 34.190 34.190 34.691 -0.501 18832
1386 1 5 . 1 1 36 36 VAL H H 36 9.016 9.016 8.980 0.036 18832
1387 1 5 . 1 1 37 37 HIS N N 37 122.190 122.190 125.851 -3.661 18832
1388 1 5 . 1 1 37 37 HIS HA H 37 4.811 4.811 4.934 -0.123 18832
1389 1 5 . 1 1 37 37 HIS CA C 37 52.560 52.560 53.272 -0.712 18832
1390 1 5 . 1 1 37 37 HIS CB C 37 31.260 31.260 30.800 0.460 18832
1391 1 5 . 1 1 37 37 HIS H H 37 8.491 8.491 8.651 -0.160 18832
1392 1 5 . 1 1 38 38 ILE N N 38 126.650 126.650 126.580 0.070 18832
1393 1 5 . 1 1 38 38 ILE HA H 38 3.750 3.750 4.200 -0.450 18832
1394 1 5 . 1 1 38 38 ILE CA C 38 61.640 61.640 62.543 -0.903 18832
1395 1 5 . 1 1 38 38 ILE CB C 38 38.880 38.880 38.393 0.487 18832
1396 1 5 . 1 1 38 38 ILE H H 38 8.638 8.638 8.733 -0.095 18832
1397 1 5 . 1 1 39 39 LEU N N 39 126.180 126.180 122.699 3.481 18832
1398 1 5 . 1 1 39 39 LEU HA H 39 4.380 4.380 4.977 -0.597 18832
1399 1 5 . 1 1 39 39 LEU CA C 39 55.490 55.490 54.870 0.620 18832
1400 1 5 . 1 1 39 39 LEU CB C 39 43.750 43.750 43.763 -0.013 18832
1401 1 5 . 1 1 39 39 LEU H H 39 9.163 9.163 9.027 0.136 18832
1402 1 5 . 1 1 40 40 GLU N N 40 115.160 115.160 118.383 -3.223 18832
1403 1 5 . 1 1 40 40 GLU HA H 40 5.020 5.020 4.806 0.214 18832
1404 1 5 . 1 1 40 40 GLU CA C 40 55.090 55.090 55.182 -0.092 18832
1405 1 5 . 1 1 40 40 GLU CB C 40 35.730 35.730 34.120 1.610 18832
1406 1 5 . 1 1 40 40 GLU H H 40 7.852 7.852 7.873 -0.021 18832
1407 1 5 . 1 1 41 41 THR HA H 41 4.270 4.270 4.623 -0.353 18832
1408 1 5 . 1 1 41 41 THR CA C 41 61.250 61.250 59.286 1.964 18832
1409 1 5 . 1 1 41 41 THR CB C 41 71.410 71.410 70.729 0.681 18832
1410 1 5 . 1 1 42 42 TYR HA H 42 4.550 4.550 4.354 0.196 18832
1411 1 5 . 1 1 43 43 GLU N N 43 124.100 124.100 120.352 3.748 18832
1412 1 5 . 1 1 43 43 GLU HA H 43 3.740 3.740 4.123 -0.383 18832
1413 1 5 . 1 1 43 43 GLU H H 43 8.590 8.590 8.056 0.534 18832
1414 1 5 . 1 1 44 44 GLY N N 44 110.789 110.789 109.412 1.377 18832
1415 1 5 . 1 1 44 44 GLY CA C 44 45.440 45.440 45.406 0.035 18832
1416 1 5 . 1 1 44 44 GLY H H 44 8.432 8.432 8.887 -0.455 18832
1417 1 5 . 1 1 45 45 TRP HA H 45 4.690 4.690 4.742 -0.052 18832
1418 1 5 . 1 1 45 45 TRP CA C 45 57.550 57.550 56.093 1.457 18832
1419 1 5 . 1 1 46 46 TYR HA H 46 5.600 5.600 5.075 0.525 18832
1420 1 5 . 1 1 46 46 TYR CA C 46 54.060 54.060 54.745 -0.685 18832
1421 1 5 . 1 1 46 46 TYR CB C 46 42.650 42.650 41.311 1.339 18832
1422 1 5 . 1 1 47 47 ARG N N 47 118.100 118.100 120.418 -2.318 18832
1423 1 5 . 1 1 47 47 ARG HA H 47 5.094 5.094 5.088 0.006 18832
1424 1 5 . 1 1 47 47 ARG CA C 47 54.060 54.060 54.174 -0.114 18832
1425 1 5 . 1 1 47 47 ARG CB C 47 33.250 33.250 34.429 -1.179 18832
1426 1 5 . 1 1 47 47 ARG H H 47 8.492 8.492 8.901 -0.409 18832
1427 1 5 . 1 1 48 48 GLY N N 48 114.000 114.000 111.197 2.803 18832
1428 1 5 . 1 1 48 48 GLY CA C 48 46.560 46.560 45.972 0.588 18832
1429 1 5 . 1 1 48 48 GLY H H 48 9.183 9.183 8.722 0.461 18832
1430 1 5 . 1 1 49 49 TYR N N 49 116.100 116.100 115.409 0.691 18832
1431 1 5 . 1 1 49 49 TYR HA H 49 5.373 5.373 5.364 0.009 18832
1432 1 5 . 1 1 49 49 TYR CA C 49 55.110 55.110 54.908 0.202 18832
1433 1 5 . 1 1 49 49 TYR CB C 49 40.750 40.750 40.765 -0.015 18832
1434 1 5 . 1 1 49 49 TYR H H 49 8.194 8.194 8.292 -0.098 18832
1435 1 5 . 1 1 50 50 THR N N 50 112.350 112.350 115.715 -3.365 18832
1436 1 5 . 1 1 50 50 THR HA H 50 5.105 5.105 4.465 0.640 18832
1437 1 5 . 1 1 50 50 THR CA C 50 59.770 59.770 61.279 -1.508 18832
1438 1 5 . 1 1 50 50 THR CB C 50 69.460 69.460 69.567 -0.107 18832
1439 1 5 . 1 1 50 50 THR H H 50 9.441 9.441 8.717 0.724 18832
1440 1 5 . 1 1 51 51 LEU N N 51 121.260 121.260 121.657 -0.397 18832
1441 1 5 . 1 1 51 51 LEU HA H 51 4.236 4.236 4.066 0.170 18832
1442 1 5 . 1 1 51 51 LEU CA C 51 56.790 56.790 57.115 -0.325 18832
1443 1 5 . 1 1 51 51 LEU CB C 51 40.000 40.000 41.082 -1.082 18832
1444 1 5 . 1 1 51 51 LEU H H 51 8.310 8.310 8.205 0.105 18832
1445 1 5 . 1 1 52 52 ARG N N 52 116.570 116.570 119.243 -2.673 18832
1446 1 5 . 1 1 52 52 ARG HA H 52 4.250 4.250 4.170 0.080 18832
1447 1 5 . 1 1 52 52 ARG CA C 52 57.350 57.350 58.565 -1.215 18832
1448 1 5 . 1 1 52 52 ARG CB C 52 30.510 30.510 30.525 -0.015 18832
1449 1 5 . 1 1 52 52 ARG H H 52 8.047 8.047 8.260 -0.213 18832
1450 1 5 . 1 1 53 53 LYS N N 53 122.660 122.660 119.278 3.382 18832
1451 1 5 . 1 1 53 53 LYS HA H 53 4.616 4.616 4.545 0.071 18832
1452 1 5 . 1 1 53 53 LYS CA C 53 54.620 54.620 55.411 -0.791 18832
1453 1 5 . 1 1 53 53 LYS CB C 53 32.860 32.860 31.342 1.518 18832
1454 1 5 . 1 1 53 53 LYS H H 53 7.649 7.649 8.168 -0.519 18832
1455 1 5 . 1 1 54 54 LYS N N 54 125.010 125.010 122.494 2.516 18832
1456 1 5 . 1 1 54 54 LYS HA H 54 4.090 4.090 4.306 -0.216 18832
1457 1 5 . 1 1 54 54 LYS CA C 54 58.470 58.470 59.291 -0.821 18832
1458 1 5 . 1 1 54 54 LYS CB C 54 32.130 32.130 32.734 -0.604 18832
1459 1 5 . 1 1 54 54 LYS H H 54 8.496 8.496 8.162 0.334 18832
1460 1 5 . 1 1 55 55 SER N N 55 110.240 110.240 113.770 -3.530 18832
1461 1 5 . 1 1 55 55 SER HA H 55 4.122 4.122 4.252 -0.130 18832
1462 1 5 . 1 1 55 55 SER CA C 55 58.960 58.960 59.433 -0.473 18832
1463 1 5 . 1 1 55 55 SER CB C 55 63.310 63.310 63.457 -0.147 18832
1464 1 5 . 1 1 55 55 SER H H 55 7.857 7.857 8.188 -0.331 18832
1465 1 5 . 1 1 56 56 LYS N N 56 124.070 124.070 121.403 2.667 18832
1466 1 5 . 1 1 56 56 LYS HA H 56 4.668 4.668 4.231 0.437 18832
1467 1 5 . 1 1 56 56 LYS CA C 56 54.810 54.810 56.778 -1.968 18832
1468 1 5 . 1 1 56 56 LYS CB C 56 33.250 33.250 33.172 0.078 18832
1469 1 5 . 1 1 56 56 LYS H H 56 7.473 7.473 7.925 -0.452 18832
1470 1 5 . 1 1 57 57 LYS N N 57 125.940 125.940 121.799 4.141 18832
1471 1 5 . 1 1 57 57 LYS HA H 57 5.341 5.341 5.059 0.282 18832
1472 1 5 . 1 1 57 57 LYS CA C 57 54.620 54.620 55.026 -0.406 18832
1473 1 5 . 1 1 57 57 LYS CB C 57 34.240 34.240 36.516 -2.276 18832
1474 1 5 . 1 1 57 57 LYS H H 57 8.474 8.474 8.179 0.295 18832
1475 1 5 . 1 1 58 58 GLY N N 58 109.540 109.540 109.214 0.326 18832
1476 1 5 . 1 1 58 58 GLY CA C 58 45.620 45.620 44.828 0.792 18832
1477 1 5 . 1 1 58 58 GLY H H 58 9.075 9.075 8.596 0.479 18832
1478 1 5 . 1 1 59 59 ILE N N 59 113.900 113.900 115.715 -1.815 18832
1479 1 5 . 1 1 59 59 ILE HA H 59 6.000 6.000 5.062 0.938 18832
1480 1 5 . 1 1 59 59 ILE CA C 59 59.590 59.590 58.604 0.986 18832
1481 1 5 . 1 1 59 59 ILE CB C 59 41.140 41.140 40.230 0.910 18832
1482 1 5 . 1 1 59 59 ILE H H 59 8.628 8.628 7.937 0.691 18832
1483 1 5 . 1 1 60 60 PHE N N 60 117.040 117.040 117.335 -0.295 18832
1484 1 5 . 1 1 60 60 PHE HA H 60 5.120 5.120 5.273 -0.153 18832
1485 1 5 . 1 1 60 60 PHE CA C 60 54.060 54.060 54.803 -0.744 18832
1486 1 5 . 1 1 60 60 PHE CB C 60 37.190 37.190 39.539 -2.349 18832
1487 1 5 . 1 1 60 60 PHE H H 60 8.724 8.724 8.439 0.285 18832
1488 1 5 . 1 1 61 61 PRO HA H 61 3.480 3.480 4.596 -1.116 18832
1489 1 5 . 1 1 61 61 PRO CA C 61 62.200 62.200 62.618 -0.418 18832
1490 1 5 . 1 1 61 61 PRO CB C 61 31.190 31.190 32.950 -1.760 18832
1491 1 5 . 1 1 62 62 ALA N N 62 124.770 124.770 126.208 -1.438 18832
1492 1 5 . 1 1 62 62 ALA HA H 62 3.710 3.710 4.124 -0.414 18832
1493 1 5 . 1 1 62 62 ALA CA C 62 54.370 54.370 54.674 -0.304 18832
1494 1 5 . 1 1 62 62 ALA CB C 62 17.650 17.650 18.186 -0.536 18832
1495 1 5 . 1 1 62 62 ALA H H 62 7.898 7.898 8.451 -0.553 18832
1496 1 5 . 1 1 63 63 SER N N 63 109.700 109.700 113.637 -3.937 18832
1497 1 5 . 1 1 63 63 SER HA H 63 4.200 4.200 4.175 0.025 18832
1498 1 5 . 1 1 63 63 SER CA C 63 59.400 59.400 60.502 -1.103 18832
1499 1 5 . 1 1 63 63 SER CB C 63 62.380 62.380 62.694 -0.314 18832
1500 1 5 . 1 1 63 63 SER H H 63 8.030 8.030 8.471 -0.441 18832
1501 1 5 . 1 1 64 64 TYR N N 64 120.300 120.300 118.264 2.036 18832
1502 1 5 . 1 1 64 64 TYR HA H 64 4.250 4.250 4.668 -0.418 18832
1503 1 5 . 1 1 64 64 TYR CA C 64 57.720 57.720 56.864 0.856 18832
1504 1 5 . 1 1 64 64 TYR CB C 64 37.560 37.560 37.593 -0.033 18832
1505 1 5 . 1 1 64 64 TYR H H 64 7.128 7.128 7.286 -0.158 18832
1506 1 5 . 1 1 65 65 ILE N N 65 118.000 118.000 118.080 -0.080 18832
1507 1 5 . 1 1 65 65 ILE HA H 65 4.810 4.810 4.471 0.339 18832
1508 1 5 . 1 1 65 65 ILE CA C 65 56.980 56.980 58.843 -1.863 18832
1509 1 5 . 1 1 65 65 ILE CB C 65 39.630 39.630 42.359 -2.729 18832
1510 1 5 . 1 1 65 65 ILE H H 65 7.671 7.671 7.386 0.285 18832
1511 1 5 . 1 1 66 66 HIS N N 66 124.300 124.300 122.186 2.114 18832
1512 1 5 . 1 1 66 66 HIS HA H 66 5.130 5.130 4.852 0.278 18832
1513 1 5 . 1 1 66 66 HIS CA C 66 53.060 53.060 54.722 -1.662 18832
1514 1 5 . 1 1 66 66 HIS CB C 66 30.510 30.510 33.637 -3.127 18832
1515 1 5 . 1 1 66 66 HIS H H 66 9.159 9.159 8.973 0.186 18832
1516 1 5 . 1 1 67 67 LEU N N 67 127.580 127.580 127.327 0.253 18832
1517 1 5 . 1 1 67 67 LEU HA H 67 4.570 4.570 4.635 -0.065 18832
1518 1 5 . 1 1 67 67 LEU CA C 67 55.300 55.300 54.153 1.147 18832
1519 1 5 . 1 1 67 67 LEU CB C 67 42.060 42.060 40.755 1.304 18832
1520 1 5 . 1 1 67 67 LEU H H 67 8.992 8.992 8.453 0.539 18832
1521 1 5 . 1 1 68 68 LYS N N 68 121.900 121.900 124.556 -2.656 18832
1522 1 5 . 1 1 68 68 LYS HA H 68 4.490 4.490 4.639 -0.149 18832
1523 1 5 . 1 1 68 68 LYS CA C 68 55.110 55.110 54.821 0.289 18832
1524 1 5 . 1 1 68 68 LYS CB C 68 34.610 34.610 33.991 0.619 18832
1525 1 5 . 1 1 68 68 LYS H H 68 8.499 8.499 8.228 0.271 18832
1526 1 5 . 1 1 69 69 GLU N N 69 122.190 122.190 119.772 2.418 18832
1527 1 5 . 1 1 69 69 GLU HA H 69 4.280 4.280 4.345 -0.065 18832
1528 1 5 . 1 1 69 69 GLU CA C 69 56.610 56.610 54.778 1.832 18832
1529 1 5 . 1 1 69 69 GLU CB C 69 30.330 30.330 29.786 0.544 18832
1530 1 5 . 1 1 69 69 GLU H H 69 8.569 8.569 8.650 -0.081 18832
1531 1 5 . 1 1 70 70 ALA N N 70 123.370 123.370 121.540 1.830 18832
1532 1 5 . 1 1 70 70 ALA HA H 70 4.200 4.200 3.962 0.237 18832
1533 1 5 . 1 1 70 70 ALA CA C 70 51.810 51.810 53.053 -1.243 18832
1534 1 5 . 1 1 70 70 ALA CB C 70 19.700 19.700 18.131 1.569 18832
1535 1 5 . 1 1 70 70 ALA H H 70 8.181 8.181 8.201 -0.020 18832
1536 1 5 . 1 1 71 71 ILE N N 71 120.080 120.080 119.209 0.871 18832
1537 1 5 . 1 1 71 71 ILE HA H 71 4.070 4.070 4.579 -0.509 18832
1538 1 5 . 1 1 71 71 ILE CA C 71 60.330 60.330 59.926 0.404 18832
1539 1 5 . 1 1 71 71 ILE CB C 71 38.690 38.690 37.763 0.927 18832
1540 1 5 . 1 1 71 71 ILE H H 71 7.776 7.776 8.296 -0.520 18832
1541 1 5 . 1 1 72 72 VAL N N 72 124.540 124.540 122.712 1.828 18832
1542 1 5 . 1 1 72 72 VAL HA H 72 4.070 4.070 4.407 -0.338 18832
1543 1 5 . 1 1 72 72 VAL CA C 72 61.640 61.640 62.384 -0.744 18832
1544 1 5 . 1 1 72 72 VAL CB C 72 32.690 32.690 30.542 2.148 18832
1545 1 5 . 1 1 72 72 VAL H H 72 8.089 8.089 8.694 -0.605 18832
1546 1 5 . 1 1 73 73 GLU N N 73 125.940 125.940 123.154 2.786 18832
1547 1 5 . 1 1 73 73 GLU HA H 73 4.280 4.280 4.629 -0.349 18832
1548 1 5 . 1 1 73 73 GLU CA C 73 56.610 56.610 55.978 0.632 18832
1549 1 5 . 1 1 73 73 GLU CB C 73 30.710 30.710 30.520 0.190 18832
1550 1 5 . 1 1 73 73 GLU H H 73 8.464 8.464 8.411 0.053 18832
1551 1 6 . 1 1 2 2 THR N N 2 116.400 116.400 115.071 1.329 18832
1552 1 6 . 1 1 2 2 THR HA H 2 4.120 4.120 4.578 -0.458 18832
1553 1 6 . 1 1 2 2 THR CA C 2 62.100 62.100 61.575 0.525 18832
1554 1 6 . 1 1 2 2 THR CB C 2 69.440 69.440 69.706 -0.266 18832
1555 1 6 . 1 1 2 2 THR H H 2 8.150 8.150 8.087 0.063 18832
1556 1 6 . 1 1 3 3 ARG HA H 3 4.310 4.310 4.433 -0.123 18832
1557 1 6 . 1 1 3 3 ARG CA C 3 55.750 55.750 55.411 0.339 18832
1558 1 6 . 1 1 3 3 ARG CB C 3 30.620 30.620 31.090 -0.470 18832
1559 1 6 . 1 1 4 4 TRP N N 4 123.300 123.300 120.586 2.714 18832
1560 1 6 . 1 1 4 4 TRP HA H 4 4.480 4.480 4.528 -0.048 18832
1561 1 6 . 1 1 4 4 TRP CA C 4 57.560 57.560 56.782 0.778 18832
1562 1 6 . 1 1 4 4 TRP CB C 4 29.490 29.490 29.585 -0.095 18832
1563 1 6 . 1 1 4 4 TRP H H 4 8.108 8.108 8.413 -0.305 18832
1564 1 6 . 1 1 5 5 VAL HA H 5 4.570 4.570 4.152 0.418 18832
1565 1 6 . 1 1 5 5 VAL CB C 5 30.840 30.840 31.685 -0.845 18832
1566 1 6 . 1 1 6 6 PRO HA H 6 4.810 4.810 4.510 0.300 18832
1567 1 6 . 1 1 6 6 PRO CB C 6 32.210 32.210 29.802 2.408 18832
1568 1 6 . 1 1 7 7 THR HA H 7 4.270 4.270 3.826 0.444 18832
1569 1 6 . 1 1 7 7 THR CA C 7 60.890 60.890 62.929 -2.039 18832
1570 1 6 . 1 1 7 7 THR CB C 7 70.140 70.140 68.668 1.472 18832
1571 1 6 . 1 1 8 8 LYS HA H 8 4.440 4.440 4.402 0.037 18832
1572 1 6 . 1 1 8 8 LYS CA C 8 55.980 55.980 55.160 0.820 18832
1573 1 6 . 1 1 8 8 LYS CB C 8 35.050 35.050 33.838 1.212 18832
1574 1 6 . 1 1 10 10 GLU HA H 10 4.580 4.580 4.397 0.183 18832
1575 1 6 . 1 1 10 10 GLU CA C 10 55.570 55.570 55.339 0.231 18832
1576 1 6 . 1 1 10 10 GLU CB C 10 30.780 30.780 31.031 -0.251 18832
1577 1 6 . 1 1 11 11 GLU N N 11 122.500 122.500 120.229 2.271 18832
1578 1 6 . 1 1 11 11 GLU HA H 11 4.340 4.340 4.367 -0.027 18832
1579 1 6 . 1 1 11 11 GLU CA C 11 57.140 57.140 57.368 -0.228 18832
1580 1 6 . 1 1 11 11 GLU CB C 11 29.400 29.400 30.407 -1.008 18832
1581 1 6 . 1 1 11 11 GLU H H 11 8.271 8.271 8.737 -0.466 18832
1582 1 6 . 1 1 12 12 LYS HA H 12 4.380 4.380 4.390 -0.010 18832
1583 1 6 . 1 1 12 12 LYS CA C 12 55.790 55.790 56.530 -0.740 18832
1584 1 6 . 1 1 12 12 LYS CB C 12 33.600 33.600 34.680 -1.080 18832
1585 1 6 . 1 1 13 13 TYR HA H 13 5.560 5.560 4.767 0.793 18832
1586 1 6 . 1 1 13 13 TYR CA C 13 55.860 55.860 55.395 0.465 18832
1587 1 6 . 1 1 13 13 TYR CB C 13 42.440 42.440 40.835 1.605 18832
1588 1 6 . 1 1 14 14 GLY N N 14 105.320 105.320 106.300 -0.980 18832
1589 1 6 . 1 1 14 14 GLY CA C 14 45.240 45.240 44.592 0.648 18832
1590 1 6 . 1 1 14 14 GLY H H 14 8.401 8.401 8.765 -0.364 18832
1591 1 6 . 1 1 15 15 VAL N N 15 118.900 118.900 118.714 0.186 18832
1592 1 6 . 1 1 15 15 VAL HA H 15 5.341 5.341 4.675 0.666 18832
1593 1 6 . 1 1 15 15 VAL CA C 15 59.210 59.210 59.964 -0.754 18832
1594 1 6 . 1 1 15 15 VAL CB C 15 35.740 35.740 34.970 0.770 18832
1595 1 6 . 1 1 15 15 VAL H H 15 8.851 8.851 8.832 0.019 18832
1596 1 6 . 1 1 16 16 ALA N N 16 129.460 129.460 127.908 1.552 18832
1597 1 6 . 1 1 16 16 ALA HA H 16 5.000 5.000 5.486 -0.486 18832
1598 1 6 . 1 1 16 16 ALA CA C 16 52.000 52.000 50.069 1.931 18832
1599 1 6 . 1 1 16 16 ALA CB C 16 19.330 19.330 21.310 -1.980 18832
1600 1 6 . 1 1 16 16 ALA H H 16 9.113 9.113 8.606 0.507 18832
1601 1 6 . 1 1 17 17 PHE N N 17 124.070 124.070 122.581 1.489 18832
1602 1 6 . 1 1 17 17 PHE HA H 17 4.801 4.801 5.051 -0.250 18832
1603 1 6 . 1 1 17 17 PHE CA C 17 56.230 56.230 56.119 0.111 18832
1604 1 6 . 1 1 17 17 PHE CB C 17 40.000 40.000 38.526 1.474 18832
1605 1 6 . 1 1 17 17 PHE H H 17 8.787 8.787 8.160 0.627 18832
1606 1 6 . 1 1 18 18 TYR N N 18 118.210 118.210 122.418 -4.208 18832
1607 1 6 . 1 1 18 18 TYR HA H 18 4.483 4.483 4.344 0.139 18832
1608 1 6 . 1 1 18 18 TYR CA C 18 55.300 55.300 57.573 -2.273 18832
1609 1 6 . 1 1 18 18 TYR CB C 18 42.810 42.810 42.324 0.486 18832
1610 1 6 . 1 1 18 18 TYR H H 18 7.281 7.281 7.560 -0.279 18832
1611 1 6 . 1 1 19 19 ASN N N 19 116.800 116.800 118.845 -2.045 18832
1612 1 6 . 1 1 19 19 ASN HA H 19 4.710 4.710 4.843 -0.133 18832
1613 1 6 . 1 1 19 19 ASN CA C 19 52.940 52.940 52.587 0.353 18832
1614 1 6 . 1 1 19 19 ASN CB C 19 39.060 39.060 38.072 0.988 18832
1615 1 6 . 1 1 19 19 ASN H H 19 8.134 8.134 8.224 -0.090 18832
1616 1 6 . 1 1 20 20 TYR N N 20 122.190 122.190 122.648 -0.458 18832
1617 1 6 . 1 1 20 20 TYR HA H 20 4.687 4.687 4.647 0.040 18832
1618 1 6 . 1 1 20 20 TYR CA C 20 57.720 57.720 57.156 0.564 18832
1619 1 6 . 1 1 20 20 TYR CB C 20 42.250 42.250 41.226 1.024 18832
1620 1 6 . 1 1 20 20 TYR H H 20 8.993 8.993 8.066 0.927 18832
1621 1 6 . 1 1 21 21 ASP N N 21 128.520 128.520 126.990 1.530 18832
1622 1 6 . 1 1 21 21 ASP HA H 21 4.790 4.790 4.722 0.068 18832
1623 1 6 . 1 1 21 21 ASP CA C 21 52.370 52.370 51.792 0.578 18832
1624 1 6 . 1 1 21 21 ASP CB C 21 41.130 41.130 43.673 -2.543 18832
1625 1 6 . 1 1 21 21 ASP H H 21 7.838 7.838 8.394 -0.556 18832
1626 1 6 . 1 1 22 22 ALA N N 22 125.240 125.240 126.400 -1.160 18832
1627 1 6 . 1 1 22 22 ALA HA H 22 4.051 4.051 3.898 0.153 18832
1628 1 6 . 1 1 22 22 ALA CA C 22 52.940 52.940 52.880 0.060 18832
1629 1 6 . 1 1 22 22 ALA CB C 22 20.450 20.450 19.395 1.055 18832
1630 1 6 . 1 1 22 22 ALA H H 22 8.103 8.103 8.338 -0.235 18832
1631 1 6 . 1 1 23 23 ARG N N 23 122.190 122.190 122.512 -0.322 18832
1632 1 6 . 1 1 23 23 ARG HA H 23 4.346 4.346 4.410 -0.064 18832
1633 1 6 . 1 1 23 23 ARG CA C 23 55.490 55.490 56.532 -1.042 18832
1634 1 6 . 1 1 23 23 ARG CB C 23 30.700 30.700 31.709 -1.009 18832
1635 1 6 . 1 1 23 23 ARG H H 23 8.887 8.887 8.811 0.076 18832
1636 1 6 . 1 1 24 24 GLY N N 24 105.320 105.320 105.605 -0.285 18832
1637 1 6 . 1 1 24 24 GLY CA C 24 44.500 44.500 45.029 -0.529 18832
1638 1 6 . 1 1 24 24 GLY H H 24 7.258 7.258 7.573 -0.315 18832
1639 1 6 . 1 1 25 25 ALA N N 25 122.190 122.190 121.742 0.448 18832
1640 1 6 . 1 1 25 25 ALA HA H 25 4.166 4.166 4.268 -0.102 18832
1641 1 6 . 1 1 25 25 ALA CA C 25 54.440 54.440 53.737 0.703 18832
1642 1 6 . 1 1 25 25 ALA CB C 25 18.770 18.770 19.206 -0.435 18832
1643 1 6 . 1 1 25 25 ALA H H 25 8.627 8.627 8.356 0.271 18832
1644 1 6 . 1 1 26 26 ASP N N 26 114.690 114.690 116.609 -1.919 18832
1645 1 6 . 1 1 26 26 ASP HA H 26 4.700 4.700 4.460 0.240 18832
1646 1 6 . 1 1 26 26 ASP CA C 26 53.870 53.870 56.054 -2.184 18832
1647 1 6 . 1 1 26 26 ASP CB C 26 40.390 40.390 41.118 -0.728 18832
1648 1 6 . 1 1 26 26 ASP H H 26 8.955 8.955 8.575 0.380 18832
1649 1 6 . 1 1 27 27 GLU N N 27 118.910 118.910 116.308 2.602 18832
1650 1 6 . 1 1 27 27 GLU HA H 27 5.202 5.202 4.778 0.424 18832
1651 1 6 . 1 1 27 27 GLU CA C 27 54.930 54.930 55.486 -0.556 18832
1652 1 6 . 1 1 27 27 GLU CB C 27 32.880 32.880 32.707 0.173 18832
1653 1 6 . 1 1 27 27 GLU H H 27 7.537 7.537 7.490 0.047 18832
1654 1 6 . 1 1 28 28 LEU N N 28 121.490 121.490 119.976 1.514 18832
1655 1 6 . 1 1 28 28 LEU HA H 28 4.756 4.756 4.728 0.028 18832
1656 1 6 . 1 1 28 28 LEU CA C 28 53.120 53.120 53.984 -0.864 18832
1657 1 6 . 1 1 28 28 LEU CB C 28 44.500 44.500 44.857 -0.357 18832
1658 1 6 . 1 1 28 28 LEU H H 28 8.890 8.890 8.553 0.337 18832
1659 1 6 . 1 1 29 29 SER N N 29 115.870 115.870 118.420 -2.550 18832
1660 1 6 . 1 1 29 29 SER HA H 29 5.009 5.009 4.309 0.700 18832
1661 1 6 . 1 1 29 29 SER CA C 29 58.470 58.470 58.693 -0.223 18832
1662 1 6 . 1 1 29 29 SER CB C 29 63.690 63.690 63.830 -0.140 18832
1663 1 6 . 1 1 29 29 SER H H 29 7.948 7.948 8.410 -0.462 18832
1664 1 6 . 1 1 30 30 LEU N N 30 121.260 121.260 126.491 -5.231 18832
1665 1 6 . 1 1 30 30 LEU HA H 30 4.776 4.776 4.803 -0.027 18832
1666 1 6 . 1 1 30 30 LEU CA C 30 52.940 52.940 54.256 -1.316 18832
1667 1 6 . 1 1 30 30 LEU CB C 30 46.370 46.370 45.699 0.671 18832
1668 1 6 . 1 1 30 30 LEU H H 30 9.500 9.500 8.358 1.142 18832
1669 1 6 . 1 1 31 31 GLN N N 31 123.130 123.130 119.107 4.023 18832
1670 1 6 . 1 1 31 31 GLN HA H 31 5.065 5.065 5.365 -0.300 18832
1671 1 6 . 1 1 31 31 GLN CA C 31 52.940 52.940 53.531 -0.591 18832
1672 1 6 . 1 1 31 31 GLN CB C 31 31.190 31.190 33.261 -2.071 18832
1673 1 6 . 1 1 31 31 GLN H H 31 9.147 9.147 8.437 0.710 18832
1674 1 6 . 1 1 32 32 ILE N N 32 120.790 120.790 119.948 0.842 18832
1675 1 6 . 1 1 32 32 ILE HA H 32 3.032 3.032 4.108 -1.076 18832
1676 1 6 . 1 1 32 32 ILE CA C 32 64.250 64.250 63.258 0.992 18832
1677 1 6 . 1 1 32 32 ILE CB C 32 37.940 37.940 37.905 0.035 18832
1678 1 6 . 1 1 32 32 ILE H H 32 8.016 8.016 8.333 -0.317 18832
1679 1 6 . 1 1 33 33 GLY N N 33 115.870 115.870 115.258 0.612 18832
1680 1 6 . 1 1 33 33 GLY CA C 33 44.500 44.500 44.864 -0.364 18832
1681 1 6 . 1 1 33 33 GLY H H 33 8.775 8.775 9.072 -0.297 18832
1682 1 6 . 1 1 34 34 ASP N N 34 122.430 122.430 122.126 0.304 18832
1683 1 6 . 1 1 34 34 ASP HA H 34 4.634 4.634 4.985 -0.351 18832
1684 1 6 . 1 1 34 34 ASP CA C 34 55.860 55.860 53.849 2.011 18832
1685 1 6 . 1 1 34 34 ASP CB C 34 41.310 41.310 42.355 -1.045 18832
1686 1 6 . 1 1 34 34 ASP H H 34 8.686 8.686 7.717 0.969 18832
1687 1 6 . 1 1 35 35 THR N N 35 117.980 117.980 117.053 0.927 18832
1688 1 6 . 1 1 35 35 THR HA H 35 5.154 5.154 4.927 0.227 18832
1689 1 6 . 1 1 35 35 THR CA C 35 61.450 61.450 61.807 -0.357 18832
1690 1 6 . 1 1 35 35 THR CB C 35 69.090 69.090 70.471 -1.381 18832
1691 1 6 . 1 1 35 35 THR H H 35 8.392 8.392 8.443 -0.051 18832
1692 1 6 . 1 1 36 36 VAL N N 36 118.200 118.200 119.492 -1.292 18832
1693 1 6 . 1 1 36 36 VAL HA H 36 5.152 5.152 4.545 0.607 18832
1694 1 6 . 1 1 36 36 VAL CA C 36 57.910 57.910 59.617 -1.708 18832
1695 1 6 . 1 1 36 36 VAL CB C 36 34.190 34.190 34.473 -0.283 18832
1696 1 6 . 1 1 36 36 VAL H H 36 9.016 9.016 8.831 0.185 18832
1697 1 6 . 1 1 37 37 HIS N N 37 122.190 122.190 125.953 -3.763 18832
1698 1 6 . 1 1 37 37 HIS HA H 37 4.811 4.811 4.935 -0.124 18832
1699 1 6 . 1 1 37 37 HIS CA C 37 52.560 52.560 53.716 -1.156 18832
1700 1 6 . 1 1 37 37 HIS CB C 37 31.260 31.260 30.272 0.988 18832
1701 1 6 . 1 1 37 37 HIS H H 37 8.491 8.491 8.232 0.259 18832
1702 1 6 . 1 1 38 38 ILE N N 38 126.650 126.650 128.042 -1.392 18832
1703 1 6 . 1 1 38 38 ILE HA H 38 3.750 3.750 3.900 -0.150 18832
1704 1 6 . 1 1 38 38 ILE CA C 38 61.640 61.640 62.268 -0.628 18832
1705 1 6 . 1 1 38 38 ILE CB C 38 38.880 38.880 36.976 1.904 18832
1706 1 6 . 1 1 38 38 ILE H H 38 8.638 8.638 8.529 0.109 18832
1707 1 6 . 1 1 39 39 LEU N N 39 126.180 126.180 129.068 -2.888 18832
1708 1 6 . 1 1 39 39 LEU HA H 39 4.380 4.380 4.532 -0.152 18832
1709 1 6 . 1 1 39 39 LEU CA C 39 55.490 55.490 55.696 -0.206 18832
1710 1 6 . 1 1 39 39 LEU CB C 39 43.750 43.750 43.840 -0.090 18832
1711 1 6 . 1 1 39 39 LEU H H 39 9.163 9.163 8.498 0.665 18832
1712 1 6 . 1 1 40 40 GLU N N 40 115.160 115.160 114.167 0.993 18832
1713 1 6 . 1 1 40 40 GLU HA H 40 5.020 5.020 4.544 0.476 18832
1714 1 6 . 1 1 40 40 GLU CA C 40 55.090 55.090 55.422 -0.332 18832
1715 1 6 . 1 1 40 40 GLU CB C 40 35.730 35.730 33.657 2.073 18832
1716 1 6 . 1 1 40 40 GLU H H 40 7.852 7.852 8.104 -0.252 18832
1717 1 6 . 1 1 41 41 THR HA H 41 4.270 4.270 4.500 -0.230 18832
1718 1 6 . 1 1 41 41 THR CA C 41 61.250 61.250 59.296 1.954 18832
1719 1 6 . 1 1 41 41 THR CB C 41 71.410 71.410 70.487 0.923 18832
1720 1 6 . 1 1 42 42 TYR HA H 42 4.550 4.550 4.255 0.295 18832
1721 1 6 . 1 1 43 43 GLU N N 43 124.100 124.100 120.659 3.441 18832
1722 1 6 . 1 1 43 43 GLU HA H 43 3.740 3.740 4.141 -0.401 18832
1723 1 6 . 1 1 43 43 GLU H H 43 8.590 8.590 7.928 0.662 18832
1724 1 6 . 1 1 44 44 GLY N N 44 110.789 110.789 110.197 0.592 18832
1725 1 6 . 1 1 44 44 GLY CA C 44 45.440 45.440 45.409 0.031 18832
1726 1 6 . 1 1 44 44 GLY H H 44 8.432 8.432 8.157 0.275 18832
1727 1 6 . 1 1 45 45 TRP HA H 45 4.690 4.690 4.445 0.245 18832
1728 1 6 . 1 1 45 45 TRP CA C 45 57.550 57.550 56.116 1.434 18832
1729 1 6 . 1 1 46 46 TYR HA H 46 5.600 5.600 4.638 0.962 18832
1730 1 6 . 1 1 46 46 TYR CA C 46 54.060 54.060 54.750 -0.690 18832
1731 1 6 . 1 1 46 46 TYR CB C 46 42.650 42.650 41.212 1.438 18832
1732 1 6 . 1 1 47 47 ARG N N 47 118.100 118.100 122.303 -4.203 18832
1733 1 6 . 1 1 47 47 ARG HA H 47 5.094 5.094 5.010 0.084 18832
1734 1 6 . 1 1 47 47 ARG CA C 47 54.060 54.060 54.554 -0.494 18832
1735 1 6 . 1 1 47 47 ARG CB C 47 33.250 33.250 33.453 -0.203 18832
1736 1 6 . 1 1 47 47 ARG H H 47 8.492 8.492 8.849 -0.357 18832
1737 1 6 . 1 1 48 48 GLY N N 48 114.000 114.000 113.106 0.894 18832
1738 1 6 . 1 1 48 48 GLY CA C 48 46.560 46.560 44.927 1.633 18832
1739 1 6 . 1 1 48 48 GLY H H 48 9.183 9.183 8.680 0.503 18832
1740 1 6 . 1 1 49 49 TYR N N 49 116.100 116.100 115.454 0.646 18832
1741 1 6 . 1 1 49 49 TYR HA H 49 5.373 5.373 5.228 0.145 18832
1742 1 6 . 1 1 49 49 TYR CA C 49 55.110 55.110 55.583 -0.472 18832
1743 1 6 . 1 1 49 49 TYR CB C 49 40.750 40.750 40.089 0.661 18832
1744 1 6 . 1 1 49 49 TYR H H 49 8.194 8.194 8.062 0.132 18832
1745 1 6 . 1 1 50 50 THR N N 50 112.350 112.350 117.355 -5.005 18832
1746 1 6 . 1 1 50 50 THR HA H 50 5.105 5.105 4.457 0.648 18832
1747 1 6 . 1 1 50 50 THR CA C 50 59.770 59.770 62.079 -2.309 18832
1748 1 6 . 1 1 50 50 THR CB C 50 69.460 69.460 69.620 -0.160 18832
1749 1 6 . 1 1 50 50 THR H H 50 9.441 9.441 8.725 0.716 18832
1750 1 6 . 1 1 51 51 LEU N N 51 121.260 121.260 121.785 -0.525 18832
1751 1 6 . 1 1 51 51 LEU HA H 51 4.236 4.236 4.080 0.156 18832
1752 1 6 . 1 1 51 51 LEU CA C 51 56.790 56.790 57.328 -0.538 18832
1753 1 6 . 1 1 51 51 LEU CB C 51 40.000 40.000 40.980 -0.980 18832
1754 1 6 . 1 1 51 51 LEU H H 51 8.310 8.310 8.635 -0.325 18832
1755 1 6 . 1 1 52 52 ARG N N 52 116.570 116.570 118.197 -1.627 18832
1756 1 6 . 1 1 52 52 ARG HA H 52 4.250 4.250 4.222 0.028 18832
1757 1 6 . 1 1 52 52 ARG CA C 52 57.350 57.350 58.219 -0.869 18832
1758 1 6 . 1 1 52 52 ARG CB C 52 30.510 30.510 30.681 -0.171 18832
1759 1 6 . 1 1 52 52 ARG H H 52 8.047 8.047 8.186 -0.139 18832
1760 1 6 . 1 1 53 53 LYS N N 53 122.660 122.660 118.495 4.165 18832
1761 1 6 . 1 1 53 53 LYS HA H 53 4.616 4.616 4.490 0.126 18832
1762 1 6 . 1 1 53 53 LYS CA C 53 54.620 54.620 55.389 -0.769 18832
1763 1 6 . 1 1 53 53 LYS CB C 53 32.860 32.860 30.716 2.144 18832
1764 1 6 . 1 1 53 53 LYS H H 53 7.649 7.649 8.122 -0.473 18832
1765 1 6 . 1 1 54 54 LYS N N 54 125.010 125.010 119.713 5.297 18832
1766 1 6 . 1 1 54 54 LYS HA H 54 4.090 4.090 4.171 -0.081 18832
1767 1 6 . 1 1 54 54 LYS CA C 54 58.470 58.470 58.050 0.420 18832
1768 1 6 . 1 1 54 54 LYS CB C 54 32.130 32.130 32.657 -0.527 18832
1769 1 6 . 1 1 54 54 LYS H H 54 8.496 8.496 7.995 0.501 18832
1770 1 6 . 1 1 55 55 SER N N 55 110.240 110.240 112.225 -1.985 18832
1771 1 6 . 1 1 55 55 SER HA H 55 4.122 4.122 4.373 -0.251 18832
1772 1 6 . 1 1 55 55 SER CA C 55 58.960 58.960 58.879 0.081 18832
1773 1 6 . 1 1 55 55 SER CB C 55 63.310 63.310 63.774 -0.464 18832
1774 1 6 . 1 1 55 55 SER H H 55 7.857 7.857 8.087 -0.230 18832
1775 1 6 . 1 1 56 56 LYS N N 56 124.070 124.070 122.004 2.066 18832
1776 1 6 . 1 1 56 56 LYS HA H 56 4.668 4.668 4.470 0.198 18832
1777 1 6 . 1 1 56 56 LYS CA C 56 54.810 54.810 55.882 -1.072 18832
1778 1 6 . 1 1 56 56 LYS CB C 56 33.250 33.250 34.046 -0.796 18832
1779 1 6 . 1 1 56 56 LYS H H 56 7.473 7.473 7.951 -0.478 18832
1780 1 6 . 1 1 57 57 LYS N N 57 125.940 125.940 119.891 6.049 18832
1781 1 6 . 1 1 57 57 LYS HA H 57 5.341 5.341 4.918 0.423 18832
1782 1 6 . 1 1 57 57 LYS CA C 57 54.620 54.620 55.000 -0.380 18832
1783 1 6 . 1 1 57 57 LYS CB C 57 34.240 34.240 36.033 -1.793 18832
1784 1 6 . 1 1 57 57 LYS H H 57 8.474 8.474 8.253 0.221 18832
1785 1 6 . 1 1 58 58 GLY N N 58 109.540 109.540 108.531 1.009 18832
1786 1 6 . 1 1 58 58 GLY CA C 58 45.620 45.620 44.968 0.652 18832
1787 1 6 . 1 1 58 58 GLY H H 58 9.075 9.075 8.670 0.405 18832
1788 1 6 . 1 1 59 59 ILE N N 59 113.900 113.900 115.367 -1.467 18832
1789 1 6 . 1 1 59 59 ILE HA H 59 6.000 6.000 5.106 0.894 18832
1790 1 6 . 1 1 59 59 ILE CA C 59 59.590 59.590 58.475 1.115 18832
1791 1 6 . 1 1 59 59 ILE CB C 59 41.140 41.140 41.364 -0.224 18832
1792 1 6 . 1 1 59 59 ILE H H 59 8.628 8.628 8.192 0.436 18832
1793 1 6 . 1 1 60 60 PHE N N 60 117.040 117.040 117.105 -0.065 18832
1794 1 6 . 1 1 60 60 PHE HA H 60 5.120 5.120 5.529 -0.409 18832
1795 1 6 . 1 1 60 60 PHE CA C 60 54.060 54.060 55.101 -1.041 18832
1796 1 6 . 1 1 60 60 PHE CB C 60 37.190 37.190 40.410 -3.220 18832
1797 1 6 . 1 1 60 60 PHE H H 60 8.724 8.724 8.779 -0.055 18832
1798 1 6 . 1 1 61 61 PRO HA H 61 3.480 3.480 4.411 -0.931 18832
1799 1 6 . 1 1 61 61 PRO CA C 61 62.200 62.200 62.284 -0.084 18832
1800 1 6 . 1 1 61 61 PRO CB C 61 31.190 31.190 32.401 -1.211 18832
1801 1 6 . 1 1 62 62 ALA N N 62 124.770 124.770 126.108 -1.338 18832
1802 1 6 . 1 1 62 62 ALA HA H 62 3.710 3.710 3.990 -0.280 18832
1803 1 6 . 1 1 62 62 ALA CA C 62 54.370 54.370 54.381 -0.011 18832
1804 1 6 . 1 1 62 62 ALA CB C 62 17.650 17.650 18.010 -0.360 18832
1805 1 6 . 1 1 62 62 ALA H H 62 7.898 7.898 8.317 -0.419 18832
1806 1 6 . 1 1 63 63 SER N N 63 109.700 109.700 115.000 -5.300 18832
1807 1 6 . 1 1 63 63 SER HA H 63 4.200 4.200 4.160 0.040 18832
1808 1 6 . 1 1 63 63 SER CA C 63 59.400 59.400 60.324 -0.924 18832
1809 1 6 . 1 1 63 63 SER CB C 63 62.380 62.380 62.976 -0.596 18832
1810 1 6 . 1 1 63 63 SER H H 63 8.030 8.030 8.492 -0.462 18832
1811 1 6 . 1 1 64 64 TYR N N 64 120.300 120.300 111.902 8.398 18832
1812 1 6 . 1 1 64 64 TYR HA H 64 4.250 4.250 4.415 -0.165 18832
1813 1 6 . 1 1 64 64 TYR CA C 64 57.720 57.720 54.664 3.056 18832
1814 1 6 . 1 1 64 64 TYR CB C 64 37.560 37.560 37.126 0.434 18832
1815 1 6 . 1 1 64 64 TYR H H 64 7.128 7.128 6.918 0.210 18832
1816 1 6 . 1 1 65 65 ILE N N 65 118.000 118.000 121.710 -3.710 18832
1817 1 6 . 1 1 65 65 ILE HA H 65 4.810 4.810 4.931 -0.121 18832
1818 1 6 . 1 1 65 65 ILE CA C 65 56.980 56.980 59.406 -2.426 18832
1819 1 6 . 1 1 65 65 ILE CB C 65 39.630 39.630 38.948 0.682 18832
1820 1 6 . 1 1 65 65 ILE H H 65 7.671 7.671 7.492 0.179 18832
1821 1 6 . 1 1 66 66 HIS N N 66 124.300 124.300 127.163 -2.863 18832
1822 1 6 . 1 1 66 66 HIS HA H 66 5.130 5.130 4.906 0.224 18832
1823 1 6 . 1 1 66 66 HIS CA C 66 53.060 53.060 54.877 -1.817 18832
1824 1 6 . 1 1 66 66 HIS CB C 66 30.510 30.510 33.146 -2.636 18832
1825 1 6 . 1 1 66 66 HIS H H 66 9.159 9.159 8.867 0.292 18832
1826 1 6 . 1 1 67 67 LEU N N 67 127.580 127.580 127.773 -0.193 18832
1827 1 6 . 1 1 67 67 LEU HA H 67 4.570 4.570 4.250 0.320 18832
1828 1 6 . 1 1 67 67 LEU CA C 67 55.300 55.300 55.010 0.290 18832
1829 1 6 . 1 1 67 67 LEU CB C 67 42.060 42.060 41.177 0.883 18832
1830 1 6 . 1 1 67 67 LEU H H 67 8.992 8.992 8.499 0.493 18832
1831 1 6 . 1 1 68 68 LYS N N 68 121.900 121.900 124.592 -2.692 18832
1832 1 6 . 1 1 68 68 LYS HA H 68 4.490 4.490 4.495 -0.005 18832
1833 1 6 . 1 1 68 68 LYS CA C 68 55.110 55.110 55.243 -0.133 18832
1834 1 6 . 1 1 68 68 LYS CB C 68 34.610 34.610 33.743 0.867 18832
1835 1 6 . 1 1 68 68 LYS H H 68 8.499 8.499 7.882 0.617 18832
1836 1 6 . 1 1 69 69 GLU N N 69 122.190 122.190 119.761 2.429 18832
1837 1 6 . 1 1 69 69 GLU HA H 69 4.280 4.280 4.369 -0.089 18832
1838 1 6 . 1 1 69 69 GLU CA C 69 56.610 56.610 55.388 1.222 18832
1839 1 6 . 1 1 69 69 GLU CB C 69 30.330 30.330 29.598 0.732 18832
1840 1 6 . 1 1 69 69 GLU H H 69 8.569 8.569 8.588 -0.019 18832
1841 1 6 . 1 1 70 70 ALA N N 70 123.370 123.370 120.905 2.465 18832
1842 1 6 . 1 1 70 70 ALA HA H 70 4.200 4.200 4.032 0.168 18832
1843 1 6 . 1 1 70 70 ALA CA C 70 51.810 51.810 52.928 -1.117 18832
1844 1 6 . 1 1 70 70 ALA CB C 70 19.700 19.700 18.805 0.895 18832
1845 1 6 . 1 1 70 70 ALA H H 70 8.181 8.181 8.152 0.029 18832
1846 1 6 . 1 1 71 71 ILE N N 71 120.080 120.080 119.614 0.466 18832
1847 1 6 . 1 1 71 71 ILE HA H 71 4.070 4.070 4.741 -0.671 18832
1848 1 6 . 1 1 71 71 ILE CA C 71 60.330 60.330 61.190 -0.860 18832
1849 1 6 . 1 1 71 71 ILE CB C 71 38.690 38.690 37.787 0.903 18832
1850 1 6 . 1 1 71 71 ILE H H 71 7.776 7.776 9.015 -1.239 18832
1851 1 6 . 1 1 72 72 VAL N N 72 124.540 124.540 122.924 1.616 18832
1852 1 6 . 1 1 72 72 VAL HA H 72 4.070 4.070 4.635 -0.565 18832
1853 1 6 . 1 1 72 72 VAL CA C 72 61.640 61.640 61.058 0.582 18832
1854 1 6 . 1 1 72 72 VAL CB C 72 32.690 32.690 33.434 -0.744 18832
1855 1 6 . 1 1 72 72 VAL H H 72 8.089 8.089 8.153 -0.064 18832
1856 1 6 . 1 1 73 73 GLU N N 73 125.940 125.940 120.057 5.883 18832
1857 1 6 . 1 1 73 73 GLU HA H 73 4.280 4.280 4.235 0.045 18832
1858 1 6 . 1 1 73 73 GLU CA C 73 56.610 56.610 57.322 -0.712 18832
1859 1 6 . 1 1 73 73 GLU CB C 73 30.710 30.710 28.150 2.560 18832
1860 1 6 . 1 1 73 73 GLU H H 73 8.464 8.464 9.496 -1.032 18832
1861 1 7 . 1 1 2 2 THR N N 2 116.400 116.400 116.510 -0.110 18832
1862 1 7 . 1 1 2 2 THR HA H 2 4.120 4.120 4.452 -0.332 18832
1863 1 7 . 1 1 2 2 THR CA C 2 62.100 62.100 62.440 -0.340 18832
1864 1 7 . 1 1 2 2 THR CB C 2 69.440 69.440 70.639 -1.199 18832
1865 1 7 . 1 1 2 2 THR H H 2 8.150 8.150 7.617 0.533 18832
1866 1 7 . 1 1 3 3 ARG HA H 3 4.310 4.310 4.497 -0.187 18832
1867 1 7 . 1 1 3 3 ARG CA C 3 55.750 55.750 57.041 -1.292 18832
1868 1 7 . 1 1 3 3 ARG CB C 3 30.620 30.620 30.806 -0.186 18832
1869 1 7 . 1 1 4 4 TRP N N 4 123.300 123.300 124.833 -1.533 18832
1870 1 7 . 1 1 4 4 TRP HA H 4 4.480 4.480 5.099 -0.619 18832
1871 1 7 . 1 1 4 4 TRP CA C 4 57.560 57.560 56.059 1.501 18832
1872 1 7 . 1 1 4 4 TRP CB C 4 29.490 29.490 31.725 -2.235 18832
1873 1 7 . 1 1 4 4 TRP H H 4 8.108 8.108 8.594 -0.486 18832
1874 1 7 . 1 1 5 5 VAL HA H 5 4.570 4.570 4.529 0.041 18832
1875 1 7 . 1 1 5 5 VAL CB C 5 30.840 30.840 33.315 -2.474 18832
1876 1 7 . 1 1 6 6 PRO HA H 6 4.810 4.810 4.636 0.174 18832
1877 1 7 . 1 1 6 6 PRO CB C 6 32.210 32.210 30.964 1.246 18832
1878 1 7 . 1 1 7 7 THR HA H 7 4.270 4.270 3.813 0.457 18832
1879 1 7 . 1 1 7 7 THR CA C 7 60.890 60.890 62.726 -1.836 18832
1880 1 7 . 1 1 7 7 THR CB C 7 70.140 70.140 69.133 1.006 18832
1881 1 7 . 1 1 8 8 LYS HA H 8 4.440 4.440 4.322 0.118 18832
1882 1 7 . 1 1 8 8 LYS CA C 8 55.980 55.980 55.558 0.422 18832
1883 1 7 . 1 1 8 8 LYS CB C 8 35.050 35.050 33.456 1.594 18832
1884 1 7 . 1 1 10 10 GLU HA H 10 4.580 4.580 4.490 0.090 18832
1885 1 7 . 1 1 10 10 GLU CA C 10 55.570 55.570 55.884 -0.314 18832
1886 1 7 . 1 1 10 10 GLU CB C 10 30.780 30.780 31.723 -0.943 18832
1887 1 7 . 1 1 11 11 GLU N N 11 122.500 122.500 120.646 1.854 18832
1888 1 7 . 1 1 11 11 GLU HA H 11 4.340 4.340 4.298 0.042 18832
1889 1 7 . 1 1 11 11 GLU CA C 11 57.140 57.140 57.628 -0.488 18832
1890 1 7 . 1 1 11 11 GLU CB C 11 29.400 29.400 30.361 -0.961 18832
1891 1 7 . 1 1 11 11 GLU H H 11 8.271 8.271 8.593 -0.322 18832
1892 1 7 . 1 1 12 12 LYS HA H 12 4.380 4.380 4.331 0.049 18832
1893 1 7 . 1 1 12 12 LYS CA C 12 55.790 55.790 56.618 -0.828 18832
1894 1 7 . 1 1 12 12 LYS CB C 12 33.600 33.600 34.296 -0.696 18832
1895 1 7 . 1 1 13 13 TYR HA H 13 5.560 5.560 4.641 0.919 18832
1896 1 7 . 1 1 13 13 TYR CA C 13 55.860 55.860 55.946 -0.086 18832
1897 1 7 . 1 1 13 13 TYR CB C 13 42.440 42.440 40.366 2.074 18832
1898 1 7 . 1 1 14 14 GLY N N 14 105.320 105.320 106.420 -1.100 18832
1899 1 7 . 1 1 14 14 GLY CA C 14 45.240 45.240 44.771 0.469 18832
1900 1 7 . 1 1 14 14 GLY H H 14 8.401 8.401 8.947 -0.546 18832
1901 1 7 . 1 1 15 15 VAL N N 15 118.900 118.900 118.874 0.026 18832
1902 1 7 . 1 1 15 15 VAL HA H 15 5.341 5.341 4.701 0.640 18832
1903 1 7 . 1 1 15 15 VAL CA C 15 59.210 59.210 60.365 -1.155 18832
1904 1 7 . 1 1 15 15 VAL CB C 15 35.740 35.740 36.523 -0.783 18832
1905 1 7 . 1 1 15 15 VAL H H 15 8.851 8.851 8.858 -0.007 18832
1906 1 7 . 1 1 16 16 ALA N N 16 129.460 129.460 125.279 4.181 18832
1907 1 7 . 1 1 16 16 ALA HA H 16 5.000 5.000 4.840 0.160 18832
1908 1 7 . 1 1 16 16 ALA CA C 16 52.000 52.000 50.211 1.789 18832
1909 1 7 . 1 1 16 16 ALA CB C 16 19.330 19.330 20.601 -1.271 18832
1910 1 7 . 1 1 16 16 ALA H H 16 9.113 9.113 8.432 0.681 18832
1911 1 7 . 1 1 17 17 PHE N N 17 124.070 124.070 122.476 1.594 18832
1912 1 7 . 1 1 17 17 PHE HA H 17 4.801 4.801 4.796 0.005 18832
1913 1 7 . 1 1 17 17 PHE CA C 17 56.230 56.230 56.699 -0.469 18832
1914 1 7 . 1 1 17 17 PHE CB C 17 40.000 40.000 38.380 1.620 18832
1915 1 7 . 1 1 17 17 PHE H H 17 8.787 8.787 7.336 1.451 18832
1916 1 7 . 1 1 18 18 TYR N N 18 118.210 118.210 123.585 -5.375 18832
1917 1 7 . 1 1 18 18 TYR HA H 18 4.483 4.483 4.449 0.034 18832
1918 1 7 . 1 1 18 18 TYR CA C 18 55.300 55.300 57.719 -2.419 18832
1919 1 7 . 1 1 18 18 TYR CB C 18 42.810 42.810 42.739 0.071 18832
1920 1 7 . 1 1 18 18 TYR H H 18 7.281 7.281 7.624 -0.343 18832
1921 1 7 . 1 1 19 19 ASN N N 19 116.800 116.800 120.355 -3.555 18832
1922 1 7 . 1 1 19 19 ASN HA H 19 4.710 4.710 4.783 -0.073 18832
1923 1 7 . 1 1 19 19 ASN CA C 19 52.940 52.940 52.562 0.378 18832
1924 1 7 . 1 1 19 19 ASN CB C 19 39.060 39.060 38.389 0.671 18832
1925 1 7 . 1 1 19 19 ASN H H 19 8.134 8.134 7.604 0.530 18832
1926 1 7 . 1 1 20 20 TYR N N 20 122.190 122.190 121.374 0.816 18832
1927 1 7 . 1 1 20 20 TYR HA H 20 4.687 4.687 4.612 0.075 18832
1928 1 7 . 1 1 20 20 TYR CA C 20 57.720 57.720 59.196 -1.476 18832
1929 1 7 . 1 1 20 20 TYR CB C 20 42.250 42.250 40.395 1.855 18832
1930 1 7 . 1 1 20 20 TYR H H 20 8.993 8.993 8.055 0.938 18832
1931 1 7 . 1 1 21 21 ASP N N 21 128.520 128.520 126.422 2.098 18832
1932 1 7 . 1 1 21 21 ASP HA H 21 4.790 4.790 4.848 -0.058 18832
1933 1 7 . 1 1 21 21 ASP CA C 21 52.370 52.370 52.732 -0.362 18832
1934 1 7 . 1 1 21 21 ASP CB C 21 41.130 41.130 42.542 -1.412 18832
1935 1 7 . 1 1 21 21 ASP H H 21 7.838 7.838 8.325 -0.487 18832
1936 1 7 . 1 1 22 22 ALA N N 22 125.240 125.240 126.006 -0.766 18832
1937 1 7 . 1 1 22 22 ALA HA H 22 4.051 4.051 4.418 -0.367 18832
1938 1 7 . 1 1 22 22 ALA CA C 22 52.940 52.940 53.139 -0.199 18832
1939 1 7 . 1 1 22 22 ALA CB C 22 20.450 20.450 19.474 0.976 18832
1940 1 7 . 1 1 22 22 ALA H H 22 8.103 8.103 8.562 -0.459 18832
1941 1 7 . 1 1 23 23 ARG N N 23 122.190 122.190 121.604 0.586 18832
1942 1 7 . 1 1 23 23 ARG HA H 23 4.346 4.346 4.459 -0.113 18832
1943 1 7 . 1 1 23 23 ARG CA C 23 55.490 55.490 55.720 -0.230 18832
1944 1 7 . 1 1 23 23 ARG CB C 23 30.700 30.700 30.122 0.578 18832
1945 1 7 . 1 1 23 23 ARG H H 23 8.887 8.887 8.613 0.274 18832
1946 1 7 . 1 1 24 24 GLY N N 24 105.320 105.320 106.153 -0.833 18832
1947 1 7 . 1 1 24 24 GLY CA C 24 44.500 44.500 45.082 -0.582 18832
1948 1 7 . 1 1 24 24 GLY H H 24 7.258 7.258 7.378 -0.120 18832
1949 1 7 . 1 1 25 25 ALA N N 25 122.190 122.190 121.900 0.290 18832
1950 1 7 . 1 1 25 25 ALA HA H 25 4.166 4.166 4.245 -0.079 18832
1951 1 7 . 1 1 25 25 ALA CA C 25 54.440 54.440 53.974 0.466 18832
1952 1 7 . 1 1 25 25 ALA CB C 25 18.770 18.770 19.113 -0.343 18832
1953 1 7 . 1 1 25 25 ALA H H 25 8.627 8.627 8.519 0.108 18832
1954 1 7 . 1 1 26 26 ASP N N 26 114.690 114.690 115.737 -1.047 18832
1955 1 7 . 1 1 26 26 ASP HA H 26 4.700 4.700 4.400 0.300 18832
1956 1 7 . 1 1 26 26 ASP CA C 26 53.870 53.870 56.217 -2.347 18832
1957 1 7 . 1 1 26 26 ASP CB C 26 40.390 40.390 41.144 -0.754 18832
1958 1 7 . 1 1 26 26 ASP H H 26 8.955 8.955 8.602 0.353 18832
1959 1 7 . 1 1 27 27 GLU N N 27 118.910 118.910 115.632 3.278 18832
1960 1 7 . 1 1 27 27 GLU HA H 27 5.202 5.202 4.721 0.481 18832
1961 1 7 . 1 1 27 27 GLU CA C 27 54.930 54.930 54.794 0.136 18832
1962 1 7 . 1 1 27 27 GLU CB C 27 32.880 32.880 33.117 -0.237 18832
1963 1 7 . 1 1 27 27 GLU H H 27 7.537 7.537 7.634 -0.097 18832
1964 1 7 . 1 1 28 28 LEU N N 28 121.490 121.490 121.039 0.451 18832
1965 1 7 . 1 1 28 28 LEU HA H 28 4.756 4.756 4.754 0.002 18832
1966 1 7 . 1 1 28 28 LEU CA C 28 53.120 53.120 53.805 -0.685 18832
1967 1 7 . 1 1 28 28 LEU CB C 28 44.500 44.500 44.873 -0.373 18832
1968 1 7 . 1 1 28 28 LEU H H 28 8.890 8.890 8.349 0.541 18832
1969 1 7 . 1 1 29 29 SER N N 29 115.870 115.870 118.598 -2.728 18832
1970 1 7 . 1 1 29 29 SER HA H 29 5.009 5.009 4.723 0.286 18832
1971 1 7 . 1 1 29 29 SER CA C 29 58.470 58.470 58.938 -0.468 18832
1972 1 7 . 1 1 29 29 SER CB C 29 63.690 63.690 63.855 -0.165 18832
1973 1 7 . 1 1 29 29 SER H H 29 7.948 7.948 8.438 -0.490 18832
1974 1 7 . 1 1 30 30 LEU N N 30 121.260 121.260 125.288 -4.028 18832
1975 1 7 . 1 1 30 30 LEU HA H 30 4.776 4.776 4.710 0.066 18832
1976 1 7 . 1 1 30 30 LEU CA C 30 52.940 52.940 53.976 -1.036 18832
1977 1 7 . 1 1 30 30 LEU CB C 30 46.370 46.370 45.483 0.887 18832
1978 1 7 . 1 1 30 30 LEU H H 30 9.500 9.500 8.345 1.155 18832
1979 1 7 . 1 1 31 31 GLN N N 31 123.130 123.130 119.303 3.827 18832
1980 1 7 . 1 1 31 31 GLN HA H 31 5.065 5.065 4.843 0.222 18832
1981 1 7 . 1 1 31 31 GLN CA C 31 52.940 52.940 53.687 -0.747 18832
1982 1 7 . 1 1 31 31 GLN CB C 31 31.190 31.190 32.544 -1.354 18832
1983 1 7 . 1 1 31 31 GLN H H 31 9.147 9.147 8.440 0.707 18832
1984 1 7 . 1 1 32 32 ILE N N 32 120.790 120.790 120.755 0.035 18832
1985 1 7 . 1 1 32 32 ILE HA H 32 3.032 3.032 4.123 -1.091 18832
1986 1 7 . 1 1 32 32 ILE CA C 32 64.250 64.250 63.253 0.997 18832
1987 1 7 . 1 1 32 32 ILE CB C 32 37.940 37.940 37.672 0.268 18832
1988 1 7 . 1 1 32 32 ILE H H 32 8.016 8.016 8.640 -0.624 18832
1989 1 7 . 1 1 33 33 GLY N N 33 115.870 115.870 115.503 0.367 18832
1990 1 7 . 1 1 33 33 GLY CA C 33 44.500 44.500 44.688 -0.188 18832
1991 1 7 . 1 1 33 33 GLY H H 33 8.775 8.775 8.959 -0.184 18832
1992 1 7 . 1 1 34 34 ASP N N 34 122.430 122.430 122.618 -0.188 18832
1993 1 7 . 1 1 34 34 ASP HA H 34 4.634 4.634 4.896 -0.262 18832
1994 1 7 . 1 1 34 34 ASP CA C 34 55.860 55.860 54.423 1.437 18832
1995 1 7 . 1 1 34 34 ASP CB C 34 41.310 41.310 41.894 -0.584 18832
1996 1 7 . 1 1 34 34 ASP H H 34 8.686 8.686 7.834 0.852 18832
1997 1 7 . 1 1 35 35 THR N N 35 117.980 117.980 117.350 0.630 18832
1998 1 7 . 1 1 35 35 THR HA H 35 5.154 5.154 4.898 0.256 18832
1999 1 7 . 1 1 35 35 THR CA C 35 61.450 61.450 61.946 -0.496 18832
2000 1 7 . 1 1 35 35 THR CB C 35 69.090 69.090 70.025 -0.935 18832
2001 1 7 . 1 1 35 35 THR H H 35 8.392 8.392 8.415 -0.023 18832
2002 1 7 . 1 1 36 36 VAL N N 36 118.200 118.200 117.699 0.501 18832
2003 1 7 . 1 1 36 36 VAL HA H 36 5.152 5.152 4.562 0.590 18832
2004 1 7 . 1 1 36 36 VAL CA C 36 57.910 57.910 60.140 -2.230 18832
2005 1 7 . 1 1 36 36 VAL CB C 36 34.190 34.190 34.669 -0.479 18832
2006 1 7 . 1 1 36 36 VAL H H 36 9.016 9.016 9.055 -0.039 18832
2007 1 7 . 1 1 37 37 HIS N N 37 122.190 122.190 126.681 -4.491 18832
2008 1 7 . 1 1 37 37 HIS HA H 37 4.811 4.811 4.881 -0.070 18832
2009 1 7 . 1 1 37 37 HIS CA C 37 52.560 52.560 53.945 -1.385 18832
2010 1 7 . 1 1 37 37 HIS CB C 37 31.260 31.260 30.730 0.530 18832
2011 1 7 . 1 1 37 37 HIS H H 37 8.491 8.491 8.282 0.209 18832
2012 1 7 . 1 1 38 38 ILE N N 38 126.650 126.650 127.048 -0.398 18832
2013 1 7 . 1 1 38 38 ILE HA H 38 3.750 3.750 4.165 -0.415 18832
2014 1 7 . 1 1 38 38 ILE CA C 38 61.640 61.640 59.786 1.854 18832
2015 1 7 . 1 1 38 38 ILE CB C 38 38.880 38.880 36.107 2.773 18832
2016 1 7 . 1 1 38 38 ILE H H 38 8.638 8.638 8.417 0.221 18832
2017 1 7 . 1 1 39 39 LEU N N 39 126.180 126.180 123.021 3.159 18832
2018 1 7 . 1 1 39 39 LEU HA H 39 4.380 4.380 4.852 -0.472 18832
2019 1 7 . 1 1 39 39 LEU CA C 39 55.490 55.490 54.962 0.528 18832
2020 1 7 . 1 1 39 39 LEU CB C 39 43.750 43.750 43.884 -0.134 18832
2021 1 7 . 1 1 39 39 LEU H H 39 9.163 9.163 8.892 0.271 18832
2022 1 7 . 1 1 40 40 GLU N N 40 115.160 115.160 116.878 -1.718 18832
2023 1 7 . 1 1 40 40 GLU HA H 40 5.020 5.020 5.029 -0.009 18832
2024 1 7 . 1 1 40 40 GLU CA C 40 55.090 55.090 55.728 -0.638 18832
2025 1 7 . 1 1 40 40 GLU CB C 40 35.730 35.730 34.292 1.438 18832
2026 1 7 . 1 1 40 40 GLU H H 40 7.852 7.852 7.769 0.083 18832
2027 1 7 . 1 1 41 41 THR HA H 41 4.270 4.270 4.373 -0.103 18832
2028 1 7 . 1 1 41 41 THR CA C 41 61.250 61.250 60.168 1.082 18832
2029 1 7 . 1 1 41 41 THR CB C 41 71.410 71.410 70.019 1.391 18832
2030 1 7 . 1 1 42 42 TYR HA H 42 4.550 4.550 4.344 0.206 18832
2031 1 7 . 1 1 43 43 GLU N N 43 124.100 124.100 119.843 4.257 18832
2032 1 7 . 1 1 43 43 GLU HA H 43 3.740 3.740 4.665 -0.925 18832
2033 1 7 . 1 1 43 43 GLU H H 43 8.590 8.590 8.368 0.222 18832
2034 1 7 . 1 1 44 44 GLY N N 44 110.789 110.789 110.228 0.561 18832
2035 1 7 . 1 1 44 44 GLY CA C 44 45.440 45.440 45.483 -0.043 18832
2036 1 7 . 1 1 44 44 GLY H H 44 8.432 8.432 8.579 -0.147 18832
2037 1 7 . 1 1 45 45 TRP HA H 45 4.690 4.690 4.875 -0.185 18832
2038 1 7 . 1 1 45 45 TRP CA C 45 57.550 57.550 55.953 1.597 18832
2039 1 7 . 1 1 46 46 TYR HA H 46 5.600 5.600 4.577 1.023 18832
2040 1 7 . 1 1 46 46 TYR CA C 46 54.060 54.060 55.077 -1.017 18832
2041 1 7 . 1 1 46 46 TYR CB C 46 42.650 42.650 41.196 1.454 18832
2042 1 7 . 1 1 47 47 ARG N N 47 118.100 118.100 119.411 -1.311 18832
2043 1 7 . 1 1 47 47 ARG HA H 47 5.094 5.094 5.035 0.059 18832
2044 1 7 . 1 1 47 47 ARG CA C 47 54.060 54.060 54.237 -0.177 18832
2045 1 7 . 1 1 47 47 ARG CB C 47 33.250 33.250 34.568 -1.318 18832
2046 1 7 . 1 1 47 47 ARG H H 47 8.492 8.492 8.213 0.279 18832
2047 1 7 . 1 1 48 48 GLY N N 48 114.000 114.000 111.219 2.781 18832
2048 1 7 . 1 1 48 48 GLY CA C 48 46.560 46.560 45.991 0.569 18832
2049 1 7 . 1 1 48 48 GLY H H 48 9.183 9.183 8.729 0.454 18832
2050 1 7 . 1 1 49 49 TYR N N 49 116.100 116.100 115.301 0.799 18832
2051 1 7 . 1 1 49 49 TYR HA H 49 5.373 5.373 5.443 -0.070 18832
2052 1 7 . 1 1 49 49 TYR CA C 49 55.110 55.110 55.286 -0.176 18832
2053 1 7 . 1 1 49 49 TYR CB C 49 40.750 40.750 40.711 0.039 18832
2054 1 7 . 1 1 49 49 TYR H H 49 8.194 8.194 8.224 -0.030 18832
2055 1 7 . 1 1 50 50 THR N N 50 112.350 112.350 116.466 -4.116 18832
2056 1 7 . 1 1 50 50 THR HA H 50 5.105 5.105 4.483 0.622 18832
2057 1 7 . 1 1 50 50 THR CA C 50 59.770 59.770 61.621 -1.851 18832
2058 1 7 . 1 1 50 50 THR CB C 50 69.460 69.460 69.567 -0.107 18832
2059 1 7 . 1 1 50 50 THR H H 50 9.441 9.441 8.853 0.588 18832
2060 1 7 . 1 1 51 51 LEU N N 51 121.260 121.260 122.172 -0.912 18832
2061 1 7 . 1 1 51 51 LEU HA H 51 4.236 4.236 4.004 0.232 18832
2062 1 7 . 1 1 51 51 LEU CA C 51 56.790 56.790 57.239 -0.449 18832
2063 1 7 . 1 1 51 51 LEU CB C 51 40.000 40.000 41.017 -1.017 18832
2064 1 7 . 1 1 51 51 LEU H H 51 8.310 8.310 8.081 0.229 18832
2065 1 7 . 1 1 52 52 ARG N N 52 116.570 116.570 117.581 -1.011 18832
2066 1 7 . 1 1 52 52 ARG HA H 52 4.250 4.250 4.140 0.110 18832
2067 1 7 . 1 1 52 52 ARG CA C 52 57.350 57.350 58.239 -0.889 18832
2068 1 7 . 1 1 52 52 ARG CB C 52 30.510 30.510 30.622 -0.112 18832
2069 1 7 . 1 1 52 52 ARG H H 52 8.047 8.047 8.335 -0.288 18832
2070 1 7 . 1 1 53 53 LYS N N 53 122.660 122.660 117.863 4.797 18832
2071 1 7 . 1 1 53 53 LYS HA H 53 4.616 4.616 4.598 0.018 18832
2072 1 7 . 1 1 53 53 LYS CA C 53 54.620 54.620 55.308 -0.688 18832
2073 1 7 . 1 1 53 53 LYS CB C 53 32.860 32.860 31.928 0.932 18832
2074 1 7 . 1 1 53 53 LYS H H 53 7.649 7.649 7.500 0.149 18832
2075 1 7 . 1 1 54 54 LYS N N 54 125.010 125.010 122.126 2.884 18832
2076 1 7 . 1 1 54 54 LYS HA H 54 4.090 4.090 4.319 -0.229 18832
2077 1 7 . 1 1 54 54 LYS CA C 54 58.470 58.470 59.083 -0.613 18832
2078 1 7 . 1 1 54 54 LYS CB C 54 32.130 32.130 32.094 0.036 18832
2079 1 7 . 1 1 54 54 LYS H H 54 8.496 8.496 8.584 -0.088 18832
2080 1 7 . 1 1 55 55 SER N N 55 110.240 110.240 113.748 -3.508 18832
2081 1 7 . 1 1 55 55 SER HA H 55 4.122 4.122 4.284 -0.162 18832
2082 1 7 . 1 1 55 55 SER CA C 55 58.960 58.960 60.114 -1.154 18832
2083 1 7 . 1 1 55 55 SER CB C 55 63.310 63.310 63.392 -0.082 18832
2084 1 7 . 1 1 55 55 SER H H 55 7.857 7.857 8.255 -0.398 18832
2085 1 7 . 1 1 56 56 LYS N N 56 124.070 124.070 121.673 2.397 18832
2086 1 7 . 1 1 56 56 LYS HA H 56 4.668 4.668 4.269 0.399 18832
2087 1 7 . 1 1 56 56 LYS CA C 56 54.810 54.810 56.422 -1.613 18832
2088 1 7 . 1 1 56 56 LYS CB C 56 33.250 33.250 33.390 -0.140 18832
2089 1 7 . 1 1 56 56 LYS H H 56 7.473 7.473 7.442 0.031 18832
2090 1 7 . 1 1 57 57 LYS N N 57 125.940 125.940 122.812 3.128 18832
2091 1 7 . 1 1 57 57 LYS HA H 57 5.341 5.341 5.047 0.294 18832
2092 1 7 . 1 1 57 57 LYS CA C 57 54.620 54.620 54.883 -0.263 18832
2093 1 7 . 1 1 57 57 LYS CB C 57 34.240 34.240 36.350 -2.111 18832
2094 1 7 . 1 1 57 57 LYS H H 57 8.474 8.474 8.267 0.207 18832
2095 1 7 . 1 1 58 58 GLY N N 58 109.540 109.540 110.767 -1.227 18832
2096 1 7 . 1 1 58 58 GLY CA C 58 45.620 45.620 44.514 1.106 18832
2097 1 7 . 1 1 58 58 GLY H H 58 9.075 9.075 8.694 0.381 18832
2098 1 7 . 1 1 59 59 ILE N N 59 113.900 113.900 115.001 -1.101 18832
2099 1 7 . 1 1 59 59 ILE HA H 59 6.000 6.000 4.949 1.051 18832
2100 1 7 . 1 1 59 59 ILE CA C 59 59.590 59.590 58.255 1.335 18832
2101 1 7 . 1 1 59 59 ILE CB C 59 41.140 41.140 41.665 -0.525 18832
2102 1 7 . 1 1 59 59 ILE H H 59 8.628 8.628 8.004 0.624 18832
2103 1 7 . 1 1 60 60 PHE N N 60 117.040 117.040 114.626 2.414 18832
2104 1 7 . 1 1 60 60 PHE HA H 60 5.120 5.120 5.254 -0.134 18832
2105 1 7 . 1 1 60 60 PHE CA C 60 54.060 54.060 55.097 -1.037 18832
2106 1 7 . 1 1 60 60 PHE CB C 60 37.190 37.190 38.828 -1.638 18832
2107 1 7 . 1 1 60 60 PHE H H 60 8.724 8.724 8.044 0.680 18832
2108 1 7 . 1 1 61 61 PRO HA H 61 3.480 3.480 4.645 -1.165 18832
2109 1 7 . 1 1 61 61 PRO CA C 61 62.200 62.200 62.541 -0.341 18832
2110 1 7 . 1 1 61 61 PRO CB C 61 31.190 31.190 32.518 -1.328 18832
2111 1 7 . 1 1 62 62 ALA N N 62 124.770 124.770 127.083 -2.313 18832
2112 1 7 . 1 1 62 62 ALA HA H 62 3.710 3.710 4.071 -0.361 18832
2113 1 7 . 1 1 62 62 ALA CA C 62 54.370 54.370 54.263 0.107 18832
2114 1 7 . 1 1 62 62 ALA CB C 62 17.650 17.650 18.087 -0.437 18832
2115 1 7 . 1 1 62 62 ALA H H 62 7.898 7.898 8.249 -0.351 18832
2116 1 7 . 1 1 63 63 SER N N 63 109.700 109.700 112.841 -3.141 18832
2117 1 7 . 1 1 63 63 SER HA H 63 4.200 4.200 4.274 -0.074 18832
2118 1 7 . 1 1 63 63 SER CA C 63 59.400 59.400 59.320 0.080 18832
2119 1 7 . 1 1 63 63 SER CB C 63 62.380 62.380 62.560 -0.180 18832
2120 1 7 . 1 1 63 63 SER H H 63 8.030 8.030 8.273 -0.243 18832
2121 1 7 . 1 1 64 64 TYR N N 64 120.300 120.300 118.234 2.066 18832
2122 1 7 . 1 1 64 64 TYR HA H 64 4.250 4.250 4.425 -0.175 18832
2123 1 7 . 1 1 64 64 TYR CA C 64 57.720 57.720 56.342 1.378 18832
2124 1 7 . 1 1 64 64 TYR CB C 64 37.560 37.560 38.736 -1.176 18832
2125 1 7 . 1 1 64 64 TYR H H 64 7.128 7.128 7.416 -0.288 18832
2126 1 7 . 1 1 65 65 ILE N N 65 118.000 118.000 118.386 -0.386 18832
2127 1 7 . 1 1 65 65 ILE HA H 65 4.810 4.810 4.601 0.209 18832
2128 1 7 . 1 1 65 65 ILE CA C 65 56.980 56.980 58.983 -2.003 18832
2129 1 7 . 1 1 65 65 ILE CB C 65 39.630 39.630 41.424 -1.794 18832
2130 1 7 . 1 1 65 65 ILE H H 65 7.671 7.671 7.301 0.370 18832
2131 1 7 . 1 1 66 66 HIS N N 66 124.300 124.300 124.208 0.092 18832
2132 1 7 . 1 1 66 66 HIS HA H 66 5.130 5.130 4.928 0.202 18832
2133 1 7 . 1 1 66 66 HIS CA C 66 53.060 53.060 55.244 -2.184 18832
2134 1 7 . 1 1 66 66 HIS CB C 66 30.510 30.510 33.080 -2.570 18832
2135 1 7 . 1 1 66 66 HIS H H 66 9.159 9.159 9.038 0.121 18832
2136 1 7 . 1 1 67 67 LEU N N 67 127.580 127.580 127.515 0.065 18832
2137 1 7 . 1 1 67 67 LEU HA H 67 4.570 4.570 4.207 0.363 18832
2138 1 7 . 1 1 67 67 LEU CA C 67 55.300 55.300 56.330 -1.030 18832
2139 1 7 . 1 1 67 67 LEU CB C 67 42.060 42.060 42.275 -0.215 18832
2140 1 7 . 1 1 67 67 LEU H H 67 8.992 8.992 8.509 0.483 18832
2141 1 7 . 1 1 68 68 LYS N N 68 121.900 121.900 122.461 -0.561 18832
2142 1 7 . 1 1 68 68 LYS HA H 68 4.490 4.490 4.702 -0.212 18832
2143 1 7 . 1 1 68 68 LYS CA C 68 55.110 55.110 54.245 0.865 18832
2144 1 7 . 1 1 68 68 LYS CB C 68 34.610 34.610 35.052 -0.442 18832
2145 1 7 . 1 1 68 68 LYS H H 68 8.499 8.499 8.170 0.329 18832
2146 1 7 . 1 1 69 69 GLU N N 69 122.190 122.190 121.707 0.483 18832
2147 1 7 . 1 1 69 69 GLU HA H 69 4.280 4.280 4.358 -0.078 18832
2148 1 7 . 1 1 69 69 GLU CA C 69 56.610 56.610 56.073 0.537 18832
2149 1 7 . 1 1 69 69 GLU CB C 69 30.330 30.330 28.756 1.574 18832
2150 1 7 . 1 1 69 69 GLU H H 69 8.569 8.569 8.693 -0.124 18832
2151 1 7 . 1 1 70 70 ALA N N 70 123.370 123.370 127.710 -4.340 18832
2152 1 7 . 1 1 70 70 ALA HA H 70 4.200 4.200 4.109 0.091 18832
2153 1 7 . 1 1 70 70 ALA CA C 70 51.810 51.810 52.080 -0.270 18832
2154 1 7 . 1 1 70 70 ALA CB C 70 19.700 19.700 19.366 0.334 18832
2155 1 7 . 1 1 70 70 ALA H H 70 8.181 8.181 7.686 0.495 18832
2156 1 7 . 1 1 71 71 ILE N N 71 120.080 120.080 114.320 5.760 18832
2157 1 7 . 1 1 71 71 ILE HA H 71 4.070 4.070 4.417 -0.347 18832
2158 1 7 . 1 1 71 71 ILE CA C 71 60.330 60.330 60.190 0.140 18832
2159 1 7 . 1 1 71 71 ILE CB C 71 38.690 38.690 40.160 -1.470 18832
2160 1 7 . 1 1 71 71 ILE H H 71 7.776 7.776 7.973 -0.197 18832
2161 1 7 . 1 1 72 72 VAL N N 72 124.540 124.540 118.672 5.868 18832
2162 1 7 . 1 1 72 72 VAL HA H 72 4.070 4.070 4.364 -0.294 18832
2163 1 7 . 1 1 72 72 VAL CA C 72 61.640 61.640 61.898 -0.258 18832
2164 1 7 . 1 1 72 72 VAL CB C 72 32.690 32.690 31.542 1.148 18832
2165 1 7 . 1 1 72 72 VAL H H 72 8.089 8.089 8.401 -0.312 18832
2166 1 7 . 1 1 73 73 GLU N N 73 125.940 125.940 122.308 3.632 18832
2167 1 7 . 1 1 73 73 GLU HA H 73 4.280 4.280 4.576 -0.296 18832
2168 1 7 . 1 1 73 73 GLU CA C 73 56.610 56.610 55.749 0.861 18832
2169 1 7 . 1 1 73 73 GLU CB C 73 30.710 30.710 29.090 1.621 18832
2170 1 7 . 1 1 73 73 GLU H H 73 8.464 8.464 8.213 0.251 18832
2171 1 8 . 1 1 2 2 THR N N 2 116.400 116.400 118.794 -2.394 18832
2172 1 8 . 1 1 2 2 THR HA H 2 4.120 4.120 4.189 -0.069 18832
2173 1 8 . 1 1 2 2 THR CA C 2 62.100 62.100 63.379 -1.279 18832
2174 1 8 . 1 1 2 2 THR CB C 2 69.440 69.440 69.204 0.236 18832
2175 1 8 . 1 1 2 2 THR H H 2 8.150 8.150 8.629 -0.479 18832
2176 1 8 . 1 1 3 3 ARG HA H 3 4.310 4.310 4.545 -0.235 18832
2177 1 8 . 1 1 3 3 ARG CA C 3 55.750 55.750 55.854 -0.104 18832
2178 1 8 . 1 1 3 3 ARG CB C 3 30.620 30.620 31.388 -0.768 18832
2179 1 8 . 1 1 4 4 TRP N N 4 123.300 123.300 120.765 2.535 18832
2180 1 8 . 1 1 4 4 TRP HA H 4 4.480 4.480 4.699 -0.219 18832
2181 1 8 . 1 1 4 4 TRP CA C 4 57.560 57.560 56.210 1.350 18832
2182 1 8 . 1 1 4 4 TRP CB C 4 29.490 29.490 32.138 -2.648 18832
2183 1 8 . 1 1 4 4 TRP H H 4 8.108 8.108 7.541 0.567 18832
2184 1 8 . 1 1 5 5 VAL HA H 5 4.570 4.570 4.575 -0.005 18832
2185 1 8 . 1 1 5 5 VAL CB C 5 30.840 30.840 34.731 -3.891 18832
2186 1 8 . 1 1 6 6 PRO HA H 6 4.810 4.810 4.808 0.002 18832
2187 1 8 . 1 1 6 6 PRO CB C 6 32.210 32.210 31.295 0.915 18832
2188 1 8 . 1 1 7 7 THR HA H 7 4.270 4.270 3.798 0.472 18832
2189 1 8 . 1 1 7 7 THR CA C 7 60.890 60.890 62.536 -1.646 18832
2190 1 8 . 1 1 7 7 THR CB C 7 70.140 70.140 68.799 1.341 18832
2191 1 8 . 1 1 8 8 LYS HA H 8 4.440 4.440 4.076 0.364 18832
2192 1 8 . 1 1 8 8 LYS CA C 8 55.980 55.980 57.839 -1.859 18832
2193 1 8 . 1 1 8 8 LYS CB C 8 35.050 35.050 32.887 2.163 18832
2194 1 8 . 1 1 10 10 GLU HA H 10 4.580 4.580 4.431 0.149 18832
2195 1 8 . 1 1 10 10 GLU CA C 10 55.570 55.570 55.671 -0.101 18832
2196 1 8 . 1 1 10 10 GLU CB C 10 30.780 30.780 32.167 -1.387 18832
2197 1 8 . 1 1 11 11 GLU N N 11 122.500 122.500 120.494 2.006 18832
2198 1 8 . 1 1 11 11 GLU HA H 11 4.340 4.340 4.425 -0.085 18832
2199 1 8 . 1 1 11 11 GLU CA C 11 57.140 57.140 56.171 0.969 18832
2200 1 8 . 1 1 11 11 GLU CB C 11 29.400 29.400 29.266 0.134 18832
2201 1 8 . 1 1 11 11 GLU H H 11 8.271 8.271 8.583 -0.312 18832
2202 1 8 . 1 1 12 12 LYS HA H 12 4.380 4.380 4.105 0.275 18832
2203 1 8 . 1 1 12 12 LYS CA C 12 55.790 55.790 54.893 0.897 18832
2204 1 8 . 1 1 12 12 LYS CB C 12 33.600 33.600 34.524 -0.924 18832
2205 1 8 . 1 1 13 13 TYR HA H 13 5.560 5.560 4.629 0.931 18832
2206 1 8 . 1 1 13 13 TYR CA C 13 55.860 55.860 56.339 -0.479 18832
2207 1 8 . 1 1 13 13 TYR CB C 13 42.440 42.440 40.368 2.072 18832
2208 1 8 . 1 1 14 14 GLY N N 14 105.320 105.320 106.326 -1.006 18832
2209 1 8 . 1 1 14 14 GLY CA C 14 45.240 45.240 44.798 0.442 18832
2210 1 8 . 1 1 14 14 GLY H H 14 8.401 8.401 8.675 -0.274 18832
2211 1 8 . 1 1 15 15 VAL N N 15 118.900 118.900 119.343 -0.443 18832
2212 1 8 . 1 1 15 15 VAL HA H 15 5.341 5.341 4.736 0.605 18832
2213 1 8 . 1 1 15 15 VAL CA C 15 59.210 59.210 59.736 -0.526 18832
2214 1 8 . 1 1 15 15 VAL CB C 15 35.740 35.740 35.198 0.542 18832
2215 1 8 . 1 1 15 15 VAL H H 15 8.851 8.851 8.838 0.013 18832
2216 1 8 . 1 1 16 16 ALA N N 16 129.460 129.460 128.750 0.710 18832
2217 1 8 . 1 1 16 16 ALA HA H 16 5.000 5.000 5.605 -0.605 18832
2218 1 8 . 1 1 16 16 ALA CA C 16 52.000 52.000 49.767 2.233 18832
2219 1 8 . 1 1 16 16 ALA CB C 16 19.330 19.330 21.375 -2.045 18832
2220 1 8 . 1 1 16 16 ALA H H 16 9.113 9.113 8.553 0.560 18832
2221 1 8 . 1 1 17 17 PHE N N 17 124.070 124.070 120.750 3.320 18832
2222 1 8 . 1 1 17 17 PHE HA H 17 4.801 4.801 5.134 -0.333 18832
2223 1 8 . 1 1 17 17 PHE CA C 17 56.230 56.230 55.669 0.561 18832
2224 1 8 . 1 1 17 17 PHE CB C 17 40.000 40.000 38.878 1.122 18832
2225 1 8 . 1 1 17 17 PHE H H 17 8.787 8.787 8.289 0.498 18832
2226 1 8 . 1 1 18 18 TYR N N 18 118.210 118.210 122.991 -4.781 18832
2227 1 8 . 1 1 18 18 TYR HA H 18 4.483 4.483 4.303 0.180 18832
2228 1 8 . 1 1 18 18 TYR CA C 18 55.300 55.300 57.227 -1.927 18832
2229 1 8 . 1 1 18 18 TYR CB C 18 42.810 42.810 41.958 0.852 18832
2230 1 8 . 1 1 18 18 TYR H H 18 7.281 7.281 7.739 -0.458 18832
2231 1 8 . 1 1 19 19 ASN N N 19 116.800 116.800 119.394 -2.594 18832
2232 1 8 . 1 1 19 19 ASN HA H 19 4.710 4.710 4.845 -0.135 18832
2233 1 8 . 1 1 19 19 ASN CA C 19 52.940 52.940 52.868 0.071 18832
2234 1 8 . 1 1 19 19 ASN CB C 19 39.060 39.060 38.636 0.424 18832
2235 1 8 . 1 1 19 19 ASN H H 19 8.134 8.134 8.363 -0.229 18832
2236 1 8 . 1 1 20 20 TYR N N 20 122.190 122.190 122.565 -0.375 18832
2237 1 8 . 1 1 20 20 TYR HA H 20 4.687 4.687 4.567 0.120 18832
2238 1 8 . 1 1 20 20 TYR CA C 20 57.720 57.720 57.728 -0.008 18832
2239 1 8 . 1 1 20 20 TYR CB C 20 42.250 42.250 39.923 2.326 18832
2240 1 8 . 1 1 20 20 TYR H H 20 8.993 8.993 7.918 1.075 18832
2241 1 8 . 1 1 21 21 ASP N N 21 128.520 128.520 126.311 2.209 18832
2242 1 8 . 1 1 21 21 ASP HA H 21 4.790 4.790 4.653 0.137 18832
2243 1 8 . 1 1 21 21 ASP CA C 21 52.370 52.370 52.522 -0.152 18832
2244 1 8 . 1 1 21 21 ASP CB C 21 41.130 41.130 42.383 -1.253 18832
2245 1 8 . 1 1 21 21 ASP H H 21 7.838 7.838 8.219 -0.381 18832
2246 1 8 . 1 1 22 22 ALA N N 22 125.240 125.240 127.177 -1.937 18832
2247 1 8 . 1 1 22 22 ALA HA H 22 4.051 4.051 4.141 -0.090 18832
2248 1 8 . 1 1 22 22 ALA CA C 22 52.940 52.940 52.399 0.541 18832
2249 1 8 . 1 1 22 22 ALA CB C 22 20.450 20.450 19.951 0.499 18832
2250 1 8 . 1 1 22 22 ALA H H 22 8.103 8.103 8.560 -0.457 18832
2251 1 8 . 1 1 23 23 ARG N N 23 122.190 122.190 121.647 0.543 18832
2252 1 8 . 1 1 23 23 ARG HA H 23 4.346 4.346 4.286 0.060 18832
2253 1 8 . 1 1 23 23 ARG CA C 23 55.490 55.490 56.474 -0.983 18832
2254 1 8 . 1 1 23 23 ARG CB C 23 30.700 30.700 30.819 -0.119 18832
2255 1 8 . 1 1 23 23 ARG H H 23 8.887 8.887 8.705 0.182 18832
2256 1 8 . 1 1 24 24 GLY N N 24 105.320 105.320 105.823 -0.503 18832
2257 1 8 . 1 1 24 24 GLY CA C 24 44.500 44.500 44.714 -0.214 18832
2258 1 8 . 1 1 24 24 GLY H H 24 7.258 7.258 7.535 -0.277 18832
2259 1 8 . 1 1 25 25 ALA N N 25 122.190 122.190 121.740 0.450 18832
2260 1 8 . 1 1 25 25 ALA HA H 25 4.166 4.166 4.296 -0.130 18832
2261 1 8 . 1 1 25 25 ALA CA C 25 54.440 54.440 53.704 0.736 18832
2262 1 8 . 1 1 25 25 ALA CB C 25 18.770 18.770 19.180 -0.410 18832
2263 1 8 . 1 1 25 25 ALA H H 25 8.627 8.627 8.362 0.265 18832
2264 1 8 . 1 1 26 26 ASP N N 26 114.690 114.690 116.771 -2.081 18832
2265 1 8 . 1 1 26 26 ASP HA H 26 4.700 4.700 4.477 0.223 18832
2266 1 8 . 1 1 26 26 ASP CA C 26 53.870 53.870 55.984 -2.114 18832
2267 1 8 . 1 1 26 26 ASP CB C 26 40.390 40.390 41.088 -0.698 18832
2268 1 8 . 1 1 26 26 ASP H H 26 8.955 8.955 8.570 0.385 18832
2269 1 8 . 1 1 27 27 GLU N N 27 118.910 118.910 116.151 2.759 18832
2270 1 8 . 1 1 27 27 GLU HA H 27 5.202 5.202 4.773 0.429 18832
2271 1 8 . 1 1 27 27 GLU CA C 27 54.930 54.930 55.488 -0.558 18832
2272 1 8 . 1 1 27 27 GLU CB C 27 32.880 32.880 32.886 -0.006 18832
2273 1 8 . 1 1 27 27 GLU H H 27 7.537 7.537 7.490 0.047 18832
2274 1 8 . 1 1 28 28 LEU N N 28 121.490 121.490 120.323 1.167 18832
2275 1 8 . 1 1 28 28 LEU HA H 28 4.756 4.756 4.723 0.033 18832
2276 1 8 . 1 1 28 28 LEU CA C 28 53.120 53.120 54.071 -0.951 18832
2277 1 8 . 1 1 28 28 LEU CB C 28 44.500 44.500 44.866 -0.366 18832
2278 1 8 . 1 1 28 28 LEU H H 28 8.890 8.890 8.704 0.186 18832
2279 1 8 . 1 1 29 29 SER N N 29 115.870 115.870 120.015 -4.145 18832
2280 1 8 . 1 1 29 29 SER HA H 29 5.009 5.009 4.364 0.645 18832
2281 1 8 . 1 1 29 29 SER CA C 29 58.470 58.470 59.208 -0.738 18832
2282 1 8 . 1 1 29 29 SER CB C 29 63.690 63.690 63.500 0.190 18832
2283 1 8 . 1 1 29 29 SER H H 29 7.948 7.948 8.458 -0.510 18832
2284 1 8 . 1 1 30 30 LEU N N 30 121.260 121.260 127.185 -5.925 18832
2285 1 8 . 1 1 30 30 LEU HA H 30 4.776 4.776 4.818 -0.042 18832
2286 1 8 . 1 1 30 30 LEU CA C 30 52.940 52.940 53.838 -0.898 18832
2287 1 8 . 1 1 30 30 LEU CB C 30 46.370 46.370 44.556 1.814 18832
2288 1 8 . 1 1 30 30 LEU H H 30 9.500 9.500 8.076 1.424 18832
2289 1 8 . 1 1 31 31 GLN N N 31 123.130 123.130 120.459 2.671 18832
2290 1 8 . 1 1 31 31 GLN HA H 31 5.065 5.065 5.127 -0.062 18832
2291 1 8 . 1 1 31 31 GLN CA C 31 52.940 52.940 53.924 -0.984 18832
2292 1 8 . 1 1 31 31 GLN CB C 31 31.190 31.190 32.881 -1.691 18832
2293 1 8 . 1 1 31 31 GLN H H 31 9.147 9.147 8.525 0.622 18832
2294 1 8 . 1 1 32 32 ILE N N 32 120.790 120.790 121.282 -0.492 18832
2295 1 8 . 1 1 32 32 ILE HA H 32 3.032 3.032 4.109 -1.077 18832
2296 1 8 . 1 1 32 32 ILE CA C 32 64.250 64.250 63.072 1.178 18832
2297 1 8 . 1 1 32 32 ILE CB C 32 37.940 37.940 37.884 0.056 18832
2298 1 8 . 1 1 32 32 ILE H H 32 8.016 8.016 8.349 -0.333 18832
2299 1 8 . 1 1 33 33 GLY N N 33 115.870 115.870 115.216 0.654 18832
2300 1 8 . 1 1 33 33 GLY CA C 33 44.500 44.500 44.808 -0.308 18832
2301 1 8 . 1 1 33 33 GLY H H 33 8.775 8.775 9.011 -0.236 18832
2302 1 8 . 1 1 34 34 ASP N N 34 122.430 122.430 122.693 -0.263 18832
2303 1 8 . 1 1 34 34 ASP HA H 34 4.634 4.634 4.954 -0.320 18832
2304 1 8 . 1 1 34 34 ASP CA C 34 55.860 55.860 53.825 2.035 18832
2305 1 8 . 1 1 34 34 ASP CB C 34 41.310 41.310 41.873 -0.563 18832
2306 1 8 . 1 1 34 34 ASP H H 34 8.686 8.686 7.783 0.903 18832
2307 1 8 . 1 1 35 35 THR N N 35 117.980 117.980 118.630 -0.650 18832
2308 1 8 . 1 1 35 35 THR HA H 35 5.154 5.154 4.995 0.159 18832
2309 1 8 . 1 1 35 35 THR CA C 35 61.450 61.450 62.382 -0.931 18832
2310 1 8 . 1 1 35 35 THR CB C 35 69.090 69.090 69.948 -0.858 18832
2311 1 8 . 1 1 35 35 THR H H 35 8.392 8.392 8.591 -0.199 18832
2312 1 8 . 1 1 36 36 VAL N N 36 118.200 118.200 118.157 0.043 18832
2313 1 8 . 1 1 36 36 VAL HA H 36 5.152 5.152 4.571 0.581 18832
2314 1 8 . 1 1 36 36 VAL CA C 36 57.910 57.910 59.699 -1.789 18832
2315 1 8 . 1 1 36 36 VAL CB C 36 34.190 34.190 35.279 -1.089 18832
2316 1 8 . 1 1 36 36 VAL H H 36 9.016 9.016 8.978 0.038 18832
2317 1 8 . 1 1 37 37 HIS N N 37 122.190 122.190 123.877 -1.687 18832
2318 1 8 . 1 1 37 37 HIS HA H 37 4.811 4.811 4.813 -0.002 18832
2319 1 8 . 1 1 37 37 HIS CA C 37 52.560 52.560 54.051 -1.491 18832
2320 1 8 . 1 1 37 37 HIS CB C 37 31.260 31.260 30.128 1.132 18832
2321 1 8 . 1 1 37 37 HIS H H 37 8.491 8.491 8.148 0.343 18832
2322 1 8 . 1 1 38 38 ILE N N 38 126.650 126.650 126.006 0.644 18832
2323 1 8 . 1 1 38 38 ILE HA H 38 3.750 3.750 3.894 -0.144 18832
2324 1 8 . 1 1 38 38 ILE CA C 38 61.640 61.640 62.776 -1.136 18832
2325 1 8 . 1 1 38 38 ILE CB C 38 38.880 38.880 37.367 1.513 18832
2326 1 8 . 1 1 38 38 ILE H H 38 8.638 8.638 8.801 -0.163 18832
2327 1 8 . 1 1 39 39 LEU N N 39 126.180 126.180 128.226 -2.046 18832
2328 1 8 . 1 1 39 39 LEU HA H 39 4.380 4.380 4.497 -0.117 18832
2329 1 8 . 1 1 39 39 LEU CA C 39 55.490 55.490 55.706 -0.216 18832
2330 1 8 . 1 1 39 39 LEU CB C 39 43.750 43.750 43.919 -0.169 18832
2331 1 8 . 1 1 39 39 LEU H H 39 9.163 9.163 8.867 0.296 18832
2332 1 8 . 1 1 40 40 GLU N N 40 115.160 115.160 115.928 -0.768 18832
2333 1 8 . 1 1 40 40 GLU HA H 40 5.020 5.020 4.801 0.219 18832
2334 1 8 . 1 1 40 40 GLU CA C 40 55.090 55.090 55.358 -0.269 18832
2335 1 8 . 1 1 40 40 GLU CB C 40 35.730 35.730 34.205 1.525 18832
2336 1 8 . 1 1 40 40 GLU H H 40 7.852 7.852 8.285 -0.433 18832
2337 1 8 . 1 1 41 41 THR HA H 41 4.270 4.270 4.352 -0.082 18832
2338 1 8 . 1 1 41 41 THR CA C 41 61.250 61.250 58.995 2.256 18832
2339 1 8 . 1 1 41 41 THR CB C 41 71.410 71.410 70.002 1.408 18832
2340 1 8 . 1 1 42 42 TYR HA H 42 4.550 4.550 4.346 0.204 18832
2341 1 8 . 1 1 43 43 GLU N N 43 124.100 124.100 119.040 5.060 18832
2342 1 8 . 1 1 43 43 GLU HA H 43 3.740 3.740 4.505 -0.765 18832
2343 1 8 . 1 1 43 43 GLU H H 43 8.590 8.590 8.360 0.230 18832
2344 1 8 . 1 1 44 44 GLY N N 44 110.789 110.789 108.513 2.276 18832
2345 1 8 . 1 1 44 44 GLY CA C 44 45.440 45.440 44.814 0.626 18832
2346 1 8 . 1 1 44 44 GLY H H 44 8.432 8.432 8.119 0.313 18832
2347 1 8 . 1 1 45 45 TRP HA H 45 4.690 4.690 4.648 0.042 18832
2348 1 8 . 1 1 45 45 TRP CA C 45 57.550 57.550 56.358 1.192 18832
2349 1 8 . 1 1 46 46 TYR HA H 46 5.600 5.600 4.644 0.956 18832
2350 1 8 . 1 1 46 46 TYR CA C 46 54.060 54.060 54.800 -0.740 18832
2351 1 8 . 1 1 46 46 TYR CB C 46 42.650 42.650 41.579 1.071 18832
2352 1 8 . 1 1 47 47 ARG N N 47 118.100 118.100 121.507 -3.407 18832
2353 1 8 . 1 1 47 47 ARG HA H 47 5.094 5.094 4.935 0.159 18832
2354 1 8 . 1 1 47 47 ARG CA C 47 54.060 54.060 54.531 -0.471 18832
2355 1 8 . 1 1 47 47 ARG CB C 47 33.250 33.250 33.883 -0.633 18832
2356 1 8 . 1 1 47 47 ARG H H 47 8.492 8.492 8.732 -0.240 18832
2357 1 8 . 1 1 48 48 GLY N N 48 114.000 114.000 113.071 0.929 18832
2358 1 8 . 1 1 48 48 GLY CA C 48 46.560 46.560 45.213 1.347 18832
2359 1 8 . 1 1 48 48 GLY H H 48 9.183 9.183 8.917 0.266 18832
2360 1 8 . 1 1 49 49 TYR N N 49 116.100 116.100 115.102 0.998 18832
2361 1 8 . 1 1 49 49 TYR HA H 49 5.373 5.373 5.275 0.098 18832
2362 1 8 . 1 1 49 49 TYR CA C 49 55.110 55.110 55.743 -0.633 18832
2363 1 8 . 1 1 49 49 TYR CB C 49 40.750 40.750 40.340 0.410 18832
2364 1 8 . 1 1 49 49 TYR H H 49 8.194 8.194 8.090 0.104 18832
2365 1 8 . 1 1 50 50 THR N N 50 112.350 112.350 116.849 -4.499 18832
2366 1 8 . 1 1 50 50 THR HA H 50 5.105 5.105 4.403 0.702 18832
2367 1 8 . 1 1 50 50 THR CA C 50 59.770 59.770 61.804 -2.034 18832
2368 1 8 . 1 1 50 50 THR CB C 50 69.460 69.460 69.819 -0.359 18832
2369 1 8 . 1 1 50 50 THR H H 50 9.441 9.441 8.754 0.687 18832
2370 1 8 . 1 1 51 51 LEU N N 51 121.260 121.260 120.694 0.566 18832
2371 1 8 . 1 1 51 51 LEU HA H 51 4.236 4.236 3.970 0.266 18832
2372 1 8 . 1 1 51 51 LEU CA C 51 56.790 56.790 56.800 -0.010 18832
2373 1 8 . 1 1 51 51 LEU CB C 51 40.000 40.000 40.876 -0.876 18832
2374 1 8 . 1 1 51 51 LEU H H 51 8.310 8.310 7.843 0.467 18832
2375 1 8 . 1 1 52 52 ARG N N 52 116.570 116.570 118.937 -2.367 18832
2376 1 8 . 1 1 52 52 ARG HA H 52 4.250 4.250 4.088 0.162 18832
2377 1 8 . 1 1 52 52 ARG CA C 52 57.350 57.350 58.432 -1.082 18832
2378 1 8 . 1 1 52 52 ARG CB C 52 30.510 30.510 30.421 0.089 18832
2379 1 8 . 1 1 52 52 ARG H H 52 8.047 8.047 8.463 -0.416 18832
2380 1 8 . 1 1 53 53 LYS N N 53 122.660 122.660 116.227 6.433 18832
2381 1 8 . 1 1 53 53 LYS HA H 53 4.616 4.616 4.556 0.060 18832
2382 1 8 . 1 1 53 53 LYS CA C 53 54.620 54.620 55.223 -0.603 18832
2383 1 8 . 1 1 53 53 LYS CB C 53 32.860 32.860 32.117 0.743 18832
2384 1 8 . 1 1 53 53 LYS H H 53 7.649 7.649 7.941 -0.292 18832
2385 1 8 . 1 1 54 54 LYS N N 54 125.010 125.010 121.685 3.325 18832
2386 1 8 . 1 1 54 54 LYS HA H 54 4.090 4.090 4.316 -0.226 18832
2387 1 8 . 1 1 54 54 LYS CA C 54 58.470 58.470 58.597 -0.127 18832
2388 1 8 . 1 1 54 54 LYS CB C 54 32.130 32.130 32.395 -0.265 18832
2389 1 8 . 1 1 54 54 LYS H H 54 8.496 8.496 8.463 0.033 18832
2390 1 8 . 1 1 55 55 SER N N 55 110.240 110.240 114.703 -4.463 18832
2391 1 8 . 1 1 55 55 SER HA H 55 4.122 4.122 4.214 -0.092 18832
2392 1 8 . 1 1 55 55 SER CA C 55 58.960 58.960 60.374 -1.414 18832
2393 1 8 . 1 1 55 55 SER CB C 55 63.310 63.310 63.442 -0.132 18832
2394 1 8 . 1 1 55 55 SER H H 55 7.857 7.857 8.137 -0.280 18832
2395 1 8 . 1 1 56 56 LYS N N 56 124.070 124.070 120.424 3.646 18832
2396 1 8 . 1 1 56 56 LYS HA H 56 4.668 4.668 4.234 0.434 18832
2397 1 8 . 1 1 56 56 LYS CA C 56 54.810 54.810 56.754 -1.944 18832
2398 1 8 . 1 1 56 56 LYS CB C 56 33.250 33.250 33.042 0.208 18832
2399 1 8 . 1 1 56 56 LYS H H 56 7.473 7.473 8.048 -0.575 18832
2400 1 8 . 1 1 57 57 LYS N N 57 125.940 125.940 122.792 3.148 18832
2401 1 8 . 1 1 57 57 LYS HA H 57 5.341 5.341 4.647 0.694 18832
2402 1 8 . 1 1 57 57 LYS CA C 57 54.620 54.620 55.197 -0.577 18832
2403 1 8 . 1 1 57 57 LYS CB C 57 34.240 34.240 35.680 -1.440 18832
2404 1 8 . 1 1 57 57 LYS H H 57 8.474 8.474 8.193 0.281 18832
2405 1 8 . 1 1 58 58 GLY N N 58 109.540 109.540 107.124 2.416 18832
2406 1 8 . 1 1 58 58 GLY CA C 58 45.620 45.620 45.105 0.515 18832
2407 1 8 . 1 1 58 58 GLY H H 58 9.075 9.075 8.748 0.327 18832
2408 1 8 . 1 1 59 59 ILE N N 59 113.900 113.900 115.462 -1.562 18832
2409 1 8 . 1 1 59 59 ILE HA H 59 6.000 6.000 4.985 1.015 18832
2410 1 8 . 1 1 59 59 ILE CA C 59 59.590 59.590 59.085 0.505 18832
2411 1 8 . 1 1 59 59 ILE CB C 59 41.140 41.140 41.196 -0.056 18832
2412 1 8 . 1 1 59 59 ILE H H 59 8.628 8.628 8.185 0.443 18832
2413 1 8 . 1 1 60 60 PHE N N 60 117.040 117.040 116.985 0.055 18832
2414 1 8 . 1 1 60 60 PHE HA H 60 5.120 5.120 5.543 -0.423 18832
2415 1 8 . 1 1 60 60 PHE CA C 60 54.060 54.060 54.779 -0.719 18832
2416 1 8 . 1 1 60 60 PHE CB C 60 37.190 37.190 40.196 -3.006 18832
2417 1 8 . 1 1 60 60 PHE H H 60 8.724 8.724 8.585 0.139 18832
2418 1 8 . 1 1 61 61 PRO HA H 61 3.480 3.480 4.604 -1.124 18832
2419 1 8 . 1 1 61 61 PRO CA C 61 62.200 62.200 62.001 0.199 18832
2420 1 8 . 1 1 61 61 PRO CB C 61 31.190 31.190 32.372 -1.182 18832
2421 1 8 . 1 1 62 62 ALA N N 62 124.770 124.770 127.396 -2.626 18832
2422 1 8 . 1 1 62 62 ALA HA H 62 3.710 3.710 4.005 -0.295 18832
2423 1 8 . 1 1 62 62 ALA CA C 62 54.370 54.370 54.158 0.212 18832
2424 1 8 . 1 1 62 62 ALA CB C 62 17.650 17.650 18.347 -0.697 18832
2425 1 8 . 1 1 62 62 ALA H H 62 7.898 7.898 8.118 -0.220 18832
2426 1 8 . 1 1 63 63 SER N N 63 109.700 109.700 114.355 -4.655 18832
2427 1 8 . 1 1 63 63 SER HA H 63 4.200 4.200 4.167 0.033 18832
2428 1 8 . 1 1 63 63 SER CA C 63 59.400 59.400 60.787 -1.387 18832
2429 1 8 . 1 1 63 63 SER CB C 63 62.380 62.380 62.884 -0.504 18832
2430 1 8 . 1 1 63 63 SER H H 63 8.030 8.030 8.305 -0.275 18832
2431 1 8 . 1 1 64 64 TYR N N 64 120.300 120.300 113.402 6.898 18832
2432 1 8 . 1 1 64 64 TYR HA H 64 4.250 4.250 4.294 -0.044 18832
2433 1 8 . 1 1 64 64 TYR CA C 64 57.720 57.720 54.737 2.983 18832
2434 1 8 . 1 1 64 64 TYR CB C 64 37.560 37.560 37.396 0.164 18832
2435 1 8 . 1 1 64 64 TYR H H 64 7.128 7.128 6.964 0.164 18832
2436 1 8 . 1 1 65 65 ILE N N 65 118.000 118.000 121.955 -3.955 18832
2437 1 8 . 1 1 65 65 ILE HA H 65 4.810 4.810 5.046 -0.236 18832
2438 1 8 . 1 1 65 65 ILE CA C 65 56.980 56.980 59.177 -2.197 18832
2439 1 8 . 1 1 65 65 ILE CB C 65 39.630 39.630 39.302 0.328 18832
2440 1 8 . 1 1 65 65 ILE H H 65 7.671 7.671 7.430 0.241 18832
2441 1 8 . 1 1 66 66 HIS N N 66 124.300 124.300 127.515 -3.215 18832
2442 1 8 . 1 1 66 66 HIS HA H 66 5.130 5.130 4.942 0.188 18832
2443 1 8 . 1 1 66 66 HIS CA C 66 53.060 53.060 54.690 -1.630 18832
2444 1 8 . 1 1 66 66 HIS CB C 66 30.510 30.510 32.674 -2.164 18832
2445 1 8 . 1 1 66 66 HIS H H 66 9.159 9.159 9.162 -0.003 18832
2446 1 8 . 1 1 67 67 LEU N N 67 127.580 127.580 128.873 -1.293 18832
2447 1 8 . 1 1 67 67 LEU HA H 67 4.570 4.570 4.340 0.230 18832
2448 1 8 . 1 1 67 67 LEU CA C 67 55.300 55.300 56.104 -0.804 18832
2449 1 8 . 1 1 67 67 LEU CB C 67 42.060 42.060 41.755 0.305 18832
2450 1 8 . 1 1 67 67 LEU H H 67 8.992 8.992 8.484 0.508 18832
2451 1 8 . 1 1 68 68 LYS N N 68 121.900 121.900 123.226 -1.326 18832
2452 1 8 . 1 1 68 68 LYS HA H 68 4.490 4.490 4.444 0.046 18832
2453 1 8 . 1 1 68 68 LYS CA C 68 55.110 55.110 55.397 -0.287 18832
2454 1 8 . 1 1 68 68 LYS CB C 68 34.610 34.610 33.157 1.453 18832
2455 1 8 . 1 1 68 68 LYS H H 68 8.499 8.499 8.304 0.195 18832
2456 1 8 . 1 1 69 69 GLU N N 69 122.190 122.190 119.371 2.819 18832
2457 1 8 . 1 1 69 69 GLU HA H 69 4.280 4.280 4.172 0.108 18832
2458 1 8 . 1 1 69 69 GLU CA C 69 56.610 56.610 56.159 0.451 18832
2459 1 8 . 1 1 69 69 GLU CB C 69 30.330 30.330 29.726 0.604 18832
2460 1 8 . 1 1 69 69 GLU H H 69 8.569 8.569 8.705 -0.136 18832
2461 1 8 . 1 1 70 70 ALA N N 70 123.370 123.370 120.931 2.439 18832
2462 1 8 . 1 1 70 70 ALA HA H 70 4.200 4.200 3.912 0.288 18832
2463 1 8 . 1 1 70 70 ALA CA C 70 51.810 51.810 52.349 -0.539 18832
2464 1 8 . 1 1 70 70 ALA CB C 70 19.700 19.700 17.744 1.956 18832
2465 1 8 . 1 1 70 70 ALA H H 70 8.181 8.181 7.991 0.190 18832
2466 1 8 . 1 1 71 71 ILE N N 71 120.080 120.080 118.377 1.703 18832
2467 1 8 . 1 1 71 71 ILE HA H 71 4.070 4.070 4.470 -0.400 18832
2468 1 8 . 1 1 71 71 ILE CA C 71 60.330 60.330 60.516 -0.186 18832
2469 1 8 . 1 1 71 71 ILE CB C 71 38.690 38.690 39.164 -0.474 18832
2470 1 8 . 1 1 71 71 ILE H H 71 7.776 7.776 7.926 -0.150 18832
2471 1 8 . 1 1 72 72 VAL N N 72 124.540 124.540 127.583 -3.043 18832
2472 1 8 . 1 1 72 72 VAL HA H 72 4.070 4.070 4.338 -0.268 18832
2473 1 8 . 1 1 72 72 VAL CA C 72 61.640 61.640 62.084 -0.444 18832
2474 1 8 . 1 1 72 72 VAL CB C 72 32.690 32.690 32.488 0.202 18832
2475 1 8 . 1 1 72 72 VAL H H 72 8.089 8.089 8.590 -0.501 18832
2476 1 8 . 1 1 73 73 GLU N N 73 125.940 125.940 129.045 -3.105 18832
2477 1 8 . 1 1 73 73 GLU HA H 73 4.280 4.280 4.442 -0.162 18832
2478 1 8 . 1 1 73 73 GLU CA C 73 56.610 56.610 56.045 0.565 18832
2479 1 8 . 1 1 73 73 GLU CB C 73 30.710 30.710 28.953 1.757 18832
2480 1 8 . 1 1 73 73 GLU H H 73 8.464 8.464 8.937 -0.473 18832
2481 1 9 . 1 1 2 2 THR N N 2 116.400 116.400 113.623 2.777 18832
2482 1 9 . 1 1 2 2 THR HA H 2 4.120 4.120 4.588 -0.468 18832
2483 1 9 . 1 1 2 2 THR CA C 2 62.100 62.100 61.868 0.232 18832
2484 1 9 . 1 1 2 2 THR CB C 2 69.440 69.440 70.549 -1.109 18832
2485 1 9 . 1 1 2 2 THR H H 2 8.150 8.150 8.194 -0.044 18832
2486 1 9 . 1 1 3 3 ARG HA H 3 4.310 4.310 4.170 0.140 18832
2487 1 9 . 1 1 3 3 ARG CA C 3 55.750 55.750 56.762 -1.012 18832
2488 1 9 . 1 1 3 3 ARG CB C 3 30.620 30.620 29.638 0.982 18832
2489 1 9 . 1 1 4 4 TRP N N 4 123.300 123.300 124.949 -1.649 18832
2490 1 9 . 1 1 4 4 TRP HA H 4 4.480 4.480 4.576 -0.096 18832
2491 1 9 . 1 1 4 4 TRP CA C 4 57.560 57.560 56.417 1.143 18832
2492 1 9 . 1 1 4 4 TRP CB C 4 29.490 29.490 30.279 -0.789 18832
2493 1 9 . 1 1 4 4 TRP H H 4 8.108 8.108 8.151 -0.043 18832
2494 1 9 . 1 1 5 5 VAL HA H 5 4.570 4.570 4.522 0.048 18832
2495 1 9 . 1 1 5 5 VAL CB C 5 30.840 30.840 34.624 -3.784 18832
2496 1 9 . 1 1 6 6 PRO HA H 6 4.810 4.810 4.714 0.096 18832
2497 1 9 . 1 1 6 6 PRO CB C 6 32.210 32.210 31.472 0.738 18832
2498 1 9 . 1 1 7 7 THR HA H 7 4.270 4.270 3.866 0.404 18832
2499 1 9 . 1 1 7 7 THR CA C 7 60.890 60.890 63.163 -2.273 18832
2500 1 9 . 1 1 7 7 THR CB C 7 70.140 70.140 68.751 1.389 18832
2501 1 9 . 1 1 8 8 LYS HA H 8 4.440 4.440 4.445 -0.005 18832
2502 1 9 . 1 1 8 8 LYS CA C 8 55.980 55.980 55.959 0.021 18832
2503 1 9 . 1 1 8 8 LYS CB C 8 35.050 35.050 31.546 3.504 18832
2504 1 9 . 1 1 10 10 GLU HA H 10 4.580 4.580 4.189 0.391 18832
2505 1 9 . 1 1 10 10 GLU CA C 10 55.570 55.570 56.792 -1.222 18832
2506 1 9 . 1 1 10 10 GLU CB C 10 30.780 30.780 30.547 0.233 18832
2507 1 9 . 1 1 11 11 GLU N N 11 122.500 122.500 115.942 6.558 18832
2508 1 9 . 1 1 11 11 GLU HA H 11 4.340 4.340 4.030 0.310 18832
2509 1 9 . 1 1 11 11 GLU CA C 11 57.140 57.140 57.537 -0.397 18832
2510 1 9 . 1 1 11 11 GLU CB C 11 29.400 29.400 27.425 1.975 18832
2511 1 9 . 1 1 11 11 GLU H H 11 8.271 8.271 8.462 -0.191 18832
2512 1 9 . 1 1 12 12 LYS HA H 12 4.380 4.380 4.264 0.116 18832
2513 1 9 . 1 1 12 12 LYS CA C 12 55.790 55.790 54.617 1.173 18832
2514 1 9 . 1 1 12 12 LYS CB C 12 33.600 33.600 35.914 -2.314 18832
2515 1 9 . 1 1 13 13 TYR HA H 13 5.560 5.560 5.072 0.488 18832
2516 1 9 . 1 1 13 13 TYR CA C 13 55.860 55.860 55.877 -0.017 18832
2517 1 9 . 1 1 13 13 TYR CB C 13 42.440 42.440 39.609 2.831 18832
2518 1 9 . 1 1 14 14 GLY N N 14 105.320 105.320 105.425 -0.105 18832
2519 1 9 . 1 1 14 14 GLY CA C 14 45.240 45.240 45.290 -0.050 18832
2520 1 9 . 1 1 14 14 GLY H H 14 8.401 8.401 8.402 -0.001 18832
2521 1 9 . 1 1 15 15 VAL N N 15 118.900 118.900 118.943 -0.043 18832
2522 1 9 . 1 1 15 15 VAL HA H 15 5.341 5.341 4.625 0.716 18832
2523 1 9 . 1 1 15 15 VAL CA C 15 59.210 59.210 60.885 -1.675 18832
2524 1 9 . 1 1 15 15 VAL CB C 15 35.740 35.740 34.264 1.476 18832
2525 1 9 . 1 1 15 15 VAL H H 15 8.851 8.851 8.887 -0.036 18832
2526 1 9 . 1 1 16 16 ALA N N 16 129.460 129.460 125.351 4.109 18832
2527 1 9 . 1 1 16 16 ALA HA H 16 5.000 5.000 4.779 0.221 18832
2528 1 9 . 1 1 16 16 ALA CA C 16 52.000 52.000 50.433 1.567 18832
2529 1 9 . 1 1 16 16 ALA CB C 16 19.330 19.330 20.834 -1.504 18832
2530 1 9 . 1 1 16 16 ALA H H 16 9.113 9.113 8.658 0.455 18832
2531 1 9 . 1 1 17 17 PHE N N 17 124.070 124.070 121.932 2.138 18832
2532 1 9 . 1 1 17 17 PHE HA H 17 4.801 4.801 5.059 -0.258 18832
2533 1 9 . 1 1 17 17 PHE CA C 17 56.230 56.230 55.989 0.241 18832
2534 1 9 . 1 1 17 17 PHE CB C 17 40.000 40.000 38.310 1.690 18832
2535 1 9 . 1 1 17 17 PHE H H 17 8.787 8.787 7.470 1.317 18832
2536 1 9 . 1 1 18 18 TYR N N 18 118.210 118.210 124.252 -6.042 18832
2537 1 9 . 1 1 18 18 TYR HA H 18 4.483 4.483 4.471 0.012 18832
2538 1 9 . 1 1 18 18 TYR CA C 18 55.300 55.300 57.863 -2.563 18832
2539 1 9 . 1 1 18 18 TYR CB C 18 42.810 42.810 42.966 -0.156 18832
2540 1 9 . 1 1 18 18 TYR H H 18 7.281 7.281 7.592 -0.311 18832
2541 1 9 . 1 1 19 19 ASN N N 19 116.800 116.800 120.110 -3.310 18832
2542 1 9 . 1 1 19 19 ASN HA H 19 4.710 4.710 4.765 -0.055 18832
2543 1 9 . 1 1 19 19 ASN CA C 19 52.940 52.940 52.475 0.465 18832
2544 1 9 . 1 1 19 19 ASN CB C 19 39.060 39.060 38.401 0.659 18832
2545 1 9 . 1 1 19 19 ASN H H 19 8.134 8.134 7.608 0.526 18832
2546 1 9 . 1 1 20 20 TYR N N 20 122.190 122.190 122.335 -0.145 18832
2547 1 9 . 1 1 20 20 TYR HA H 20 4.687 4.687 4.565 0.122 18832
2548 1 9 . 1 1 20 20 TYR CA C 20 57.720 57.720 59.164 -1.444 18832
2549 1 9 . 1 1 20 20 TYR CB C 20 42.250 42.250 40.210 2.040 18832
2550 1 9 . 1 1 20 20 TYR H H 20 8.993 8.993 8.091 0.902 18832
2551 1 9 . 1 1 21 21 ASP N N 21 128.520 128.520 127.665 0.855 18832
2552 1 9 . 1 1 21 21 ASP HA H 21 4.790 4.790 4.834 -0.044 18832
2553 1 9 . 1 1 21 21 ASP CA C 21 52.370 52.370 53.135 -0.765 18832
2554 1 9 . 1 1 21 21 ASP CB C 21 41.130 41.130 41.634 -0.504 18832
2555 1 9 . 1 1 21 21 ASP H H 21 7.838 7.838 8.278 -0.440 18832
2556 1 9 . 1 1 22 22 ALA N N 22 125.240 125.240 126.205 -0.965 18832
2557 1 9 . 1 1 22 22 ALA HA H 22 4.051 4.051 4.489 -0.438 18832
2558 1 9 . 1 1 22 22 ALA CA C 22 52.940 52.940 53.524 -0.584 18832
2559 1 9 . 1 1 22 22 ALA CB C 22 20.450 20.450 19.620 0.830 18832
2560 1 9 . 1 1 22 22 ALA H H 22 8.103 8.103 8.626 -0.523 18832
2561 1 9 . 1 1 23 23 ARG N N 23 122.190 122.190 123.857 -1.667 18832
2562 1 9 . 1 1 23 23 ARG HA H 23 4.346 4.346 4.487 -0.141 18832
2563 1 9 . 1 1 23 23 ARG CA C 23 55.490 55.490 55.955 -0.465 18832
2564 1 9 . 1 1 23 23 ARG CB C 23 30.700 30.700 30.218 0.482 18832
2565 1 9 . 1 1 23 23 ARG H H 23 8.887 8.887 8.619 0.268 18832
2566 1 9 . 1 1 24 24 GLY N N 24 105.320 105.320 105.641 -0.321 18832
2567 1 9 . 1 1 24 24 GLY CA C 24 44.500 44.500 45.224 -0.723 18832
2568 1 9 . 1 1 24 24 GLY H H 24 7.258 7.258 7.407 -0.149 18832
2569 1 9 . 1 1 25 25 ALA N N 25 122.190 122.190 121.944 0.246 18832
2570 1 9 . 1 1 25 25 ALA HA H 25 4.166 4.166 4.163 0.003 18832
2571 1 9 . 1 1 25 25 ALA CA C 25 54.440 54.440 54.017 0.423 18832
2572 1 9 . 1 1 25 25 ALA CB C 25 18.770 18.770 18.975 -0.205 18832
2573 1 9 . 1 1 25 25 ALA H H 25 8.627 8.627 8.490 0.137 18832
2574 1 9 . 1 1 26 26 ASP N N 26 114.690 114.690 116.795 -2.105 18832
2575 1 9 . 1 1 26 26 ASP HA H 26 4.700 4.700 4.439 0.261 18832
2576 1 9 . 1 1 26 26 ASP CA C 26 53.870 53.870 56.357 -2.487 18832
2577 1 9 . 1 1 26 26 ASP CB C 26 40.390 40.390 41.121 -0.731 18832
2578 1 9 . 1 1 26 26 ASP H H 26 8.955 8.955 8.508 0.447 18832
2579 1 9 . 1 1 27 27 GLU N N 27 118.910 118.910 116.088 2.822 18832
2580 1 9 . 1 1 27 27 GLU HA H 27 5.202 5.202 4.568 0.634 18832
2581 1 9 . 1 1 27 27 GLU CA C 27 54.930 54.930 55.532 -0.603 18832
2582 1 9 . 1 1 27 27 GLU CB C 27 32.880 32.880 31.379 1.501 18832
2583 1 9 . 1 1 27 27 GLU H H 27 7.537 7.537 7.693 -0.156 18832
2584 1 9 . 1 1 28 28 LEU N N 28 121.490 121.490 122.848 -1.358 18832
2585 1 9 . 1 1 28 28 LEU HA H 28 4.756 4.756 4.593 0.163 18832
2586 1 9 . 1 1 28 28 LEU CA C 28 53.120 53.120 54.022 -0.902 18832
2587 1 9 . 1 1 28 28 LEU CB C 28 44.500 44.500 44.292 0.208 18832
2588 1 9 . 1 1 28 28 LEU H H 28 8.890 8.890 8.427 0.463 18832
2589 1 9 . 1 1 29 29 SER N N 29 115.870 115.870 117.934 -2.064 18832
2590 1 9 . 1 1 29 29 SER HA H 29 5.009 5.009 4.643 0.366 18832
2591 1 9 . 1 1 29 29 SER CA C 29 58.470 58.470 58.967 -0.497 18832
2592 1 9 . 1 1 29 29 SER CB C 29 63.690 63.690 64.054 -0.364 18832
2593 1 9 . 1 1 29 29 SER H H 29 7.948 7.948 8.489 -0.541 18832
2594 1 9 . 1 1 30 30 LEU N N 30 121.260 121.260 127.691 -6.431 18832
2595 1 9 . 1 1 30 30 LEU HA H 30 4.776 4.776 4.677 0.099 18832
2596 1 9 . 1 1 30 30 LEU CA C 30 52.940 52.940 54.411 -1.471 18832
2597 1 9 . 1 1 30 30 LEU CB C 30 46.370 46.370 45.611 0.758 18832
2598 1 9 . 1 1 30 30 LEU H H 30 9.500 9.500 8.294 1.206 18832
2599 1 9 . 1 1 31 31 GLN N N 31 123.130 123.130 121.870 1.260 18832
2600 1 9 . 1 1 31 31 GLN HA H 31 5.065 5.065 4.850 0.215 18832
2601 1 9 . 1 1 31 31 GLN CA C 31 52.940 52.940 53.593 -0.653 18832
2602 1 9 . 1 1 31 31 GLN CB C 31 31.190 31.190 32.348 -1.158 18832
2603 1 9 . 1 1 31 31 GLN H H 31 9.147 9.147 8.425 0.722 18832
2604 1 9 . 1 1 32 32 ILE N N 32 120.790 120.790 120.926 -0.136 18832
2605 1 9 . 1 1 32 32 ILE HA H 32 3.032 3.032 4.077 -1.045 18832
2606 1 9 . 1 1 32 32 ILE CA C 32 64.250 64.250 63.200 1.050 18832
2607 1 9 . 1 1 32 32 ILE CB C 32 37.940 37.940 37.742 0.198 18832
2608 1 9 . 1 1 32 32 ILE H H 32 8.016 8.016 8.628 -0.612 18832
2609 1 9 . 1 1 33 33 GLY N N 33 115.870 115.870 115.536 0.334 18832
2610 1 9 . 1 1 33 33 GLY CA C 33 44.500 44.500 44.870 -0.370 18832
2611 1 9 . 1 1 33 33 GLY H H 33 8.775 8.775 8.981 -0.206 18832
2612 1 9 . 1 1 34 34 ASP N N 34 122.430 122.430 121.950 0.480 18832
2613 1 9 . 1 1 34 34 ASP HA H 34 4.634 4.634 4.941 -0.307 18832
2614 1 9 . 1 1 34 34 ASP CA C 34 55.860 55.860 53.941 1.919 18832
2615 1 9 . 1 1 34 34 ASP CB C 34 41.310 41.310 42.191 -0.881 18832
2616 1 9 . 1 1 34 34 ASP H H 34 8.686 8.686 7.748 0.938 18832
2617 1 9 . 1 1 35 35 THR N N 35 117.980 117.980 116.801 1.179 18832
2618 1 9 . 1 1 35 35 THR HA H 35 5.154 5.154 5.000 0.154 18832
2619 1 9 . 1 1 35 35 THR CA C 35 61.450 61.450 61.936 -0.486 18832
2620 1 9 . 1 1 35 35 THR CB C 35 69.090 69.090 69.951 -0.861 18832
2621 1 9 . 1 1 35 35 THR H H 35 8.392 8.392 8.451 -0.059 18832
2622 1 9 . 1 1 36 36 VAL N N 36 118.200 118.200 116.842 1.358 18832
2623 1 9 . 1 1 36 36 VAL HA H 36 5.152 5.152 4.637 0.515 18832
2624 1 9 . 1 1 36 36 VAL CA C 36 57.910 57.910 60.592 -2.682 18832
2625 1 9 . 1 1 36 36 VAL CB C 36 34.190 34.190 35.349 -1.159 18832
2626 1 9 . 1 1 36 36 VAL H H 36 9.016 9.016 9.200 -0.184 18832
2627 1 9 . 1 1 37 37 HIS N N 37 122.190 122.190 126.143 -3.953 18832
2628 1 9 . 1 1 37 37 HIS HA H 37 4.811 4.811 4.999 -0.188 18832
2629 1 9 . 1 1 37 37 HIS CA C 37 52.560 52.560 53.460 -0.900 18832
2630 1 9 . 1 1 37 37 HIS CB C 37 31.260 31.260 30.038 1.222 18832
2631 1 9 . 1 1 37 37 HIS H H 37 8.491 8.491 8.958 -0.467 18832
2632 1 9 . 1 1 38 38 ILE N N 38 126.650 126.650 127.330 -0.680 18832
2633 1 9 . 1 1 38 38 ILE HA H 38 3.750 3.750 4.045 -0.295 18832
2634 1 9 . 1 1 38 38 ILE CA C 38 61.640 61.640 62.107 -0.467 18832
2635 1 9 . 1 1 38 38 ILE CB C 38 38.880 38.880 37.924 0.956 18832
2636 1 9 . 1 1 38 38 ILE H H 38 8.638 8.638 8.681 -0.043 18832
2637 1 9 . 1 1 39 39 LEU N N 39 126.180 126.180 123.562 2.618 18832
2638 1 9 . 1 1 39 39 LEU HA H 39 4.380 4.380 4.613 -0.233 18832
2639 1 9 . 1 1 39 39 LEU CA C 39 55.490 55.490 54.898 0.592 18832
2640 1 9 . 1 1 39 39 LEU CB C 39 43.750 43.750 43.427 0.323 18832
2641 1 9 . 1 1 39 39 LEU H H 39 9.163 9.163 8.799 0.364 18832
2642 1 9 . 1 1 40 40 GLU N N 40 115.160 115.160 117.059 -1.899 18832
2643 1 9 . 1 1 40 40 GLU HA H 40 5.020 5.020 4.954 0.066 18832
2644 1 9 . 1 1 40 40 GLU CA C 40 55.090 55.090 55.336 -0.245 18832
2645 1 9 . 1 1 40 40 GLU CB C 40 35.730 35.730 34.194 1.536 18832
2646 1 9 . 1 1 40 40 GLU H H 40 7.852 7.852 7.795 0.057 18832
2647 1 9 . 1 1 41 41 THR HA H 41 4.270 4.270 4.599 -0.329 18832
2648 1 9 . 1 1 41 41 THR CA C 41 61.250 61.250 60.163 1.087 18832
2649 1 9 . 1 1 41 41 THR CB C 41 71.410 71.410 70.869 0.541 18832
2650 1 9 . 1 1 42 42 TYR HA H 42 4.550 4.550 4.375 0.175 18832
2651 1 9 . 1 1 43 43 GLU N N 43 124.100 124.100 119.769 4.331 18832
2652 1 9 . 1 1 43 43 GLU HA H 43 3.740 3.740 4.128 -0.388 18832
2653 1 9 . 1 1 43 43 GLU H H 43 8.590 8.590 7.881 0.709 18832
2654 1 9 . 1 1 44 44 GLY N N 44 110.789 110.789 108.064 2.725 18832
2655 1 9 . 1 1 44 44 GLY CA C 44 45.440 45.440 45.035 0.405 18832
2656 1 9 . 1 1 44 44 GLY H H 44 8.432 8.432 8.317 0.115 18832
2657 1 9 . 1 1 45 45 TRP HA H 45 4.690 4.690 4.624 0.066 18832
2658 1 9 . 1 1 45 45 TRP CA C 45 57.550 57.550 56.103 1.447 18832
2659 1 9 . 1 1 46 46 TYR HA H 46 5.600 5.600 4.625 0.975 18832
2660 1 9 . 1 1 46 46 TYR CA C 46 54.060 54.060 54.759 -0.699 18832
2661 1 9 . 1 1 46 46 TYR CB C 46 42.650 42.650 41.290 1.360 18832
2662 1 9 . 1 1 47 47 ARG N N 47 118.100 118.100 119.906 -1.806 18832
2663 1 9 . 1 1 47 47 ARG HA H 47 5.094 5.094 5.032 0.062 18832
2664 1 9 . 1 1 47 47 ARG CA C 47 54.060 54.060 54.058 0.002 18832
2665 1 9 . 1 1 47 47 ARG CB C 47 33.250 33.250 34.410 -1.161 18832
2666 1 9 . 1 1 47 47 ARG H H 47 8.492 8.492 8.145 0.347 18832
2667 1 9 . 1 1 48 48 GLY N N 48 114.000 114.000 110.707 3.293 18832
2668 1 9 . 1 1 48 48 GLY CA C 48 46.560 46.560 46.066 0.494 18832
2669 1 9 . 1 1 48 48 GLY H H 48 9.183 9.183 8.948 0.235 18832
2670 1 9 . 1 1 49 49 TYR N N 49 116.100 116.100 114.653 1.447 18832
2671 1 9 . 1 1 49 49 TYR HA H 49 5.373 5.373 5.215 0.158 18832
2672 1 9 . 1 1 49 49 TYR CA C 49 55.110 55.110 56.223 -1.113 18832
2673 1 9 . 1 1 49 49 TYR CB C 49 40.750 40.750 40.686 0.064 18832
2674 1 9 . 1 1 49 49 TYR H H 49 8.194 8.194 8.077 0.117 18832
2675 1 9 . 1 1 50 50 THR N N 50 112.350 112.350 113.730 -1.380 18832
2676 1 9 . 1 1 50 50 THR HA H 50 5.105 5.105 4.709 0.396 18832
2677 1 9 . 1 1 50 50 THR CA C 50 59.770 59.770 60.946 -1.176 18832
2678 1 9 . 1 1 50 50 THR CB C 50 69.460 69.460 70.039 -0.579 18832
2679 1 9 . 1 1 50 50 THR H H 50 9.441 9.441 8.745 0.696 18832
2680 1 9 . 1 1 51 51 LEU N N 51 121.260 121.260 120.746 0.514 18832
2681 1 9 . 1 1 51 51 LEU HA H 51 4.236 4.236 4.139 0.097 18832
2682 1 9 . 1 1 51 51 LEU CA C 51 56.790 56.790 56.638 0.152 18832
2683 1 9 . 1 1 51 51 LEU CB C 51 40.000 40.000 41.073 -1.073 18832
2684 1 9 . 1 1 51 51 LEU H H 51 8.310 8.310 8.122 0.188 18832
2685 1 9 . 1 1 52 52 ARG N N 52 116.570 116.570 117.341 -0.771 18832
2686 1 9 . 1 1 52 52 ARG HA H 52 4.250 4.250 4.161 0.089 18832
2687 1 9 . 1 1 52 52 ARG CA C 52 57.350 57.350 58.287 -0.937 18832
2688 1 9 . 1 1 52 52 ARG CB C 52 30.510 30.510 30.655 -0.145 18832
2689 1 9 . 1 1 52 52 ARG H H 52 8.047 8.047 8.371 -0.324 18832
2690 1 9 . 1 1 53 53 LYS N N 53 122.660 122.660 119.527 3.133 18832
2691 1 9 . 1 1 53 53 LYS HA H 53 4.616 4.616 4.648 -0.032 18832
2692 1 9 . 1 1 53 53 LYS CA C 53 54.620 54.620 55.334 -0.714 18832
2693 1 9 . 1 1 53 53 LYS CB C 53 32.860 32.860 32.264 0.596 18832
2694 1 9 . 1 1 53 53 LYS H H 53 7.649 7.649 7.860 -0.211 18832
2695 1 9 . 1 1 54 54 LYS N N 54 125.010 125.010 122.877 2.133 18832
2696 1 9 . 1 1 54 54 LYS HA H 54 4.090 4.090 4.289 -0.199 18832
2697 1 9 . 1 1 54 54 LYS CA C 54 58.470 58.470 58.703 -0.232 18832
2698 1 9 . 1 1 54 54 LYS CB C 54 32.130 32.130 32.407 -0.277 18832
2699 1 9 . 1 1 54 54 LYS H H 54 8.496 8.496 8.504 -0.008 18832
2700 1 9 . 1 1 55 55 SER N N 55 110.240 110.240 113.403 -3.163 18832
2701 1 9 . 1 1 55 55 SER HA H 55 4.122 4.122 4.244 -0.122 18832
2702 1 9 . 1 1 55 55 SER CA C 55 58.960 58.960 60.083 -1.123 18832
2703 1 9 . 1 1 55 55 SER CB C 55 63.310 63.310 63.318 -0.007 18832
2704 1 9 . 1 1 55 55 SER H H 55 7.857 7.857 8.249 -0.392 18832
2705 1 9 . 1 1 56 56 LYS N N 56 124.070 124.070 121.574 2.496 18832
2706 1 9 . 1 1 56 56 LYS HA H 56 4.668 4.668 4.185 0.483 18832
2707 1 9 . 1 1 56 56 LYS CA C 56 54.810 54.810 56.893 -2.083 18832
2708 1 9 . 1 1 56 56 LYS CB C 56 33.250 33.250 32.508 0.742 18832
2709 1 9 . 1 1 56 56 LYS H H 56 7.473 7.473 8.090 -0.617 18832
2710 1 9 . 1 1 57 57 LYS N N 57 125.940 125.940 123.507 2.433 18832
2711 1 9 . 1 1 57 57 LYS HA H 57 5.341 5.341 5.169 0.172 18832
2712 1 9 . 1 1 57 57 LYS CA C 57 54.620 54.620 54.795 -0.175 18832
2713 1 9 . 1 1 57 57 LYS CB C 57 34.240 34.240 35.884 -1.644 18832
2714 1 9 . 1 1 57 57 LYS H H 57 8.474 8.474 8.232 0.242 18832
2715 1 9 . 1 1 58 58 GLY N N 58 109.540 109.540 110.674 -1.134 18832
2716 1 9 . 1 1 58 58 GLY CA C 58 45.620 45.620 44.572 1.048 18832
2717 1 9 . 1 1 58 58 GLY H H 58 9.075 9.075 8.978 0.097 18832
2718 1 9 . 1 1 59 59 ILE N N 59 113.900 113.900 115.325 -1.425 18832
2719 1 9 . 1 1 59 59 ILE HA H 59 6.000 6.000 5.007 0.993 18832
2720 1 9 . 1 1 59 59 ILE CA C 59 59.590 59.590 58.434 1.155 18832
2721 1 9 . 1 1 59 59 ILE CB C 59 41.140 41.140 41.378 -0.238 18832
2722 1 9 . 1 1 59 59 ILE H H 59 8.628 8.628 8.074 0.554 18832
2723 1 9 . 1 1 60 60 PHE N N 60 117.040 117.040 117.014 0.026 18832
2724 1 9 . 1 1 60 60 PHE HA H 60 5.120 5.120 5.310 -0.190 18832
2725 1 9 . 1 1 60 60 PHE CA C 60 54.060 54.060 54.718 -0.658 18832
2726 1 9 . 1 1 60 60 PHE CB C 60 37.190 37.190 39.579 -2.389 18832
2727 1 9 . 1 1 60 60 PHE H H 60 8.724 8.724 8.318 0.406 18832
2728 1 9 . 1 1 61 61 PRO HA H 61 3.480 3.480 4.605 -1.125 18832
2729 1 9 . 1 1 61 61 PRO CA C 61 62.200 62.200 62.521 -0.321 18832
2730 1 9 . 1 1 61 61 PRO CB C 61 31.190 31.190 33.049 -1.859 18832
2731 1 9 . 1 1 62 62 ALA N N 62 124.770 124.770 126.064 -1.294 18832
2732 1 9 . 1 1 62 62 ALA HA H 62 3.710 3.710 4.153 -0.443 18832
2733 1 9 . 1 1 62 62 ALA CA C 62 54.370 54.370 54.416 -0.046 18832
2734 1 9 . 1 1 62 62 ALA CB C 62 17.650 17.650 18.204 -0.554 18832
2735 1 9 . 1 1 62 62 ALA H H 62 7.898 7.898 8.375 -0.477 18832
2736 1 9 . 1 1 63 63 SER N N 63 109.700 109.700 113.349 -3.649 18832
2737 1 9 . 1 1 63 63 SER HA H 63 4.200 4.200 4.253 -0.053 18832
2738 1 9 . 1 1 63 63 SER CA C 63 59.400 59.400 59.250 0.150 18832
2739 1 9 . 1 1 63 63 SER CB C 63 62.380 62.380 62.840 -0.460 18832
2740 1 9 . 1 1 63 63 SER H H 63 8.030 8.030 8.280 -0.250 18832
2741 1 9 . 1 1 64 64 TYR N N 64 120.300 120.300 118.004 2.296 18832
2742 1 9 . 1 1 64 64 TYR HA H 64 4.250 4.250 4.337 -0.087 18832
2743 1 9 . 1 1 64 64 TYR CA C 64 57.720 57.720 56.310 1.410 18832
2744 1 9 . 1 1 64 64 TYR CB C 64 37.560 37.560 38.612 -1.052 18832
2745 1 9 . 1 1 64 64 TYR H H 64 7.128 7.128 7.401 -0.273 18832
2746 1 9 . 1 1 65 65 ILE N N 65 118.000 118.000 118.350 -0.350 18832
2747 1 9 . 1 1 65 65 ILE HA H 65 4.810 4.810 4.553 0.257 18832
2748 1 9 . 1 1 65 65 ILE CA C 65 56.980 56.980 58.787 -1.807 18832
2749 1 9 . 1 1 65 65 ILE CB C 65 39.630 39.630 41.707 -2.077 18832
2750 1 9 . 1 1 65 65 ILE H H 65 7.671 7.671 7.268 0.403 18832
2751 1 9 . 1 1 66 66 HIS N N 66 124.300 124.300 122.533 1.767 18832
2752 1 9 . 1 1 66 66 HIS HA H 66 5.130 5.130 4.889 0.241 18832
2753 1 9 . 1 1 66 66 HIS CA C 66 53.060 53.060 54.790 -1.730 18832
2754 1 9 . 1 1 66 66 HIS CB C 66 30.510 30.510 33.183 -2.673 18832
2755 1 9 . 1 1 66 66 HIS H H 66 9.159 9.159 9.100 0.059 18832
2756 1 9 . 1 1 67 67 LEU N N 67 127.580 127.580 127.360 0.220 18832
2757 1 9 . 1 1 67 67 LEU HA H 67 4.570 4.570 4.328 0.242 18832
2758 1 9 . 1 1 67 67 LEU CA C 67 55.300 55.300 55.522 -0.222 18832
2759 1 9 . 1 1 67 67 LEU CB C 67 42.060 42.060 40.980 1.080 18832
2760 1 9 . 1 1 67 67 LEU H H 67 8.992 8.992 8.618 0.374 18832
2761 1 9 . 1 1 68 68 LYS N N 68 121.900 121.900 125.621 -3.721 18832
2762 1 9 . 1 1 68 68 LYS HA H 68 4.490 4.490 4.699 -0.209 18832
2763 1 9 . 1 1 68 68 LYS CA C 68 55.110 55.110 54.535 0.575 18832
2764 1 9 . 1 1 68 68 LYS CB C 68 34.610 34.610 34.289 0.321 18832
2765 1 9 . 1 1 68 68 LYS H H 68 8.499 8.499 8.272 0.227 18832
2766 1 9 . 1 1 69 69 GLU N N 69 122.190 122.190 120.769 1.421 18832
2767 1 9 . 1 1 69 69 GLU HA H 69 4.280 4.280 4.366 -0.086 18832
2768 1 9 . 1 1 69 69 GLU CA C 69 56.610 56.610 55.660 0.950 18832
2769 1 9 . 1 1 69 69 GLU CB C 69 30.330 30.330 29.606 0.724 18832
2770 1 9 . 1 1 69 69 GLU H H 69 8.569 8.569 8.745 -0.176 18832
2771 1 9 . 1 1 70 70 ALA N N 70 123.370 123.370 129.131 -5.761 18832
2772 1 9 . 1 1 70 70 ALA HA H 70 4.200 4.200 4.293 -0.093 18832
2773 1 9 . 1 1 70 70 ALA CA C 70 51.810 51.810 51.420 0.390 18832
2774 1 9 . 1 1 70 70 ALA CB C 70 19.700 19.700 18.052 1.648 18832
2775 1 9 . 1 1 70 70 ALA H H 70 8.181 8.181 8.564 -0.383 18832
2776 1 9 . 1 1 71 71 ILE N N 71 120.080 120.080 120.688 -0.608 18832
2777 1 9 . 1 1 71 71 ILE HA H 71 4.070 4.070 3.723 0.347 18832
2778 1 9 . 1 1 71 71 ILE CA C 71 60.330 60.330 61.925 -1.595 18832
2779 1 9 . 1 1 71 71 ILE CB C 71 38.690 38.690 38.186 0.504 18832
2780 1 9 . 1 1 71 71 ILE H H 71 7.776 7.776 8.077 -0.301 18832
2781 1 9 . 1 1 72 72 VAL N N 72 124.540 124.540 122.401 2.139 18832
2782 1 9 . 1 1 72 72 VAL HA H 72 4.070 4.070 4.347 -0.277 18832
2783 1 9 . 1 1 72 72 VAL CA C 72 61.640 61.640 62.548 -0.909 18832
2784 1 9 . 1 1 72 72 VAL CB C 72 32.690 32.690 32.186 0.504 18832
2785 1 9 . 1 1 72 72 VAL H H 72 8.089 8.089 8.157 -0.068 18832
2786 1 9 . 1 1 73 73 GLU N N 73 125.940 125.940 127.254 -1.314 18832
2787 1 9 . 1 1 73 73 GLU HA H 73 4.280 4.280 4.579 -0.299 18832
2788 1 9 . 1 1 73 73 GLU CA C 73 56.610 56.610 56.321 0.289 18832
2789 1 9 . 1 1 73 73 GLU CB C 73 30.710 30.710 29.483 1.226 18832
2790 1 9 . 1 1 73 73 GLU H H 73 8.464 8.464 8.953 -0.489 18832
2791 1 10 . 1 1 2 2 THR N N 2 116.400 116.400 120.027 -3.627 18832
2792 1 10 . 1 1 2 2 THR HA H 2 4.120 4.120 4.714 -0.594 18832
2793 1 10 . 1 1 2 2 THR CA C 2 62.100 62.100 62.604 -0.504 18832
2794 1 10 . 1 1 2 2 THR CB C 2 69.440 69.440 69.397 0.044 18832
2795 1 10 . 1 1 2 2 THR H H 2 8.150 8.150 8.392 -0.242 18832
2796 1 10 . 1 1 3 3 ARG HA H 3 4.310 4.310 4.732 -0.422 18832
2797 1 10 . 1 1 3 3 ARG CA C 3 55.750 55.750 55.419 0.331 18832
2798 1 10 . 1 1 3 3 ARG CB C 3 30.620 30.620 31.757 -1.137 18832
2799 1 10 . 1 1 4 4 TRP N N 4 123.300 123.300 125.935 -2.635 18832
2800 1 10 . 1 1 4 4 TRP HA H 4 4.480 4.480 4.829 -0.349 18832
2801 1 10 . 1 1 4 4 TRP CA C 4 57.560 57.560 57.741 -0.181 18832
2802 1 10 . 1 1 4 4 TRP CB C 4 29.490 29.490 29.763 -0.273 18832
2803 1 10 . 1 1 4 4 TRP H H 4 8.108 8.108 8.706 -0.598 18832
2804 1 10 . 1 1 5 5 VAL HA H 5 4.570 4.570 4.174 0.396 18832
2805 1 10 . 1 1 5 5 VAL CB C 5 30.840 30.840 31.349 -0.509 18832
2806 1 10 . 1 1 6 6 PRO HA H 6 4.810 4.810 4.309 0.500 18832
2807 1 10 . 1 1 6 6 PRO CB C 6 32.210 32.210 31.623 0.587 18832
2808 1 10 . 1 1 7 7 THR HA H 7 4.270 4.270 3.890 0.380 18832
2809 1 10 . 1 1 7 7 THR CA C 7 60.890 60.890 63.025 -2.135 18832
2810 1 10 . 1 1 7 7 THR CB C 7 70.140 70.140 67.571 2.569 18832
2811 1 10 . 1 1 8 8 LYS HA H 8 4.440 4.440 4.557 -0.117 18832
2812 1 10 . 1 1 8 8 LYS CA C 8 55.980 55.980 54.209 1.771 18832
2813 1 10 . 1 1 8 8 LYS CB C 8 35.050 35.050 34.460 0.590 18832
2814 1 10 . 1 1 10 10 GLU HA H 10 4.580 4.580 4.222 0.358 18832
2815 1 10 . 1 1 10 10 GLU CA C 10 55.570 55.570 56.947 -1.377 18832
2816 1 10 . 1 1 10 10 GLU CB C 10 30.780 30.780 29.393 1.387 18832
2817 1 10 . 1 1 11 11 GLU N N 11 122.500 122.500 124.754 -2.254 18832
2818 1 10 . 1 1 11 11 GLU HA H 11 4.340 4.340 3.876 0.464 18832
2819 1 10 . 1 1 11 11 GLU CA C 11 57.140 57.140 59.534 -2.394 18832
2820 1 10 . 1 1 11 11 GLU CB C 11 29.400 29.400 28.950 0.450 18832
2821 1 10 . 1 1 11 11 GLU H H 11 8.271 8.271 8.749 -0.478 18832
2822 1 10 . 1 1 12 12 LYS HA H 12 4.380 4.380 4.148 0.232 18832
2823 1 10 . 1 1 12 12 LYS CA C 12 55.790 55.790 56.511 -0.721 18832
2824 1 10 . 1 1 12 12 LYS CB C 12 33.600 33.600 35.303 -1.703 18832
2825 1 10 . 1 1 13 13 TYR HA H 13 5.560 5.560 4.834 0.726 18832
2826 1 10 . 1 1 13 13 TYR CA C 13 55.860 55.860 56.349 -0.489 18832
2827 1 10 . 1 1 13 13 TYR CB C 13 42.440 42.440 39.335 3.105 18832
2828 1 10 . 1 1 14 14 GLY N N 14 105.320 105.320 106.353 -1.033 18832
2829 1 10 . 1 1 14 14 GLY CA C 14 45.240 45.240 44.102 1.138 18832
2830 1 10 . 1 1 14 14 GLY H H 14 8.401 8.401 8.531 -0.130 18832
2831 1 10 . 1 1 15 15 VAL N N 15 118.900 118.900 118.747 0.153 18832
2832 1 10 . 1 1 15 15 VAL HA H 15 5.341 5.341 4.838 0.503 18832
2833 1 10 . 1 1 15 15 VAL CA C 15 59.210 59.210 60.822 -1.612 18832
2834 1 10 . 1 1 15 15 VAL CB C 15 35.740 35.740 35.273 0.468 18832
2835 1 10 . 1 1 15 15 VAL H H 15 8.851 8.851 8.251 0.600 18832
2836 1 10 . 1 1 16 16 ALA N N 16 129.460 129.460 126.504 2.956 18832
2837 1 10 . 1 1 16 16 ALA HA H 16 5.000 5.000 5.763 -0.763 18832
2838 1 10 . 1 1 16 16 ALA CA C 16 52.000 52.000 49.763 2.237 18832
2839 1 10 . 1 1 16 16 ALA CB C 16 19.330 19.330 22.079 -2.749 18832
2840 1 10 . 1 1 16 16 ALA H H 16 9.113 9.113 8.626 0.487 18832
2841 1 10 . 1 1 17 17 PHE N N 17 124.070 124.070 119.857 4.213 18832
2842 1 10 . 1 1 17 17 PHE HA H 17 4.801 4.801 5.162 -0.361 18832
2843 1 10 . 1 1 17 17 PHE CA C 17 56.230 56.230 55.674 0.556 18832
2844 1 10 . 1 1 17 17 PHE CB C 17 40.000 40.000 39.052 0.948 18832
2845 1 10 . 1 1 17 17 PHE H H 17 8.787 8.787 8.250 0.537 18832
2846 1 10 . 1 1 18 18 TYR N N 18 118.210 118.210 122.827 -4.617 18832
2847 1 10 . 1 1 18 18 TYR HA H 18 4.483 4.483 4.289 0.194 18832
2848 1 10 . 1 1 18 18 TYR CA C 18 55.300 55.300 57.225 -1.925 18832
2849 1 10 . 1 1 18 18 TYR CB C 18 42.810 42.810 41.949 0.861 18832
2850 1 10 . 1 1 18 18 TYR H H 18 7.281 7.281 7.862 -0.581 18832
2851 1 10 . 1 1 19 19 ASN N N 19 116.800 116.800 119.343 -2.543 18832
2852 1 10 . 1 1 19 19 ASN HA H 19 4.710 4.710 4.882 -0.172 18832
2853 1 10 . 1 1 19 19 ASN CA C 19 52.940 52.940 52.970 -0.030 18832
2854 1 10 . 1 1 19 19 ASN CB C 19 39.060 39.060 38.553 0.507 18832
2855 1 10 . 1 1 19 19 ASN H H 19 8.134 8.134 8.385 -0.251 18832
2856 1 10 . 1 1 20 20 TYR N N 20 122.190 122.190 122.943 -0.753 18832
2857 1 10 . 1 1 20 20 TYR HA H 20 4.687 4.687 4.654 0.033 18832
2858 1 10 . 1 1 20 20 TYR CA C 20 57.720 57.720 56.959 0.761 18832
2859 1 10 . 1 1 20 20 TYR CB C 20 42.250 42.250 40.926 1.324 18832
2860 1 10 . 1 1 20 20 TYR H H 20 8.993 8.993 8.123 0.870 18832
2861 1 10 . 1 1 21 21 ASP N N 21 128.520 128.520 126.609 1.911 18832
2862 1 10 . 1 1 21 21 ASP HA H 21 4.790 4.790 4.570 0.220 18832
2863 1 10 . 1 1 21 21 ASP CA C 21 52.370 52.370 52.275 0.095 18832
2864 1 10 . 1 1 21 21 ASP CB C 21 41.130 41.130 43.359 -2.229 18832
2865 1 10 . 1 1 21 21 ASP H H 21 7.838 7.838 8.130 -0.292 18832
2866 1 10 . 1 1 22 22 ALA N N 22 125.240 125.240 126.002 -0.762 18832
2867 1 10 . 1 1 22 22 ALA HA H 22 4.051 4.051 4.030 0.021 18832
2868 1 10 . 1 1 22 22 ALA CA C 22 52.940 52.940 52.574 0.366 18832
2869 1 10 . 1 1 22 22 ALA CB C 22 20.450 20.450 19.308 1.142 18832
2870 1 10 . 1 1 22 22 ALA H H 22 8.103 8.103 8.446 -0.343 18832
2871 1 10 . 1 1 23 23 ARG N N 23 122.190 122.190 122.855 -0.665 18832
2872 1 10 . 1 1 23 23 ARG HA H 23 4.346 4.346 4.199 0.147 18832
2873 1 10 . 1 1 23 23 ARG CA C 23 55.490 55.490 56.960 -1.470 18832
2874 1 10 . 1 1 23 23 ARG CB C 23 30.700 30.700 30.945 -0.245 18832
2875 1 10 . 1 1 23 23 ARG H H 23 8.887 8.887 8.690 0.197 18832
2876 1 10 . 1 1 24 24 GLY N N 24 105.320 105.320 104.980 0.340 18832
2877 1 10 . 1 1 24 24 GLY CA C 24 44.500 44.500 45.027 -0.527 18832
2878 1 10 . 1 1 24 24 GLY H H 24 7.258 7.258 7.444 -0.186 18832
2879 1 10 . 1 1 25 25 ALA N N 25 122.190 122.190 121.224 0.966 18832
2880 1 10 . 1 1 25 25 ALA HA H 25 4.166 4.166 4.266 -0.100 18832
2881 1 10 . 1 1 25 25 ALA CA C 25 54.440 54.440 53.865 0.575 18832
2882 1 10 . 1 1 25 25 ALA CB C 25 18.770 18.770 19.198 -0.428 18832
2883 1 10 . 1 1 25 25 ALA H H 25 8.627 8.627 8.427 0.200 18832
2884 1 10 . 1 1 26 26 ASP N N 26 114.690 114.690 115.917 -1.227 18832
2885 1 10 . 1 1 26 26 ASP HA H 26 4.700 4.700 4.432 0.268 18832
2886 1 10 . 1 1 26 26 ASP CA C 26 53.870 53.870 55.998 -2.128 18832
2887 1 10 . 1 1 26 26 ASP CB C 26 40.390 40.390 41.267 -0.877 18832
2888 1 10 . 1 1 26 26 ASP H H 26 8.955 8.955 8.593 0.362 18832
2889 1 10 . 1 1 27 27 GLU N N 27 118.910 118.910 117.298 1.612 18832
2890 1 10 . 1 1 27 27 GLU HA H 27 5.202 5.202 4.517 0.685 18832
2891 1 10 . 1 1 27 27 GLU CA C 27 54.930 54.930 55.626 -0.696 18832
2892 1 10 . 1 1 27 27 GLU CB C 27 32.880 32.880 32.144 0.737 18832
2893 1 10 . 1 1 27 27 GLU H H 27 7.537 7.537 7.477 0.060 18832
2894 1 10 . 1 1 28 28 LEU N N 28 121.490 121.490 121.464 0.026 18832
2895 1 10 . 1 1 28 28 LEU HA H 28 4.756 4.756 4.740 0.016 18832
2896 1 10 . 1 1 28 28 LEU CA C 28 53.120 53.120 53.572 -0.452 18832
2897 1 10 . 1 1 28 28 LEU CB C 28 44.500 44.500 46.379 -1.879 18832
2898 1 10 . 1 1 28 28 LEU H H 28 8.890 8.890 8.097 0.793 18832
2899 1 10 . 1 1 29 29 SER N N 29 115.870 115.870 121.374 -5.504 18832
2900 1 10 . 1 1 29 29 SER HA H 29 5.009 5.009 4.435 0.574 18832
2901 1 10 . 1 1 29 29 SER CA C 29 58.470 58.470 58.629 -0.159 18832
2902 1 10 . 1 1 29 29 SER CB C 29 63.690 63.690 63.195 0.495 18832
2903 1 10 . 1 1 29 29 SER H H 29 7.948 7.948 8.518 -0.570 18832
2904 1 10 . 1 1 30 30 LEU N N 30 121.260 121.260 127.081 -5.821 18832
2905 1 10 . 1 1 30 30 LEU HA H 30 4.776 4.776 4.738 0.038 18832
2906 1 10 . 1 1 30 30 LEU CA C 30 52.940 52.940 54.039 -1.099 18832
2907 1 10 . 1 1 30 30 LEU CB C 30 46.370 46.370 43.969 2.401 18832
2908 1 10 . 1 1 30 30 LEU H H 30 9.500 9.500 8.224 1.276 18832
2909 1 10 . 1 1 31 31 GLN N N 31 123.130 123.130 120.823 2.307 18832
2910 1 10 . 1 1 31 31 GLN HA H 31 5.065 5.065 5.107 -0.042 18832
2911 1 10 . 1 1 31 31 GLN CA C 31 52.940 52.940 53.679 -0.739 18832
2912 1 10 . 1 1 31 31 GLN CB C 31 31.190 31.190 32.201 -1.011 18832
2913 1 10 . 1 1 31 31 GLN H H 31 9.147 9.147 8.619 0.528 18832
2914 1 10 . 1 1 32 32 ILE N N 32 120.790 120.790 123.136 -2.346 18832
2915 1 10 . 1 1 32 32 ILE HA H 32 3.032 3.032 3.996 -0.964 18832
2916 1 10 . 1 1 32 32 ILE CA C 32 64.250 64.250 63.364 0.886 18832
2917 1 10 . 1 1 32 32 ILE CB C 32 37.940 37.940 37.595 0.345 18832
2918 1 10 . 1 1 32 32 ILE H H 32 8.016 8.016 8.289 -0.273 18832
2919 1 10 . 1 1 33 33 GLY N N 33 115.870 115.870 115.755 0.115 18832
2920 1 10 . 1 1 33 33 GLY CA C 33 44.500 44.500 44.675 -0.175 18832
2921 1 10 . 1 1 33 33 GLY H H 33 8.775 8.775 8.688 0.087 18832
2922 1 10 . 1 1 34 34 ASP N N 34 122.430 122.430 121.529 0.901 18832
2923 1 10 . 1 1 34 34 ASP HA H 34 4.634 4.634 4.950 -0.316 18832
2924 1 10 . 1 1 34 34 ASP CA C 34 55.860 55.860 53.890 1.970 18832
2925 1 10 . 1 1 34 34 ASP CB C 34 41.310 41.310 42.667 -1.357 18832
2926 1 10 . 1 1 34 34 ASP H H 34 8.686 8.686 7.888 0.798 18832
2927 1 10 . 1 1 35 35 THR N N 35 117.980 117.980 117.690 0.290 18832
2928 1 10 . 1 1 35 35 THR HA H 35 5.154 5.154 5.191 -0.037 18832
2929 1 10 . 1 1 35 35 THR CA C 35 61.450 61.450 62.002 -0.552 18832
2930 1 10 . 1 1 35 35 THR CB C 35 69.090 69.090 70.143 -1.053 18832
2931 1 10 . 1 1 35 35 THR H H 35 8.392 8.392 8.486 -0.094 18832
2932 1 10 . 1 1 36 36 VAL N N 36 118.200 118.200 117.807 0.393 18832
2933 1 10 . 1 1 36 36 VAL HA H 36 5.152 5.152 4.701 0.451 18832
2934 1 10 . 1 1 36 36 VAL CA C 36 57.910 57.910 60.227 -2.317 18832
2935 1 10 . 1 1 36 36 VAL CB C 36 34.190 34.190 34.589 -0.399 18832
2936 1 10 . 1 1 36 36 VAL H H 36 9.016 9.016 8.986 0.030 18832
2937 1 10 . 1 1 37 37 HIS N N 37 122.190 122.190 126.039 -3.849 18832
2938 1 10 . 1 1 37 37 HIS HA H 37 4.811 4.811 4.963 -0.152 18832
2939 1 10 . 1 1 37 37 HIS CA C 37 52.560 52.560 53.201 -0.641 18832
2940 1 10 . 1 1 37 37 HIS CB C 37 31.260 31.260 30.931 0.329 18832
2941 1 10 . 1 1 37 37 HIS H H 37 8.491 8.491 8.832 -0.341 18832
2942 1 10 . 1 1 38 38 ILE N N 38 126.650 126.650 126.937 -0.287 18832
2943 1 10 . 1 1 38 38 ILE HA H 38 3.750 3.750 4.237 -0.487 18832
2944 1 10 . 1 1 38 38 ILE CA C 38 61.640 61.640 62.254 -0.614 18832
2945 1 10 . 1 1 38 38 ILE CB C 38 38.880 38.880 37.988 0.892 18832
2946 1 10 . 1 1 38 38 ILE H H 38 8.638 8.638 8.912 -0.274 18832
2947 1 10 . 1 1 39 39 LEU N N 39 126.180 126.180 124.486 1.694 18832
2948 1 10 . 1 1 39 39 LEU HA H 39 4.380 4.380 4.706 -0.326 18832
2949 1 10 . 1 1 39 39 LEU CA C 39 55.490 55.490 55.564 -0.074 18832
2950 1 10 . 1 1 39 39 LEU CB C 39 43.750 43.750 43.470 0.280 18832
2951 1 10 . 1 1 39 39 LEU H H 39 9.163 9.163 8.911 0.252 18832
2952 1 10 . 1 1 40 40 GLU N N 40 115.160 115.160 117.697 -2.537 18832
2953 1 10 . 1 1 40 40 GLU HA H 40 5.020 5.020 4.819 0.201 18832
2954 1 10 . 1 1 40 40 GLU CA C 40 55.090 55.090 55.132 -0.042 18832
2955 1 10 . 1 1 40 40 GLU CB C 40 35.730 35.730 33.579 2.151 18832
2956 1 10 . 1 1 40 40 GLU H H 40 7.852 7.852 7.680 0.172 18832
2957 1 10 . 1 1 41 41 THR HA H 41 4.270 4.270 4.497 -0.227 18832
2958 1 10 . 1 1 41 41 THR CA C 41 61.250 61.250 61.377 -0.127 18832
2959 1 10 . 1 1 41 41 THR CB C 41 71.410 71.410 70.664 0.746 18832
2960 1 10 . 1 1 42 42 TYR HA H 42 4.550 4.550 4.491 0.059 18832
2961 1 10 . 1 1 43 43 GLU N N 43 124.100 124.100 120.302 3.798 18832
2962 1 10 . 1 1 43 43 GLU HA H 43 3.740 3.740 4.342 -0.602 18832
2963 1 10 . 1 1 43 43 GLU H H 43 8.590 8.590 8.097 0.493 18832
2964 1 10 . 1 1 44 44 GLY N N 44 110.789 110.789 112.610 -1.821 18832
2965 1 10 . 1 1 44 44 GLY CA C 44 45.440 45.440 45.631 -0.191 18832
2966 1 10 . 1 1 44 44 GLY H H 44 8.432 8.432 8.511 -0.079 18832
2967 1 10 . 1 1 45 45 TRP HA H 45 4.690 4.690 4.675 0.015 18832
2968 1 10 . 1 1 45 45 TRP CA C 45 57.550 57.550 55.499 2.051 18832
2969 1 10 . 1 1 46 46 TYR HA H 46 5.600 5.600 4.844 0.756 18832
2970 1 10 . 1 1 46 46 TYR CA C 46 54.060 54.060 54.972 -0.912 18832
2971 1 10 . 1 1 46 46 TYR CB C 46 42.650 42.650 40.695 1.955 18832
2972 1 10 . 1 1 47 47 ARG N N 47 118.100 118.100 119.538 -1.438 18832
2973 1 10 . 1 1 47 47 ARG HA H 47 5.094 5.094 5.058 0.036 18832
2974 1 10 . 1 1 47 47 ARG CA C 47 54.060 54.060 54.133 -0.072 18832
2975 1 10 . 1 1 47 47 ARG CB C 47 33.250 33.250 33.763 -0.513 18832
2976 1 10 . 1 1 47 47 ARG H H 47 8.492 8.492 8.415 0.077 18832
2977 1 10 . 1 1 48 48 GLY N N 48 114.000 114.000 109.451 4.549 18832
2978 1 10 . 1 1 48 48 GLY CA C 48 46.560 46.560 46.203 0.357 18832
2979 1 10 . 1 1 48 48 GLY H H 48 9.183 9.183 8.707 0.476 18832
2980 1 10 . 1 1 49 49 TYR N N 49 116.100 116.100 115.373 0.727 18832
2981 1 10 . 1 1 49 49 TYR HA H 49 5.373 5.373 5.122 0.251 18832
2982 1 10 . 1 1 49 49 TYR CA C 49 55.110 55.110 55.563 -0.453 18832
2983 1 10 . 1 1 49 49 TYR CB C 49 40.750 40.750 40.679 0.071 18832
2984 1 10 . 1 1 49 49 TYR H H 49 8.194 8.194 7.982 0.212 18832
2985 1 10 . 1 1 50 50 THR N N 50 112.350 112.350 115.090 -2.740 18832
2986 1 10 . 1 1 50 50 THR HA H 50 5.105 5.105 4.641 0.464 18832
2987 1 10 . 1 1 50 50 THR CA C 50 59.770 59.770 61.309 -1.539 18832
2988 1 10 . 1 1 50 50 THR CB C 50 69.460 69.460 69.775 -0.315 18832
2989 1 10 . 1 1 50 50 THR H H 50 9.441 9.441 8.832 0.609 18832
2990 1 10 . 1 1 51 51 LEU N N 51 121.260 121.260 121.924 -0.664 18832
2991 1 10 . 1 1 51 51 LEU HA H 51 4.236 4.236 4.079 0.157 18832
2992 1 10 . 1 1 51 51 LEU CA C 51 56.790 56.790 56.916 -0.126 18832
2993 1 10 . 1 1 51 51 LEU CB C 51 40.000 40.000 41.139 -1.139 18832
2994 1 10 . 1 1 51 51 LEU H H 51 8.310 8.310 8.244 0.066 18832
2995 1 10 . 1 1 52 52 ARG N N 52 116.570 116.570 117.753 -1.183 18832
2996 1 10 . 1 1 52 52 ARG HA H 52 4.250 4.250 4.127 0.123 18832
2997 1 10 . 1 1 52 52 ARG CA C 52 57.350 57.350 58.471 -1.121 18832
2998 1 10 . 1 1 52 52 ARG CB C 52 30.510 30.510 30.681 -0.171 18832
2999 1 10 . 1 1 52 52 ARG H H 52 8.047 8.047 8.340 -0.293 18832
3000 1 10 . 1 1 53 53 LYS N N 53 122.660 122.660 117.823 4.837 18832
3001 1 10 . 1 1 53 53 LYS HA H 53 4.616 4.616 4.545 0.071 18832
3002 1 10 . 1 1 53 53 LYS CA C 53 54.620 54.620 55.391 -0.770 18832
3003 1 10 . 1 1 53 53 LYS CB C 53 32.860 32.860 32.376 0.484 18832
3004 1 10 . 1 1 53 53 LYS H H 53 7.649 7.649 7.857 -0.208 18832
3005 1 10 . 1 1 54 54 LYS N N 54 125.010 125.010 122.000 3.010 18832
3006 1 10 . 1 1 54 54 LYS HA H 54 4.090 4.090 4.308 -0.218 18832
3007 1 10 . 1 1 54 54 LYS CA C 54 58.470 58.470 58.276 0.194 18832
3008 1 10 . 1 1 54 54 LYS CB C 54 32.130 32.130 32.406 -0.276 18832
3009 1 10 . 1 1 54 54 LYS H H 54 8.496 8.496 8.649 -0.153 18832
3010 1 10 . 1 1 55 55 SER N N 55 110.240 110.240 113.656 -3.416 18832
3011 1 10 . 1 1 55 55 SER HA H 55 4.122 4.122 4.186 -0.064 18832
3012 1 10 . 1 1 55 55 SER CA C 55 58.960 58.960 60.048 -1.088 18832
3013 1 10 . 1 1 55 55 SER CB C 55 63.310 63.310 63.517 -0.206 18832
3014 1 10 . 1 1 55 55 SER H H 55 7.857 7.857 8.239 -0.382 18832
3015 1 10 . 1 1 56 56 LYS N N 56 124.070 124.070 121.231 2.839 18832
3016 1 10 . 1 1 56 56 LYS HA H 56 4.668 4.668 4.361 0.307 18832
3017 1 10 . 1 1 56 56 LYS CA C 56 54.810 54.810 55.911 -1.101 18832
3018 1 10 . 1 1 56 56 LYS CB C 56 33.250 33.250 33.491 -0.241 18832
3019 1 10 . 1 1 56 56 LYS H H 56 7.473 7.473 7.588 -0.115 18832
3020 1 10 . 1 1 57 57 LYS N N 57 125.940 125.940 120.107 5.833 18832
3021 1 10 . 1 1 57 57 LYS HA H 57 5.341 5.341 4.863 0.478 18832
3022 1 10 . 1 1 57 57 LYS CA C 57 54.620 54.620 54.907 -0.287 18832
3023 1 10 . 1 1 57 57 LYS CB C 57 34.240 34.240 36.360 -2.120 18832
3024 1 10 . 1 1 57 57 LYS H H 57 8.474 8.474 8.174 0.300 18832
3025 1 10 . 1 1 58 58 GLY N N 58 109.540 109.540 107.128 2.412 18832
3026 1 10 . 1 1 58 58 GLY CA C 58 45.620 45.620 45.465 0.155 18832
3027 1 10 . 1 1 58 58 GLY H H 58 9.075 9.075 8.471 0.604 18832
3028 1 10 . 1 1 59 59 ILE N N 59 113.900 113.900 115.356 -1.456 18832
3029 1 10 . 1 1 59 59 ILE HA H 59 6.000 6.000 5.254 0.746 18832
3030 1 10 . 1 1 59 59 ILE CA C 59 59.590 59.590 57.960 1.630 18832
3031 1 10 . 1 1 59 59 ILE CB C 59 41.140 41.140 41.193 -0.053 18832
3032 1 10 . 1 1 59 59 ILE H H 59 8.628 8.628 7.669 0.959 18832
3033 1 10 . 1 1 60 60 PHE N N 60 117.040 117.040 116.020 1.020 18832
3034 1 10 . 1 1 60 60 PHE HA H 60 5.120 5.120 5.505 -0.385 18832
3035 1 10 . 1 1 60 60 PHE CA C 60 54.060 54.060 55.015 -0.955 18832
3036 1 10 . 1 1 60 60 PHE CB C 60 37.190 37.190 39.893 -2.703 18832
3037 1 10 . 1 1 60 60 PHE H H 60 8.724 8.724 8.147 0.577 18832
3038 1 10 . 1 1 61 61 PRO HA H 61 3.480 3.480 4.700 -1.220 18832
3039 1 10 . 1 1 61 61 PRO CA C 61 62.200 62.200 62.231 -0.031 18832
3040 1 10 . 1 1 61 61 PRO CB C 61 31.190 31.190 32.349 -1.159 18832
3041 1 10 . 1 1 62 62 ALA N N 62 124.770 124.770 127.506 -2.736 18832
3042 1 10 . 1 1 62 62 ALA HA H 62 3.710 3.710 3.992 -0.282 18832
3043 1 10 . 1 1 62 62 ALA CA C 62 54.370 54.370 54.319 0.051 18832
3044 1 10 . 1 1 62 62 ALA CB C 62 17.650 17.650 18.195 -0.545 18832
3045 1 10 . 1 1 62 62 ALA H H 62 7.898 7.898 8.157 -0.259 18832
3046 1 10 . 1 1 63 63 SER N N 63 109.700 109.700 114.780 -5.080 18832
3047 1 10 . 1 1 63 63 SER HA H 63 4.200 4.200 4.196 0.004 18832
3048 1 10 . 1 1 63 63 SER CA C 63 59.400 59.400 60.345 -0.945 18832
3049 1 10 . 1 1 63 63 SER CB C 63 62.380 62.380 62.909 -0.529 18832
3050 1 10 . 1 1 63 63 SER H H 63 8.030 8.030 8.385 -0.355 18832
3051 1 10 . 1 1 64 64 TYR N N 64 120.300 120.300 113.151 7.149 18832
3052 1 10 . 1 1 64 64 TYR HA H 64 4.250 4.250 4.453 -0.203 18832
3053 1 10 . 1 1 64 64 TYR CA C 64 57.720 57.720 54.780 2.940 18832
3054 1 10 . 1 1 64 64 TYR CB C 64 37.560 37.560 36.984 0.576 18832
3055 1 10 . 1 1 64 64 TYR H H 64 7.128 7.128 7.087 0.041 18832
3056 1 10 . 1 1 65 65 ILE N N 65 118.000 118.000 121.010 -3.010 18832
3057 1 10 . 1 1 65 65 ILE HA H 65 4.810 4.810 4.972 -0.162 18832
3058 1 10 . 1 1 65 65 ILE CA C 65 56.980 56.980 59.284 -2.304 18832
3059 1 10 . 1 1 65 65 ILE CB C 65 39.630 39.630 40.237 -0.607 18832
3060 1 10 . 1 1 65 65 ILE H H 65 7.671 7.671 7.644 0.027 18832
3061 1 10 . 1 1 66 66 HIS N N 66 124.300 124.300 126.887 -2.587 18832
3062 1 10 . 1 1 66 66 HIS HA H 66 5.130 5.130 4.908 0.222 18832
3063 1 10 . 1 1 66 66 HIS CA C 66 53.060 53.060 54.524 -1.464 18832
3064 1 10 . 1 1 66 66 HIS CB C 66 30.510 30.510 32.650 -2.140 18832
3065 1 10 . 1 1 66 66 HIS H H 66 9.159 9.159 8.672 0.487 18832
3066 1 10 . 1 1 67 67 LEU N N 67 127.580 127.580 128.369 -0.789 18832
3067 1 10 . 1 1 67 67 LEU HA H 67 4.570 4.570 4.378 0.192 18832
3068 1 10 . 1 1 67 67 LEU CA C 67 55.300 55.300 55.766 -0.466 18832
3069 1 10 . 1 1 67 67 LEU CB C 67 42.060 42.060 41.021 1.039 18832
3070 1 10 . 1 1 67 67 LEU H H 67 8.992 8.992 8.652 0.340 18832
3071 1 10 . 1 1 68 68 LYS N N 68 121.900 121.900 126.084 -4.184 18832
3072 1 10 . 1 1 68 68 LYS HA H 68 4.490 4.490 4.811 -0.321 18832
3073 1 10 . 1 1 68 68 LYS CA C 68 55.110 55.110 54.440 0.670 18832
3074 1 10 . 1 1 68 68 LYS CB C 68 34.610 34.610 34.570 0.040 18832
3075 1 10 . 1 1 68 68 LYS H H 68 8.499 8.499 8.200 0.299 18832
3076 1 10 . 1 1 69 69 GLU N N 69 122.190 122.190 120.497 1.693 18832
3077 1 10 . 1 1 69 69 GLU HA H 69 4.280 4.280 4.148 0.132 18832
3078 1 10 . 1 1 69 69 GLU CA C 69 56.610 56.610 58.635 -2.025 18832
3079 1 10 . 1 1 69 69 GLU CB C 69 30.330 30.330 30.337 -0.007 18832
3080 1 10 . 1 1 69 69 GLU H H 69 8.569 8.569 8.714 -0.145 18832
3081 1 10 . 1 1 70 70 ALA N N 70 123.370 123.370 119.809 3.561 18832
3082 1 10 . 1 1 70 70 ALA HA H 70 4.200 4.200 4.474 -0.274 18832
3083 1 10 . 1 1 70 70 ALA CA C 70 51.810 51.810 51.973 -0.163 18832
3084 1 10 . 1 1 70 70 ALA CB C 70 19.700 19.700 18.718 0.982 18832
3085 1 10 . 1 1 70 70 ALA H H 70 8.181 8.181 7.855 0.326 18832
3086 1 10 . 1 1 71 71 ILE N N 71 120.080 120.080 120.908 -0.828 18832
3087 1 10 . 1 1 71 71 ILE HA H 71 4.070 4.070 4.614 -0.544 18832
3088 1 10 . 1 1 71 71 ILE CA C 71 60.330 60.330 60.619 -0.289 18832
3089 1 10 . 1 1 71 71 ILE CB C 71 38.690 38.690 38.792 -0.102 18832
3090 1 10 . 1 1 71 71 ILE H H 71 7.776 7.776 8.304 -0.528 18832
3091 1 10 . 1 1 72 72 VAL N N 72 124.540 124.540 124.559 -0.019 18832
3092 1 10 . 1 1 72 72 VAL HA H 72 4.070 4.070 4.295 -0.225 18832
3093 1 10 . 1 1 72 72 VAL CA C 72 61.640 61.640 62.269 -0.629 18832
3094 1 10 . 1 1 72 72 VAL CB C 72 32.690 32.690 32.333 0.357 18832
3095 1 10 . 1 1 72 72 VAL H H 72 8.089 8.089 8.518 -0.429 18832
3096 1 10 . 1 1 73 73 GLU N N 73 125.940 125.940 128.539 -2.599 18832
3097 1 10 . 1 1 73 73 GLU HA H 73 4.280 4.280 4.268 0.012 18832
3098 1 10 . 1 1 73 73 GLU CA C 73 56.610 56.610 56.198 0.412 18832
3099 1 10 . 1 1 73 73 GLU CB C 73 30.710 30.710 29.596 1.113 18832
3100 1 10 . 1 1 73 73 GLU H H 73 8.464 8.464 8.784 -0.320 18832
3101 1 11 . 1 1 2 2 THR N N 2 116.400 116.400 115.282 1.118 18832
3102 1 11 . 1 1 2 2 THR HA H 2 4.120 4.120 4.646 -0.526 18832
3103 1 11 . 1 1 2 2 THR CA C 2 62.100 62.100 61.639 0.461 18832
3104 1 11 . 1 1 2 2 THR CB C 2 69.440 69.440 69.871 -0.431 18832
3105 1 11 . 1 1 2 2 THR H H 2 8.150 8.150 8.283 -0.133 18832
3106 1 11 . 1 1 3 3 ARG HA H 3 4.310 4.310 4.684 -0.374 18832
3107 1 11 . 1 1 3 3 ARG CA C 3 55.750 55.750 55.972 -0.223 18832
3108 1 11 . 1 1 3 3 ARG CB C 3 30.620 30.620 29.044 1.575 18832
3109 1 11 . 1 1 4 4 TRP N N 4 123.300 123.300 123.611 -0.311 18832
3110 1 11 . 1 1 4 4 TRP HA H 4 4.480 4.480 4.672 -0.192 18832
3111 1 11 . 1 1 4 4 TRP CA C 4 57.560 57.560 57.996 -0.436 18832
3112 1 11 . 1 1 4 4 TRP CB C 4 29.490 29.490 30.397 -0.907 18832
3113 1 11 . 1 1 4 4 TRP H H 4 8.108 8.108 8.228 -0.120 18832
3114 1 11 . 1 1 5 5 VAL HA H 5 4.570 4.570 4.304 0.266 18832
3115 1 11 . 1 1 5 5 VAL CB C 5 30.840 30.840 33.675 -2.835 18832
3116 1 11 . 1 1 6 6 PRO HA H 6 4.810 4.810 4.453 0.357 18832
3117 1 11 . 1 1 6 6 PRO CB C 6 32.210 32.210 32.670 -0.461 18832
3118 1 11 . 1 1 7 7 THR HA H 7 4.270 4.270 3.924 0.346 18832
3119 1 11 . 1 1 7 7 THR CA C 7 60.890 60.890 63.611 -2.721 18832
3120 1 11 . 1 1 7 7 THR CB C 7 70.140 70.140 69.033 1.107 18832
3121 1 11 . 1 1 8 8 LYS HA H 8 4.440 4.440 4.346 0.094 18832
3122 1 11 . 1 1 8 8 LYS CA C 8 55.980 55.980 54.992 0.987 18832
3123 1 11 . 1 1 8 8 LYS CB C 8 35.050 35.050 34.710 0.340 18832
3124 1 11 . 1 1 10 10 GLU HA H 10 4.580 4.580 4.303 0.277 18832
3125 1 11 . 1 1 10 10 GLU CA C 10 55.570 55.570 55.386 0.183 18832
3126 1 11 . 1 1 10 10 GLU CB C 10 30.780 30.780 30.857 -0.077 18832
3127 1 11 . 1 1 11 11 GLU N N 11 122.500 122.500 120.258 2.242 18832
3128 1 11 . 1 1 11 11 GLU HA H 11 4.340 4.340 4.304 0.036 18832
3129 1 11 . 1 1 11 11 GLU CA C 11 57.140 57.140 56.586 0.554 18832
3130 1 11 . 1 1 11 11 GLU CB C 11 29.400 29.400 30.498 -1.098 18832
3131 1 11 . 1 1 11 11 GLU H H 11 8.271 8.271 8.534 -0.263 18832
3132 1 11 . 1 1 12 12 LYS HA H 12 4.380 4.380 4.189 0.191 18832
3133 1 11 . 1 1 12 12 LYS CA C 12 55.790 55.790 58.095 -2.305 18832
3134 1 11 . 1 1 12 12 LYS CB C 12 33.600 33.600 33.505 0.095 18832
3135 1 11 . 1 1 13 13 TYR HA H 13 5.560 5.560 5.147 0.413 18832
3136 1 11 . 1 1 13 13 TYR CA C 13 55.860 55.860 54.985 0.875 18832
3137 1 11 . 1 1 13 13 TYR CB C 13 42.440 42.440 41.233 1.207 18832
3138 1 11 . 1 1 14 14 GLY N N 14 105.320 105.320 106.832 -1.512 18832
3139 1 11 . 1 1 14 14 GLY CA C 14 45.240 45.240 44.208 1.032 18832
3140 1 11 . 1 1 14 14 GLY H H 14 8.401 8.401 9.012 -0.611 18832
3141 1 11 . 1 1 15 15 VAL N N 15 118.900 118.900 118.641 0.259 18832
3142 1 11 . 1 1 15 15 VAL HA H 15 5.341 5.341 4.706 0.635 18832
3143 1 11 . 1 1 15 15 VAL CA C 15 59.210 59.210 60.403 -1.193 18832
3144 1 11 . 1 1 15 15 VAL CB C 15 35.740 35.740 36.383 -0.643 18832
3145 1 11 . 1 1 15 15 VAL H H 15 8.851 8.851 8.793 0.058 18832
3146 1 11 . 1 1 16 16 ALA N N 16 129.460 129.460 126.098 3.362 18832
3147 1 11 . 1 1 16 16 ALA HA H 16 5.000 5.000 5.142 -0.142 18832
3148 1 11 . 1 1 16 16 ALA CA C 16 52.000 52.000 50.124 1.875 18832
3149 1 11 . 1 1 16 16 ALA CB C 16 19.330 19.330 20.897 -1.567 18832
3150 1 11 . 1 1 16 16 ALA H H 16 9.113 9.113 8.598 0.515 18832
3151 1 11 . 1 1 17 17 PHE N N 17 124.070 124.070 120.449 3.621 18832
3152 1 11 . 1 1 17 17 PHE HA H 17 4.801 4.801 4.878 -0.077 18832
3153 1 11 . 1 1 17 17 PHE CA C 17 56.230 56.230 56.107 0.123 18832
3154 1 11 . 1 1 17 17 PHE CB C 17 40.000 40.000 38.588 1.412 18832
3155 1 11 . 1 1 17 17 PHE H H 17 8.787 8.787 7.638 1.149 18832
3156 1 11 . 1 1 18 18 TYR N N 18 118.210 118.210 123.528 -5.318 18832
3157 1 11 . 1 1 18 18 TYR HA H 18 4.483 4.483 4.356 0.127 18832
3158 1 11 . 1 1 18 18 TYR CA C 18 55.300 55.300 57.380 -2.080 18832
3159 1 11 . 1 1 18 18 TYR CB C 18 42.810 42.810 42.121 0.689 18832
3160 1 11 . 1 1 18 18 TYR H H 18 7.281 7.281 7.671 -0.390 18832
3161 1 11 . 1 1 19 19 ASN N N 19 116.800 116.800 119.083 -2.283 18832
3162 1 11 . 1 1 19 19 ASN HA H 19 4.710 4.710 4.818 -0.108 18832
3163 1 11 . 1 1 19 19 ASN CA C 19 52.940 52.940 52.659 0.281 18832
3164 1 11 . 1 1 19 19 ASN CB C 19 39.060 39.060 38.282 0.778 18832
3165 1 11 . 1 1 19 19 ASN H H 19 8.134 8.134 8.321 -0.187 18832
3166 1 11 . 1 1 20 20 TYR N N 20 122.190 122.190 122.110 0.080 18832
3167 1 11 . 1 1 20 20 TYR HA H 20 4.687 4.687 4.456 0.231 18832
3168 1 11 . 1 1 20 20 TYR CA C 20 57.720 57.720 58.892 -1.172 18832
3169 1 11 . 1 1 20 20 TYR CB C 20 42.250 42.250 39.871 2.379 18832
3170 1 11 . 1 1 20 20 TYR H H 20 8.993 8.993 7.922 1.071 18832
3171 1 11 . 1 1 21 21 ASP N N 21 128.520 128.520 127.523 0.997 18832
3172 1 11 . 1 1 21 21 ASP HA H 21 4.790 4.790 4.847 -0.057 18832
3173 1 11 . 1 1 21 21 ASP CA C 21 52.370 52.370 52.062 0.308 18832
3174 1 11 . 1 1 21 21 ASP CB C 21 41.130 41.130 42.223 -1.093 18832
3175 1 11 . 1 1 21 21 ASP H H 21 7.838 7.838 8.268 -0.430 18832
3176 1 11 . 1 1 22 22 ALA N N 22 125.240 125.240 126.115 -0.875 18832
3177 1 11 . 1 1 22 22 ALA HA H 22 4.051 4.051 4.608 -0.557 18832
3178 1 11 . 1 1 22 22 ALA CA C 22 52.940 52.940 53.310 -0.370 18832
3179 1 11 . 1 1 22 22 ALA CB C 22 20.450 20.450 19.696 0.754 18832
3180 1 11 . 1 1 22 22 ALA H H 22 8.103 8.103 8.488 -0.385 18832
3181 1 11 . 1 1 23 23 ARG N N 23 122.190 122.190 123.321 -1.131 18832
3182 1 11 . 1 1 23 23 ARG HA H 23 4.346 4.346 4.546 -0.200 18832
3183 1 11 . 1 1 23 23 ARG CA C 23 55.490 55.490 55.781 -0.291 18832
3184 1 11 . 1 1 23 23 ARG CB C 23 30.700 30.700 30.331 0.369 18832
3185 1 11 . 1 1 23 23 ARG H H 23 8.887 8.887 8.846 0.041 18832
3186 1 11 . 1 1 24 24 GLY N N 24 105.320 105.320 106.308 -0.988 18832
3187 1 11 . 1 1 24 24 GLY CA C 24 44.500 44.500 45.581 -1.081 18832
3188 1 11 . 1 1 24 24 GLY H H 24 7.258 7.258 7.654 -0.396 18832
3189 1 11 . 1 1 25 25 ALA N N 25 122.190 122.190 121.826 0.364 18832
3190 1 11 . 1 1 25 25 ALA HA H 25 4.166 4.166 4.247 -0.081 18832
3191 1 11 . 1 1 25 25 ALA CA C 25 54.440 54.440 53.902 0.538 18832
3192 1 11 . 1 1 25 25 ALA CB C 25 18.770 18.770 19.163 -0.393 18832
3193 1 11 . 1 1 25 25 ALA H H 25 8.627 8.627 8.468 0.159 18832
3194 1 11 . 1 1 26 26 ASP N N 26 114.690 114.690 115.825 -1.135 18832
3195 1 11 . 1 1 26 26 ASP HA H 26 4.700 4.700 4.501 0.199 18832
3196 1 11 . 1 1 26 26 ASP CA C 26 53.870 53.870 55.605 -1.735 18832
3197 1 11 . 1 1 26 26 ASP CB C 26 40.390 40.390 41.094 -0.704 18832
3198 1 11 . 1 1 26 26 ASP H H 26 8.955 8.955 8.538 0.417 18832
3199 1 11 . 1 1 27 27 GLU N N 27 118.910 118.910 116.569 2.341 18832
3200 1 11 . 1 1 27 27 GLU HA H 27 5.202 5.202 4.606 0.596 18832
3201 1 11 . 1 1 27 27 GLU CA C 27 54.930 54.930 55.461 -0.531 18832
3202 1 11 . 1 1 27 27 GLU CB C 27 32.880 32.880 33.197 -0.317 18832
3203 1 11 . 1 1 27 27 GLU H H 27 7.537 7.537 7.448 0.089 18832
3204 1 11 . 1 1 28 28 LEU N N 28 121.490 121.490 124.915 -3.425 18832
3205 1 11 . 1 1 28 28 LEU HA H 28 4.756 4.756 4.684 0.072 18832
3206 1 11 . 1 1 28 28 LEU CA C 28 53.120 53.120 53.938 -0.818 18832
3207 1 11 . 1 1 28 28 LEU CB C 28 44.500 44.500 44.421 0.079 18832
3208 1 11 . 1 1 28 28 LEU H H 28 8.890 8.890 8.446 0.444 18832
3209 1 11 . 1 1 29 29 SER N N 29 115.870 115.870 119.415 -3.545 18832
3210 1 11 . 1 1 29 29 SER HA H 29 5.009 5.009 4.694 0.315 18832
3211 1 11 . 1 1 29 29 SER CA C 29 58.470 58.470 58.526 -0.056 18832
3212 1 11 . 1 1 29 29 SER CB C 29 63.690 63.690 64.235 -0.545 18832
3213 1 11 . 1 1 29 29 SER H H 29 7.948 7.948 8.401 -0.453 18832
3214 1 11 . 1 1 30 30 LEU N N 30 121.260 121.260 123.465 -2.205 18832
3215 1 11 . 1 1 30 30 LEU HA H 30 4.776 4.776 4.693 0.083 18832
3216 1 11 . 1 1 30 30 LEU CA C 30 52.940 52.940 54.229 -1.289 18832
3217 1 11 . 1 1 30 30 LEU CB C 30 46.370 46.370 45.574 0.796 18832
3218 1 11 . 1 1 30 30 LEU H H 30 9.500 9.500 8.015 1.485 18832
3219 1 11 . 1 1 31 31 GLN N N 31 123.130 123.130 119.811 3.319 18832
3220 1 11 . 1 1 31 31 GLN HA H 31 5.065 5.065 5.008 0.057 18832
3221 1 11 . 1 1 31 31 GLN CA C 31 52.940 52.940 53.916 -0.976 18832
3222 1 11 . 1 1 31 31 GLN CB C 31 31.190 31.190 32.725 -1.535 18832
3223 1 11 . 1 1 31 31 GLN H H 31 9.147 9.147 8.434 0.713 18832
3224 1 11 . 1 1 32 32 ILE N N 32 120.790 120.790 119.876 0.914 18832
3225 1 11 . 1 1 32 32 ILE HA H 32 3.032 3.032 4.186 -1.154 18832
3226 1 11 . 1 1 32 32 ILE CA C 32 64.250 64.250 63.340 0.910 18832
3227 1 11 . 1 1 32 32 ILE CB C 32 37.940 37.940 37.770 0.170 18832
3228 1 11 . 1 1 32 32 ILE H H 32 8.016 8.016 8.416 -0.400 18832
3229 1 11 . 1 1 33 33 GLY N N 33 115.870 115.870 115.096 0.774 18832
3230 1 11 . 1 1 33 33 GLY CA C 33 44.500 44.500 44.762 -0.262 18832
3231 1 11 . 1 1 33 33 GLY H H 33 8.775 8.775 8.963 -0.189 18832
3232 1 11 . 1 1 34 34 ASP N N 34 122.430 122.430 122.066 0.364 18832
3233 1 11 . 1 1 34 34 ASP HA H 34 4.634 4.634 5.004 -0.370 18832
3234 1 11 . 1 1 34 34 ASP CA C 34 55.860 55.860 53.520 2.340 18832
3235 1 11 . 1 1 34 34 ASP CB C 34 41.310 41.310 42.361 -1.052 18832
3236 1 11 . 1 1 34 34 ASP H H 34 8.686 8.686 7.803 0.883 18832
3237 1 11 . 1 1 35 35 THR N N 35 117.980 117.980 115.474 2.506 18832
3238 1 11 . 1 1 35 35 THR HA H 35 5.154 5.154 4.959 0.195 18832
3239 1 11 . 1 1 35 35 THR CA C 35 61.450 61.450 61.766 -0.316 18832
3240 1 11 . 1 1 35 35 THR CB C 35 69.090 69.090 70.338 -1.248 18832
3241 1 11 . 1 1 35 35 THR H H 35 8.392 8.392 8.356 0.036 18832
3242 1 11 . 1 1 36 36 VAL N N 36 118.200 118.200 116.180 2.020 18832
3243 1 11 . 1 1 36 36 VAL HA H 36 5.152 5.152 4.502 0.650 18832
3244 1 11 . 1 1 36 36 VAL CA C 36 57.910 57.910 60.441 -2.531 18832
3245 1 11 . 1 1 36 36 VAL CB C 36 34.190 34.190 34.608 -0.418 18832
3246 1 11 . 1 1 36 36 VAL H H 36 9.016 9.016 8.749 0.267 18832
3247 1 11 . 1 1 37 37 HIS N N 37 122.190 122.190 126.133 -3.943 18832
3248 1 11 . 1 1 37 37 HIS HA H 37 4.811 4.811 5.035 -0.224 18832
3249 1 11 . 1 1 37 37 HIS CA C 37 52.560 52.560 53.792 -1.232 18832
3250 1 11 . 1 1 37 37 HIS CB C 37 31.260 31.260 30.555 0.705 18832
3251 1 11 . 1 1 37 37 HIS H H 37 8.491 8.491 8.973 -0.482 18832
3252 1 11 . 1 1 38 38 ILE N N 38 126.650 126.650 126.775 -0.125 18832
3253 1 11 . 1 1 38 38 ILE HA H 38 3.750 3.750 4.072 -0.322 18832
3254 1 11 . 1 1 38 38 ILE CA C 38 61.640 61.640 61.866 -0.226 18832
3255 1 11 . 1 1 38 38 ILE CB C 38 38.880 38.880 38.172 0.708 18832
3256 1 11 . 1 1 38 38 ILE H H 38 8.638 8.638 8.398 0.240 18832
3257 1 11 . 1 1 39 39 LEU N N 39 126.180 126.180 123.217 2.963 18832
3258 1 11 . 1 1 39 39 LEU HA H 39 4.380 4.380 4.601 -0.222 18832
3259 1 11 . 1 1 39 39 LEU CA C 39 55.490 55.490 55.120 0.370 18832
3260 1 11 . 1 1 39 39 LEU CB C 39 43.750 43.750 43.105 0.645 18832
3261 1 11 . 1 1 39 39 LEU H H 39 9.163 9.163 8.589 0.574 18832
3262 1 11 . 1 1 40 40 GLU N N 40 115.160 115.160 119.703 -4.543 18832
3263 1 11 . 1 1 40 40 GLU HA H 40 5.020 5.020 4.596 0.424 18832
3264 1 11 . 1 1 40 40 GLU CA C 40 55.090 55.090 55.426 -0.336 18832
3265 1 11 . 1 1 40 40 GLU CB C 40 35.730 35.730 33.681 2.049 18832
3266 1 11 . 1 1 40 40 GLU H H 40 7.852 7.852 7.779 0.073 18832
3267 1 11 . 1 1 41 41 THR HA H 41 4.270 4.270 4.490 -0.220 18832
3268 1 11 . 1 1 41 41 THR CA C 41 61.250 61.250 60.143 1.107 18832
3269 1 11 . 1 1 41 41 THR CB C 41 71.410 71.410 70.268 1.142 18832
3270 1 11 . 1 1 42 42 TYR HA H 42 4.550 4.550 4.186 0.364 18832
3271 1 11 . 1 1 43 43 GLU N N 43 124.100 124.100 118.423 5.677 18832
3272 1 11 . 1 1 43 43 GLU HA H 43 3.740 3.740 4.112 -0.372 18832
3273 1 11 . 1 1 43 43 GLU H H 43 8.590 8.590 8.553 0.037 18832
3274 1 11 . 1 1 44 44 GLY N N 44 110.789 110.789 110.538 0.251 18832
3275 1 11 . 1 1 44 44 GLY CA C 44 45.440 45.440 45.133 0.307 18832
3276 1 11 . 1 1 44 44 GLY H H 44 8.432 8.432 8.590 -0.158 18832
3277 1 11 . 1 1 45 45 TRP HA H 45 4.690 4.690 4.562 0.128 18832
3278 1 11 . 1 1 45 45 TRP CA C 45 57.550 57.550 56.471 1.079 18832
3279 1 11 . 1 1 46 46 TYR HA H 46 5.600 5.600 4.800 0.800 18832
3280 1 11 . 1 1 46 46 TYR CA C 46 54.060 54.060 54.909 -0.849 18832
3281 1 11 . 1 1 46 46 TYR CB C 46 42.650 42.650 40.943 1.707 18832
3282 1 11 . 1 1 47 47 ARG N N 47 118.100 118.100 121.229 -3.129 18832
3283 1 11 . 1 1 47 47 ARG HA H 47 5.094 5.094 4.812 0.282 18832
3284 1 11 . 1 1 47 47 ARG CA C 47 54.060 54.060 54.388 -0.328 18832
3285 1 11 . 1 1 47 47 ARG CB C 47 33.250 33.250 33.836 -0.586 18832
3286 1 11 . 1 1 47 47 ARG H H 47 8.492 8.492 8.932 -0.440 18832
3287 1 11 . 1 1 48 48 GLY N N 48 114.000 114.000 110.762 3.238 18832
3288 1 11 . 1 1 48 48 GLY CA C 48 46.560 46.560 46.002 0.558 18832
3289 1 11 . 1 1 48 48 GLY H H 48 9.183 9.183 8.861 0.322 18832
3290 1 11 . 1 1 49 49 TYR N N 49 116.100 116.100 115.389 0.711 18832
3291 1 11 . 1 1 49 49 TYR HA H 49 5.373 5.373 5.128 0.245 18832
3292 1 11 . 1 1 49 49 TYR CA C 49 55.110 55.110 55.936 -0.826 18832
3293 1 11 . 1 1 49 49 TYR CB C 49 40.750 40.750 40.439 0.311 18832
3294 1 11 . 1 1 49 49 TYR H H 49 8.194 8.194 8.116 0.078 18832
3295 1 11 . 1 1 50 50 THR N N 50 112.350 112.350 113.844 -1.494 18832
3296 1 11 . 1 1 50 50 THR HA H 50 5.105 5.105 4.581 0.524 18832
3297 1 11 . 1 1 50 50 THR CA C 50 59.770 59.770 60.289 -0.519 18832
3298 1 11 . 1 1 50 50 THR CB C 50 69.460 69.460 69.861 -0.401 18832
3299 1 11 . 1 1 50 50 THR H H 50 9.441 9.441 8.864 0.577 18832
3300 1 11 . 1 1 51 51 LEU N N 51 121.260 121.260 121.871 -0.611 18832
3301 1 11 . 1 1 51 51 LEU HA H 51 4.236 4.236 4.049 0.187 18832
3302 1 11 . 1 1 51 51 LEU CA C 51 56.790 56.790 57.382 -0.592 18832
3303 1 11 . 1 1 51 51 LEU CB C 51 40.000 40.000 41.416 -1.416 18832
3304 1 11 . 1 1 51 51 LEU H H 51 8.310 8.310 8.266 0.044 18832
3305 1 11 . 1 1 52 52 ARG N N 52 116.570 116.570 117.647 -1.077 18832
3306 1 11 . 1 1 52 52 ARG HA H 52 4.250 4.250 4.139 0.111 18832
3307 1 11 . 1 1 52 52 ARG CA C 52 57.350 57.350 58.662 -1.312 18832
3308 1 11 . 1 1 52 52 ARG CB C 52 30.510 30.510 30.448 0.062 18832
3309 1 11 . 1 1 52 52 ARG H H 52 8.047 8.047 8.452 -0.405 18832
3310 1 11 . 1 1 53 53 LYS N N 53 122.660 122.660 119.104 3.556 18832
3311 1 11 . 1 1 53 53 LYS HA H 53 4.616 4.616 4.614 0.002 18832
3312 1 11 . 1 1 53 53 LYS CA C 53 54.620 54.620 55.658 -1.038 18832
3313 1 11 . 1 1 53 53 LYS CB C 53 32.860 32.860 31.366 1.494 18832
3314 1 11 . 1 1 53 53 LYS H H 53 7.649 7.649 7.846 -0.197 18832
3315 1 11 . 1 1 54 54 LYS N N 54 125.010 125.010 121.984 3.026 18832
3316 1 11 . 1 1 54 54 LYS HA H 54 4.090 4.090 4.223 -0.133 18832
3317 1 11 . 1 1 54 54 LYS CA C 54 58.470 58.470 58.760 -0.290 18832
3318 1 11 . 1 1 54 54 LYS CB C 54 32.130 32.130 32.367 -0.237 18832
3319 1 11 . 1 1 54 54 LYS H H 54 8.496 8.496 8.238 0.258 18832
3320 1 11 . 1 1 55 55 SER N N 55 110.240 110.240 115.407 -5.167 18832
3321 1 11 . 1 1 55 55 SER HA H 55 4.122 4.122 4.164 -0.042 18832
3322 1 11 . 1 1 55 55 SER CA C 55 58.960 58.960 60.196 -1.236 18832
3323 1 11 . 1 1 55 55 SER CB C 55 63.310 63.310 63.244 0.066 18832
3324 1 11 . 1 1 55 55 SER H H 55 7.857 7.857 8.369 -0.512 18832
3325 1 11 . 1 1 56 56 LYS N N 56 124.070 124.070 121.281 2.789 18832
3326 1 11 . 1 1 56 56 LYS HA H 56 4.668 4.668 4.288 0.380 18832
3327 1 11 . 1 1 56 56 LYS CA C 56 54.810 54.810 56.434 -1.625 18832
3328 1 11 . 1 1 56 56 LYS CB C 56 33.250 33.250 33.297 -0.048 18832
3329 1 11 . 1 1 56 56 LYS H H 56 7.473 7.473 7.721 -0.248 18832
3330 1 11 . 1 1 57 57 LYS N N 57 125.940 125.940 122.198 3.742 18832
3331 1 11 . 1 1 57 57 LYS HA H 57 5.341 5.341 4.815 0.526 18832
3332 1 11 . 1 1 57 57 LYS CA C 57 54.620 54.620 55.228 -0.608 18832
3333 1 11 . 1 1 57 57 LYS CB C 57 34.240 34.240 36.513 -2.273 18832
3334 1 11 . 1 1 57 57 LYS H H 57 8.474 8.474 8.271 0.203 18832
3335 1 11 . 1 1 58 58 GLY N N 58 109.540 109.540 109.074 0.466 18832
3336 1 11 . 1 1 58 58 GLY CA C 58 45.620 45.620 45.078 0.542 18832
3337 1 11 . 1 1 58 58 GLY H H 58 9.075 9.075 8.995 0.080 18832
3338 1 11 . 1 1 59 59 ILE N N 59 113.900 113.900 115.606 -1.706 18832
3339 1 11 . 1 1 59 59 ILE HA H 59 6.000 6.000 4.990 1.010 18832
3340 1 11 . 1 1 59 59 ILE CA C 59 59.590 59.590 58.510 1.080 18832
3341 1 11 . 1 1 59 59 ILE CB C 59 41.140 41.140 40.673 0.467 18832
3342 1 11 . 1 1 59 59 ILE H H 59 8.628 8.628 8.093 0.535 18832
3343 1 11 . 1 1 60 60 PHE N N 60 117.040 117.040 117.382 -0.342 18832
3344 1 11 . 1 1 60 60 PHE HA H 60 5.120 5.120 5.339 -0.219 18832
3345 1 11 . 1 1 60 60 PHE CA C 60 54.060 54.060 54.737 -0.677 18832
3346 1 11 . 1 1 60 60 PHE CB C 60 37.190 37.190 40.027 -2.837 18832
3347 1 11 . 1 1 60 60 PHE H H 60 8.724 8.724 8.542 0.182 18832
3348 1 11 . 1 1 61 61 PRO HA H 61 3.480 3.480 4.619 -1.139 18832
3349 1 11 . 1 1 61 61 PRO CA C 61 62.200 62.200 62.270 -0.070 18832
3350 1 11 . 1 1 61 61 PRO CB C 61 31.190 31.190 32.592 -1.402 18832
3351 1 11 . 1 1 62 62 ALA N N 62 124.770 124.770 125.595 -0.825 18832
3352 1 11 . 1 1 62 62 ALA HA H 62 3.710 3.710 3.984 -0.274 18832
3353 1 11 . 1 1 62 62 ALA CA C 62 54.370 54.370 54.410 -0.040 18832
3354 1 11 . 1 1 62 62 ALA CB C 62 17.650 17.650 18.040 -0.390 18832
3355 1 11 . 1 1 62 62 ALA H H 62 7.898 7.898 8.332 -0.434 18832
3356 1 11 . 1 1 63 63 SER N N 63 109.700 109.700 113.609 -3.909 18832
3357 1 11 . 1 1 63 63 SER HA H 63 4.200 4.200 4.218 -0.018 18832
3358 1 11 . 1 1 63 63 SER CA C 63 59.400 59.400 60.217 -0.817 18832
3359 1 11 . 1 1 63 63 SER CB C 63 62.380 62.380 63.012 -0.632 18832
3360 1 11 . 1 1 63 63 SER H H 63 8.030 8.030 8.181 -0.151 18832
3361 1 11 . 1 1 64 64 TYR N N 64 120.300 120.300 114.768 5.532 18832
3362 1 11 . 1 1 64 64 TYR HA H 64 4.250 4.250 4.630 -0.380 18832
3363 1 11 . 1 1 64 64 TYR CA C 64 57.720 57.720 55.378 2.342 18832
3364 1 11 . 1 1 64 64 TYR CB C 64 37.560 37.560 38.131 -0.571 18832
3365 1 11 . 1 1 64 64 TYR H H 64 7.128 7.128 6.825 0.303 18832
3366 1 11 . 1 1 65 65 ILE N N 65 118.000 118.000 121.345 -3.345 18832
3367 1 11 . 1 1 65 65 ILE HA H 65 4.810 4.810 4.739 0.071 18832
3368 1 11 . 1 1 65 65 ILE CA C 65 56.980 56.980 59.297 -2.317 18832
3369 1 11 . 1 1 65 65 ILE CB C 65 39.630 39.630 38.863 0.767 18832
3370 1 11 . 1 1 65 65 ILE H H 65 7.671 7.671 7.435 0.236 18832
3371 1 11 . 1 1 66 66 HIS N N 66 124.300 124.300 126.995 -2.695 18832
3372 1 11 . 1 1 66 66 HIS HA H 66 5.130 5.130 4.987 0.143 18832
3373 1 11 . 1 1 66 66 HIS CA C 66 53.060 53.060 54.776 -1.716 18832
3374 1 11 . 1 1 66 66 HIS CB C 66 30.510 30.510 32.853 -2.343 18832
3375 1 11 . 1 1 66 66 HIS H H 66 9.159 9.159 8.769 0.390 18832
3376 1 11 . 1 1 67 67 LEU N N 67 127.580 127.580 127.234 0.346 18832
3377 1 11 . 1 1 67 67 LEU HA H 67 4.570 4.570 4.261 0.309 18832
3378 1 11 . 1 1 67 67 LEU CA C 67 55.300 55.300 56.119 -0.819 18832
3379 1 11 . 1 1 67 67 LEU CB C 67 42.060 42.060 42.193 -0.133 18832
3380 1 11 . 1 1 67 67 LEU H H 67 8.992 8.992 8.595 0.397 18832
3381 1 11 . 1 1 68 68 LYS N N 68 121.900 121.900 121.866 0.034 18832
3382 1 11 . 1 1 68 68 LYS HA H 68 4.490 4.490 4.716 -0.226 18832
3383 1 11 . 1 1 68 68 LYS CA C 68 55.110 55.110 54.467 0.643 18832
3384 1 11 . 1 1 68 68 LYS CB C 68 34.610 34.610 34.913 -0.302 18832
3385 1 11 . 1 1 68 68 LYS H H 68 8.499 8.499 8.329 0.170 18832
3386 1 11 . 1 1 69 69 GLU N N 69 122.190 122.190 120.664 1.526 18832
3387 1 11 . 1 1 69 69 GLU HA H 69 4.280 4.280 4.232 0.048 18832
3388 1 11 . 1 1 69 69 GLU CA C 69 56.610 56.610 55.992 0.618 18832
3389 1 11 . 1 1 69 69 GLU CB C 69 30.330 30.330 29.625 0.705 18832
3390 1 11 . 1 1 69 69 GLU H H 69 8.569 8.569 8.677 -0.108 18832
3391 1 11 . 1 1 70 70 ALA N N 70 123.370 123.370 128.450 -5.080 18832
3392 1 11 . 1 1 70 70 ALA HA H 70 4.200 4.200 4.252 -0.052 18832
3393 1 11 . 1 1 70 70 ALA CA C 70 51.810 51.810 52.565 -0.755 18832
3394 1 11 . 1 1 70 70 ALA CB C 70 19.700 19.700 19.089 0.611 18832
3395 1 11 . 1 1 70 70 ALA H H 70 8.181 8.181 8.069 0.112 18832
3396 1 11 . 1 1 71 71 ILE N N 71 120.080 120.080 121.250 -1.170 18832
3397 1 11 . 1 1 71 71 ILE HA H 71 4.070 4.070 4.559 -0.489 18832
3398 1 11 . 1 1 71 71 ILE CA C 71 60.330 60.330 60.972 -0.642 18832
3399 1 11 . 1 1 71 71 ILE CB C 71 38.690 38.690 39.040 -0.350 18832
3400 1 11 . 1 1 71 71 ILE H H 71 7.776 7.776 8.284 -0.508 18832
3401 1 11 . 1 1 72 72 VAL N N 72 124.540 124.540 125.951 -1.411 18832
3402 1 11 . 1 1 72 72 VAL HA H 72 4.070 4.070 4.378 -0.308 18832
3403 1 11 . 1 1 72 72 VAL CA C 72 61.640 61.640 61.081 0.559 18832
3404 1 11 . 1 1 72 72 VAL CB C 72 32.690 32.690 35.488 -2.798 18832
3405 1 11 . 1 1 72 72 VAL H H 72 8.089 8.089 8.304 -0.215 18832
3406 1 11 . 1 1 73 73 GLU N N 73 125.940 125.940 125.348 0.592 18832
3407 1 11 . 1 1 73 73 GLU HA H 73 4.280 4.280 4.325 -0.045 18832
3408 1 11 . 1 1 73 73 GLU CA C 73 56.610 56.610 57.279 -0.669 18832
3409 1 11 . 1 1 73 73 GLU CB C 73 30.710 30.710 29.901 0.809 18832
3410 1 11 . 1 1 73 73 GLU H H 73 8.464 8.464 8.600 -0.136 18832
3411 1 12 . 1 1 2 2 THR N N 2 116.400 116.400 114.651 1.749 18832
3412 1 12 . 1 1 2 2 THR HA H 2 4.120 4.120 4.630 -0.510 18832
3413 1 12 . 1 1 2 2 THR CA C 2 62.100 62.100 61.652 0.448 18832
3414 1 12 . 1 1 2 2 THR CB C 2 69.440 69.440 69.123 0.317 18832
3415 1 12 . 1 1 2 2 THR H H 2 8.150 8.150 8.055 0.095 18832
3416 1 12 . 1 1 3 3 ARG HA H 3 4.310 4.310 4.594 -0.284 18832
3417 1 12 . 1 1 3 3 ARG CA C 3 55.750 55.750 55.863 -0.113 18832
3418 1 12 . 1 1 3 3 ARG CB C 3 30.620 30.620 28.979 1.641 18832
3419 1 12 . 1 1 4 4 TRP N N 4 123.300 123.300 120.744 2.556 18832
3420 1 12 . 1 1 4 4 TRP HA H 4 4.480 4.480 4.783 -0.303 18832
3421 1 12 . 1 1 4 4 TRP CA C 4 57.560 57.560 56.974 0.586 18832
3422 1 12 . 1 1 4 4 TRP CB C 4 29.490 29.490 31.190 -1.700 18832
3423 1 12 . 1 1 4 4 TRP H H 4 8.108 8.108 7.712 0.396 18832
3424 1 12 . 1 1 5 5 VAL HA H 5 4.570 4.570 4.489 0.081 18832
3425 1 12 . 1 1 5 5 VAL CB C 5 30.840 30.840 32.806 -1.966 18832
3426 1 12 . 1 1 6 6 PRO HA H 6 4.810 4.810 4.560 0.250 18832
3427 1 12 . 1 1 6 6 PRO CB C 6 32.210 32.210 32.162 0.048 18832
3428 1 12 . 1 1 7 7 THR HA H 7 4.270 4.270 4.176 0.094 18832
3429 1 12 . 1 1 7 7 THR CA C 7 60.890 60.890 60.606 0.284 18832
3430 1 12 . 1 1 7 7 THR CB C 7 70.140 70.140 67.132 3.008 18832
3431 1 12 . 1 1 8 8 LYS HA H 8 4.440 4.440 4.202 0.238 18832
3432 1 12 . 1 1 8 8 LYS CA C 8 55.980 55.980 56.128 -0.148 18832
3433 1 12 . 1 1 8 8 LYS CB C 8 35.050 35.050 33.012 2.038 18832
3434 1 12 . 1 1 10 10 GLU HA H 10 4.580 4.580 4.394 0.186 18832
3435 1 12 . 1 1 10 10 GLU CA C 10 55.570 55.570 54.968 0.602 18832
3436 1 12 . 1 1 10 10 GLU CB C 10 30.780 30.780 31.719 -0.939 18832
3437 1 12 . 1 1 11 11 GLU N N 11 122.500 122.500 120.395 2.105 18832
3438 1 12 . 1 1 11 11 GLU HA H 11 4.340 4.340 4.441 -0.101 18832
3439 1 12 . 1 1 11 11 GLU CA C 11 57.140 57.140 56.987 0.152 18832
3440 1 12 . 1 1 11 11 GLU CB C 11 29.400 29.400 30.702 -1.302 18832
3441 1 12 . 1 1 11 11 GLU H H 11 8.271 8.271 8.745 -0.474 18832
3442 1 12 . 1 1 12 12 LYS HA H 12 4.380 4.380 4.396 -0.016 18832
3443 1 12 . 1 1 12 12 LYS CA C 12 55.790 55.790 56.286 -0.496 18832
3444 1 12 . 1 1 12 12 LYS CB C 12 33.600 33.600 34.880 -1.280 18832
3445 1 12 . 1 1 13 13 TYR HA H 13 5.560 5.560 4.553 1.007 18832
3446 1 12 . 1 1 13 13 TYR CA C 13 55.860 55.860 55.767 0.093 18832
3447 1 12 . 1 1 13 13 TYR CB C 13 42.440 42.440 39.616 2.824 18832
3448 1 12 . 1 1 14 14 GLY N N 14 105.320 105.320 105.712 -0.392 18832
3449 1 12 . 1 1 14 14 GLY CA C 14 45.240 45.240 43.962 1.278 18832
3450 1 12 . 1 1 14 14 GLY H H 14 8.401 8.401 8.851 -0.450 18832
3451 1 12 . 1 1 15 15 VAL N N 15 118.900 118.900 118.440 0.460 18832
3452 1 12 . 1 1 15 15 VAL HA H 15 5.341 5.341 4.522 0.819 18832
3453 1 12 . 1 1 15 15 VAL CA C 15 59.210 59.210 60.798 -1.588 18832
3454 1 12 . 1 1 15 15 VAL CB C 15 35.740 35.740 34.502 1.238 18832
3455 1 12 . 1 1 15 15 VAL H H 15 8.851 8.851 8.810 0.041 18832
3456 1 12 . 1 1 16 16 ALA N N 16 129.460 129.460 128.227 1.233 18832
3457 1 12 . 1 1 16 16 ALA HA H 16 5.000 5.000 5.277 -0.277 18832
3458 1 12 . 1 1 16 16 ALA CA C 16 52.000 52.000 49.926 2.074 18832
3459 1 12 . 1 1 16 16 ALA CB C 16 19.330 19.330 20.892 -1.562 18832
3460 1 12 . 1 1 16 16 ALA H H 16 9.113 9.113 8.524 0.589 18832
3461 1 12 . 1 1 17 17 PHE N N 17 124.070 124.070 120.473 3.597 18832
3462 1 12 . 1 1 17 17 PHE HA H 17 4.801 4.801 4.873 -0.072 18832
3463 1 12 . 1 1 17 17 PHE CA C 17 56.230 56.230 55.955 0.275 18832
3464 1 12 . 1 1 17 17 PHE CB C 17 40.000 40.000 38.649 1.351 18832
3465 1 12 . 1 1 17 17 PHE H H 17 8.787 8.787 7.660 1.127 18832
3466 1 12 . 1 1 18 18 TYR N N 18 118.210 118.210 123.365 -5.155 18832
3467 1 12 . 1 1 18 18 TYR HA H 18 4.483 4.483 4.351 0.132 18832
3468 1 12 . 1 1 18 18 TYR CA C 18 55.300 55.300 57.309 -2.009 18832
3469 1 12 . 1 1 18 18 TYR CB C 18 42.810 42.810 41.986 0.824 18832
3470 1 12 . 1 1 18 18 TYR H H 18 7.281 7.281 7.658 -0.377 18832
3471 1 12 . 1 1 19 19 ASN N N 19 116.800 116.800 119.380 -2.580 18832
3472 1 12 . 1 1 19 19 ASN HA H 19 4.710 4.710 4.838 -0.128 18832
3473 1 12 . 1 1 19 19 ASN CA C 19 52.940 52.940 52.839 0.101 18832
3474 1 12 . 1 1 19 19 ASN CB C 19 39.060 39.060 38.706 0.354 18832
3475 1 12 . 1 1 19 19 ASN H H 19 8.134 8.134 8.359 -0.225 18832
3476 1 12 . 1 1 20 20 TYR N N 20 122.190 122.190 122.371 -0.181 18832
3477 1 12 . 1 1 20 20 TYR HA H 20 4.687 4.687 4.561 0.126 18832
3478 1 12 . 1 1 20 20 TYR CA C 20 57.720 57.720 58.059 -0.339 18832
3479 1 12 . 1 1 20 20 TYR CB C 20 42.250 42.250 40.124 2.126 18832
3480 1 12 . 1 1 20 20 TYR H H 20 8.993 8.993 7.948 1.045 18832
3481 1 12 . 1 1 21 21 ASP N N 21 128.520 128.520 125.422 3.098 18832
3482 1 12 . 1 1 21 21 ASP HA H 21 4.790 4.790 4.587 0.203 18832
3483 1 12 . 1 1 21 21 ASP CA C 21 52.370 52.370 52.292 0.078 18832
3484 1 12 . 1 1 21 21 ASP CB C 21 41.130 41.130 43.142 -2.012 18832
3485 1 12 . 1 1 21 21 ASP H H 21 7.838 7.838 8.045 -0.207 18832
3486 1 12 . 1 1 22 22 ALA N N 22 125.240 125.240 126.304 -1.064 18832
3487 1 12 . 1 1 22 22 ALA HA H 22 4.051 4.051 3.982 0.069 18832
3488 1 12 . 1 1 22 22 ALA CA C 22 52.940 52.940 52.913 0.027 18832
3489 1 12 . 1 1 22 22 ALA CB C 22 20.450 20.450 19.491 0.959 18832
3490 1 12 . 1 1 22 22 ALA H H 22 8.103 8.103 8.285 -0.182 18832
3491 1 12 . 1 1 23 23 ARG N N 23 122.190 122.190 123.541 -1.351 18832
3492 1 12 . 1 1 23 23 ARG HA H 23 4.346 4.346 4.180 0.166 18832
3493 1 12 . 1 1 23 23 ARG CA C 23 55.490 55.490 56.982 -1.492 18832
3494 1 12 . 1 1 23 23 ARG CB C 23 30.700 30.700 30.576 0.124 18832
3495 1 12 . 1 1 23 23 ARG H H 23 8.887 8.887 8.630 0.257 18832
3496 1 12 . 1 1 24 24 GLY N N 24 105.320 105.320 104.782 0.538 18832
3497 1 12 . 1 1 24 24 GLY CA C 24 44.500 44.500 44.627 -0.127 18832
3498 1 12 . 1 1 24 24 GLY H H 24 7.258 7.258 7.560 -0.302 18832
3499 1 12 . 1 1 25 25 ALA N N 25 122.190 122.190 121.546 0.644 18832
3500 1 12 . 1 1 25 25 ALA HA H 25 4.166 4.166 4.245 -0.079 18832
3501 1 12 . 1 1 25 25 ALA CA C 25 54.440 54.440 54.081 0.359 18832
3502 1 12 . 1 1 25 25 ALA CB C 25 18.770 18.770 19.018 -0.248 18832
3503 1 12 . 1 1 25 25 ALA H H 25 8.627 8.627 8.468 0.159 18832
3504 1 12 . 1 1 26 26 ASP N N 26 114.690 114.690 116.476 -1.786 18832
3505 1 12 . 1 1 26 26 ASP HA H 26 4.700 4.700 4.488 0.212 18832
3506 1 12 . 1 1 26 26 ASP CA C 26 53.870 53.870 55.993 -2.123 18832
3507 1 12 . 1 1 26 26 ASP CB C 26 40.390 40.390 40.724 -0.334 18832
3508 1 12 . 1 1 26 26 ASP H H 26 8.955 8.955 8.536 0.419 18832
3509 1 12 . 1 1 27 27 GLU N N 27 118.910 118.910 116.565 2.345 18832
3510 1 12 . 1 1 27 27 GLU HA H 27 5.202 5.202 4.722 0.480 18832
3511 1 12 . 1 1 27 27 GLU CA C 27 54.930 54.930 55.337 -0.407 18832
3512 1 12 . 1 1 27 27 GLU CB C 27 32.880 32.880 32.057 0.823 18832
3513 1 12 . 1 1 27 27 GLU H H 27 7.537 7.537 7.520 0.017 18832
3514 1 12 . 1 1 28 28 LEU N N 28 121.490 121.490 123.635 -2.145 18832
3515 1 12 . 1 1 28 28 LEU HA H 28 4.756 4.756 4.739 0.017 18832
3516 1 12 . 1 1 28 28 LEU CA C 28 53.120 53.120 53.874 -0.755 18832
3517 1 12 . 1 1 28 28 LEU CB C 28 44.500 44.500 44.909 -0.409 18832
3518 1 12 . 1 1 28 28 LEU H H 28 8.890 8.890 8.625 0.265 18832
3519 1 12 . 1 1 29 29 SER N N 29 115.870 115.870 119.557 -3.687 18832
3520 1 12 . 1 1 29 29 SER HA H 29 5.009 5.009 4.486 0.523 18832
3521 1 12 . 1 1 29 29 SER CA C 29 58.470 58.470 58.845 -0.375 18832
3522 1 12 . 1 1 29 29 SER CB C 29 63.690 63.690 63.726 -0.036 18832
3523 1 12 . 1 1 29 29 SER H H 29 7.948 7.948 8.368 -0.420 18832
3524 1 12 . 1 1 30 30 LEU N N 30 121.260 121.260 126.073 -4.813 18832
3525 1 12 . 1 1 30 30 LEU HA H 30 4.776 4.776 4.724 0.052 18832
3526 1 12 . 1 1 30 30 LEU CA C 30 52.940 52.940 54.235 -1.295 18832
3527 1 12 . 1 1 30 30 LEU CB C 30 46.370 46.370 45.371 0.999 18832
3528 1 12 . 1 1 30 30 LEU H H 30 9.500 9.500 8.188 1.312 18832
3529 1 12 . 1 1 31 31 GLN N N 31 123.130 123.130 118.840 4.290 18832
3530 1 12 . 1 1 31 31 GLN HA H 31 5.065 5.065 5.254 -0.189 18832
3531 1 12 . 1 1 31 31 GLN CA C 31 52.940 52.940 53.908 -0.968 18832
3532 1 12 . 1 1 31 31 GLN CB C 31 31.190 31.190 32.996 -1.806 18832
3533 1 12 . 1 1 31 31 GLN H H 31 9.147 9.147 8.417 0.730 18832
3534 1 12 . 1 1 32 32 ILE N N 32 120.790 120.790 120.884 -0.094 18832
3535 1 12 . 1 1 32 32 ILE HA H 32 3.032 3.032 4.130 -1.098 18832
3536 1 12 . 1 1 32 32 ILE CA C 32 64.250 64.250 63.118 1.132 18832
3537 1 12 . 1 1 32 32 ILE CB C 32 37.940 37.940 37.900 0.040 18832
3538 1 12 . 1 1 32 32 ILE H H 32 8.016 8.016 8.384 -0.368 18832
3539 1 12 . 1 1 33 33 GLY N N 33 115.870 115.870 115.475 0.395 18832
3540 1 12 . 1 1 33 33 GLY CA C 33 44.500 44.500 44.824 -0.324 18832
3541 1 12 . 1 1 33 33 GLY H H 33 8.775 8.775 9.024 -0.249 18832
3542 1 12 . 1 1 34 34 ASP N N 34 122.430 122.430 122.217 0.213 18832
3543 1 12 . 1 1 34 34 ASP HA H 34 4.634 4.634 4.941 -0.307 18832
3544 1 12 . 1 1 34 34 ASP CA C 34 55.860 55.860 53.888 1.972 18832
3545 1 12 . 1 1 34 34 ASP CB C 34 41.310 41.310 42.204 -0.894 18832
3546 1 12 . 1 1 34 34 ASP H H 34 8.686 8.686 7.702 0.984 18832
3547 1 12 . 1 1 35 35 THR N N 35 117.980 117.980 118.577 -0.597 18832
3548 1 12 . 1 1 35 35 THR HA H 35 5.154 5.154 4.859 0.295 18832
3549 1 12 . 1 1 35 35 THR CA C 35 61.450 61.450 61.925 -0.475 18832
3550 1 12 . 1 1 35 35 THR CB C 35 69.090 69.090 69.855 -0.765 18832
3551 1 12 . 1 1 35 35 THR H H 35 8.392 8.392 8.496 -0.104 18832
3552 1 12 . 1 1 36 36 VAL N N 36 118.200 118.200 120.037 -1.837 18832
3553 1 12 . 1 1 36 36 VAL HA H 36 5.152 5.152 4.718 0.434 18832
3554 1 12 . 1 1 36 36 VAL CA C 36 57.910 57.910 59.609 -1.699 18832
3555 1 12 . 1 1 36 36 VAL CB C 36 34.190 34.190 34.555 -0.365 18832
3556 1 12 . 1 1 36 36 VAL H H 36 9.016 9.016 9.083 -0.067 18832
3557 1 12 . 1 1 37 37 HIS N N 37 122.190 122.190 126.369 -4.179 18832
3558 1 12 . 1 1 37 37 HIS HA H 37 4.811 4.811 4.896 -0.085 18832
3559 1 12 . 1 1 37 37 HIS CA C 37 52.560 52.560 54.033 -1.473 18832
3560 1 12 . 1 1 37 37 HIS CB C 37 31.260 31.260 30.252 1.008 18832
3561 1 12 . 1 1 37 37 HIS H H 37 8.491 8.491 8.726 -0.235 18832
3562 1 12 . 1 1 38 38 ILE N N 38 126.650 126.650 128.380 -1.730 18832
3563 1 12 . 1 1 38 38 ILE HA H 38 3.750 3.750 3.980 -0.230 18832
3564 1 12 . 1 1 38 38 ILE CA C 38 61.640 61.640 62.924 -1.284 18832
3565 1 12 . 1 1 38 38 ILE CB C 38 38.880 38.880 37.304 1.576 18832
3566 1 12 . 1 1 38 38 ILE H H 38 8.638 8.638 8.717 -0.079 18832
3567 1 12 . 1 1 39 39 LEU N N 39 126.180 126.180 128.657 -2.477 18832
3568 1 12 . 1 1 39 39 LEU HA H 39 4.380 4.380 4.666 -0.286 18832
3569 1 12 . 1 1 39 39 LEU CA C 39 55.490 55.490 55.344 0.146 18832
3570 1 12 . 1 1 39 39 LEU CB C 39 43.750 43.750 43.888 -0.138 18832
3571 1 12 . 1 1 39 39 LEU H H 39 9.163 9.163 8.906 0.257 18832
3572 1 12 . 1 1 40 40 GLU N N 40 115.160 115.160 116.589 -1.429 18832
3573 1 12 . 1 1 40 40 GLU HA H 40 5.020 5.020 4.581 0.439 18832
3574 1 12 . 1 1 40 40 GLU CA C 40 55.090 55.090 55.401 -0.311 18832
3575 1 12 . 1 1 40 40 GLU CB C 40 35.730 35.730 34.219 1.511 18832
3576 1 12 . 1 1 40 40 GLU H H 40 7.852 7.852 8.188 -0.336 18832
3577 1 12 . 1 1 41 41 THR HA H 41 4.270 4.270 4.453 -0.183 18832
3578 1 12 . 1 1 41 41 THR CA C 41 61.250 61.250 60.056 1.194 18832
3579 1 12 . 1 1 41 41 THR CB C 41 71.410 71.410 70.705 0.705 18832
3580 1 12 . 1 1 42 42 TYR HA H 42 4.550 4.550 4.285 0.265 18832
3581 1 12 . 1 1 43 43 GLU N N 43 124.100 124.100 119.807 4.293 18832
3582 1 12 . 1 1 43 43 GLU HA H 43 3.740 3.740 4.060 -0.320 18832
3583 1 12 . 1 1 43 43 GLU H H 43 8.590 8.590 8.265 0.325 18832
3584 1 12 . 1 1 44 44 GLY N N 44 110.789 110.789 109.910 0.879 18832
3585 1 12 . 1 1 44 44 GLY CA C 44 45.440 45.440 44.992 0.448 18832
3586 1 12 . 1 1 44 44 GLY H H 44 8.432 8.432 8.428 0.004 18832
3587 1 12 . 1 1 45 45 TRP HA H 45 4.690 4.690 4.444 0.246 18832
3588 1 12 . 1 1 45 45 TRP CA C 45 57.550 57.550 56.297 1.253 18832
3589 1 12 . 1 1 46 46 TYR HA H 46 5.600 5.600 4.544 1.056 18832
3590 1 12 . 1 1 46 46 TYR CA C 46 54.060 54.060 54.500 -0.440 18832
3591 1 12 . 1 1 46 46 TYR CB C 46 42.650 42.650 41.408 1.242 18832
3592 1 12 . 1 1 47 47 ARG N N 47 118.100 118.100 122.694 -4.594 18832
3593 1 12 . 1 1 47 47 ARG HA H 47 5.094 5.094 4.915 0.179 18832
3594 1 12 . 1 1 47 47 ARG CA C 47 54.060 54.060 54.667 -0.607 18832
3595 1 12 . 1 1 47 47 ARG CB C 47 33.250 33.250 33.239 0.011 18832
3596 1 12 . 1 1 47 47 ARG H H 47 8.492 8.492 8.302 0.190 18832
3597 1 12 . 1 1 48 48 GLY N N 48 114.000 114.000 113.494 0.506 18832
3598 1 12 . 1 1 48 48 GLY CA C 48 46.560 46.560 44.978 1.582 18832
3599 1 12 . 1 1 48 48 GLY H H 48 9.183 9.183 8.418 0.765 18832
3600 1 12 . 1 1 49 49 TYR N N 49 116.100 116.100 115.617 0.483 18832
3601 1 12 . 1 1 49 49 TYR HA H 49 5.373 5.373 5.316 0.057 18832
3602 1 12 . 1 1 49 49 TYR CA C 49 55.110 55.110 55.109 0.001 18832
3603 1 12 . 1 1 49 49 TYR CB C 49 40.750 40.750 40.617 0.133 18832
3604 1 12 . 1 1 49 49 TYR H H 49 8.194 8.194 8.141 0.053 18832
3605 1 12 . 1 1 50 50 THR N N 50 112.350 112.350 116.516 -4.166 18832
3606 1 12 . 1 1 50 50 THR HA H 50 5.105 5.105 4.578 0.527 18832
3607 1 12 . 1 1 50 50 THR CA C 50 59.770 59.770 61.739 -1.969 18832
3608 1 12 . 1 1 50 50 THR CB C 50 69.460 69.460 69.884 -0.424 18832
3609 1 12 . 1 1 50 50 THR H H 50 9.441 9.441 8.716 0.725 18832
3610 1 12 . 1 1 51 51 LEU N N 51 121.260 121.260 122.228 -0.968 18832
3611 1 12 . 1 1 51 51 LEU HA H 51 4.236 4.236 4.107 0.129 18832
3612 1 12 . 1 1 51 51 LEU CA C 51 56.790 56.790 57.065 -0.275 18832
3613 1 12 . 1 1 51 51 LEU CB C 51 40.000 40.000 41.136 -1.136 18832
3614 1 12 . 1 1 51 51 LEU H H 51 8.310 8.310 8.692 -0.382 18832
3615 1 12 . 1 1 52 52 ARG N N 52 116.570 116.570 118.346 -1.776 18832
3616 1 12 . 1 1 52 52 ARG HA H 52 4.250 4.250 4.213 0.037 18832
3617 1 12 . 1 1 52 52 ARG CA C 52 57.350 57.350 58.391 -1.041 18832
3618 1 12 . 1 1 52 52 ARG CB C 52 30.510 30.510 30.730 -0.220 18832
3619 1 12 . 1 1 52 52 ARG H H 52 8.047 8.047 8.258 -0.211 18832
3620 1 12 . 1 1 53 53 LYS N N 53 122.660 122.660 119.084 3.576 18832
3621 1 12 . 1 1 53 53 LYS HA H 53 4.616 4.616 4.569 0.047 18832
3622 1 12 . 1 1 53 53 LYS CA C 53 54.620 54.620 55.239 -0.619 18832
3623 1 12 . 1 1 53 53 LYS CB C 53 32.860 32.860 30.875 1.986 18832
3624 1 12 . 1 1 53 53 LYS H H 53 7.649 7.649 8.117 -0.468 18832
3625 1 12 . 1 1 54 54 LYS N N 54 125.010 125.010 120.608 4.402 18832
3626 1 12 . 1 1 54 54 LYS HA H 54 4.090 4.090 4.180 -0.090 18832
3627 1 12 . 1 1 54 54 LYS CA C 54 58.470 58.470 58.742 -0.272 18832
3628 1 12 . 1 1 54 54 LYS CB C 54 32.130 32.130 32.576 -0.446 18832
3629 1 12 . 1 1 54 54 LYS H H 54 8.496 8.496 8.147 0.349 18832
3630 1 12 . 1 1 55 55 SER N N 55 110.240 110.240 113.675 -3.435 18832
3631 1 12 . 1 1 55 55 SER HA H 55 4.122 4.122 4.274 -0.152 18832
3632 1 12 . 1 1 55 55 SER CA C 55 58.960 58.960 59.725 -0.765 18832
3633 1 12 . 1 1 55 55 SER CB C 55 63.310 63.310 63.469 -0.159 18832
3634 1 12 . 1 1 55 55 SER H H 55 7.857 7.857 8.270 -0.413 18832
3635 1 12 . 1 1 56 56 LYS N N 56 124.070 124.070 121.807 2.263 18832
3636 1 12 . 1 1 56 56 LYS HA H 56 4.668 4.668 4.271 0.397 18832
3637 1 12 . 1 1 56 56 LYS CA C 56 54.810 54.810 56.101 -1.291 18832
3638 1 12 . 1 1 56 56 LYS CB C 56 33.250 33.250 32.374 0.876 18832
3639 1 12 . 1 1 56 56 LYS H H 56 7.473 7.473 8.148 -0.675 18832
3640 1 12 . 1 1 57 57 LYS N N 57 125.940 125.940 124.764 1.176 18832
3641 1 12 . 1 1 57 57 LYS HA H 57 5.341 5.341 4.591 0.750 18832
3642 1 12 . 1 1 57 57 LYS CA C 57 54.620 54.620 54.998 -0.378 18832
3643 1 12 . 1 1 57 57 LYS CB C 57 34.240 34.240 35.308 -1.068 18832
3644 1 12 . 1 1 57 57 LYS H H 57 8.474 8.474 8.323 0.151 18832
3645 1 12 . 1 1 58 58 GLY N N 58 109.540 109.540 109.559 -0.019 18832
3646 1 12 . 1 1 58 58 GLY CA C 58 45.620 45.620 44.876 0.744 18832
3647 1 12 . 1 1 58 58 GLY H H 58 9.075 9.075 8.541 0.534 18832
3648 1 12 . 1 1 59 59 ILE N N 59 113.900 113.900 115.469 -1.569 18832
3649 1 12 . 1 1 59 59 ILE HA H 59 6.000 6.000 5.044 0.956 18832
3650 1 12 . 1 1 59 59 ILE CA C 59 59.590 59.590 59.063 0.527 18832
3651 1 12 . 1 1 59 59 ILE CB C 59 41.140 41.140 41.242 -0.102 18832
3652 1 12 . 1 1 59 59 ILE H H 59 8.628 8.628 8.186 0.442 18832
3653 1 12 . 1 1 60 60 PHE N N 60 117.040 117.040 117.087 -0.047 18832
3654 1 12 . 1 1 60 60 PHE HA H 60 5.120 5.120 5.405 -0.285 18832
3655 1 12 . 1 1 60 60 PHE CA C 60 54.060 54.060 55.075 -1.015 18832
3656 1 12 . 1 1 60 60 PHE CB C 60 37.190 37.190 40.073 -2.883 18832
3657 1 12 . 1 1 60 60 PHE H H 60 8.724 8.724 8.758 -0.034 18832
3658 1 12 . 1 1 61 61 PRO HA H 61 3.480 3.480 4.499 -1.019 18832
3659 1 12 . 1 1 61 61 PRO CA C 61 62.200 62.200 62.144 0.056 18832
3660 1 12 . 1 1 61 61 PRO CB C 61 31.190 31.190 32.491 -1.301 18832
3661 1 12 . 1 1 62 62 ALA N N 62 124.770 124.770 125.132 -0.362 18832
3662 1 12 . 1 1 62 62 ALA HA H 62 3.710 3.710 3.919 -0.209 18832
3663 1 12 . 1 1 62 62 ALA CA C 62 54.370 54.370 54.334 0.036 18832
3664 1 12 . 1 1 62 62 ALA CB C 62 17.650 17.650 17.885 -0.235 18832
3665 1 12 . 1 1 62 62 ALA H H 62 7.898 7.898 8.252 -0.354 18832
3666 1 12 . 1 1 63 63 SER N N 63 109.700 109.700 115.712 -6.012 18832
3667 1 12 . 1 1 63 63 SER HA H 63 4.200 4.200 4.175 0.025 18832
3668 1 12 . 1 1 63 63 SER CA C 63 59.400 59.400 61.197 -1.797 18832
3669 1 12 . 1 1 63 63 SER CB C 63 62.380 62.380 62.889 -0.509 18832
3670 1 12 . 1 1 63 63 SER H H 63 8.030 8.030 8.512 -0.482 18832
3671 1 12 . 1 1 64 64 TYR N N 64 120.300 120.300 112.197 8.103 18832
3672 1 12 . 1 1 64 64 TYR HA H 64 4.250 4.250 4.471 -0.221 18832
3673 1 12 . 1 1 64 64 TYR CA C 64 57.720 57.720 54.875 2.845 18832
3674 1 12 . 1 1 64 64 TYR CB C 64 37.560 37.560 37.228 0.332 18832
3675 1 12 . 1 1 64 64 TYR H H 64 7.128 7.128 6.917 0.211 18832
3676 1 12 . 1 1 65 65 ILE N N 65 118.000 118.000 121.519 -3.519 18832
3677 1 12 . 1 1 65 65 ILE HA H 65 4.810 4.810 4.816 -0.006 18832
3678 1 12 . 1 1 65 65 ILE CA C 65 56.980 56.980 59.047 -2.067 18832
3679 1 12 . 1 1 65 65 ILE CB C 65 39.630 39.630 38.916 0.714 18832
3680 1 12 . 1 1 65 65 ILE H H 65 7.671 7.671 7.372 0.299 18832
3681 1 12 . 1 1 66 66 HIS N N 66 124.300 124.300 127.052 -2.752 18832
3682 1 12 . 1 1 66 66 HIS HA H 66 5.130 5.130 4.912 0.218 18832
3683 1 12 . 1 1 66 66 HIS CA C 66 53.060 53.060 54.469 -1.409 18832
3684 1 12 . 1 1 66 66 HIS CB C 66 30.510 30.510 33.767 -3.257 18832
3685 1 12 . 1 1 66 66 HIS H H 66 9.159 9.159 8.847 0.312 18832
3686 1 12 . 1 1 67 67 LEU N N 67 127.580 127.580 127.127 0.453 18832
3687 1 12 . 1 1 67 67 LEU HA H 67 4.570 4.570 4.424 0.146 18832
3688 1 12 . 1 1 67 67 LEU CA C 67 55.300 55.300 54.178 1.122 18832
3689 1 12 . 1 1 67 67 LEU CB C 67 42.060 42.060 40.659 1.401 18832
3690 1 12 . 1 1 67 67 LEU H H 67 8.992 8.992 8.492 0.500 18832
3691 1 12 . 1 1 68 68 LYS N N 68 121.900 121.900 125.119 -3.219 18832
3692 1 12 . 1 1 68 68 LYS HA H 68 4.490 4.490 4.506 -0.016 18832
3693 1 12 . 1 1 68 68 LYS CA C 68 55.110 55.110 54.719 0.391 18832
3694 1 12 . 1 1 68 68 LYS CB C 68 34.610 34.610 33.402 1.208 18832
3695 1 12 . 1 1 68 68 LYS H H 68 8.499 8.499 8.175 0.324 18832
3696 1 12 . 1 1 69 69 GLU N N 69 122.190 122.190 119.620 2.570 18832
3697 1 12 . 1 1 69 69 GLU HA H 69 4.280 4.280 4.695 -0.415 18832
3698 1 12 . 1 1 69 69 GLU CA C 69 56.610 56.610 55.285 1.325 18832
3699 1 12 . 1 1 69 69 GLU CB C 69 30.330 30.330 30.813 -0.483 18832
3700 1 12 . 1 1 69 69 GLU H H 69 8.569 8.569 8.570 -0.001 18832
3701 1 12 . 1 1 70 70 ALA N N 70 123.370 123.370 128.446 -5.076 18832
3702 1 12 . 1 1 70 70 ALA HA H 70 4.200 4.200 4.115 0.085 18832
3703 1 12 . 1 1 70 70 ALA CA C 70 51.810 51.810 52.352 -0.542 18832
3704 1 12 . 1 1 70 70 ALA CB C 70 19.700 19.700 18.685 1.015 18832
3705 1 12 . 1 1 70 70 ALA H H 70 8.181 8.181 8.810 -0.629 18832
3706 1 12 . 1 1 71 71 ILE N N 71 120.080 120.080 124.986 -4.906 18832
3707 1 12 . 1 1 71 71 ILE HA H 71 4.070 4.070 3.956 0.114 18832
3708 1 12 . 1 1 71 71 ILE CA C 71 60.330 60.330 61.792 -1.462 18832
3709 1 12 . 1 1 71 71 ILE CB C 71 38.690 38.690 38.212 0.478 18832
3710 1 12 . 1 1 71 71 ILE H H 71 7.776 7.776 7.851 -0.075 18832
3711 1 12 . 1 1 72 72 VAL N N 72 124.540 124.540 129.041 -4.501 18832
3712 1 12 . 1 1 72 72 VAL HA H 72 4.070 4.070 4.286 -0.216 18832
3713 1 12 . 1 1 72 72 VAL CA C 72 61.640 61.640 61.831 -0.191 18832
3714 1 12 . 1 1 72 72 VAL CB C 72 32.690 32.690 33.710 -1.020 18832
3715 1 12 . 1 1 72 72 VAL H H 72 8.089 8.089 8.317 -0.228 18832
3716 1 12 . 1 1 73 73 GLU N N 73 125.940 125.940 125.103 0.837 18832
3717 1 12 . 1 1 73 73 GLU HA H 73 4.280 4.280 4.635 -0.355 18832
3718 1 12 . 1 1 73 73 GLU CA C 73 56.610 56.610 56.212 0.398 18832
3719 1 12 . 1 1 73 73 GLU CB C 73 30.710 30.710 30.255 0.455 18832
3720 1 12 . 1 1 73 73 GLU H H 73 8.464 8.464 8.773 -0.309 18832
3721 1 13 . 1 1 2 2 THR N N 2 116.400 116.400 111.800 4.600 18832
3722 1 13 . 1 1 2 2 THR HA H 2 4.120 4.120 4.063 0.057 18832
3723 1 13 . 1 1 2 2 THR CA C 2 62.100 62.100 63.270 -1.170 18832
3724 1 13 . 1 1 2 2 THR CB C 2 69.440 69.440 68.072 1.368 18832
3725 1 13 . 1 1 2 2 THR H H 2 8.150 8.150 8.399 -0.249 18832
3726 1 13 . 1 1 3 3 ARG HA H 3 4.310 4.310 4.406 -0.096 18832
3727 1 13 . 1 1 3 3 ARG CA C 3 55.750 55.750 55.382 0.368 18832
3728 1 13 . 1 1 3 3 ARG CB C 3 30.620 30.620 31.491 -0.870 18832
3729 1 13 . 1 1 4 4 TRP N N 4 123.300 123.300 121.009 2.291 18832
3730 1 13 . 1 1 4 4 TRP HA H 4 4.480 4.480 4.603 -0.123 18832
3731 1 13 . 1 1 4 4 TRP CA C 4 57.560 57.560 57.230 0.330 18832
3732 1 13 . 1 1 4 4 TRP CB C 4 29.490 29.490 29.984 -0.494 18832
3733 1 13 . 1 1 4 4 TRP H H 4 8.108 8.108 8.651 -0.543 18832
3734 1 13 . 1 1 5 5 VAL HA H 5 4.570 4.570 4.297 0.273 18832
3735 1 13 . 1 1 5 5 VAL CB C 5 30.840 30.840 32.028 -1.188 18832
3736 1 13 . 1 1 6 6 PRO HA H 6 4.810 4.810 4.512 0.298 18832
3737 1 13 . 1 1 6 6 PRO CB C 6 32.210 32.210 32.619 -0.409 18832
3738 1 13 . 1 1 7 7 THR HA H 7 4.270 4.270 3.968 0.302 18832
3739 1 13 . 1 1 7 7 THR CA C 7 60.890 60.890 64.460 -3.570 18832
3740 1 13 . 1 1 7 7 THR CB C 7 70.140 70.140 68.828 1.312 18832
3741 1 13 . 1 1 8 8 LYS HA H 8 4.440 4.440 4.342 0.098 18832
3742 1 13 . 1 1 8 8 LYS CA C 8 55.980 55.980 55.645 0.335 18832
3743 1 13 . 1 1 8 8 LYS CB C 8 35.050 35.050 34.206 0.843 18832
3744 1 13 . 1 1 10 10 GLU HA H 10 4.580 4.580 4.421 0.159 18832
3745 1 13 . 1 1 10 10 GLU CA C 10 55.570 55.570 56.051 -0.481 18832
3746 1 13 . 1 1 10 10 GLU CB C 10 30.780 30.780 31.045 -0.265 18832
3747 1 13 . 1 1 11 11 GLU N N 11 122.500 122.500 123.843 -1.343 18832
3748 1 13 . 1 1 11 11 GLU HA H 11 4.340 4.340 4.595 -0.255 18832
3749 1 13 . 1 1 11 11 GLU CA C 11 57.140 57.140 56.478 0.662 18832
3750 1 13 . 1 1 11 11 GLU CB C 11 29.400 29.400 29.887 -0.487 18832
3751 1 13 . 1 1 11 11 GLU H H 11 8.271 8.271 8.784 -0.513 18832
3752 1 13 . 1 1 12 12 LYS HA H 12 4.380 4.380 4.449 -0.069 18832
3753 1 13 . 1 1 12 12 LYS CA C 12 55.790 55.790 55.244 0.546 18832
3754 1 13 . 1 1 12 12 LYS CB C 12 33.600 33.600 35.425 -1.825 18832
3755 1 13 . 1 1 13 13 TYR HA H 13 5.560 5.560 4.735 0.825 18832
3756 1 13 . 1 1 13 13 TYR CA C 13 55.860 55.860 56.090 -0.230 18832
3757 1 13 . 1 1 13 13 TYR CB C 13 42.440 42.440 39.971 2.469 18832
3758 1 13 . 1 1 14 14 GLY N N 14 105.320 105.320 106.899 -1.579 18832
3759 1 13 . 1 1 14 14 GLY CA C 14 45.240 45.240 44.297 0.943 18832
3760 1 13 . 1 1 14 14 GLY H H 14 8.401 8.401 9.080 -0.679 18832
3761 1 13 . 1 1 15 15 VAL N N 15 118.900 118.900 118.260 0.640 18832
3762 1 13 . 1 1 15 15 VAL HA H 15 5.341 5.341 4.710 0.631 18832
3763 1 13 . 1 1 15 15 VAL CA C 15 59.210 59.210 60.949 -1.739 18832
3764 1 13 . 1 1 15 15 VAL CB C 15 35.740 35.740 36.761 -1.021 18832
3765 1 13 . 1 1 15 15 VAL H H 15 8.851 8.851 8.834 0.017 18832
3766 1 13 . 1 1 16 16 ALA N N 16 129.460 129.460 125.396 4.064 18832
3767 1 13 . 1 1 16 16 ALA HA H 16 5.000 5.000 5.417 -0.417 18832
3768 1 13 . 1 1 16 16 ALA CA C 16 52.000 52.000 50.491 1.509 18832
3769 1 13 . 1 1 16 16 ALA CB C 16 19.330 19.330 21.052 -1.722 18832
3770 1 13 . 1 1 16 16 ALA H H 16 9.113 9.113 8.548 0.565 18832
3771 1 13 . 1 1 17 17 PHE N N 17 124.070 124.070 120.700 3.370 18832
3772 1 13 . 1 1 17 17 PHE HA H 17 4.801 4.801 4.902 -0.101 18832
3773 1 13 . 1 1 17 17 PHE CA C 17 56.230 56.230 55.664 0.566 18832
3774 1 13 . 1 1 17 17 PHE CB C 17 40.000 40.000 38.751 1.249 18832
3775 1 13 . 1 1 17 17 PHE H H 17 8.787 8.787 8.274 0.513 18832
3776 1 13 . 1 1 18 18 TYR N N 18 118.210 118.210 123.744 -5.534 18832
3777 1 13 . 1 1 18 18 TYR HA H 18 4.483 4.483 4.262 0.221 18832
3778 1 13 . 1 1 18 18 TYR CA C 18 55.300 55.300 57.152 -1.852 18832
3779 1 13 . 1 1 18 18 TYR CB C 18 42.810 42.810 41.838 0.972 18832
3780 1 13 . 1 1 18 18 TYR H H 18 7.281 7.281 7.615 -0.334 18832
3781 1 13 . 1 1 19 19 ASN N N 19 116.800 116.800 119.326 -2.526 18832
3782 1 13 . 1 1 19 19 ASN HA H 19 4.710 4.710 4.842 -0.132 18832
3783 1 13 . 1 1 19 19 ASN CA C 19 52.940 52.940 52.892 0.048 18832
3784 1 13 . 1 1 19 19 ASN CB C 19 39.060 39.060 38.697 0.363 18832
3785 1 13 . 1 1 19 19 ASN H H 19 8.134 8.134 8.146 -0.012 18832
3786 1 13 . 1 1 20 20 TYR N N 20 122.190 122.190 123.141 -0.951 18832
3787 1 13 . 1 1 20 20 TYR HA H 20 4.687 4.687 4.712 -0.025 18832
3788 1 13 . 1 1 20 20 TYR CA C 20 57.720 57.720 57.007 0.713 18832
3789 1 13 . 1 1 20 20 TYR CB C 20 42.250 42.250 40.841 1.409 18832
3790 1 13 . 1 1 20 20 TYR H H 20 8.993 8.993 8.086 0.907 18832
3791 1 13 . 1 1 21 21 ASP N N 21 128.520 128.520 124.881 3.639 18832
3792 1 13 . 1 1 21 21 ASP HA H 21 4.790 4.790 4.622 0.168 18832
3793 1 13 . 1 1 21 21 ASP CA C 21 52.370 52.370 51.967 0.404 18832
3794 1 13 . 1 1 21 21 ASP CB C 21 41.130 41.130 44.552 -3.422 18832
3795 1 13 . 1 1 21 21 ASP H H 21 7.838 7.838 8.313 -0.475 18832
3796 1 13 . 1 1 22 22 ALA N N 22 125.240 125.240 123.013 2.227 18832
3797 1 13 . 1 1 22 22 ALA HA H 22 4.051 4.051 4.178 -0.127 18832
3798 1 13 . 1 1 22 22 ALA CA C 22 52.940 52.940 51.750 1.190 18832
3799 1 13 . 1 1 22 22 ALA CB C 22 20.450 20.450 19.821 0.629 18832
3800 1 13 . 1 1 22 22 ALA H H 22 8.103 8.103 8.120 -0.017 18832
3801 1 13 . 1 1 23 23 ARG N N 23 122.190 122.190 123.767 -1.577 18832
3802 1 13 . 1 1 23 23 ARG HA H 23 4.346 4.346 4.410 -0.064 18832
3803 1 13 . 1 1 23 23 ARG CA C 23 55.490 55.490 55.271 0.219 18832
3804 1 13 . 1 1 23 23 ARG CB C 23 30.700 30.700 30.192 0.508 18832
3805 1 13 . 1 1 23 23 ARG H H 23 8.887 8.887 8.625 0.262 18832
3806 1 13 . 1 1 24 24 GLY N N 24 105.320 105.320 105.557 -0.237 18832
3807 1 13 . 1 1 24 24 GLY CA C 24 44.500 44.500 44.564 -0.064 18832
3808 1 13 . 1 1 24 24 GLY H H 24 7.258 7.258 7.290 -0.032 18832
3809 1 13 . 1 1 25 25 ALA N N 25 122.190 122.190 121.069 1.121 18832
3810 1 13 . 1 1 25 25 ALA HA H 25 4.166 4.166 4.087 0.079 18832
3811 1 13 . 1 1 25 25 ALA CA C 25 54.440 54.440 54.305 0.135 18832
3812 1 13 . 1 1 25 25 ALA CB C 25 18.770 18.770 19.151 -0.381 18832
3813 1 13 . 1 1 25 25 ALA H H 25 8.627 8.627 8.336 0.291 18832
3814 1 13 . 1 1 26 26 ASP N N 26 114.690 114.690 117.267 -2.577 18832
3815 1 13 . 1 1 26 26 ASP HA H 26 4.700 4.700 4.344 0.356 18832
3816 1 13 . 1 1 26 26 ASP CA C 26 53.870 53.870 56.540 -2.670 18832
3817 1 13 . 1 1 26 26 ASP CB C 26 40.390 40.390 41.094 -0.704 18832
3818 1 13 . 1 1 26 26 ASP H H 26 8.955 8.955 8.593 0.362 18832
3819 1 13 . 1 1 27 27 GLU N N 27 118.910 118.910 116.667 2.243 18832
3820 1 13 . 1 1 27 27 GLU HA H 27 5.202 5.202 4.614 0.588 18832
3821 1 13 . 1 1 27 27 GLU CA C 27 54.930 54.930 55.101 -0.171 18832
3822 1 13 . 1 1 27 27 GLU CB C 27 32.880 32.880 32.297 0.583 18832
3823 1 13 . 1 1 27 27 GLU H H 27 7.537 7.537 7.709 -0.172 18832
3824 1 13 . 1 1 28 28 LEU N N 28 121.490 121.490 119.735 1.755 18832
3825 1 13 . 1 1 28 28 LEU HA H 28 4.756 4.756 4.706 0.050 18832
3826 1 13 . 1 1 28 28 LEU CA C 28 53.120 53.120 53.851 -0.731 18832
3827 1 13 . 1 1 28 28 LEU CB C 28 44.500 44.500 45.623 -1.123 18832
3828 1 13 . 1 1 28 28 LEU H H 28 8.890 8.890 8.588 0.302 18832
3829 1 13 . 1 1 29 29 SER N N 29 115.870 115.870 119.098 -3.228 18832
3830 1 13 . 1 1 29 29 SER HA H 29 5.009 5.009 4.395 0.614 18832
3831 1 13 . 1 1 29 29 SER CA C 29 58.470 58.470 58.374 0.096 18832
3832 1 13 . 1 1 29 29 SER CB C 29 63.690 63.690 63.089 0.601 18832
3833 1 13 . 1 1 29 29 SER H H 29 7.948 7.948 8.348 -0.400 18832
3834 1 13 . 1 1 30 30 LEU N N 30 121.260 121.260 127.262 -6.002 18832
3835 1 13 . 1 1 30 30 LEU HA H 30 4.776 4.776 4.673 0.103 18832
3836 1 13 . 1 1 30 30 LEU CA C 30 52.940 52.940 54.259 -1.319 18832
3837 1 13 . 1 1 30 30 LEU CB C 30 46.370 46.370 44.321 2.049 18832
3838 1 13 . 1 1 30 30 LEU H H 30 9.500 9.500 8.244 1.256 18832
3839 1 13 . 1 1 31 31 GLN N N 31 123.130 123.130 119.444 3.686 18832
3840 1 13 . 1 1 31 31 GLN HA H 31 5.065 5.065 5.167 -0.102 18832
3841 1 13 . 1 1 31 31 GLN CA C 31 52.940 52.940 53.448 -0.508 18832
3842 1 13 . 1 1 31 31 GLN CB C 31 31.190 31.190 33.105 -1.915 18832
3843 1 13 . 1 1 31 31 GLN H H 31 9.147 9.147 8.520 0.627 18832
3844 1 13 . 1 1 32 32 ILE N N 32 120.790 120.790 120.563 0.227 18832
3845 1 13 . 1 1 32 32 ILE HA H 32 3.032 3.032 4.029 -0.997 18832
3846 1 13 . 1 1 32 32 ILE CA C 32 64.250 64.250 63.453 0.797 18832
3847 1 13 . 1 1 32 32 ILE CB C 32 37.940 37.940 37.732 0.208 18832
3848 1 13 . 1 1 32 32 ILE H H 32 8.016 8.016 8.380 -0.364 18832
3849 1 13 . 1 1 33 33 GLY N N 33 115.870 115.870 115.728 0.142 18832
3850 1 13 . 1 1 33 33 GLY CA C 33 44.500 44.500 44.831 -0.331 18832
3851 1 13 . 1 1 33 33 GLY H H 33 8.775 8.775 9.057 -0.282 18832
3852 1 13 . 1 1 34 34 ASP N N 34 122.430 122.430 122.562 -0.132 18832
3853 1 13 . 1 1 34 34 ASP HA H 34 4.634 4.634 4.977 -0.343 18832
3854 1 13 . 1 1 34 34 ASP CA C 34 55.860 55.860 53.831 2.029 18832
3855 1 13 . 1 1 34 34 ASP CB C 34 41.310 41.310 42.301 -0.991 18832
3856 1 13 . 1 1 34 34 ASP H H 34 8.686 8.686 7.821 0.865 18832
3857 1 13 . 1 1 35 35 THR N N 35 117.980 117.980 117.906 0.074 18832
3858 1 13 . 1 1 35 35 THR HA H 35 5.154 5.154 4.767 0.387 18832
3859 1 13 . 1 1 35 35 THR CA C 35 61.450 61.450 62.581 -1.131 18832
3860 1 13 . 1 1 35 35 THR CB C 35 69.090 69.090 69.730 -0.640 18832
3861 1 13 . 1 1 35 35 THR H H 35 8.392 8.392 8.490 -0.098 18832
3862 1 13 . 1 1 36 36 VAL N N 36 118.200 118.200 116.791 1.409 18832
3863 1 13 . 1 1 36 36 VAL HA H 36 5.152 5.152 4.602 0.550 18832
3864 1 13 . 1 1 36 36 VAL CA C 36 57.910 57.910 60.013 -2.103 18832
3865 1 13 . 1 1 36 36 VAL CB C 36 34.190 34.190 35.234 -1.044 18832
3866 1 13 . 1 1 36 36 VAL H H 36 9.016 9.016 8.745 0.271 18832
3867 1 13 . 1 1 37 37 HIS N N 37 122.190 122.190 125.897 -3.707 18832
3868 1 13 . 1 1 37 37 HIS HA H 37 4.811 4.811 4.981 -0.170 18832
3869 1 13 . 1 1 37 37 HIS CA C 37 52.560 52.560 54.453 -1.893 18832
3870 1 13 . 1 1 37 37 HIS CB C 37 31.260 31.260 30.947 0.313 18832
3871 1 13 . 1 1 37 37 HIS H H 37 8.491 8.491 8.092 0.399 18832
3872 1 13 . 1 1 38 38 ILE N N 38 126.650 126.650 127.239 -0.589 18832
3873 1 13 . 1 1 38 38 ILE HA H 38 3.750 3.750 4.107 -0.357 18832
3874 1 13 . 1 1 38 38 ILE CA C 38 61.640 61.640 62.655 -1.015 18832
3875 1 13 . 1 1 38 38 ILE CB C 38 38.880 38.880 37.964 0.916 18832
3876 1 13 . 1 1 38 38 ILE H H 38 8.638 8.638 8.543 0.095 18832
3877 1 13 . 1 1 39 39 LEU N N 39 126.180 126.180 123.896 2.284 18832
3878 1 13 . 1 1 39 39 LEU HA H 39 4.380 4.380 4.695 -0.315 18832
3879 1 13 . 1 1 39 39 LEU CA C 39 55.490 55.490 55.381 0.109 18832
3880 1 13 . 1 1 39 39 LEU CB C 39 43.750 43.750 43.286 0.464 18832
3881 1 13 . 1 1 39 39 LEU H H 39 9.163 9.163 8.895 0.268 18832
3882 1 13 . 1 1 40 40 GLU N N 40 115.160 115.160 117.479 -2.319 18832
3883 1 13 . 1 1 40 40 GLU HA H 40 5.020 5.020 4.540 0.480 18832
3884 1 13 . 1 1 40 40 GLU CA C 40 55.090 55.090 54.969 0.121 18832
3885 1 13 . 1 1 40 40 GLU CB C 40 35.730 35.730 33.661 2.069 18832
3886 1 13 . 1 1 40 40 GLU H H 40 7.852 7.852 7.670 0.182 18832
3887 1 13 . 1 1 41 41 THR HA H 41 4.270 4.270 4.484 -0.214 18832
3888 1 13 . 1 1 41 41 THR CA C 41 61.250 61.250 60.695 0.555 18832
3889 1 13 . 1 1 41 41 THR CB C 41 71.410 71.410 70.041 1.369 18832
3890 1 13 . 1 1 42 42 TYR HA H 42 4.550 4.550 4.363 0.187 18832
3891 1 13 . 1 1 43 43 GLU N N 43 124.100 124.100 118.575 5.525 18832
3892 1 13 . 1 1 43 43 GLU HA H 43 3.740 3.740 4.521 -0.781 18832
3893 1 13 . 1 1 43 43 GLU H H 43 8.590 8.590 8.287 0.303 18832
3894 1 13 . 1 1 44 44 GLY N N 44 110.789 110.789 110.347 0.442 18832
3895 1 13 . 1 1 44 44 GLY CA C 44 45.440 45.440 45.319 0.121 18832
3896 1 13 . 1 1 44 44 GLY H H 44 8.432 8.432 8.809 -0.377 18832
3897 1 13 . 1 1 45 45 TRP HA H 45 4.690 4.690 4.609 0.081 18832
3898 1 13 . 1 1 45 45 TRP CA C 45 57.550 57.550 55.916 1.634 18832
3899 1 13 . 1 1 46 46 TYR HA H 46 5.600 5.600 4.744 0.856 18832
3900 1 13 . 1 1 46 46 TYR CA C 46 54.060 54.060 54.992 -0.932 18832
3901 1 13 . 1 1 46 46 TYR CB C 46 42.650 42.650 40.989 1.661 18832
3902 1 13 . 1 1 47 47 ARG N N 47 118.100 118.100 119.405 -1.305 18832
3903 1 13 . 1 1 47 47 ARG HA H 47 5.094 5.094 5.048 0.046 18832
3904 1 13 . 1 1 47 47 ARG CA C 47 54.060 54.060 54.047 0.013 18832
3905 1 13 . 1 1 47 47 ARG CB C 47 33.250 33.250 34.626 -1.376 18832
3906 1 13 . 1 1 47 47 ARG H H 47 8.492 8.492 8.160 0.332 18832
3907 1 13 . 1 1 48 48 GLY N N 48 114.000 114.000 109.726 4.274 18832
3908 1 13 . 1 1 48 48 GLY CA C 48 46.560 46.560 46.102 0.458 18832
3909 1 13 . 1 1 48 48 GLY H H 48 9.183 9.183 8.891 0.292 18832
3910 1 13 . 1 1 49 49 TYR N N 49 116.100 116.100 115.119 0.981 18832
3911 1 13 . 1 1 49 49 TYR HA H 49 5.373 5.373 5.158 0.215 18832
3912 1 13 . 1 1 49 49 TYR CA C 49 55.110 55.110 56.206 -1.095 18832
3913 1 13 . 1 1 49 49 TYR CB C 49 40.750 40.750 40.577 0.173 18832
3914 1 13 . 1 1 49 49 TYR H H 49 8.194 8.194 8.068 0.126 18832
3915 1 13 . 1 1 50 50 THR N N 50 112.350 112.350 114.575 -2.225 18832
3916 1 13 . 1 1 50 50 THR HA H 50 5.105 5.105 4.606 0.499 18832
3917 1 13 . 1 1 50 50 THR CA C 50 59.770 59.770 61.496 -1.726 18832
3918 1 13 . 1 1 50 50 THR CB C 50 69.460 69.460 69.958 -0.498 18832
3919 1 13 . 1 1 50 50 THR H H 50 9.441 9.441 8.699 0.742 18832
3920 1 13 . 1 1 51 51 LEU N N 51 121.260 121.260 123.226 -1.966 18832
3921 1 13 . 1 1 51 51 LEU HA H 51 4.236 4.236 4.069 0.167 18832
3922 1 13 . 1 1 51 51 LEU CA C 51 56.790 56.790 58.191 -1.401 18832
3923 1 13 . 1 1 51 51 LEU CB C 51 40.000 40.000 41.712 -1.712 18832
3924 1 13 . 1 1 51 51 LEU H H 51 8.310 8.310 8.265 0.045 18832
3925 1 13 . 1 1 52 52 ARG N N 52 116.570 116.570 117.297 -0.727 18832
3926 1 13 . 1 1 52 52 ARG HA H 52 4.250 4.250 4.207 0.043 18832
3927 1 13 . 1 1 52 52 ARG CA C 52 57.350 57.350 57.958 -0.608 18832
3928 1 13 . 1 1 52 52 ARG CB C 52 30.510 30.510 30.524 -0.014 18832
3929 1 13 . 1 1 52 52 ARG H H 52 8.047 8.047 8.288 -0.241 18832
3930 1 13 . 1 1 53 53 LYS N N 53 122.660 122.660 119.143 3.517 18832
3931 1 13 . 1 1 53 53 LYS HA H 53 4.616 4.616 4.524 0.092 18832
3932 1 13 . 1 1 53 53 LYS CA C 53 54.620 54.620 55.354 -0.734 18832
3933 1 13 . 1 1 53 53 LYS CB C 53 32.860 32.860 32.651 0.209 18832
3934 1 13 . 1 1 53 53 LYS H H 53 7.649 7.649 7.551 0.098 18832
3935 1 13 . 1 1 54 54 LYS N N 54 125.010 125.010 119.070 5.940 18832
3936 1 13 . 1 1 54 54 LYS HA H 54 4.090 4.090 4.136 -0.046 18832
3937 1 13 . 1 1 54 54 LYS CA C 54 58.470 58.470 58.559 -0.090 18832
3938 1 13 . 1 1 54 54 LYS CB C 54 32.130 32.130 32.131 -0.001 18832
3939 1 13 . 1 1 54 54 LYS H H 54 8.496 8.496 8.385 0.111 18832
3940 1 13 . 1 1 55 55 SER N N 55 110.240 110.240 114.237 -3.997 18832
3941 1 13 . 1 1 55 55 SER HA H 55 4.122 4.122 4.128 -0.006 18832
3942 1 13 . 1 1 55 55 SER CA C 55 58.960 58.960 60.092 -1.131 18832
3943 1 13 . 1 1 55 55 SER CB C 55 63.310 63.310 63.336 -0.026 18832
3944 1 13 . 1 1 55 55 SER H H 55 7.857 7.857 8.187 -0.330 18832
3945 1 13 . 1 1 56 56 LYS N N 56 124.070 124.070 121.056 3.014 18832
3946 1 13 . 1 1 56 56 LYS HA H 56 4.668 4.668 4.294 0.374 18832
3947 1 13 . 1 1 56 56 LYS CA C 56 54.810 54.810 56.326 -1.516 18832
3948 1 13 . 1 1 56 56 LYS CB C 56 33.250 33.250 33.022 0.228 18832
3949 1 13 . 1 1 56 56 LYS H H 56 7.473 7.473 8.057 -0.584 18832
3950 1 13 . 1 1 57 57 LYS N N 57 125.940 125.940 122.073 3.867 18832
3951 1 13 . 1 1 57 57 LYS HA H 57 5.341 5.341 5.012 0.329 18832
3952 1 13 . 1 1 57 57 LYS CA C 57 54.620 54.620 54.401 0.219 18832
3953 1 13 . 1 1 57 57 LYS CB C 57 34.240 34.240 36.209 -1.969 18832
3954 1 13 . 1 1 57 57 LYS H H 57 8.474 8.474 8.103 0.371 18832
3955 1 13 . 1 1 58 58 GLY N N 58 109.540 109.540 105.737 3.803 18832
3956 1 13 . 1 1 58 58 GLY CA C 58 45.620 45.620 45.562 0.058 18832
3957 1 13 . 1 1 58 58 GLY H H 58 9.075 9.075 8.458 0.617 18832
3958 1 13 . 1 1 59 59 ILE N N 59 113.900 113.900 115.962 -2.062 18832
3959 1 13 . 1 1 59 59 ILE HA H 59 6.000 6.000 5.067 0.933 18832
3960 1 13 . 1 1 59 59 ILE CA C 59 59.590 59.590 58.536 1.054 18832
3961 1 13 . 1 1 59 59 ILE CB C 59 41.140 41.140 40.766 0.374 18832
3962 1 13 . 1 1 59 59 ILE H H 59 8.628 8.628 7.795 0.833 18832
3963 1 13 . 1 1 60 60 PHE N N 60 117.040 117.040 116.837 0.203 18832
3964 1 13 . 1 1 60 60 PHE HA H 60 5.120 5.120 5.525 -0.405 18832
3965 1 13 . 1 1 60 60 PHE CA C 60 54.060 54.060 54.694 -0.634 18832
3966 1 13 . 1 1 60 60 PHE CB C 60 37.190 37.190 40.256 -3.066 18832
3967 1 13 . 1 1 60 60 PHE H H 60 8.724 8.724 8.594 0.130 18832
3968 1 13 . 1 1 61 61 PRO HA H 61 3.480 3.480 4.718 -1.238 18832
3969 1 13 . 1 1 61 61 PRO CA C 61 62.200 62.200 62.275 -0.075 18832
3970 1 13 . 1 1 61 61 PRO CB C 61 31.190 31.190 32.776 -1.585 18832
3971 1 13 . 1 1 62 62 ALA N N 62 124.770 124.770 127.242 -2.472 18832
3972 1 13 . 1 1 62 62 ALA HA H 62 3.710 3.710 3.992 -0.282 18832
3973 1 13 . 1 1 62 62 ALA CA C 62 54.370 54.370 53.854 0.516 18832
3974 1 13 . 1 1 62 62 ALA CB C 62 17.650 17.650 18.201 -0.551 18832
3975 1 13 . 1 1 62 62 ALA H H 62 7.898 7.898 8.343 -0.445 18832
3976 1 13 . 1 1 63 63 SER N N 63 109.700 109.700 114.415 -4.715 18832
3977 1 13 . 1 1 63 63 SER HA H 63 4.200 4.200 4.139 0.061 18832
3978 1 13 . 1 1 63 63 SER CA C 63 59.400 59.400 60.298 -0.898 18832
3979 1 13 . 1 1 63 63 SER CB C 63 62.380 62.380 62.933 -0.553 18832
3980 1 13 . 1 1 63 63 SER H H 63 8.030 8.030 8.331 -0.301 18832
3981 1 13 . 1 1 64 64 TYR N N 64 120.300 120.300 111.652 8.648 18832
3982 1 13 . 1 1 64 64 TYR HA H 64 4.250 4.250 4.576 -0.326 18832
3983 1 13 . 1 1 64 64 TYR CA C 64 57.720 57.720 54.357 3.363 18832
3984 1 13 . 1 1 64 64 TYR CB C 64 37.560 37.560 37.205 0.355 18832
3985 1 13 . 1 1 64 64 TYR H H 64 7.128 7.128 6.940 0.188 18832
3986 1 13 . 1 1 65 65 ILE N N 65 118.000 118.000 121.822 -3.822 18832
3987 1 13 . 1 1 65 65 ILE HA H 65 4.810 4.810 4.859 -0.049 18832
3988 1 13 . 1 1 65 65 ILE CA C 65 56.980 56.980 59.624 -2.644 18832
3989 1 13 . 1 1 65 65 ILE CB C 65 39.630 39.630 38.484 1.146 18832
3990 1 13 . 1 1 65 65 ILE H H 65 7.671 7.671 7.453 0.218 18832
3991 1 13 . 1 1 66 66 HIS N N 66 124.300 124.300 127.588 -3.288 18832
3992 1 13 . 1 1 66 66 HIS HA H 66 5.130 5.130 4.941 0.189 18832
3993 1 13 . 1 1 66 66 HIS CA C 66 53.060 53.060 54.903 -1.843 18832
3994 1 13 . 1 1 66 66 HIS CB C 66 30.510 30.510 32.686 -2.176 18832
3995 1 13 . 1 1 66 66 HIS H H 66 9.159 9.159 9.165 -0.006 18832
3996 1 13 . 1 1 67 67 LEU N N 67 127.580 127.580 128.115 -0.535 18832
3997 1 13 . 1 1 67 67 LEU HA H 67 4.570 4.570 4.310 0.260 18832
3998 1 13 . 1 1 67 67 LEU CA C 67 55.300 55.300 56.218 -0.918 18832
3999 1 13 . 1 1 67 67 LEU CB C 67 42.060 42.060 42.263 -0.202 18832
4000 1 13 . 1 1 67 67 LEU H H 67 8.992 8.992 8.599 0.393 18832
4001 1 13 . 1 1 68 68 LYS N N 68 121.900 121.900 122.005 -0.105 18832
4002 1 13 . 1 1 68 68 LYS HA H 68 4.490 4.490 4.686 -0.196 18832
4003 1 13 . 1 1 68 68 LYS CA C 68 55.110 55.110 54.540 0.570 18832
4004 1 13 . 1 1 68 68 LYS CB C 68 34.610 34.610 34.759 -0.149 18832
4005 1 13 . 1 1 68 68 LYS H H 68 8.499 8.499 8.195 0.304 18832
4006 1 13 . 1 1 69 69 GLU N N 69 122.190 122.190 120.590 1.600 18832
4007 1 13 . 1 1 69 69 GLU HA H 69 4.280 4.280 4.461 -0.181 18832
4008 1 13 . 1 1 69 69 GLU CA C 69 56.610 56.610 55.043 1.567 18832
4009 1 13 . 1 1 69 69 GLU CB C 69 30.330 30.330 31.197 -0.867 18832
4010 1 13 . 1 1 69 69 GLU H H 69 8.569 8.569 8.674 -0.105 18832
4011 1 13 . 1 1 70 70 ALA N N 70 123.370 123.370 128.429 -5.059 18832
4012 1 13 . 1 1 70 70 ALA HA H 70 4.200 4.200 4.079 0.121 18832
4013 1 13 . 1 1 70 70 ALA CA C 70 51.810 51.810 52.420 -0.610 18832
4014 1 13 . 1 1 70 70 ALA CB C 70 19.700 19.700 18.589 1.111 18832
4015 1 13 . 1 1 70 70 ALA H H 70 8.181 8.181 8.386 -0.205 18832
4016 1 13 . 1 1 71 71 ILE N N 71 120.080 120.080 124.489 -4.409 18832
4017 1 13 . 1 1 71 71 ILE HA H 71 4.070 4.070 4.149 -0.079 18832
4018 1 13 . 1 1 71 71 ILE CA C 71 60.330 60.330 61.205 -0.875 18832
4019 1 13 . 1 1 71 71 ILE CB C 71 38.690 38.690 38.869 -0.179 18832
4020 1 13 . 1 1 71 71 ILE H H 71 7.776 7.776 8.037 -0.261 18832
4021 1 13 . 1 1 72 72 VAL N N 72 124.540 124.540 123.225 1.315 18832
4022 1 13 . 1 1 72 72 VAL HA H 72 4.070 4.070 4.312 -0.242 18832
4023 1 13 . 1 1 72 72 VAL CA C 72 61.640 61.640 61.707 -0.067 18832
4024 1 13 . 1 1 72 72 VAL CB C 72 32.690 32.690 32.092 0.598 18832
4025 1 13 . 1 1 72 72 VAL H H 72 8.089 8.089 8.110 -0.021 18832
4026 1 13 . 1 1 73 73 GLU N N 73 125.940 125.940 126.509 -0.569 18832
4027 1 13 . 1 1 73 73 GLU HA H 73 4.280 4.280 4.374 -0.094 18832
4028 1 13 . 1 1 73 73 GLU CA C 73 56.610 56.610 56.469 0.141 18832
4029 1 13 . 1 1 73 73 GLU CB C 73 30.710 30.710 30.348 0.362 18832
4030 1 13 . 1 1 73 73 GLU H H 73 8.464 8.464 8.770 -0.306 18832
4031 1 14 . 1 1 2 2 THR N N 2 116.400 116.400 115.992 0.408 18832
4032 1 14 . 1 1 2 2 THR HA H 2 4.120 4.120 4.533 -0.413 18832
4033 1 14 . 1 1 2 2 THR CA C 2 62.100 62.100 61.613 0.487 18832
4034 1 14 . 1 1 2 2 THR CB C 2 69.440 69.440 68.852 0.588 18832
4035 1 14 . 1 1 2 2 THR H H 2 8.150 8.150 8.334 -0.184 18832
4036 1 14 . 1 1 3 3 ARG HA H 3 4.310 4.310 4.703 -0.393 18832
4037 1 14 . 1 1 3 3 ARG CA C 3 55.750 55.750 55.235 0.515 18832
4038 1 14 . 1 1 3 3 ARG CB C 3 30.620 30.620 31.381 -0.761 18832
4039 1 14 . 1 1 4 4 TRP N N 4 123.300 123.300 123.825 -0.525 18832
4040 1 14 . 1 1 4 4 TRP HA H 4 4.480 4.480 4.982 -0.502 18832
4041 1 14 . 1 1 4 4 TRP CA C 4 57.560 57.560 56.450 1.110 18832
4042 1 14 . 1 1 4 4 TRP CB C 4 29.490 29.490 30.447 -0.957 18832
4043 1 14 . 1 1 4 4 TRP H H 4 8.108 8.108 8.731 -0.623 18832
4044 1 14 . 1 1 5 5 VAL HA H 5 4.570 4.570 4.469 0.101 18832
4045 1 14 . 1 1 5 5 VAL CB C 5 30.840 30.840 32.733 -1.893 18832
4046 1 14 . 1 1 6 6 PRO HA H 6 4.810 4.810 4.324 0.486 18832
4047 1 14 . 1 1 6 6 PRO CB C 6 32.210 32.210 32.314 -0.104 18832
4048 1 14 . 1 1 7 7 THR HA H 7 4.270 4.270 4.007 0.263 18832
4049 1 14 . 1 1 7 7 THR CA C 7 60.890 60.890 62.679 -1.789 18832
4050 1 14 . 1 1 7 7 THR CB C 7 70.140 70.140 68.781 1.359 18832
4051 1 14 . 1 1 8 8 LYS HA H 8 4.440 4.440 4.244 0.196 18832
4052 1 14 . 1 1 8 8 LYS CA C 8 55.980 55.980 56.209 -0.229 18832
4053 1 14 . 1 1 8 8 LYS CB C 8 35.050 35.050 31.713 3.337 18832
4054 1 14 . 1 1 10 10 GLU HA H 10 4.580 4.580 4.489 0.091 18832
4055 1 14 . 1 1 10 10 GLU CA C 10 55.570 55.570 56.466 -0.896 18832
4056 1 14 . 1 1 10 10 GLU CB C 10 30.780 30.780 31.746 -0.966 18832
4057 1 14 . 1 1 11 11 GLU N N 11 122.500 122.500 122.803 -0.303 18832
4058 1 14 . 1 1 11 11 GLU HA H 11 4.340 4.340 4.451 -0.111 18832
4059 1 14 . 1 1 11 11 GLU CA C 11 57.140 57.140 56.451 0.689 18832
4060 1 14 . 1 1 11 11 GLU CB C 11 29.400 29.400 30.258 -0.858 18832
4061 1 14 . 1 1 11 11 GLU H H 11 8.271 8.271 8.761 -0.490 18832
4062 1 14 . 1 1 12 12 LYS HA H 12 4.380 4.380 4.021 0.359 18832
4063 1 14 . 1 1 12 12 LYS CA C 12 55.790 55.790 55.780 0.010 18832
4064 1 14 . 1 1 12 12 LYS CB C 12 33.600 33.600 32.946 0.654 18832
4065 1 14 . 1 1 13 13 TYR HA H 13 5.560 5.560 4.648 0.912 18832
4066 1 14 . 1 1 13 13 TYR CA C 13 55.860 55.860 55.275 0.585 18832
4067 1 14 . 1 1 13 13 TYR CB C 13 42.440 42.440 39.484 2.956 18832
4068 1 14 . 1 1 14 14 GLY N N 14 105.320 105.320 106.153 -0.833 18832
4069 1 14 . 1 1 14 14 GLY CA C 14 45.240 45.240 43.425 1.815 18832
4070 1 14 . 1 1 14 14 GLY H H 14 8.401 8.401 8.982 -0.581 18832
4071 1 14 . 1 1 15 15 VAL N N 15 118.900 118.900 117.944 0.956 18832
4072 1 14 . 1 1 15 15 VAL HA H 15 5.341 5.341 4.696 0.645 18832
4073 1 14 . 1 1 15 15 VAL CA C 15 59.210 59.210 60.419 -1.209 18832
4074 1 14 . 1 1 15 15 VAL CB C 15 35.740 35.740 35.471 0.269 18832
4075 1 14 . 1 1 15 15 VAL H H 15 8.851 8.851 8.743 0.108 18832
4076 1 14 . 1 1 16 16 ALA N N 16 129.460 129.460 126.564 2.896 18832
4077 1 14 . 1 1 16 16 ALA HA H 16 5.000 5.000 5.121 -0.121 18832
4078 1 14 . 1 1 16 16 ALA CA C 16 52.000 52.000 50.183 1.817 18832
4079 1 14 . 1 1 16 16 ALA CB C 16 19.330 19.330 21.117 -1.787 18832
4080 1 14 . 1 1 16 16 ALA H H 16 9.113 9.113 8.466 0.647 18832
4081 1 14 . 1 1 17 17 PHE N N 17 124.070 124.070 120.442 3.628 18832
4082 1 14 . 1 1 17 17 PHE HA H 17 4.801 4.801 4.912 -0.111 18832
4083 1 14 . 1 1 17 17 PHE CA C 17 56.230 56.230 56.093 0.137 18832
4084 1 14 . 1 1 17 17 PHE CB C 17 40.000 40.000 38.615 1.385 18832
4085 1 14 . 1 1 17 17 PHE H H 17 8.787 8.787 7.668 1.119 18832
4086 1 14 . 1 1 18 18 TYR N N 18 118.210 118.210 123.767 -5.557 18832
4087 1 14 . 1 1 18 18 TYR HA H 18 4.483 4.483 4.432 0.051 18832
4088 1 14 . 1 1 18 18 TYR CA C 18 55.300 55.300 57.429 -2.129 18832
4089 1 14 . 1 1 18 18 TYR CB C 18 42.810 42.810 42.508 0.302 18832
4090 1 14 . 1 1 18 18 TYR H H 18 7.281 7.281 7.672 -0.391 18832
4091 1 14 . 1 1 19 19 ASN N N 19 116.800 116.800 118.904 -2.104 18832
4092 1 14 . 1 1 19 19 ASN HA H 19 4.710 4.710 4.846 -0.136 18832
4093 1 14 . 1 1 19 19 ASN CA C 19 52.940 52.940 52.651 0.289 18832
4094 1 14 . 1 1 19 19 ASN CB C 19 39.060 39.060 38.797 0.263 18832
4095 1 14 . 1 1 19 19 ASN H H 19 8.134 8.134 8.499 -0.365 18832
4096 1 14 . 1 1 20 20 TYR N N 20 122.190 122.190 122.726 -0.536 18832
4097 1 14 . 1 1 20 20 TYR HA H 20 4.687 4.687 4.444 0.243 18832
4098 1 14 . 1 1 20 20 TYR CA C 20 57.720 57.720 59.098 -1.378 18832
4099 1 14 . 1 1 20 20 TYR CB C 20 42.250 42.250 39.983 2.267 18832
4100 1 14 . 1 1 20 20 TYR H H 20 8.993 8.993 7.863 1.130 18832
4101 1 14 . 1 1 21 21 ASP N N 21 128.520 128.520 126.377 2.143 18832
4102 1 14 . 1 1 21 21 ASP HA H 21 4.790 4.790 4.868 -0.078 18832
4103 1 14 . 1 1 21 21 ASP CA C 21 52.370 52.370 52.691 -0.321 18832
4104 1 14 . 1 1 21 21 ASP CB C 21 41.130 41.130 41.835 -0.705 18832
4105 1 14 . 1 1 21 21 ASP H H 21 7.838 7.838 8.290 -0.452 18832
4106 1 14 . 1 1 22 22 ALA N N 22 125.240 125.240 125.925 -0.685 18832
4107 1 14 . 1 1 22 22 ALA HA H 22 4.051 4.051 4.603 -0.552 18832
4108 1 14 . 1 1 22 22 ALA CA C 22 52.940 52.940 53.132 -0.192 18832
4109 1 14 . 1 1 22 22 ALA CB C 22 20.450 20.450 20.061 0.389 18832
4110 1 14 . 1 1 22 22 ALA H H 22 8.103 8.103 8.761 -0.658 18832
4111 1 14 . 1 1 23 23 ARG N N 23 122.190 122.190 122.278 -0.088 18832
4112 1 14 . 1 1 23 23 ARG HA H 23 4.346 4.346 4.522 -0.176 18832
4113 1 14 . 1 1 23 23 ARG CA C 23 55.490 55.490 55.642 -0.152 18832
4114 1 14 . 1 1 23 23 ARG CB C 23 30.700 30.700 30.221 0.479 18832
4115 1 14 . 1 1 23 23 ARG H H 23 8.887 8.887 8.614 0.273 18832
4116 1 14 . 1 1 24 24 GLY N N 24 105.320 105.320 106.592 -1.272 18832
4117 1 14 . 1 1 24 24 GLY CA C 24 44.500 44.500 45.409 -0.909 18832
4118 1 14 . 1 1 24 24 GLY H H 24 7.258 7.258 7.542 -0.284 18832
4119 1 14 . 1 1 25 25 ALA N N 25 122.190 122.190 121.408 0.782 18832
4120 1 14 . 1 1 25 25 ALA HA H 25 4.166 4.166 4.323 -0.157 18832
4121 1 14 . 1 1 25 25 ALA CA C 25 54.440 54.440 53.847 0.593 18832
4122 1 14 . 1 1 25 25 ALA CB C 25 18.770 18.770 19.418 -0.648 18832
4123 1 14 . 1 1 25 25 ALA H H 25 8.627 8.627 8.347 0.280 18832
4124 1 14 . 1 1 26 26 ASP N N 26 114.690 114.690 116.283 -1.593 18832
4125 1 14 . 1 1 26 26 ASP HA H 26 4.700 4.700 4.395 0.305 18832
4126 1 14 . 1 1 26 26 ASP CA C 26 53.870 53.870 56.184 -2.314 18832
4127 1 14 . 1 1 26 26 ASP CB C 26 40.390 40.390 40.767 -0.377 18832
4128 1 14 . 1 1 26 26 ASP H H 26 8.955 8.955 8.648 0.307 18832
4129 1 14 . 1 1 27 27 GLU N N 27 118.910 118.910 116.102 2.808 18832
4130 1 14 . 1 1 27 27 GLU HA H 27 5.202 5.202 4.575 0.627 18832
4131 1 14 . 1 1 27 27 GLU CA C 27 54.930 54.930 55.558 -0.628 18832
4132 1 14 . 1 1 27 27 GLU CB C 27 32.880 32.880 33.160 -0.280 18832
4133 1 14 . 1 1 27 27 GLU H H 27 7.537 7.537 7.463 0.074 18832
4134 1 14 . 1 1 28 28 LEU N N 28 121.490 121.490 121.175 0.315 18832
4135 1 14 . 1 1 28 28 LEU HA H 28 4.756 4.756 4.771 -0.015 18832
4136 1 14 . 1 1 28 28 LEU CA C 28 53.120 53.120 53.748 -0.628 18832
4137 1 14 . 1 1 28 28 LEU CB C 28 44.500 44.500 44.852 -0.352 18832
4138 1 14 . 1 1 28 28 LEU H H 28 8.890 8.890 8.551 0.339 18832
4139 1 14 . 1 1 29 29 SER N N 29 115.870 115.870 119.555 -3.685 18832
4140 1 14 . 1 1 29 29 SER HA H 29 5.009 5.009 4.706 0.303 18832
4141 1 14 . 1 1 29 29 SER CA C 29 58.470 58.470 58.692 -0.222 18832
4142 1 14 . 1 1 29 29 SER CB C 29 63.690 63.690 63.809 -0.119 18832
4143 1 14 . 1 1 29 29 SER H H 29 7.948 7.948 8.489 -0.541 18832
4144 1 14 . 1 1 30 30 LEU N N 30 121.260 121.260 125.563 -4.303 18832
4145 1 14 . 1 1 30 30 LEU HA H 30 4.776 4.776 4.720 0.056 18832
4146 1 14 . 1 1 30 30 LEU CA C 30 52.940 52.940 54.056 -1.116 18832
4147 1 14 . 1 1 30 30 LEU CB C 30 46.370 46.370 44.920 1.450 18832
4148 1 14 . 1 1 30 30 LEU H H 30 9.500 9.500 8.129 1.371 18832
4149 1 14 . 1 1 31 31 GLN N N 31 123.130 123.130 119.639 3.491 18832
4150 1 14 . 1 1 31 31 GLN HA H 31 5.065 5.065 5.120 -0.055 18832
4151 1 14 . 1 1 31 31 GLN CA C 31 52.940 52.940 53.570 -0.630 18832
4152 1 14 . 1 1 31 31 GLN CB C 31 31.190 31.190 32.649 -1.459 18832
4153 1 14 . 1 1 31 31 GLN H H 31 9.147 9.147 8.479 0.667 18832
4154 1 14 . 1 1 32 32 ILE N N 32 120.790 120.790 120.699 0.091 18832
4155 1 14 . 1 1 32 32 ILE HA H 32 3.032 3.032 4.236 -1.204 18832
4156 1 14 . 1 1 32 32 ILE CA C 32 64.250 64.250 62.680 1.570 18832
4157 1 14 . 1 1 32 32 ILE CB C 32 37.940 37.940 38.131 -0.191 18832
4158 1 14 . 1 1 32 32 ILE H H 32 8.016 8.016 8.146 -0.130 18832
4159 1 14 . 1 1 33 33 GLY N N 33 115.870 115.870 114.552 1.318 18832
4160 1 14 . 1 1 33 33 GLY CA C 33 44.500 44.500 44.745 -0.245 18832
4161 1 14 . 1 1 33 33 GLY H H 33 8.775 8.775 8.844 -0.069 18832
4162 1 14 . 1 1 34 34 ASP N N 34 122.430 122.430 122.013 0.417 18832
4163 1 14 . 1 1 34 34 ASP HA H 34 4.634 4.634 4.933 -0.299 18832
4164 1 14 . 1 1 34 34 ASP CA C 34 55.860 55.860 54.041 1.819 18832
4165 1 14 . 1 1 34 34 ASP CB C 34 41.310 41.310 42.493 -1.183 18832
4166 1 14 . 1 1 34 34 ASP H H 34 8.686 8.686 7.762 0.924 18832
4167 1 14 . 1 1 35 35 THR N N 35 117.980 117.980 116.576 1.404 18832
4168 1 14 . 1 1 35 35 THR HA H 35 5.154 5.154 4.966 0.188 18832
4169 1 14 . 1 1 35 35 THR CA C 35 61.450 61.450 61.491 -0.041 18832
4170 1 14 . 1 1 35 35 THR CB C 35 69.090 69.090 70.093 -1.003 18832
4171 1 14 . 1 1 35 35 THR H H 35 8.392 8.392 8.390 0.002 18832
4172 1 14 . 1 1 36 36 VAL N N 36 118.200 118.200 116.403 1.797 18832
4173 1 14 . 1 1 36 36 VAL HA H 36 5.152 5.152 4.566 0.586 18832
4174 1 14 . 1 1 36 36 VAL CA C 36 57.910 57.910 60.179 -2.269 18832
4175 1 14 . 1 1 36 36 VAL CB C 36 34.190 34.190 35.031 -0.841 18832
4176 1 14 . 1 1 36 36 VAL H H 36 9.016 9.016 9.077 -0.061 18832
4177 1 14 . 1 1 37 37 HIS N N 37 122.190 122.190 125.896 -3.706 18832
4178 1 14 . 1 1 37 37 HIS HA H 37 4.811 4.811 4.887 -0.076 18832
4179 1 14 . 1 1 37 37 HIS CA C 37 52.560 52.560 53.723 -1.163 18832
4180 1 14 . 1 1 37 37 HIS CB C 37 31.260 31.260 30.708 0.552 18832
4181 1 14 . 1 1 37 37 HIS H H 37 8.491 8.491 8.306 0.185 18832
4182 1 14 . 1 1 38 38 ILE N N 38 126.650 126.650 127.702 -1.052 18832
4183 1 14 . 1 1 38 38 ILE HA H 38 3.750 3.750 4.158 -0.408 18832
4184 1 14 . 1 1 38 38 ILE CA C 38 61.640 61.640 62.497 -0.857 18832
4185 1 14 . 1 1 38 38 ILE CB C 38 38.880 38.880 38.337 0.543 18832
4186 1 14 . 1 1 38 38 ILE H H 38 8.638 8.638 8.906 -0.268 18832
4187 1 14 . 1 1 39 39 LEU N N 39 126.180 126.180 124.217 1.963 18832
4188 1 14 . 1 1 39 39 LEU HA H 39 4.380 4.380 4.803 -0.423 18832
4189 1 14 . 1 1 39 39 LEU CA C 39 55.490 55.490 54.969 0.521 18832
4190 1 14 . 1 1 39 39 LEU CB C 39 43.750 43.750 43.470 0.280 18832
4191 1 14 . 1 1 39 39 LEU H H 39 9.163 9.163 9.033 0.130 18832
4192 1 14 . 1 1 40 40 GLU N N 40 115.160 115.160 117.715 -2.555 18832
4193 1 14 . 1 1 40 40 GLU HA H 40 5.020 5.020 4.561 0.459 18832
4194 1 14 . 1 1 40 40 GLU CA C 40 55.090 55.090 55.354 -0.264 18832
4195 1 14 . 1 1 40 40 GLU CB C 40 35.730 35.730 33.539 2.191 18832
4196 1 14 . 1 1 40 40 GLU H H 40 7.852 7.852 7.668 0.184 18832
4197 1 14 . 1 1 41 41 THR HA H 41 4.270 4.270 4.590 -0.320 18832
4198 1 14 . 1 1 41 41 THR CA C 41 61.250 61.250 60.628 0.622 18832
4199 1 14 . 1 1 41 41 THR CB C 41 71.410 71.410 70.237 1.173 18832
4200 1 14 . 1 1 42 42 TYR HA H 42 4.550 4.550 4.219 0.331 18832
4201 1 14 . 1 1 43 43 GLU N N 43 124.100 124.100 119.562 4.538 18832
4202 1 14 . 1 1 43 43 GLU HA H 43 3.740 3.740 4.190 -0.450 18832
4203 1 14 . 1 1 43 43 GLU H H 43 8.590 8.590 8.526 0.064 18832
4204 1 14 . 1 1 44 44 GLY N N 44 110.789 110.789 111.500 -0.711 18832
4205 1 14 . 1 1 44 44 GLY CA C 44 45.440 45.440 44.964 0.476 18832
4206 1 14 . 1 1 44 44 GLY H H 44 8.432 8.432 8.486 -0.054 18832
4207 1 14 . 1 1 45 45 TRP HA H 45 4.690 4.690 4.623 0.067 18832
4208 1 14 . 1 1 45 45 TRP CA C 45 57.550 57.550 56.405 1.145 18832
4209 1 14 . 1 1 46 46 TYR HA H 46 5.600 5.600 4.722 0.878 18832
4210 1 14 . 1 1 46 46 TYR CA C 46 54.060 54.060 54.930 -0.870 18832
4211 1 14 . 1 1 46 46 TYR CB C 46 42.650 42.650 40.850 1.800 18832
4212 1 14 . 1 1 47 47 ARG N N 47 118.100 118.100 120.497 -2.397 18832
4213 1 14 . 1 1 47 47 ARG HA H 47 5.094 5.094 5.020 0.074 18832
4214 1 14 . 1 1 47 47 ARG CA C 47 54.060 54.060 54.069 -0.009 18832
4215 1 14 . 1 1 47 47 ARG CB C 47 33.250 33.250 34.278 -1.028 18832
4216 1 14 . 1 1 47 47 ARG H H 47 8.492 8.492 8.195 0.297 18832
4217 1 14 . 1 1 48 48 GLY N N 48 114.000 114.000 110.566 3.434 18832
4218 1 14 . 1 1 48 48 GLY CA C 48 46.560 46.560 45.863 0.697 18832
4219 1 14 . 1 1 48 48 GLY H H 48 9.183 9.183 8.887 0.296 18832
4220 1 14 . 1 1 49 49 TYR N N 49 116.100 116.100 115.209 0.891 18832
4221 1 14 . 1 1 49 49 TYR HA H 49 5.373 5.373 5.286 0.087 18832
4222 1 14 . 1 1 49 49 TYR CA C 49 55.110 55.110 55.507 -0.397 18832
4223 1 14 . 1 1 49 49 TYR CB C 49 40.750 40.750 40.258 0.492 18832
4224 1 14 . 1 1 49 49 TYR H H 49 8.194 8.194 7.962 0.232 18832
4225 1 14 . 1 1 50 50 THR N N 50 112.350 112.350 115.886 -3.536 18832
4226 1 14 . 1 1 50 50 THR HA H 50 5.105 5.105 4.474 0.631 18832
4227 1 14 . 1 1 50 50 THR CA C 50 59.770 59.770 61.745 -1.975 18832
4228 1 14 . 1 1 50 50 THR CB C 50 69.460 69.460 69.831 -0.371 18832
4229 1 14 . 1 1 50 50 THR H H 50 9.441 9.441 8.575 0.866 18832
4230 1 14 . 1 1 51 51 LEU N N 51 121.260 121.260 120.463 0.797 18832
4231 1 14 . 1 1 51 51 LEU HA H 51 4.236 4.236 4.143 0.093 18832
4232 1 14 . 1 1 51 51 LEU CA C 51 56.790 56.790 56.602 0.188 18832
4233 1 14 . 1 1 51 51 LEU CB C 51 40.000 40.000 41.158 -1.158 18832
4234 1 14 . 1 1 51 51 LEU H H 51 8.310 8.310 8.202 0.108 18832
4235 1 14 . 1 1 52 52 ARG N N 52 116.570 116.570 118.207 -1.637 18832
4236 1 14 . 1 1 52 52 ARG HA H 52 4.250 4.250 4.134 0.116 18832
4237 1 14 . 1 1 52 52 ARG CA C 52 57.350 57.350 58.477 -1.127 18832
4238 1 14 . 1 1 52 52 ARG CB C 52 30.510 30.510 30.735 -0.225 18832
4239 1 14 . 1 1 52 52 ARG H H 52 8.047 8.047 8.245 -0.198 18832
4240 1 14 . 1 1 53 53 LYS N N 53 122.660 122.660 117.675 4.985 18832
4241 1 14 . 1 1 53 53 LYS HA H 53 4.616 4.616 4.519 0.097 18832
4242 1 14 . 1 1 53 53 LYS CA C 53 54.620 54.620 55.677 -1.057 18832
4243 1 14 . 1 1 53 53 LYS CB C 53 32.860 32.860 32.350 0.510 18832
4244 1 14 . 1 1 53 53 LYS H H 53 7.649 7.649 7.897 -0.248 18832
4245 1 14 . 1 1 54 54 LYS N N 54 125.010 125.010 120.985 4.025 18832
4246 1 14 . 1 1 54 54 LYS HA H 54 4.090 4.090 4.180 -0.090 18832
4247 1 14 . 1 1 54 54 LYS CA C 54 58.470 58.470 58.724 -0.254 18832
4248 1 14 . 1 1 54 54 LYS CB C 54 32.130 32.130 32.576 -0.446 18832
4249 1 14 . 1 1 54 54 LYS H H 54 8.496 8.496 8.593 -0.097 18832
4250 1 14 . 1 1 55 55 SER N N 55 110.240 110.240 113.282 -3.042 18832
4251 1 14 . 1 1 55 55 SER HA H 55 4.122 4.122 4.169 -0.047 18832
4252 1 14 . 1 1 55 55 SER CA C 55 58.960 58.960 59.415 -0.455 18832
4253 1 14 . 1 1 55 55 SER CB C 55 63.310 63.310 63.308 0.002 18832
4254 1 14 . 1 1 55 55 SER H H 55 7.857 7.857 8.179 -0.322 18832
4255 1 14 . 1 1 56 56 LYS N N 56 124.070 124.070 122.051 2.019 18832
4256 1 14 . 1 1 56 56 LYS HA H 56 4.668 4.668 4.329 0.339 18832
4257 1 14 . 1 1 56 56 LYS CA C 56 54.810 54.810 56.162 -1.352 18832
4258 1 14 . 1 1 56 56 LYS CB C 56 33.250 33.250 33.347 -0.097 18832
4259 1 14 . 1 1 56 56 LYS H H 56 7.473 7.473 7.838 -0.365 18832
4260 1 14 . 1 1 57 57 LYS N N 57 125.940 125.940 121.794 4.146 18832
4261 1 14 . 1 1 57 57 LYS HA H 57 5.341 5.341 4.992 0.349 18832
4262 1 14 . 1 1 57 57 LYS CA C 57 54.620 54.620 54.680 -0.060 18832
4263 1 14 . 1 1 57 57 LYS CB C 57 34.240 34.240 36.756 -2.516 18832
4264 1 14 . 1 1 57 57 LYS H H 57 8.474 8.474 8.242 0.232 18832
4265 1 14 . 1 1 58 58 GLY N N 58 109.540 109.540 107.778 1.762 18832
4266 1 14 . 1 1 58 58 GLY CA C 58 45.620 45.620 45.148 0.472 18832
4267 1 14 . 1 1 58 58 GLY H H 58 9.075 9.075 8.631 0.444 18832
4268 1 14 . 1 1 59 59 ILE N N 59 113.900 113.900 115.639 -1.739 18832
4269 1 14 . 1 1 59 59 ILE HA H 59 6.000 6.000 4.992 1.008 18832
4270 1 14 . 1 1 59 59 ILE CA C 59 59.590 59.590 58.338 1.252 18832
4271 1 14 . 1 1 59 59 ILE CB C 59 41.140 41.140 40.620 0.520 18832
4272 1 14 . 1 1 59 59 ILE H H 59 8.628 8.628 8.154 0.474 18832
4273 1 14 . 1 1 60 60 PHE N N 60 117.040 117.040 117.235 -0.195 18832
4274 1 14 . 1 1 60 60 PHE HA H 60 5.120 5.120 5.322 -0.202 18832
4275 1 14 . 1 1 60 60 PHE CA C 60 54.060 54.060 54.792 -0.732 18832
4276 1 14 . 1 1 60 60 PHE CB C 60 37.190 37.190 39.340 -2.150 18832
4277 1 14 . 1 1 60 60 PHE H H 60 8.724 8.724 8.366 0.358 18832
4278 1 14 . 1 1 61 61 PRO HA H 61 3.480 3.480 4.734 -1.254 18832
4279 1 14 . 1 1 61 61 PRO CA C 61 62.200 62.200 62.169 0.031 18832
4280 1 14 . 1 1 61 61 PRO CB C 61 31.190 31.190 32.589 -1.399 18832
4281 1 14 . 1 1 62 62 ALA N N 62 124.770 124.770 126.473 -1.703 18832
4282 1 14 . 1 1 62 62 ALA HA H 62 3.710 3.710 3.961 -0.251 18832
4283 1 14 . 1 1 62 62 ALA CA C 62 54.370 54.370 54.425 -0.055 18832
4284 1 14 . 1 1 62 62 ALA CB C 62 17.650 17.650 17.991 -0.341 18832
4285 1 14 . 1 1 62 62 ALA H H 62 7.898 7.898 8.293 -0.395 18832
4286 1 14 . 1 1 63 63 SER N N 63 109.700 109.700 115.194 -5.494 18832
4287 1 14 . 1 1 63 63 SER HA H 63 4.200 4.200 4.264 -0.064 18832
4288 1 14 . 1 1 63 63 SER CA C 63 59.400 59.400 60.748 -1.348 18832
4289 1 14 . 1 1 63 63 SER CB C 63 62.380 62.380 63.063 -0.683 18832
4290 1 14 . 1 1 63 63 SER H H 63 8.030 8.030 8.605 -0.575 18832
4291 1 14 . 1 1 64 64 TYR N N 64 120.300 120.300 113.109 7.191 18832
4292 1 14 . 1 1 64 64 TYR HA H 64 4.250 4.250 4.604 -0.354 18832
4293 1 14 . 1 1 64 64 TYR CA C 64 57.720 57.720 55.251 2.469 18832
4294 1 14 . 1 1 64 64 TYR CB C 64 37.560 37.560 37.206 0.354 18832
4295 1 14 . 1 1 64 64 TYR H H 64 7.128 7.128 7.057 0.071 18832
4296 1 14 . 1 1 65 65 ILE N N 65 118.000 118.000 120.881 -2.881 18832
4297 1 14 . 1 1 65 65 ILE HA H 65 4.810 4.810 4.943 -0.133 18832
4298 1 14 . 1 1 65 65 ILE CA C 65 56.980 56.980 59.197 -2.217 18832
4299 1 14 . 1 1 65 65 ILE CB C 65 39.630 39.630 40.321 -0.691 18832
4300 1 14 . 1 1 65 65 ILE H H 65 7.671 7.671 7.543 0.128 18832
4301 1 14 . 1 1 66 66 HIS N N 66 124.300 124.300 126.679 -2.379 18832
4302 1 14 . 1 1 66 66 HIS HA H 66 5.130 5.130 4.977 0.153 18832
4303 1 14 . 1 1 66 66 HIS CA C 66 53.060 53.060 54.371 -1.311 18832
4304 1 14 . 1 1 66 66 HIS CB C 66 30.510 30.510 33.233 -2.723 18832
4305 1 14 . 1 1 66 66 HIS H H 66 9.159 9.159 8.654 0.505 18832
4306 1 14 . 1 1 67 67 LEU N N 67 127.580 127.580 128.604 -1.024 18832
4307 1 14 . 1 1 67 67 LEU HA H 67 4.570 4.570 4.431 0.139 18832
4308 1 14 . 1 1 67 67 LEU CA C 67 55.300 55.300 55.941 -0.640 18832
4309 1 14 . 1 1 67 67 LEU CB C 67 42.060 42.060 42.458 -0.398 18832
4310 1 14 . 1 1 67 67 LEU H H 67 8.992 8.992 8.879 0.114 18832
4311 1 14 . 1 1 68 68 LYS N N 68 121.900 121.900 124.304 -2.404 18832
4312 1 14 . 1 1 68 68 LYS HA H 68 4.490 4.490 4.665 -0.175 18832
4313 1 14 . 1 1 68 68 LYS CA C 68 55.110 55.110 54.267 0.842 18832
4314 1 14 . 1 1 68 68 LYS CB C 68 34.610 34.610 33.810 0.800 18832
4315 1 14 . 1 1 68 68 LYS H H 68 8.499 8.499 8.348 0.151 18832
4316 1 14 . 1 1 69 69 GLU N N 69 122.190 122.190 119.799 2.391 18832
4317 1 14 . 1 1 69 69 GLU HA H 69 4.280 4.280 4.385 -0.105 18832
4318 1 14 . 1 1 69 69 GLU CA C 69 56.610 56.610 55.879 0.731 18832
4319 1 14 . 1 1 69 69 GLU CB C 69 30.330 30.330 30.311 0.020 18832
4320 1 14 . 1 1 69 69 GLU H H 69 8.569 8.569 8.397 0.172 18832
4321 1 14 . 1 1 70 70 ALA N N 70 123.370 123.370 121.287 2.083 18832
4322 1 14 . 1 1 70 70 ALA HA H 70 4.200 4.200 4.548 -0.348 18832
4323 1 14 . 1 1 70 70 ALA CA C 70 51.810 51.810 50.934 0.876 18832
4324 1 14 . 1 1 70 70 ALA CB C 70 19.700 19.700 20.167 -0.467 18832
4325 1 14 . 1 1 70 70 ALA H H 70 8.181 8.181 8.058 0.123 18832
4326 1 14 . 1 1 71 71 ILE N N 71 120.080 120.080 118.337 1.743 18832
4327 1 14 . 1 1 71 71 ILE HA H 71 4.070 4.070 4.544 -0.474 18832
4328 1 14 . 1 1 71 71 ILE CA C 71 60.330 60.330 60.524 -0.194 18832
4329 1 14 . 1 1 71 71 ILE CB C 71 38.690 38.690 36.586 2.104 18832
4330 1 14 . 1 1 71 71 ILE H H 71 7.776 7.776 8.345 -0.569 18832
4331 1 14 . 1 1 72 72 VAL N N 72 124.540 124.540 123.347 1.193 18832
4332 1 14 . 1 1 72 72 VAL HA H 72 4.070 4.070 4.411 -0.341 18832
4333 1 14 . 1 1 72 72 VAL CA C 72 61.640 61.640 61.849 -0.209 18832
4334 1 14 . 1 1 72 72 VAL CB C 72 32.690 32.690 31.753 0.936 18832
4335 1 14 . 1 1 72 72 VAL H H 72 8.089 8.089 8.257 -0.168 18832
4336 1 14 . 1 1 73 73 GLU N N 73 125.940 125.940 127.121 -1.181 18832
4337 1 14 . 1 1 73 73 GLU HA H 73 4.280 4.280 4.603 -0.323 18832
4338 1 14 . 1 1 73 73 GLU CA C 73 56.610 56.610 55.921 0.689 18832
4339 1 14 . 1 1 73 73 GLU CB C 73 30.710 30.710 31.211 -0.501 18832
4340 1 14 . 1 1 73 73 GLU H H 73 8.464 8.464 8.579 -0.116 18832
4341 1 15 . 1 1 2 2 THR N N 2 116.400 116.400 115.612 0.788 18832
4342 1 15 . 1 1 2 2 THR HA H 2 4.120 4.120 4.637 -0.517 18832
4343 1 15 . 1 1 2 2 THR CA C 2 62.100 62.100 61.766 0.334 18832
4344 1 15 . 1 1 2 2 THR CB C 2 69.440 69.440 69.730 -0.290 18832
4345 1 15 . 1 1 2 2 THR H H 2 8.150 8.150 8.349 -0.199 18832
4346 1 15 . 1 1 3 3 ARG HA H 3 4.310 4.310 4.499 -0.189 18832
4347 1 15 . 1 1 3 3 ARG CA C 3 55.750 55.750 55.547 0.203 18832
4348 1 15 . 1 1 3 3 ARG CB C 3 30.620 30.620 31.314 -0.694 18832
4349 1 15 . 1 1 4 4 TRP N N 4 123.300 123.300 121.881 1.419 18832
4350 1 15 . 1 1 4 4 TRP HA H 4 4.480 4.480 4.501 -0.021 18832
4351 1 15 . 1 1 4 4 TRP CA C 4 57.560 57.560 57.207 0.353 18832
4352 1 15 . 1 1 4 4 TRP CB C 4 29.490 29.490 29.349 0.141 18832
4353 1 15 . 1 1 4 4 TRP H H 4 8.108 8.108 8.456 -0.348 18832
4354 1 15 . 1 1 5 5 VAL HA H 5 4.570 4.570 4.133 0.437 18832
4355 1 15 . 1 1 5 5 VAL CB C 5 30.840 30.840 31.649 -0.809 18832
4356 1 15 . 1 1 6 6 PRO HA H 6 4.810 4.810 5.041 -0.231 18832
4357 1 15 . 1 1 6 6 PRO CB C 6 32.210 32.210 33.285 -1.075 18832
4358 1 15 . 1 1 7 7 THR HA H 7 4.270 4.270 4.499 -0.229 18832
4359 1 15 . 1 1 7 7 THR CA C 7 60.890 60.890 61.407 -0.517 18832
4360 1 15 . 1 1 7 7 THR CB C 7 70.140 70.140 68.511 1.629 18832
4361 1 15 . 1 1 8 8 LYS HA H 8 4.440 4.440 4.410 0.030 18832
4362 1 15 . 1 1 8 8 LYS CA C 8 55.980 55.980 55.401 0.579 18832
4363 1 15 . 1 1 8 8 LYS CB C 8 35.050 35.050 33.828 1.222 18832
4364 1 15 . 1 1 10 10 GLU HA H 10 4.580 4.580 4.329 0.251 18832
4365 1 15 . 1 1 10 10 GLU CA C 10 55.570 55.570 56.222 -0.652 18832
4366 1 15 . 1 1 10 10 GLU CB C 10 30.780 30.780 30.433 0.347 18832
4367 1 15 . 1 1 11 11 GLU N N 11 122.500 122.500 118.392 4.108 18832
4368 1 15 . 1 1 11 11 GLU HA H 11 4.340 4.340 4.031 0.309 18832
4369 1 15 . 1 1 11 11 GLU CA C 11 57.140 57.140 57.465 -0.325 18832
4370 1 15 . 1 1 11 11 GLU CB C 11 29.400 29.400 29.013 0.387 18832
4371 1 15 . 1 1 11 11 GLU H H 11 8.271 8.271 8.582 -0.311 18832
4372 1 15 . 1 1 12 12 LYS HA H 12 4.380 4.380 4.209 0.171 18832
4373 1 15 . 1 1 12 12 LYS CA C 12 55.790 55.790 55.156 0.634 18832
4374 1 15 . 1 1 12 12 LYS CB C 12 33.600 33.600 35.219 -1.619 18832
4375 1 15 . 1 1 13 13 TYR HA H 13 5.560 5.560 4.756 0.804 18832
4376 1 15 . 1 1 13 13 TYR CA C 13 55.860 55.860 54.612 1.248 18832
4377 1 15 . 1 1 13 13 TYR CB C 13 42.440 42.440 39.738 2.702 18832
4378 1 15 . 1 1 14 14 GLY N N 14 105.320 105.320 105.353 -0.033 18832
4379 1 15 . 1 1 14 14 GLY CA C 14 45.240 45.240 44.159 1.081 18832
4380 1 15 . 1 1 14 14 GLY H H 14 8.401 8.401 8.374 0.027 18832
4381 1 15 . 1 1 15 15 VAL N N 15 118.900 118.900 118.726 0.174 18832
4382 1 15 . 1 1 15 15 VAL HA H 15 5.341 5.341 4.618 0.723 18832
4383 1 15 . 1 1 15 15 VAL CA C 15 59.210 59.210 60.974 -1.764 18832
4384 1 15 . 1 1 15 15 VAL CB C 15 35.740 35.740 34.078 1.662 18832
4385 1 15 . 1 1 15 15 VAL H H 15 8.851 8.851 8.817 0.034 18832
4386 1 15 . 1 1 16 16 ALA N N 16 129.460 129.460 127.169 2.291 18832
4387 1 15 . 1 1 16 16 ALA HA H 16 5.000 5.000 4.747 0.253 18832
4388 1 15 . 1 1 16 16 ALA CA C 16 52.000 52.000 50.231 1.769 18832
4389 1 15 . 1 1 16 16 ALA CB C 16 19.330 19.330 20.720 -1.390 18832
4390 1 15 . 1 1 16 16 ALA H H 16 9.113 9.113 8.579 0.534 18832
4391 1 15 . 1 1 17 17 PHE N N 17 124.070 124.070 122.068 2.002 18832
4392 1 15 . 1 1 17 17 PHE HA H 17 4.801 4.801 4.993 -0.192 18832
4393 1 15 . 1 1 17 17 PHE CA C 17 56.230 56.230 56.085 0.145 18832
4394 1 15 . 1 1 17 17 PHE CB C 17 40.000 40.000 38.153 1.847 18832
4395 1 15 . 1 1 17 17 PHE H H 17 8.787 8.787 7.400 1.387 18832
4396 1 15 . 1 1 18 18 TYR N N 18 118.210 118.210 124.390 -6.180 18832
4397 1 15 . 1 1 18 18 TYR HA H 18 4.483 4.483 4.481 0.002 18832
4398 1 15 . 1 1 18 18 TYR CA C 18 55.300 55.300 57.904 -2.604 18832
4399 1 15 . 1 1 18 18 TYR CB C 18 42.810 42.810 42.988 -0.178 18832
4400 1 15 . 1 1 18 18 TYR H H 18 7.281 7.281 7.603 -0.322 18832
4401 1 15 . 1 1 19 19 ASN N N 19 116.800 116.800 120.984 -4.184 18832
4402 1 15 . 1 1 19 19 ASN HA H 19 4.710 4.710 4.812 -0.102 18832
4403 1 15 . 1 1 19 19 ASN CA C 19 52.940 52.940 52.708 0.232 18832
4404 1 15 . 1 1 19 19 ASN CB C 19 39.060 39.060 38.434 0.625 18832
4405 1 15 . 1 1 19 19 ASN H H 19 8.134 8.134 7.786 0.348 18832
4406 1 15 . 1 1 20 20 TYR N N 20 122.190 122.190 122.932 -0.742 18832
4407 1 15 . 1 1 20 20 TYR HA H 20 4.687 4.687 4.631 0.056 18832
4408 1 15 . 1 1 20 20 TYR CA C 20 57.720 57.720 58.577 -0.857 18832
4409 1 15 . 1 1 20 20 TYR CB C 20 42.250 42.250 40.164 2.086 18832
4410 1 15 . 1 1 20 20 TYR H H 20 8.993 8.993 8.094 0.899 18832
4411 1 15 . 1 1 21 21 ASP N N 21 128.520 128.520 127.856 0.664 18832
4412 1 15 . 1 1 21 21 ASP HA H 21 4.790 4.790 4.866 -0.076 18832
4413 1 15 . 1 1 21 21 ASP CA C 21 52.370 52.370 52.768 -0.398 18832
4414 1 15 . 1 1 21 21 ASP CB C 21 41.130 41.130 42.560 -1.430 18832
4415 1 15 . 1 1 21 21 ASP H H 21 7.838 7.838 8.400 -0.562 18832
4416 1 15 . 1 1 22 22 ALA N N 22 125.240 125.240 126.463 -1.223 18832
4417 1 15 . 1 1 22 22 ALA HA H 22 4.051 4.051 4.523 -0.472 18832
4418 1 15 . 1 1 22 22 ALA CA C 22 52.940 52.940 52.805 0.135 18832
4419 1 15 . 1 1 22 22 ALA CB C 22 20.450 20.450 19.868 0.582 18832
4420 1 15 . 1 1 22 22 ALA H H 22 8.103 8.103 8.595 -0.492 18832
4421 1 15 . 1 1 23 23 ARG N N 23 122.190 122.190 123.797 -1.607 18832
4422 1 15 . 1 1 23 23 ARG HA H 23 4.346 4.346 4.291 0.055 18832
4423 1 15 . 1 1 23 23 ARG CA C 23 55.490 55.490 57.289 -1.800 18832
4424 1 15 . 1 1 23 23 ARG CB C 23 30.700 30.700 30.929 -0.229 18832
4425 1 15 . 1 1 23 23 ARG H H 23 8.887 8.887 9.008 -0.121 18832
4426 1 15 . 1 1 24 24 GLY N N 24 105.320 105.320 105.160 0.160 18832
4427 1 15 . 1 1 24 24 GLY CA C 24 44.500 44.500 45.123 -0.623 18832
4428 1 15 . 1 1 24 24 GLY H H 24 7.258 7.258 7.512 -0.254 18832
4429 1 15 . 1 1 25 25 ALA N N 25 122.190 122.190 121.363 0.827 18832
4430 1 15 . 1 1 25 25 ALA HA H 25 4.166 4.166 4.273 -0.107 18832
4431 1 15 . 1 1 25 25 ALA CA C 25 54.440 54.440 53.756 0.684 18832
4432 1 15 . 1 1 25 25 ALA CB C 25 18.770 18.770 19.168 -0.398 18832
4433 1 15 . 1 1 25 25 ALA H H 25 8.627 8.627 8.393 0.234 18832
4434 1 15 . 1 1 26 26 ASP N N 26 114.690 114.690 117.334 -2.644 18832
4435 1 15 . 1 1 26 26 ASP HA H 26 4.700 4.700 4.411 0.289 18832
4436 1 15 . 1 1 26 26 ASP CA C 26 53.870 53.870 56.139 -2.269 18832
4437 1 15 . 1 1 26 26 ASP CB C 26 40.390 40.390 40.832 -0.442 18832
4438 1 15 . 1 1 26 26 ASP H H 26 8.955 8.955 8.487 0.468 18832
4439 1 15 . 1 1 27 27 GLU N N 27 118.910 118.910 115.713 3.197 18832
4440 1 15 . 1 1 27 27 GLU HA H 27 5.202 5.202 4.518 0.684 18832
4441 1 15 . 1 1 27 27 GLU CA C 27 54.930 54.930 55.554 -0.624 18832
4442 1 15 . 1 1 27 27 GLU CB C 27 32.880 32.880 32.682 0.198 18832
4443 1 15 . 1 1 27 27 GLU H H 27 7.537 7.537 7.517 0.020 18832
4444 1 15 . 1 1 28 28 LEU N N 28 121.490 121.490 122.487 -0.997 18832
4445 1 15 . 1 1 28 28 LEU HA H 28 4.756 4.756 4.683 0.073 18832
4446 1 15 . 1 1 28 28 LEU CA C 28 53.120 53.120 53.791 -0.671 18832
4447 1 15 . 1 1 28 28 LEU CB C 28 44.500 44.500 44.473 0.027 18832
4448 1 15 . 1 1 28 28 LEU H H 28 8.890 8.890 8.473 0.417 18832
4449 1 15 . 1 1 29 29 SER N N 29 115.870 115.870 119.490 -3.620 18832
4450 1 15 . 1 1 29 29 SER HA H 29 5.009 5.009 4.723 0.286 18832
4451 1 15 . 1 1 29 29 SER CA C 29 58.470 58.470 58.591 -0.121 18832
4452 1 15 . 1 1 29 29 SER CB C 29 63.690 63.690 63.810 -0.120 18832
4453 1 15 . 1 1 29 29 SER H H 29 7.948 7.948 8.515 -0.567 18832
4454 1 15 . 1 1 30 30 LEU N N 30 121.260 121.260 126.171 -4.911 18832
4455 1 15 . 1 1 30 30 LEU HA H 30 4.776 4.776 4.701 0.075 18832
4456 1 15 . 1 1 30 30 LEU CA C 30 52.940 52.940 54.126 -1.186 18832
4457 1 15 . 1 1 30 30 LEU CB C 30 46.370 46.370 44.934 1.436 18832
4458 1 15 . 1 1 30 30 LEU H H 30 9.500 9.500 8.294 1.206 18832
4459 1 15 . 1 1 31 31 GLN N N 31 123.130 123.130 120.433 2.697 18832
4460 1 15 . 1 1 31 31 GLN HA H 31 5.065 5.065 4.865 0.200 18832
4461 1 15 . 1 1 31 31 GLN CA C 31 52.940 52.940 53.857 -0.917 18832
4462 1 15 . 1 1 31 31 GLN CB C 31 31.190 31.190 31.896 -0.706 18832
4463 1 15 . 1 1 31 31 GLN H H 31 9.147 9.147 8.525 0.622 18832
4464 1 15 . 1 1 32 32 ILE N N 32 120.790 120.790 123.161 -2.371 18832
4465 1 15 . 1 1 32 32 ILE HA H 32 3.032 3.032 3.979 -0.947 18832
4466 1 15 . 1 1 32 32 ILE CA C 32 64.250 64.250 63.287 0.963 18832
4467 1 15 . 1 1 32 32 ILE CB C 32 37.940 37.940 37.313 0.627 18832
4468 1 15 . 1 1 32 32 ILE H H 32 8.016 8.016 8.727 -0.711 18832
4469 1 15 . 1 1 33 33 GLY N N 33 115.870 115.870 115.991 -0.121 18832
4470 1 15 . 1 1 33 33 GLY CA C 33 44.500 44.500 44.675 -0.175 18832
4471 1 15 . 1 1 33 33 GLY H H 33 8.775 8.775 8.940 -0.165 18832
4472 1 15 . 1 1 34 34 ASP N N 34 122.430 122.430 122.318 0.112 18832
4473 1 15 . 1 1 34 34 ASP HA H 34 4.634 4.634 4.952 -0.318 18832
4474 1 15 . 1 1 34 34 ASP CA C 34 55.860 55.860 53.943 1.917 18832
4475 1 15 . 1 1 34 34 ASP CB C 34 41.310 41.310 42.297 -0.987 18832
4476 1 15 . 1 1 34 34 ASP H H 34 8.686 8.686 7.974 0.712 18832
4477 1 15 . 1 1 35 35 THR N N 35 117.980 117.980 117.236 0.744 18832
4478 1 15 . 1 1 35 35 THR HA H 35 5.154 5.154 5.209 -0.055 18832
4479 1 15 . 1 1 35 35 THR CA C 35 61.450 61.450 61.416 0.034 18832
4480 1 15 . 1 1 35 35 THR CB C 35 69.090 69.090 70.033 -0.943 18832
4481 1 15 . 1 1 35 35 THR H H 35 8.392 8.392 8.421 -0.029 18832
4482 1 15 . 1 1 36 36 VAL N N 36 118.200 118.200 116.667 1.533 18832
4483 1 15 . 1 1 36 36 VAL HA H 36 5.152 5.152 4.628 0.524 18832
4484 1 15 . 1 1 36 36 VAL CA C 36 57.910 57.910 60.343 -2.433 18832
4485 1 15 . 1 1 36 36 VAL CB C 36 34.190 34.190 34.899 -0.709 18832
4486 1 15 . 1 1 36 36 VAL H H 36 9.016 9.016 9.069 -0.053 18832
4487 1 15 . 1 1 37 37 HIS N N 37 122.190 122.190 125.810 -3.620 18832
4488 1 15 . 1 1 37 37 HIS HA H 37 4.811 4.811 4.886 -0.075 18832
4489 1 15 . 1 1 37 37 HIS CA C 37 52.560 52.560 54.142 -1.581 18832
4490 1 15 . 1 1 37 37 HIS CB C 37 31.260 31.260 30.067 1.193 18832
4491 1 15 . 1 1 37 37 HIS H H 37 8.491 8.491 8.721 -0.230 18832
4492 1 15 . 1 1 38 38 ILE N N 38 126.650 126.650 126.343 0.307 18832
4493 1 15 . 1 1 38 38 ILE HA H 38 3.750 3.750 4.121 -0.371 18832
4494 1 15 . 1 1 38 38 ILE CA C 38 61.640 61.640 62.597 -0.957 18832
4495 1 15 . 1 1 38 38 ILE CB C 38 38.880 38.880 38.142 0.737 18832
4496 1 15 . 1 1 38 38 ILE H H 38 8.638 8.638 8.466 0.172 18832
4497 1 15 . 1 1 39 39 LEU N N 39 126.180 126.180 121.987 4.193 18832
4498 1 15 . 1 1 39 39 LEU HA H 39 4.380 4.380 4.991 -0.611 18832
4499 1 15 . 1 1 39 39 LEU CA C 39 55.490 55.490 54.960 0.530 18832
4500 1 15 . 1 1 39 39 LEU CB C 39 43.750 43.750 43.927 -0.177 18832
4501 1 15 . 1 1 39 39 LEU H H 39 9.163 9.163 8.999 0.164 18832
4502 1 15 . 1 1 40 40 GLU N N 40 115.160 115.160 118.676 -3.516 18832
4503 1 15 . 1 1 40 40 GLU HA H 40 5.020 5.020 4.710 0.310 18832
4504 1 15 . 1 1 40 40 GLU CA C 40 55.090 55.090 55.463 -0.373 18832
4505 1 15 . 1 1 40 40 GLU CB C 40 35.730 35.730 34.377 1.353 18832
4506 1 15 . 1 1 40 40 GLU H H 40 7.852 7.852 7.893 -0.041 18832
4507 1 15 . 1 1 41 41 THR HA H 41 4.270 4.270 4.456 -0.186 18832
4508 1 15 . 1 1 41 41 THR CA C 41 61.250 61.250 59.402 1.848 18832
4509 1 15 . 1 1 41 41 THR CB C 41 71.410 71.410 70.124 1.287 18832
4510 1 15 . 1 1 42 42 TYR HA H 42 4.550 4.550 4.324 0.226 18832
4511 1 15 . 1 1 43 43 GLU N N 43 124.100 124.100 119.991 4.109 18832
4512 1 15 . 1 1 43 43 GLU HA H 43 3.740 3.740 4.136 -0.396 18832
4513 1 15 . 1 1 43 43 GLU H H 43 8.590 8.590 7.897 0.693 18832
4514 1 15 . 1 1 44 44 GLY N N 44 110.789 110.789 108.095 2.694 18832
4515 1 15 . 1 1 44 44 GLY CA C 44 45.440 45.440 45.218 0.222 18832
4516 1 15 . 1 1 44 44 GLY H H 44 8.432 8.432 8.475 -0.043 18832
4517 1 15 . 1 1 45 45 TRP HA H 45 4.690 4.690 4.837 -0.147 18832
4518 1 15 . 1 1 45 45 TRP CA C 45 57.550 57.550 56.153 1.397 18832
4519 1 15 . 1 1 46 46 TYR HA H 46 5.600 5.600 4.824 0.776 18832
4520 1 15 . 1 1 46 46 TYR CA C 46 54.060 54.060 54.778 -0.718 18832
4521 1 15 . 1 1 46 46 TYR CB C 46 42.650 42.650 41.398 1.252 18832
4522 1 15 . 1 1 47 47 ARG N N 47 118.100 118.100 121.553 -3.453 18832
4523 1 15 . 1 1 47 47 ARG HA H 47 5.094 5.094 5.085 0.009 18832
4524 1 15 . 1 1 47 47 ARG CA C 47 54.060 54.060 54.312 -0.252 18832
4525 1 15 . 1 1 47 47 ARG CB C 47 33.250 33.250 33.956 -0.707 18832
4526 1 15 . 1 1 47 47 ARG H H 47 8.492 8.492 8.705 -0.213 18832
4527 1 15 . 1 1 48 48 GLY N N 48 114.000 114.000 111.523 2.477 18832
4528 1 15 . 1 1 48 48 GLY CA C 48 46.560 46.560 45.686 0.874 18832
4529 1 15 . 1 1 48 48 GLY H H 48 9.183 9.183 8.794 0.389 18832
4530 1 15 . 1 1 49 49 TYR N N 49 116.100 116.100 115.540 0.560 18832
4531 1 15 . 1 1 49 49 TYR HA H 49 5.373 5.373 5.167 0.206 18832
4532 1 15 . 1 1 49 49 TYR CA C 49 55.110 55.110 55.391 -0.281 18832
4533 1 15 . 1 1 49 49 TYR CB C 49 40.750 40.750 40.555 0.195 18832
4534 1 15 . 1 1 49 49 TYR H H 49 8.194 8.194 7.960 0.234 18832
4535 1 15 . 1 1 50 50 THR N N 50 112.350 112.350 116.044 -3.694 18832
4536 1 15 . 1 1 50 50 THR HA H 50 5.105 5.105 4.552 0.553 18832
4537 1 15 . 1 1 50 50 THR CA C 50 59.770 59.770 61.525 -1.755 18832
4538 1 15 . 1 1 50 50 THR CB C 50 69.460 69.460 69.733 -0.273 18832
4539 1 15 . 1 1 50 50 THR H H 50 9.441 9.441 8.879 0.562 18832
4540 1 15 . 1 1 51 51 LEU N N 51 121.260 121.260 121.519 -0.259 18832
4541 1 15 . 1 1 51 51 LEU HA H 51 4.236 4.236 4.111 0.126 18832
4542 1 15 . 1 1 51 51 LEU CA C 51 56.790 56.790 57.427 -0.637 18832
4543 1 15 . 1 1 51 51 LEU CB C 51 40.000 40.000 40.903 -0.903 18832
4544 1 15 . 1 1 51 51 LEU H H 51 8.310 8.310 8.267 0.043 18832
4545 1 15 . 1 1 52 52 ARG N N 52 116.570 116.570 117.871 -1.301 18832
4546 1 15 . 1 1 52 52 ARG HA H 52 4.250 4.250 4.202 0.048 18832
4547 1 15 . 1 1 52 52 ARG CA C 52 57.350 57.350 57.987 -0.637 18832
4548 1 15 . 1 1 52 52 ARG CB C 52 30.510 30.510 30.521 -0.011 18832
4549 1 15 . 1 1 52 52 ARG H H 52 8.047 8.047 8.407 -0.360 18832
4550 1 15 . 1 1 53 53 LYS N N 53 122.660 122.660 119.451 3.209 18832
4551 1 15 . 1 1 53 53 LYS HA H 53 4.616 4.616 4.588 0.028 18832
4552 1 15 . 1 1 53 53 LYS CA C 53 54.620 54.620 55.896 -1.276 18832
4553 1 15 . 1 1 53 53 LYS CB C 53 32.860 32.860 31.047 1.813 18832
4554 1 15 . 1 1 53 53 LYS H H 53 7.649 7.649 8.185 -0.536 18832
4555 1 15 . 1 1 54 54 LYS N N 54 125.010 125.010 122.684 2.326 18832
4556 1 15 . 1 1 54 54 LYS HA H 54 4.090 4.090 4.271 -0.181 18832
4557 1 15 . 1 1 54 54 LYS CA C 54 58.470 58.470 59.240 -0.770 18832
4558 1 15 . 1 1 54 54 LYS CB C 54 32.130 32.130 32.414 -0.284 18832
4559 1 15 . 1 1 54 54 LYS H H 54 8.496 8.496 7.886 0.610 18832
4560 1 15 . 1 1 55 55 SER N N 55 110.240 110.240 113.688 -3.448 18832
4561 1 15 . 1 1 55 55 SER HA H 55 4.122 4.122 4.200 -0.078 18832
4562 1 15 . 1 1 55 55 SER CA C 55 58.960 58.960 60.292 -1.332 18832
4563 1 15 . 1 1 55 55 SER CB C 55 63.310 63.310 63.094 0.216 18832
4564 1 15 . 1 1 55 55 SER H H 55 7.857 7.857 8.364 -0.507 18832
4565 1 15 . 1 1 56 56 LYS N N 56 124.070 124.070 121.770 2.300 18832
4566 1 15 . 1 1 56 56 LYS HA H 56 4.668 4.668 4.345 0.323 18832
4567 1 15 . 1 1 56 56 LYS CA C 56 54.810 54.810 56.207 -1.397 18832
4568 1 15 . 1 1 56 56 LYS CB C 56 33.250 33.250 33.758 -0.507 18832
4569 1 15 . 1 1 56 56 LYS H H 56 7.473 7.473 7.381 0.092 18832
4570 1 15 . 1 1 57 57 LYS N N 57 125.940 125.940 118.965 6.975 18832
4571 1 15 . 1 1 57 57 LYS HA H 57 5.341 5.341 4.965 0.376 18832
4572 1 15 . 1 1 57 57 LYS CA C 57 54.620 54.620 54.835 -0.215 18832
4573 1 15 . 1 1 57 57 LYS CB C 57 34.240 34.240 36.534 -2.294 18832
4574 1 15 . 1 1 57 57 LYS H H 57 8.474 8.474 8.151 0.323 18832
4575 1 15 . 1 1 58 58 GLY N N 58 109.540 109.540 108.753 0.787 18832
4576 1 15 . 1 1 58 58 GLY CA C 58 45.620 45.620 45.303 0.317 18832
4577 1 15 . 1 1 58 58 GLY H H 58 9.075 9.075 8.678 0.397 18832
4578 1 15 . 1 1 59 59 ILE N N 59 113.900 113.900 114.951 -1.051 18832
4579 1 15 . 1 1 59 59 ILE HA H 59 6.000 6.000 4.961 1.039 18832
4580 1 15 . 1 1 59 59 ILE CA C 59 59.590 59.590 58.672 0.918 18832
4581 1 15 . 1 1 59 59 ILE CB C 59 41.140 41.140 41.236 -0.096 18832
4582 1 15 . 1 1 59 59 ILE H H 59 8.628 8.628 7.955 0.673 18832
4583 1 15 . 1 1 60 60 PHE N N 60 117.040 117.040 114.877 2.163 18832
4584 1 15 . 1 1 60 60 PHE HA H 60 5.120 5.120 5.303 -0.183 18832
4585 1 15 . 1 1 60 60 PHE CA C 60 54.060 54.060 55.152 -1.092 18832
4586 1 15 . 1 1 60 60 PHE CB C 60 37.190 37.190 38.979 -1.789 18832
4587 1 15 . 1 1 60 60 PHE H H 60 8.724 8.724 8.148 0.576 18832
4588 1 15 . 1 1 61 61 PRO HA H 61 3.480 3.480 4.691 -1.211 18832
4589 1 15 . 1 1 61 61 PRO CA C 61 62.200 62.200 62.446 -0.245 18832
4590 1 15 . 1 1 61 61 PRO CB C 61 31.190 31.190 32.637 -1.447 18832
4591 1 15 . 1 1 62 62 ALA N N 62 124.770 124.770 125.563 -0.793 18832
4592 1 15 . 1 1 62 62 ALA HA H 62 3.710 3.710 4.124 -0.414 18832
4593 1 15 . 1 1 62 62 ALA CA C 62 54.370 54.370 54.428 -0.058 18832
4594 1 15 . 1 1 62 62 ALA CB C 62 17.650 17.650 18.117 -0.467 18832
4595 1 15 . 1 1 62 62 ALA H H 62 7.898 7.898 8.324 -0.426 18832
4596 1 15 . 1 1 63 63 SER N N 63 109.700 109.700 112.401 -2.701 18832
4597 1 15 . 1 1 63 63 SER HA H 63 4.200 4.200 4.287 -0.087 18832
4598 1 15 . 1 1 63 63 SER CA C 63 59.400 59.400 59.046 0.354 18832
4599 1 15 . 1 1 63 63 SER CB C 63 62.380 62.380 62.366 0.014 18832
4600 1 15 . 1 1 63 63 SER H H 63 8.030 8.030 8.227 -0.197 18832
4601 1 15 . 1 1 64 64 TYR N N 64 120.300 120.300 118.076 2.224 18832
4602 1 15 . 1 1 64 64 TYR HA H 64 4.250 4.250 4.404 -0.154 18832
4603 1 15 . 1 1 64 64 TYR CA C 64 57.720 57.720 56.579 1.141 18832
4604 1 15 . 1 1 64 64 TYR CB C 64 37.560 37.560 38.894 -1.334 18832
4605 1 15 . 1 1 64 64 TYR H H 64 7.128 7.128 7.413 -0.285 18832
4606 1 15 . 1 1 65 65 ILE N N 65 118.000 118.000 118.403 -0.403 18832
4607 1 15 . 1 1 65 65 ILE HA H 65 4.810 4.810 4.617 0.193 18832
4608 1 15 . 1 1 65 65 ILE CA C 65 56.980 56.980 58.633 -1.653 18832
4609 1 15 . 1 1 65 65 ILE CB C 65 39.630 39.630 41.357 -1.727 18832
4610 1 15 . 1 1 65 65 ILE H H 65 7.671 7.671 7.247 0.424 18832
4611 1 15 . 1 1 66 66 HIS N N 66 124.300 124.300 122.309 1.991 18832
4612 1 15 . 1 1 66 66 HIS HA H 66 5.130 5.130 4.831 0.299 18832
4613 1 15 . 1 1 66 66 HIS CA C 66 53.060 53.060 55.065 -2.005 18832
4614 1 15 . 1 1 66 66 HIS CB C 66 30.510 30.510 32.816 -2.306 18832
4615 1 15 . 1 1 66 66 HIS H H 66 9.159 9.159 8.648 0.511 18832
4616 1 15 . 1 1 67 67 LEU N N 67 127.580 127.580 127.598 -0.018 18832
4617 1 15 . 1 1 67 67 LEU HA H 67 4.570 4.570 4.257 0.313 18832
4618 1 15 . 1 1 67 67 LEU CA C 67 55.300 55.300 55.602 -0.302 18832
4619 1 15 . 1 1 67 67 LEU CB C 67 42.060 42.060 40.772 1.288 18832
4620 1 15 . 1 1 67 67 LEU H H 67 8.992 8.992 8.557 0.435 18832
4621 1 15 . 1 1 68 68 LYS N N 68 121.900 121.900 125.566 -3.666 18832
4622 1 15 . 1 1 68 68 LYS HA H 68 4.490 4.490 4.556 -0.066 18832
4623 1 15 . 1 1 68 68 LYS CA C 68 55.110 55.110 53.561 1.549 18832
4624 1 15 . 1 1 68 68 LYS CB C 68 34.610 34.610 34.639 -0.029 18832
4625 1 15 . 1 1 68 68 LYS H H 68 8.499 8.499 8.099 0.400 18832
4626 1 15 . 1 1 69 69 GLU N N 69 122.190 122.190 120.722 1.468 18832
4627 1 15 . 1 1 69 69 GLU HA H 69 4.280 4.280 4.330 -0.050 18832
4628 1 15 . 1 1 69 69 GLU CA C 69 56.610 56.610 55.320 1.290 18832
4629 1 15 . 1 1 69 69 GLU CB C 69 30.330 30.330 29.708 0.622 18832
4630 1 15 . 1 1 69 69 GLU H H 69 8.569 8.569 8.599 -0.030 18832
4631 1 15 . 1 1 70 70 ALA N N 70 123.370 123.370 128.144 -4.774 18832
4632 1 15 . 1 1 70 70 ALA HA H 70 4.200 4.200 4.013 0.187 18832
4633 1 15 . 1 1 70 70 ALA CA C 70 51.810 51.810 52.250 -0.440 18832
4634 1 15 . 1 1 70 70 ALA CB C 70 19.700 19.700 18.651 1.049 18832
4635 1 15 . 1 1 70 70 ALA H H 70 8.181 8.181 8.166 0.015 18832
4636 1 15 . 1 1 71 71 ILE N N 71 120.080 120.080 124.054 -3.974 18832
4637 1 15 . 1 1 71 71 ILE HA H 71 4.070 4.070 4.120 -0.050 18832
4638 1 15 . 1 1 71 71 ILE CA C 71 60.330 60.330 61.836 -1.506 18832
4639 1 15 . 1 1 71 71 ILE CB C 71 38.690 38.690 38.599 0.091 18832
4640 1 15 . 1 1 71 71 ILE H H 71 7.776 7.776 8.356 -0.580 18832
4641 1 15 . 1 1 72 72 VAL N N 72 124.540 124.540 124.078 0.462 18832
4642 1 15 . 1 1 72 72 VAL HA H 72 4.070 4.070 4.488 -0.418 18832
4643 1 15 . 1 1 72 72 VAL CA C 72 61.640 61.640 62.123 -0.483 18832
4644 1 15 . 1 1 72 72 VAL CB C 72 32.690 32.690 31.403 1.287 18832
4645 1 15 . 1 1 72 72 VAL H H 72 8.089 8.089 8.305 -0.216 18832
4646 1 15 . 1 1 73 73 GLU N N 73 125.940 125.940 128.344 -2.404 18832
4647 1 15 . 1 1 73 73 GLU HA H 73 4.280 4.280 4.597 -0.317 18832
4648 1 15 . 1 1 73 73 GLU CA C 73 56.610 56.610 56.788 -0.178 18832
4649 1 15 . 1 1 73 73 GLU CB C 73 30.710 30.710 29.894 0.816 18832
4650 1 15 . 1 1 73 73 GLU H H 73 8.464 8.464 8.947 -0.483 18832
4651 1 16 . 1 1 2 2 THR N N 2 116.400 116.400 115.781 0.619 18832
4652 1 16 . 1 1 2 2 THR HA H 2 4.120 4.120 4.448 -0.328 18832
4653 1 16 . 1 1 2 2 THR CA C 2 62.100 62.100 61.400 0.700 18832
4654 1 16 . 1 1 2 2 THR CB C 2 69.440 69.440 68.885 0.555 18832
4655 1 16 . 1 1 2 2 THR H H 2 8.150 8.150 7.796 0.354 18832
4656 1 16 . 1 1 3 3 ARG HA H 3 4.310 4.310 4.320 -0.010 18832
4657 1 16 . 1 1 3 3 ARG CA C 3 55.750 55.750 56.666 -0.916 18832
4658 1 16 . 1 1 3 3 ARG CB C 3 30.620 30.620 30.330 0.290 18832
4659 1 16 . 1 1 4 4 TRP N N 4 123.300 123.300 116.163 7.137 18832
4660 1 16 . 1 1 4 4 TRP HA H 4 4.480 4.480 4.664 -0.184 18832
4661 1 16 . 1 1 4 4 TRP CA C 4 57.560 57.560 57.756 -0.196 18832
4662 1 16 . 1 1 4 4 TRP CB C 4 29.490 29.490 29.325 0.165 18832
4663 1 16 . 1 1 4 4 TRP H H 4 8.108 8.108 7.876 0.232 18832
4664 1 16 . 1 1 5 5 VAL HA H 5 4.570 4.570 4.563 0.007 18832
4665 1 16 . 1 1 5 5 VAL CB C 5 30.840 30.840 33.076 -2.236 18832
4666 1 16 . 1 1 6 6 PRO HA H 6 4.810 4.810 5.146 -0.336 18832
4667 1 16 . 1 1 6 6 PRO CB C 6 32.210 32.210 31.365 0.845 18832
4668 1 16 . 1 1 7 7 THR HA H 7 4.270 4.270 3.876 0.394 18832
4669 1 16 . 1 1 7 7 THR CA C 7 60.890 60.890 63.355 -2.465 18832
4670 1 16 . 1 1 7 7 THR CB C 7 70.140 70.140 68.930 1.210 18832
4671 1 16 . 1 1 8 8 LYS HA H 8 4.440 4.440 4.463 -0.023 18832
4672 1 16 . 1 1 8 8 LYS CA C 8 55.980 55.980 56.162 -0.182 18832
4673 1 16 . 1 1 8 8 LYS CB C 8 35.050 35.050 32.740 2.310 18832
4674 1 16 . 1 1 10 10 GLU HA H 10 4.580 4.580 4.240 0.340 18832
4675 1 16 . 1 1 10 10 GLU CA C 10 55.570 55.570 56.518 -0.948 18832
4676 1 16 . 1 1 10 10 GLU CB C 10 30.780 30.780 30.319 0.461 18832
4677 1 16 . 1 1 11 11 GLU N N 11 122.500 122.500 119.054 3.446 18832
4678 1 16 . 1 1 11 11 GLU HA H 11 4.340 4.340 4.176 0.164 18832
4679 1 16 . 1 1 11 11 GLU CA C 11 57.140 57.140 56.605 0.535 18832
4680 1 16 . 1 1 11 11 GLU CB C 11 29.400 29.400 30.131 -0.731 18832
4681 1 16 . 1 1 11 11 GLU H H 11 8.271 8.271 8.424 -0.153 18832
4682 1 16 . 1 1 12 12 LYS HA H 12 4.380 4.380 3.994 0.386 18832
4683 1 16 . 1 1 12 12 LYS CA C 12 55.790 55.790 58.579 -2.789 18832
4684 1 16 . 1 1 12 12 LYS CB C 12 33.600 33.600 32.565 1.035 18832
4685 1 16 . 1 1 13 13 TYR HA H 13 5.560 5.560 4.637 0.923 18832
4686 1 16 . 1 1 13 13 TYR CA C 13 55.860 55.860 55.672 0.188 18832
4687 1 16 . 1 1 13 13 TYR CB C 13 42.440 42.440 40.665 1.775 18832
4688 1 16 . 1 1 14 14 GLY N N 14 105.320 105.320 106.604 -1.284 18832
4689 1 16 . 1 1 14 14 GLY CA C 14 45.240 45.240 44.285 0.955 18832
4690 1 16 . 1 1 14 14 GLY H H 14 8.401 8.401 8.734 -0.333 18832
4691 1 16 . 1 1 15 15 VAL N N 15 118.900 118.900 118.648 0.252 18832
4692 1 16 . 1 1 15 15 VAL HA H 15 5.341 5.341 4.493 0.848 18832
4693 1 16 . 1 1 15 15 VAL CA C 15 59.210 59.210 60.840 -1.630 18832
4694 1 16 . 1 1 15 15 VAL CB C 15 35.740 35.740 36.040 -0.300 18832
4695 1 16 . 1 1 15 15 VAL H H 15 8.851 8.851 8.844 0.007 18832
4696 1 16 . 1 1 16 16 ALA N N 16 129.460 129.460 127.166 2.294 18832
4697 1 16 . 1 1 16 16 ALA HA H 16 5.000 5.000 5.055 -0.055 18832
4698 1 16 . 1 1 16 16 ALA CA C 16 52.000 52.000 50.133 1.867 18832
4699 1 16 . 1 1 16 16 ALA CB C 16 19.330 19.330 21.029 -1.699 18832
4700 1 16 . 1 1 16 16 ALA H H 16 9.113 9.113 8.647 0.466 18832
4701 1 16 . 1 1 17 17 PHE N N 17 124.070 124.070 120.479 3.591 18832
4702 1 16 . 1 1 17 17 PHE HA H 17 4.801 4.801 4.900 -0.099 18832
4703 1 16 . 1 1 17 17 PHE CA C 17 56.230 56.230 55.664 0.566 18832
4704 1 16 . 1 1 17 17 PHE CB C 17 40.000 40.000 38.861 1.139 18832
4705 1 16 . 1 1 17 17 PHE H H 17 8.787 8.787 7.969 0.818 18832
4706 1 16 . 1 1 18 18 TYR N N 18 118.210 118.210 123.505 -5.295 18832
4707 1 16 . 1 1 18 18 TYR HA H 18 4.483 4.483 4.315 0.168 18832
4708 1 16 . 1 1 18 18 TYR CA C 18 55.300 55.300 57.171 -1.871 18832
4709 1 16 . 1 1 18 18 TYR CB C 18 42.810 42.810 41.681 1.129 18832
4710 1 16 . 1 1 18 18 TYR H H 18 7.281 7.281 7.667 -0.386 18832
4711 1 16 . 1 1 19 19 ASN N N 19 116.800 116.800 119.272 -2.472 18832
4712 1 16 . 1 1 19 19 ASN HA H 19 4.710 4.710 4.798 -0.088 18832
4713 1 16 . 1 1 19 19 ASN CA C 19 52.940 52.940 52.765 0.175 18832
4714 1 16 . 1 1 19 19 ASN CB C 19 39.060 39.060 38.510 0.550 18832
4715 1 16 . 1 1 19 19 ASN H H 19 8.134 8.134 8.078 0.056 18832
4716 1 16 . 1 1 20 20 TYR N N 20 122.190 122.190 122.470 -0.280 18832
4717 1 16 . 1 1 20 20 TYR HA H 20 4.687 4.687 4.549 0.138 18832
4718 1 16 . 1 1 20 20 TYR CA C 20 57.720 57.720 58.560 -0.840 18832
4719 1 16 . 1 1 20 20 TYR CB C 20 42.250 42.250 40.076 2.174 18832
4720 1 16 . 1 1 20 20 TYR H H 20 8.993 8.993 7.977 1.016 18832
4721 1 16 . 1 1 21 21 ASP N N 21 128.520 128.520 127.492 1.028 18832
4722 1 16 . 1 1 21 21 ASP HA H 21 4.790 4.790 4.902 -0.112 18832
4723 1 16 . 1 1 21 21 ASP CA C 21 52.370 52.370 53.055 -0.685 18832
4724 1 16 . 1 1 21 21 ASP CB C 21 41.130 41.130 43.017 -1.887 18832
4725 1 16 . 1 1 21 21 ASP H H 21 7.838 7.838 8.177 -0.339 18832
4726 1 16 . 1 1 22 22 ALA N N 22 125.240 125.240 124.930 0.310 18832
4727 1 16 . 1 1 22 22 ALA HA H 22 4.051 4.051 4.587 -0.536 18832
4728 1 16 . 1 1 22 22 ALA CA C 22 52.940 52.940 53.108 -0.168 18832
4729 1 16 . 1 1 22 22 ALA CB C 22 20.450 20.450 19.853 0.597 18832
4730 1 16 . 1 1 22 22 ALA H H 22 8.103 8.103 8.788 -0.685 18832
4731 1 16 . 1 1 23 23 ARG N N 23 122.190 122.190 121.072 1.118 18832
4732 1 16 . 1 1 23 23 ARG HA H 23 4.346 4.346 4.586 -0.240 18832
4733 1 16 . 1 1 23 23 ARG CA C 23 55.490 55.490 55.760 -0.270 18832
4734 1 16 . 1 1 23 23 ARG CB C 23 30.700 30.700 30.137 0.563 18832
4735 1 16 . 1 1 23 23 ARG H H 23 8.887 8.887 8.871 0.016 18832
4736 1 16 . 1 1 24 24 GLY N N 24 105.320 105.320 108.193 -2.873 18832
4737 1 16 . 1 1 24 24 GLY CA C 24 44.500 44.500 45.491 -0.991 18832
4738 1 16 . 1 1 24 24 GLY H H 24 7.258 7.258 7.588 -0.330 18832
4739 1 16 . 1 1 25 25 ALA N N 25 122.190 122.190 121.460 0.730 18832
4740 1 16 . 1 1 25 25 ALA HA H 25 4.166 4.166 4.289 -0.123 18832
4741 1 16 . 1 1 25 25 ALA CA C 25 54.440 54.440 53.837 0.602 18832
4742 1 16 . 1 1 25 25 ALA CB C 25 18.770 18.770 19.421 -0.651 18832
4743 1 16 . 1 1 25 25 ALA H H 25 8.627 8.627 8.308 0.319 18832
4744 1 16 . 1 1 26 26 ASP N N 26 114.690 114.690 116.593 -1.903 18832
4745 1 16 . 1 1 26 26 ASP HA H 26 4.700 4.700 4.422 0.278 18832
4746 1 16 . 1 1 26 26 ASP CA C 26 53.870 53.870 56.064 -2.194 18832
4747 1 16 . 1 1 26 26 ASP CB C 26 40.390 40.390 41.084 -0.694 18832
4748 1 16 . 1 1 26 26 ASP H H 26 8.955 8.955 8.628 0.327 18832
4749 1 16 . 1 1 27 27 GLU N N 27 118.910 118.910 116.512 2.398 18832
4750 1 16 . 1 1 27 27 GLU HA H 27 5.202 5.202 4.454 0.748 18832
4751 1 16 . 1 1 27 27 GLU CA C 27 54.930 54.930 55.643 -0.713 18832
4752 1 16 . 1 1 27 27 GLU CB C 27 32.880 32.880 32.947 -0.067 18832
4753 1 16 . 1 1 27 27 GLU H H 27 7.537 7.537 7.358 0.179 18832
4754 1 16 . 1 1 28 28 LEU N N 28 121.490 121.490 121.082 0.408 18832
4755 1 16 . 1 1 28 28 LEU HA H 28 4.756 4.756 4.777 -0.021 18832
4756 1 16 . 1 1 28 28 LEU CA C 28 53.120 53.120 53.607 -0.487 18832
4757 1 16 . 1 1 28 28 LEU CB C 28 44.500 44.500 45.298 -0.798 18832
4758 1 16 . 1 1 28 28 LEU H H 28 8.890 8.890 8.263 0.627 18832
4759 1 16 . 1 1 29 29 SER N N 29 115.870 115.870 118.861 -2.991 18832
4760 1 16 . 1 1 29 29 SER HA H 29 5.009 5.009 4.709 0.300 18832
4761 1 16 . 1 1 29 29 SER CA C 29 58.470 58.470 58.658 -0.188 18832
4762 1 16 . 1 1 29 29 SER CB C 29 63.690 63.690 63.932 -0.242 18832
4763 1 16 . 1 1 29 29 SER H H 29 7.948 7.948 8.501 -0.553 18832
4764 1 16 . 1 1 30 30 LEU N N 30 121.260 121.260 125.138 -3.878 18832
4765 1 16 . 1 1 30 30 LEU HA H 30 4.776 4.776 4.779 -0.003 18832
4766 1 16 . 1 1 30 30 LEU CA C 30 52.940 52.940 54.410 -1.470 18832
4767 1 16 . 1 1 30 30 LEU CB C 30 46.370 46.370 45.340 1.030 18832
4768 1 16 . 1 1 30 30 LEU H H 30 9.500 9.500 8.227 1.273 18832
4769 1 16 . 1 1 31 31 GLN N N 31 123.130 123.130 118.810 4.320 18832
4770 1 16 . 1 1 31 31 GLN HA H 31 5.065 5.065 5.314 -0.249 18832
4771 1 16 . 1 1 31 31 GLN CA C 31 52.940 52.940 53.451 -0.511 18832
4772 1 16 . 1 1 31 31 GLN CB C 31 31.190 31.190 32.995 -1.805 18832
4773 1 16 . 1 1 31 31 GLN H H 31 9.147 9.147 8.426 0.721 18832
4774 1 16 . 1 1 32 32 ILE N N 32 120.790 120.790 120.043 0.747 18832
4775 1 16 . 1 1 32 32 ILE HA H 32 3.032 3.032 4.050 -1.018 18832
4776 1 16 . 1 1 32 32 ILE CA C 32 64.250 64.250 63.492 0.758 18832
4777 1 16 . 1 1 32 32 ILE CB C 32 37.940 37.940 37.892 0.049 18832
4778 1 16 . 1 1 32 32 ILE H H 32 8.016 8.016 8.328 -0.312 18832
4779 1 16 . 1 1 33 33 GLY N N 33 115.870 115.870 115.158 0.712 18832
4780 1 16 . 1 1 33 33 GLY CA C 33 44.500 44.500 44.846 -0.346 18832
4781 1 16 . 1 1 33 33 GLY H H 33 8.775 8.775 9.032 -0.257 18832
4782 1 16 . 1 1 34 34 ASP N N 34 122.430 122.430 122.789 -0.359 18832
4783 1 16 . 1 1 34 34 ASP HA H 34 4.634 4.634 4.977 -0.343 18832
4784 1 16 . 1 1 34 34 ASP CA C 34 55.860 55.860 53.910 1.950 18832
4785 1 16 . 1 1 34 34 ASP CB C 34 41.310 41.310 41.980 -0.669 18832
4786 1 16 . 1 1 34 34 ASP H H 34 8.686 8.686 7.793 0.893 18832
4787 1 16 . 1 1 35 35 THR N N 35 117.980 117.980 117.903 0.077 18832
4788 1 16 . 1 1 35 35 THR HA H 35 5.154 5.154 4.803 0.351 18832
4789 1 16 . 1 1 35 35 THR CA C 35 61.450 61.450 62.329 -0.879 18832
4790 1 16 . 1 1 35 35 THR CB C 35 69.090 69.090 69.720 -0.630 18832
4791 1 16 . 1 1 35 35 THR H H 35 8.392 8.392 8.645 -0.253 18832
4792 1 16 . 1 1 36 36 VAL N N 36 118.200 118.200 117.452 0.748 18832
4793 1 16 . 1 1 36 36 VAL HA H 36 5.152 5.152 4.757 0.395 18832
4794 1 16 . 1 1 36 36 VAL CA C 36 57.910 57.910 60.251 -2.341 18832
4795 1 16 . 1 1 36 36 VAL CB C 36 34.190 34.190 35.297 -1.107 18832
4796 1 16 . 1 1 36 36 VAL H H 36 9.016 9.016 8.933 0.083 18832
4797 1 16 . 1 1 37 37 HIS N N 37 122.190 122.190 125.719 -3.529 18832
4798 1 16 . 1 1 37 37 HIS HA H 37 4.811 4.811 5.001 -0.190 18832
4799 1 16 . 1 1 37 37 HIS CA C 37 52.560 52.560 54.295 -1.735 18832
4800 1 16 . 1 1 37 37 HIS CB C 37 31.260 31.260 31.012 0.247 18832
4801 1 16 . 1 1 37 37 HIS H H 37 8.491 8.491 8.529 -0.038 18832
4802 1 16 . 1 1 38 38 ILE N N 38 126.650 126.650 126.673 -0.023 18832
4803 1 16 . 1 1 38 38 ILE HA H 38 3.750 3.750 4.110 -0.360 18832
4804 1 16 . 1 1 38 38 ILE CA C 38 61.640 61.640 62.276 -0.637 18832
4805 1 16 . 1 1 38 38 ILE CB C 38 38.880 38.880 38.205 0.675 18832
4806 1 16 . 1 1 38 38 ILE H H 38 8.638 8.638 8.532 0.106 18832
4807 1 16 . 1 1 39 39 LEU N N 39 126.180 126.180 121.836 4.344 18832
4808 1 16 . 1 1 39 39 LEU HA H 39 4.380 4.380 4.872 -0.492 18832
4809 1 16 . 1 1 39 39 LEU CA C 39 55.490 55.490 54.767 0.723 18832
4810 1 16 . 1 1 39 39 LEU CB C 39 43.750 43.750 43.596 0.154 18832
4811 1 16 . 1 1 39 39 LEU H H 39 9.163 9.163 9.036 0.127 18832
4812 1 16 . 1 1 40 40 GLU N N 40 115.160 115.160 117.946 -2.786 18832
4813 1 16 . 1 1 40 40 GLU HA H 40 5.020 5.020 5.203 -0.183 18832
4814 1 16 . 1 1 40 40 GLU CA C 40 55.090 55.090 55.532 -0.442 18832
4815 1 16 . 1 1 40 40 GLU CB C 40 35.730 35.730 34.255 1.475 18832
4816 1 16 . 1 1 40 40 GLU H H 40 7.852 7.852 7.719 0.133 18832
4817 1 16 . 1 1 41 41 THR HA H 41 4.270 4.270 4.745 -0.475 18832
4818 1 16 . 1 1 41 41 THR CA C 41 61.250 61.250 59.660 1.590 18832
4819 1 16 . 1 1 41 41 THR CB C 41 71.410 71.410 70.194 1.216 18832
4820 1 16 . 1 1 42 42 TYR HA H 42 4.550 4.550 4.386 0.164 18832
4821 1 16 . 1 1 43 43 GLU N N 43 124.100 124.100 120.847 3.253 18832
4822 1 16 . 1 1 43 43 GLU HA H 43 3.740 3.740 4.559 -0.819 18832
4823 1 16 . 1 1 43 43 GLU H H 43 8.590 8.590 8.463 0.127 18832
4824 1 16 . 1 1 44 44 GLY N N 44 110.789 110.789 111.765 -0.976 18832
4825 1 16 . 1 1 44 44 GLY CA C 44 45.440 45.440 45.422 0.018 18832
4826 1 16 . 1 1 44 44 GLY H H 44 8.432 8.432 8.659 -0.227 18832
4827 1 16 . 1 1 45 45 TRP HA H 45 4.690 4.690 4.637 0.053 18832
4828 1 16 . 1 1 45 45 TRP CA C 45 57.550 57.550 55.823 1.727 18832
4829 1 16 . 1 1 46 46 TYR HA H 46 5.600 5.600 4.956 0.644 18832
4830 1 16 . 1 1 46 46 TYR CA C 46 54.060 54.060 54.384 -0.324 18832
4831 1 16 . 1 1 46 46 TYR CB C 46 42.650 42.650 41.444 1.206 18832
4832 1 16 . 1 1 47 47 ARG N N 47 118.100 118.100 121.152 -3.052 18832
4833 1 16 . 1 1 47 47 ARG HA H 47 5.094 5.094 5.127 -0.033 18832
4834 1 16 . 1 1 47 47 ARG CA C 47 54.060 54.060 54.166 -0.106 18832
4835 1 16 . 1 1 47 47 ARG CB C 47 33.250 33.250 34.242 -0.992 18832
4836 1 16 . 1 1 47 47 ARG H H 47 8.492 8.492 8.480 0.012 18832
4837 1 16 . 1 1 48 48 GLY N N 48 114.000 114.000 111.195 2.805 18832
4838 1 16 . 1 1 48 48 GLY CA C 48 46.560 46.560 46.041 0.519 18832
4839 1 16 . 1 1 48 48 GLY H H 48 9.183 9.183 9.033 0.150 18832
4840 1 16 . 1 1 49 49 TYR N N 49 116.100 116.100 115.586 0.514 18832
4841 1 16 . 1 1 49 49 TYR HA H 49 5.373 5.373 5.160 0.213 18832
4842 1 16 . 1 1 49 49 TYR CA C 49 55.110 55.110 56.125 -1.015 18832
4843 1 16 . 1 1 49 49 TYR CB C 49 40.750 40.750 40.746 0.004 18832
4844 1 16 . 1 1 49 49 TYR H H 49 8.194 8.194 8.137 0.057 18832
4845 1 16 . 1 1 50 50 THR N N 50 112.350 112.350 115.738 -3.388 18832
4846 1 16 . 1 1 50 50 THR HA H 50 5.105 5.105 4.587 0.518 18832
4847 1 16 . 1 1 50 50 THR CA C 50 59.770 59.770 61.766 -1.996 18832
4848 1 16 . 1 1 50 50 THR CB C 50 69.460 69.460 69.682 -0.222 18832
4849 1 16 . 1 1 50 50 THR H H 50 9.441 9.441 8.850 0.591 18832
4850 1 16 . 1 1 51 51 LEU N N 51 121.260 121.260 120.880 0.380 18832
4851 1 16 . 1 1 51 51 LEU HA H 51 4.236 4.236 4.135 0.101 18832
4852 1 16 . 1 1 51 51 LEU CA C 51 56.790 56.790 57.393 -0.603 18832
4853 1 16 . 1 1 51 51 LEU CB C 51 40.000 40.000 41.196 -1.196 18832
4854 1 16 . 1 1 51 51 LEU H H 51 8.310 8.310 8.612 -0.302 18832
4855 1 16 . 1 1 52 52 ARG N N 52 116.570 116.570 118.067 -1.497 18832
4856 1 16 . 1 1 52 52 ARG HA H 52 4.250 4.250 4.235 0.015 18832
4857 1 16 . 1 1 52 52 ARG CA C 52 57.350 57.350 57.454 -0.104 18832
4858 1 16 . 1 1 52 52 ARG CB C 52 30.510 30.510 30.711 -0.201 18832
4859 1 16 . 1 1 52 52 ARG H H 52 8.047 8.047 8.305 -0.258 18832
4860 1 16 . 1 1 53 53 LYS N N 53 122.660 122.660 119.560 3.100 18832
4861 1 16 . 1 1 53 53 LYS HA H 53 4.616 4.616 4.582 0.034 18832
4862 1 16 . 1 1 53 53 LYS CA C 53 54.620 54.620 55.476 -0.856 18832
4863 1 16 . 1 1 53 53 LYS CB C 53 32.860 32.860 31.338 1.522 18832
4864 1 16 . 1 1 53 53 LYS H H 53 7.649 7.649 8.211 -0.562 18832
4865 1 16 . 1 1 54 54 LYS N N 54 125.010 125.010 122.458 2.552 18832
4866 1 16 . 1 1 54 54 LYS HA H 54 4.090 4.090 4.108 -0.018 18832
4867 1 16 . 1 1 54 54 LYS CA C 54 58.470 58.470 58.399 0.071 18832
4868 1 16 . 1 1 54 54 LYS CB C 54 32.130 32.130 32.365 -0.235 18832
4869 1 16 . 1 1 54 54 LYS H H 54 8.496 8.496 8.177 0.319 18832
4870 1 16 . 1 1 55 55 SER N N 55 110.240 110.240 113.971 -3.731 18832
4871 1 16 . 1 1 55 55 SER HA H 55 4.122 4.122 4.235 -0.113 18832
4872 1 16 . 1 1 55 55 SER CA C 55 58.960 58.960 59.730 -0.770 18832
4873 1 16 . 1 1 55 55 SER CB C 55 63.310 63.310 63.275 0.035 18832
4874 1 16 . 1 1 55 55 SER H H 55 7.857 7.857 8.385 -0.528 18832
4875 1 16 . 1 1 56 56 LYS N N 56 124.070 124.070 120.498 3.572 18832
4876 1 16 . 1 1 56 56 LYS HA H 56 4.668 4.668 4.447 0.221 18832
4877 1 16 . 1 1 56 56 LYS CA C 56 54.810 54.810 56.158 -1.348 18832
4878 1 16 . 1 1 56 56 LYS CB C 56 33.250 33.250 33.530 -0.280 18832
4879 1 16 . 1 1 56 56 LYS H H 56 7.473 7.473 8.019 -0.546 18832
4880 1 16 . 1 1 57 57 LYS N N 57 125.940 125.940 119.787 6.153 18832
4881 1 16 . 1 1 57 57 LYS HA H 57 5.341 5.341 5.128 0.213 18832
4882 1 16 . 1 1 57 57 LYS CA C 57 54.620 54.620 54.628 -0.008 18832
4883 1 16 . 1 1 57 57 LYS CB C 57 34.240 34.240 36.944 -2.704 18832
4884 1 16 . 1 1 57 57 LYS H H 57 8.474 8.474 8.182 0.292 18832
4885 1 16 . 1 1 58 58 GLY N N 58 109.540 109.540 108.076 1.464 18832
4886 1 16 . 1 1 58 58 GLY CA C 58 45.620 45.620 45.221 0.399 18832
4887 1 16 . 1 1 58 58 GLY H H 58 9.075 9.075 8.954 0.121 18832
4888 1 16 . 1 1 59 59 ILE N N 59 113.900 113.900 115.393 -1.493 18832
4889 1 16 . 1 1 59 59 ILE HA H 59 6.000 6.000 5.130 0.870 18832
4890 1 16 . 1 1 59 59 ILE CA C 59 59.590 59.590 58.375 1.215 18832
4891 1 16 . 1 1 59 59 ILE CB C 59 41.140 41.140 41.552 -0.412 18832
4892 1 16 . 1 1 59 59 ILE H H 59 8.628 8.628 7.941 0.687 18832
4893 1 16 . 1 1 60 60 PHE N N 60 117.040 117.040 116.934 0.106 18832
4894 1 16 . 1 1 60 60 PHE HA H 60 5.120 5.120 5.268 -0.148 18832
4895 1 16 . 1 1 60 60 PHE CA C 60 54.060 54.060 54.704 -0.644 18832
4896 1 16 . 1 1 60 60 PHE CB C 60 37.190 37.190 40.204 -3.014 18832
4897 1 16 . 1 1 60 60 PHE H H 60 8.724 8.724 8.680 0.044 18832
4898 1 16 . 1 1 61 61 PRO HA H 61 3.480 3.480 4.577 -1.097 18832
4899 1 16 . 1 1 61 61 PRO CA C 61 62.200 62.200 62.290 -0.090 18832
4900 1 16 . 1 1 61 61 PRO CB C 61 31.190 31.190 32.650 -1.460 18832
4901 1 16 . 1 1 62 62 ALA N N 62 124.770 124.770 126.951 -2.181 18832
4902 1 16 . 1 1 62 62 ALA HA H 62 3.710 3.710 3.983 -0.273 18832
4903 1 16 . 1 1 62 62 ALA CA C 62 54.370 54.370 54.130 0.240 18832
4904 1 16 . 1 1 62 62 ALA CB C 62 17.650 17.650 18.235 -0.585 18832
4905 1 16 . 1 1 62 62 ALA H H 62 7.898 7.898 8.268 -0.370 18832
4906 1 16 . 1 1 63 63 SER N N 63 109.700 109.700 115.525 -5.825 18832
4907 1 16 . 1 1 63 63 SER HA H 63 4.200 4.200 4.107 0.093 18832
4908 1 16 . 1 1 63 63 SER CA C 63 59.400 59.400 61.091 -1.691 18832
4909 1 16 . 1 1 63 63 SER CB C 63 62.380 62.380 62.541 -0.161 18832
4910 1 16 . 1 1 63 63 SER H H 63 8.030 8.030 8.386 -0.357 18832
4911 1 16 . 1 1 64 64 TYR N N 64 120.300 120.300 112.535 7.765 18832
4912 1 16 . 1 1 64 64 TYR HA H 64 4.250 4.250 4.505 -0.255 18832
4913 1 16 . 1 1 64 64 TYR CA C 64 57.720 57.720 54.530 3.190 18832
4914 1 16 . 1 1 64 64 TYR CB C 64 37.560 37.560 37.525 0.035 18832
4915 1 16 . 1 1 64 64 TYR H H 64 7.128 7.128 6.862 0.266 18832
4916 1 16 . 1 1 65 65 ILE N N 65 118.000 118.000 121.425 -3.425 18832
4917 1 16 . 1 1 65 65 ILE HA H 65 4.810 4.810 4.384 0.426 18832
4918 1 16 . 1 1 65 65 ILE CA C 65 56.980 56.980 59.684 -2.704 18832
4919 1 16 . 1 1 65 65 ILE CB C 65 39.630 39.630 38.675 0.955 18832
4920 1 16 . 1 1 65 65 ILE H H 65 7.671 7.671 7.281 0.390 18832
4921 1 16 . 1 1 66 66 HIS N N 66 124.300 124.300 126.392 -2.092 18832
4922 1 16 . 1 1 66 66 HIS HA H 66 5.130 5.130 4.873 0.257 18832
4923 1 16 . 1 1 66 66 HIS CA C 66 53.060 53.060 54.931 -1.871 18832
4924 1 16 . 1 1 66 66 HIS CB C 66 30.510 30.510 32.753 -2.243 18832
4925 1 16 . 1 1 66 66 HIS H H 66 9.159 9.159 8.673 0.486 18832
4926 1 16 . 1 1 67 67 LEU N N 67 127.580 127.580 128.865 -1.285 18832
4927 1 16 . 1 1 67 67 LEU HA H 67 4.570 4.570 4.185 0.385 18832
4928 1 16 . 1 1 67 67 LEU CA C 67 55.300 55.300 55.055 0.245 18832
4929 1 16 . 1 1 67 67 LEU CB C 67 42.060 42.060 41.376 0.684 18832
4930 1 16 . 1 1 67 67 LEU H H 67 8.992 8.992 8.328 0.664 18832
4931 1 16 . 1 1 68 68 LYS N N 68 121.900 121.900 124.001 -2.101 18832
4932 1 16 . 1 1 68 68 LYS HA H 68 4.490 4.490 4.268 0.222 18832
4933 1 16 . 1 1 68 68 LYS CA C 68 55.110 55.110 55.125 -0.015 18832
4934 1 16 . 1 1 68 68 LYS CB C 68 34.610 34.610 32.956 1.654 18832
4935 1 16 . 1 1 68 68 LYS H H 68 8.499 8.499 7.928 0.571 18832
4936 1 16 . 1 1 69 69 GLU N N 69 122.190 122.190 119.332 2.858 18832
4937 1 16 . 1 1 69 69 GLU HA H 69 4.280 4.280 4.173 0.107 18832
4938 1 16 . 1 1 69 69 GLU CA C 69 56.610 56.610 58.264 -1.654 18832
4939 1 16 . 1 1 69 69 GLU CB C 69 30.330 30.330 30.935 -0.605 18832
4940 1 16 . 1 1 69 69 GLU H H 69 8.569 8.569 8.482 0.087 18832
4941 1 16 . 1 1 70 70 ALA N N 70 123.370 123.370 120.740 2.630 18832
4942 1 16 . 1 1 70 70 ALA HA H 70 4.200 4.200 4.461 -0.261 18832
4943 1 16 . 1 1 70 70 ALA CA C 70 51.810 51.810 51.905 -0.095 18832
4944 1 16 . 1 1 70 70 ALA CB C 70 19.700 19.700 19.398 0.302 18832
4945 1 16 . 1 1 70 70 ALA H H 70 8.181 8.181 7.821 0.360 18832
4946 1 16 . 1 1 71 71 ILE N N 71 120.080 120.080 123.208 -3.128 18832
4947 1 16 . 1 1 71 71 ILE HA H 71 4.070 4.070 4.538 -0.468 18832
4948 1 16 . 1 1 71 71 ILE CA C 71 60.330 60.330 60.726 -0.396 18832
4949 1 16 . 1 1 71 71 ILE CB C 71 38.690 38.690 41.306 -2.616 18832
4950 1 16 . 1 1 71 71 ILE H H 71 7.776 7.776 8.225 -0.449 18832
4951 1 16 . 1 1 72 72 VAL N N 72 124.540 124.540 122.227 2.313 18832
4952 1 16 . 1 1 72 72 VAL HA H 72 4.070 4.070 4.406 -0.336 18832
4953 1 16 . 1 1 72 72 VAL CA C 72 61.640 61.640 60.804 0.836 18832
4954 1 16 . 1 1 72 72 VAL CB C 72 32.690 32.690 32.833 -0.143 18832
4955 1 16 . 1 1 72 72 VAL H H 72 8.089 8.089 8.131 -0.042 18832
4956 1 16 . 1 1 73 73 GLU N N 73 125.940 125.940 119.337 6.603 18832
4957 1 16 . 1 1 73 73 GLU HA H 73 4.280 4.280 4.179 0.101 18832
4958 1 16 . 1 1 73 73 GLU CA C 73 56.610 56.610 56.461 0.149 18832
4959 1 16 . 1 1 73 73 GLU CB C 73 30.710 30.710 30.052 0.657 18832
4960 1 16 . 1 1 73 73 GLU H H 73 8.464 8.464 8.716 -0.252 18832
4961 1 17 . 1 1 2 2 THR N N 2 116.400 116.400 112.876 3.524 18832
4962 1 17 . 1 1 2 2 THR HA H 2 4.120 4.120 4.282 -0.162 18832
4963 1 17 . 1 1 2 2 THR CA C 2 62.100 62.100 63.189 -1.089 18832
4964 1 17 . 1 1 2 2 THR CB C 2 69.440 69.440 69.134 0.306 18832
4965 1 17 . 1 1 2 2 THR H H 2 8.150 8.150 8.536 -0.386 18832
4966 1 17 . 1 1 3 3 ARG HA H 3 4.310 4.310 4.572 -0.262 18832
4967 1 17 . 1 1 3 3 ARG CA C 3 55.750 55.750 55.981 -0.231 18832
4968 1 17 . 1 1 3 3 ARG CB C 3 30.620 30.620 30.385 0.235 18832
4969 1 17 . 1 1 4 4 TRP N N 4 123.300 123.300 121.758 1.542 18832
4970 1 17 . 1 1 4 4 TRP HA H 4 4.480 4.480 4.830 -0.350 18832
4971 1 17 . 1 1 4 4 TRP CA C 4 57.560 57.560 57.623 -0.063 18832
4972 1 17 . 1 1 4 4 TRP CB C 4 29.490 29.490 30.022 -0.532 18832
4973 1 17 . 1 1 4 4 TRP H H 4 8.108 8.108 8.097 0.011 18832
4974 1 17 . 1 1 5 5 VAL HA H 5 4.570 4.570 4.291 0.279 18832
4975 1 17 . 1 1 5 5 VAL CB C 5 30.840 30.840 32.129 -1.289 18832
4976 1 17 . 1 1 6 6 PRO HA H 6 4.810 4.810 4.595 0.215 18832
4977 1 17 . 1 1 6 6 PRO CB C 6 32.210 32.210 31.424 0.786 18832
4978 1 17 . 1 1 7 7 THR HA H 7 4.270 4.270 3.874 0.396 18832
4979 1 17 . 1 1 7 7 THR CA C 7 60.890 60.890 63.171 -2.281 18832
4980 1 17 . 1 1 7 7 THR CB C 7 70.140 70.140 68.871 1.269 18832
4981 1 17 . 1 1 8 8 LYS HA H 8 4.440 4.440 4.463 -0.023 18832
4982 1 17 . 1 1 8 8 LYS CA C 8 55.980 55.980 56.252 -0.272 18832
4983 1 17 . 1 1 8 8 LYS CB C 8 35.050 35.050 32.550 2.500 18832
4984 1 17 . 1 1 10 10 GLU HA H 10 4.580 4.580 4.158 0.422 18832
4985 1 17 . 1 1 10 10 GLU CA C 10 55.570 55.570 57.148 -1.579 18832
4986 1 17 . 1 1 10 10 GLU CB C 10 30.780 30.780 29.942 0.838 18832
4987 1 17 . 1 1 11 11 GLU N N 11 122.500 122.500 123.078 -0.578 18832
4988 1 17 . 1 1 11 11 GLU HA H 11 4.340 4.340 4.188 0.152 18832
4989 1 17 . 1 1 11 11 GLU CA C 11 57.140 57.140 58.117 -0.977 18832
4990 1 17 . 1 1 11 11 GLU CB C 11 29.400 29.400 30.184 -0.784 18832
4991 1 17 . 1 1 11 11 GLU H H 11 8.271 8.271 8.752 -0.481 18832
4992 1 17 . 1 1 12 12 LYS HA H 12 4.380 4.380 4.160 0.220 18832
4993 1 17 . 1 1 12 12 LYS CA C 12 55.790 55.790 56.730 -0.940 18832
4994 1 17 . 1 1 12 12 LYS CB C 12 33.600 33.600 34.036 -0.436 18832
4995 1 17 . 1 1 13 13 TYR HA H 13 5.560 5.560 4.658 0.902 18832
4996 1 17 . 1 1 13 13 TYR CA C 13 55.860 55.860 55.822 0.038 18832
4997 1 17 . 1 1 13 13 TYR CB C 13 42.440 42.440 39.915 2.525 18832
4998 1 17 . 1 1 14 14 GLY N N 14 105.320 105.320 106.959 -1.639 18832
4999 1 17 . 1 1 14 14 GLY CA C 14 45.240 45.240 44.223 1.017 18832
5000 1 17 . 1 1 14 14 GLY H H 14 8.401 8.401 8.800 -0.399 18832
5001 1 17 . 1 1 15 15 VAL N N 15 118.900 118.900 118.435 0.465 18832
5002 1 17 . 1 1 15 15 VAL HA H 15 5.341 5.341 4.677 0.664 18832
5003 1 17 . 1 1 15 15 VAL CA C 15 59.210 59.210 60.459 -1.249 18832
5004 1 17 . 1 1 15 15 VAL CB C 15 35.740 35.740 35.798 -0.058 18832
5005 1 17 . 1 1 15 15 VAL H H 15 8.851 8.851 8.835 0.016 18832
5006 1 17 . 1 1 16 16 ALA N N 16 129.460 129.460 126.761 2.699 18832
5007 1 17 . 1 1 16 16 ALA HA H 16 5.000 5.000 5.193 -0.193 18832
5008 1 17 . 1 1 16 16 ALA CA C 16 52.000 52.000 50.099 1.901 18832
5009 1 17 . 1 1 16 16 ALA CB C 16 19.330 19.330 20.736 -1.406 18832
5010 1 17 . 1 1 16 16 ALA H H 16 9.113 9.113 8.461 0.652 18832
5011 1 17 . 1 1 17 17 PHE N N 17 124.070 124.070 120.400 3.670 18832
5012 1 17 . 1 1 17 17 PHE HA H 17 4.801 4.801 4.882 -0.081 18832
5013 1 17 . 1 1 17 17 PHE CA C 17 56.230 56.230 55.966 0.264 18832
5014 1 17 . 1 1 17 17 PHE CB C 17 40.000 40.000 38.688 1.312 18832
5015 1 17 . 1 1 17 17 PHE H H 17 8.787 8.787 7.646 1.141 18832
5016 1 17 . 1 1 18 18 TYR N N 18 118.210 118.210 123.500 -5.290 18832
5017 1 17 . 1 1 18 18 TYR HA H 18 4.483 4.483 4.345 0.138 18832
5018 1 17 . 1 1 18 18 TYR CA C 18 55.300 55.300 57.261 -1.961 18832
5019 1 17 . 1 1 18 18 TYR CB C 18 42.810 42.810 41.902 0.908 18832
5020 1 17 . 1 1 18 18 TYR H H 18 7.281 7.281 7.656 -0.375 18832
5021 1 17 . 1 1 19 19 ASN N N 19 116.800 116.800 119.156 -2.356 18832
5022 1 17 . 1 1 19 19 ASN HA H 19 4.710 4.710 4.861 -0.151 18832
5023 1 17 . 1 1 19 19 ASN CA C 19 52.940 52.940 52.819 0.121 18832
5024 1 17 . 1 1 19 19 ASN CB C 19 39.060 39.060 38.336 0.725 18832
5025 1 17 . 1 1 19 19 ASN H H 19 8.134 8.134 8.292 -0.158 18832
5026 1 17 . 1 1 20 20 TYR N N 20 122.190 122.190 122.546 -0.356 18832
5027 1 17 . 1 1 20 20 TYR HA H 20 4.687 4.687 4.711 -0.024 18832
5028 1 17 . 1 1 20 20 TYR CA C 20 57.720 57.720 57.108 0.612 18832
5029 1 17 . 1 1 20 20 TYR CB C 20 42.250 42.250 41.038 1.212 18832
5030 1 17 . 1 1 20 20 TYR H H 20 8.993 8.993 8.066 0.927 18832
5031 1 17 . 1 1 21 21 ASP N N 21 128.520 128.520 124.524 3.996 18832
5032 1 17 . 1 1 21 21 ASP HA H 21 4.790 4.790 4.611 0.179 18832
5033 1 17 . 1 1 21 21 ASP CA C 21 52.370 52.370 51.751 0.619 18832
5034 1 17 . 1 1 21 21 ASP CB C 21 41.130 41.130 44.519 -3.389 18832
5035 1 17 . 1 1 21 21 ASP H H 21 7.838 7.838 8.178 -0.340 18832
5036 1 17 . 1 1 22 22 ALA N N 22 125.240 125.240 123.005 2.235 18832
5037 1 17 . 1 1 22 22 ALA HA H 22 4.051 4.051 4.213 -0.162 18832
5038 1 17 . 1 1 22 22 ALA CA C 22 52.940 52.940 51.417 1.523 18832
5039 1 17 . 1 1 22 22 ALA CB C 22 20.450 20.450 20.295 0.155 18832
5040 1 17 . 1 1 22 22 ALA H H 22 8.103 8.103 8.087 0.016 18832
5041 1 17 . 1 1 23 23 ARG N N 23 122.190 122.190 120.679 1.511 18832
5042 1 17 . 1 1 23 23 ARG HA H 23 4.346 4.346 4.583 -0.237 18832
5043 1 17 . 1 1 23 23 ARG CA C 23 55.490 55.490 55.251 0.239 18832
5044 1 17 . 1 1 23 23 ARG CB C 23 30.700 30.700 30.810 -0.110 18832
5045 1 17 . 1 1 23 23 ARG H H 23 8.887 8.887 8.721 0.166 18832
5046 1 17 . 1 1 24 24 GLY N N 24 105.320 105.320 107.098 -1.778 18832
5047 1 17 . 1 1 24 24 GLY CA C 24 44.500 44.500 44.802 -0.302 18832
5048 1 17 . 1 1 24 24 GLY H H 24 7.258 7.258 7.487 -0.229 18832
5049 1 17 . 1 1 25 25 ALA N N 25 122.190 122.190 121.409 0.781 18832
5050 1 17 . 1 1 25 25 ALA HA H 25 4.166 4.166 4.201 -0.035 18832
5051 1 17 . 1 1 25 25 ALA CA C 25 54.440 54.440 54.029 0.410 18832
5052 1 17 . 1 1 25 25 ALA CB C 25 18.770 18.770 19.301 -0.531 18832
5053 1 17 . 1 1 25 25 ALA H H 25 8.627 8.627 8.262 0.365 18832
5054 1 17 . 1 1 26 26 ASP N N 26 114.690 114.690 116.775 -2.085 18832
5055 1 17 . 1 1 26 26 ASP HA H 26 4.700 4.700 4.400 0.300 18832
5056 1 17 . 1 1 26 26 ASP CA C 26 53.870 53.870 55.913 -2.043 18832
5057 1 17 . 1 1 26 26 ASP CB C 26 40.390 40.390 41.223 -0.833 18832
5058 1 17 . 1 1 26 26 ASP H H 26 8.955 8.955 8.733 0.222 18832
5059 1 17 . 1 1 27 27 GLU N N 27 118.910 118.910 115.864 3.046 18832
5060 1 17 . 1 1 27 27 GLU HA H 27 5.202 5.202 4.643 0.559 18832
5061 1 17 . 1 1 27 27 GLU CA C 27 54.930 54.930 55.464 -0.534 18832
5062 1 17 . 1 1 27 27 GLU CB C 27 32.880 32.880 33.465 -0.584 18832
5063 1 17 . 1 1 27 27 GLU H H 27 7.537 7.537 7.387 0.150 18832
5064 1 17 . 1 1 28 28 LEU N N 28 121.490 121.490 120.357 1.133 18832
5065 1 17 . 1 1 28 28 LEU HA H 28 4.756 4.756 4.740 0.016 18832
5066 1 17 . 1 1 28 28 LEU CA C 28 53.120 53.120 53.797 -0.677 18832
5067 1 17 . 1 1 28 28 LEU CB C 28 44.500 44.500 45.303 -0.803 18832
5068 1 17 . 1 1 28 28 LEU H H 28 8.890 8.890 8.593 0.297 18832
5069 1 17 . 1 1 29 29 SER N N 29 115.870 115.870 119.349 -3.479 18832
5070 1 17 . 1 1 29 29 SER HA H 29 5.009 5.009 4.345 0.664 18832
5071 1 17 . 1 1 29 29 SER CA C 29 58.470 58.470 58.285 0.185 18832
5072 1 17 . 1 1 29 29 SER CB C 29 63.690 63.690 64.035 -0.345 18832
5073 1 17 . 1 1 29 29 SER H H 29 7.948 7.948 8.372 -0.424 18832
5074 1 17 . 1 1 30 30 LEU N N 30 121.260 121.260 124.708 -3.448 18832
5075 1 17 . 1 1 30 30 LEU HA H 30 4.776 4.776 4.760 0.016 18832
5076 1 17 . 1 1 30 30 LEU CA C 30 52.940 52.940 54.435 -1.495 18832
5077 1 17 . 1 1 30 30 LEU CB C 30 46.370 46.370 45.703 0.667 18832
5078 1 17 . 1 1 30 30 LEU H H 30 9.500 9.500 8.354 1.146 18832
5079 1 17 . 1 1 31 31 GLN N N 31 123.130 123.130 119.155 3.975 18832
5080 1 17 . 1 1 31 31 GLN HA H 31 5.065 5.065 5.319 -0.254 18832
5081 1 17 . 1 1 31 31 GLN CA C 31 52.940 52.940 53.492 -0.552 18832
5082 1 17 . 1 1 31 31 GLN CB C 31 31.190 31.190 33.506 -2.316 18832
5083 1 17 . 1 1 31 31 GLN H H 31 9.147 9.147 8.445 0.702 18832
5084 1 17 . 1 1 32 32 ILE N N 32 120.790 120.790 119.932 0.858 18832
5085 1 17 . 1 1 32 32 ILE HA H 32 3.032 3.032 4.101 -1.069 18832
5086 1 17 . 1 1 32 32 ILE CA C 32 64.250 64.250 63.425 0.825 18832
5087 1 17 . 1 1 32 32 ILE CB C 32 37.940 37.940 37.891 0.049 18832
5088 1 17 . 1 1 32 32 ILE H H 32 8.016 8.016 8.360 -0.344 18832
5089 1 17 . 1 1 33 33 GLY N N 33 115.870 115.870 115.439 0.431 18832
5090 1 17 . 1 1 33 33 GLY CA C 33 44.500 44.500 44.960 -0.460 18832
5091 1 17 . 1 1 33 33 GLY H H 33 8.775 8.775 9.007 -0.232 18832
5092 1 17 . 1 1 34 34 ASP N N 34 122.430 122.430 122.007 0.423 18832
5093 1 17 . 1 1 34 34 ASP HA H 34 4.634 4.634 4.988 -0.354 18832
5094 1 17 . 1 1 34 34 ASP CA C 34 55.860 55.860 53.839 2.021 18832
5095 1 17 . 1 1 34 34 ASP CB C 34 41.310 41.310 42.212 -0.902 18832
5096 1 17 . 1 1 34 34 ASP H H 34 8.686 8.686 7.671 1.015 18832
5097 1 17 . 1 1 35 35 THR N N 35 117.980 117.980 116.976 1.004 18832
5098 1 17 . 1 1 35 35 THR HA H 35 5.154 5.154 4.878 0.276 18832
5099 1 17 . 1 1 35 35 THR CA C 35 61.450 61.450 61.533 -0.083 18832
5100 1 17 . 1 1 35 35 THR CB C 35 69.090 69.090 70.302 -1.212 18832
5101 1 17 . 1 1 35 35 THR H H 35 8.392 8.392 8.453 -0.061 18832
5102 1 17 . 1 1 36 36 VAL N N 36 118.200 118.200 118.217 -0.017 18832
5103 1 17 . 1 1 36 36 VAL HA H 36 5.152 5.152 4.552 0.600 18832
5104 1 17 . 1 1 36 36 VAL CA C 36 57.910 57.910 60.058 -2.148 18832
5105 1 17 . 1 1 36 36 VAL CB C 36 34.190 34.190 34.936 -0.746 18832
5106 1 17 . 1 1 36 36 VAL H H 36 9.016 9.016 8.654 0.362 18832
5107 1 17 . 1 1 37 37 HIS N N 37 122.190 122.190 125.206 -3.016 18832
5108 1 17 . 1 1 37 37 HIS HA H 37 4.811 4.811 4.957 -0.146 18832
5109 1 17 . 1 1 37 37 HIS CA C 37 52.560 52.560 53.335 -0.775 18832
5110 1 17 . 1 1 37 37 HIS CB C 37 31.260 31.260 30.935 0.325 18832
5111 1 17 . 1 1 37 37 HIS H H 37 8.491 8.491 8.084 0.407 18832
5112 1 17 . 1 1 38 38 ILE N N 38 126.650 126.650 127.469 -0.819 18832
5113 1 17 . 1 1 38 38 ILE HA H 38 3.750 3.750 3.938 -0.188 18832
5114 1 17 . 1 1 38 38 ILE CA C 38 61.640 61.640 62.041 -0.401 18832
5115 1 17 . 1 1 38 38 ILE CB C 38 38.880 38.880 38.079 0.801 18832
5116 1 17 . 1 1 38 38 ILE H H 38 8.638 8.638 8.812 -0.174 18832
5117 1 17 . 1 1 39 39 LEU N N 39 126.180 126.180 123.884 2.296 18832
5118 1 17 . 1 1 39 39 LEU HA H 39 4.380 4.380 4.823 -0.443 18832
5119 1 17 . 1 1 39 39 LEU CA C 39 55.490 55.490 54.911 0.579 18832
5120 1 17 . 1 1 39 39 LEU CB C 39 43.750 43.750 43.880 -0.130 18832
5121 1 17 . 1 1 39 39 LEU H H 39 9.163 9.163 8.482 0.681 18832
5122 1 17 . 1 1 40 40 GLU N N 40 115.160 115.160 117.093 -1.933 18832
5123 1 17 . 1 1 40 40 GLU HA H 40 5.020 5.020 4.766 0.254 18832
5124 1 17 . 1 1 40 40 GLU CA C 40 55.090 55.090 55.370 -0.279 18832
5125 1 17 . 1 1 40 40 GLU CB C 40 35.730 35.730 33.807 1.923 18832
5126 1 17 . 1 1 40 40 GLU H H 40 7.852 7.852 7.699 0.153 18832
5127 1 17 . 1 1 41 41 THR HA H 41 4.270 4.270 4.309 -0.039 18832
5128 1 17 . 1 1 41 41 THR CA C 41 61.250 61.250 59.478 1.772 18832
5129 1 17 . 1 1 41 41 THR CB C 41 71.410 71.410 70.349 1.062 18832
5130 1 17 . 1 1 42 42 TYR HA H 42 4.550 4.550 4.304 0.246 18832
5131 1 17 . 1 1 43 43 GLU N N 43 124.100 124.100 119.964 4.136 18832
5132 1 17 . 1 1 43 43 GLU HA H 43 3.740 3.740 4.591 -0.851 18832
5133 1 17 . 1 1 43 43 GLU H H 43 8.590 8.590 8.417 0.173 18832
5134 1 17 . 1 1 44 44 GLY N N 44 110.789 110.789 111.197 -0.408 18832
5135 1 17 . 1 1 44 44 GLY CA C 44 45.440 45.440 45.682 -0.242 18832
5136 1 17 . 1 1 44 44 GLY H H 44 8.432 8.432 8.583 -0.151 18832
5137 1 17 . 1 1 45 45 TRP HA H 45 4.690 4.690 4.664 0.026 18832
5138 1 17 . 1 1 45 45 TRP CA C 45 57.550 57.550 55.874 1.675 18832
5139 1 17 . 1 1 46 46 TYR HA H 46 5.600 5.600 4.554 1.046 18832
5140 1 17 . 1 1 46 46 TYR CA C 46 54.060 54.060 54.762 -0.702 18832
5141 1 17 . 1 1 46 46 TYR CB C 46 42.650 42.650 41.512 1.138 18832
5142 1 17 . 1 1 47 47 ARG N N 47 118.100 118.100 120.722 -2.622 18832
5143 1 17 . 1 1 47 47 ARG HA H 47 5.094 5.094 4.920 0.174 18832
5144 1 17 . 1 1 47 47 ARG CA C 47 54.060 54.060 54.653 -0.592 18832
5145 1 17 . 1 1 47 47 ARG CB C 47 33.250 33.250 33.718 -0.468 18832
5146 1 17 . 1 1 47 47 ARG H H 47 8.492 8.492 8.195 0.297 18832
5147 1 17 . 1 1 48 48 GLY N N 48 114.000 114.000 113.031 0.969 18832
5148 1 17 . 1 1 48 48 GLY CA C 48 46.560 46.560 45.062 1.498 18832
5149 1 17 . 1 1 48 48 GLY H H 48 9.183 9.183 8.911 0.272 18832
5150 1 17 . 1 1 49 49 TYR N N 49 116.100 116.100 115.007 1.093 18832
5151 1 17 . 1 1 49 49 TYR HA H 49 5.373 5.373 5.195 0.178 18832
5152 1 17 . 1 1 49 49 TYR CA C 49 55.110 55.110 55.867 -0.757 18832
5153 1 17 . 1 1 49 49 TYR CB C 49 40.750 40.750 40.078 0.672 18832
5154 1 17 . 1 1 49 49 TYR H H 49 8.194 8.194 7.999 0.195 18832
5155 1 17 . 1 1 50 50 THR N N 50 112.350 112.350 116.970 -4.620 18832
5156 1 17 . 1 1 50 50 THR HA H 50 5.105 5.105 4.495 0.610 18832
5157 1 17 . 1 1 50 50 THR CA C 50 59.770 59.770 62.051 -2.281 18832
5158 1 17 . 1 1 50 50 THR CB C 50 69.460 69.460 69.744 -0.284 18832
5159 1 17 . 1 1 50 50 THR H H 50 9.441 9.441 8.564 0.877 18832
5160 1 17 . 1 1 51 51 LEU N N 51 121.260 121.260 121.407 -0.147 18832
5161 1 17 . 1 1 51 51 LEU HA H 51 4.236 4.236 4.122 0.114 18832
5162 1 17 . 1 1 51 51 LEU CA C 51 56.790 56.790 57.325 -0.535 18832
5163 1 17 . 1 1 51 51 LEU CB C 51 40.000 40.000 40.988 -0.988 18832
5164 1 17 . 1 1 51 51 LEU H H 51 8.310 8.310 8.502 -0.192 18832
5165 1 17 . 1 1 52 52 ARG N N 52 116.570 116.570 117.287 -0.717 18832
5166 1 17 . 1 1 52 52 ARG HA H 52 4.250 4.250 4.216 0.034 18832
5167 1 17 . 1 1 52 52 ARG CA C 52 57.350 57.350 57.087 0.263 18832
5168 1 17 . 1 1 52 52 ARG CB C 52 30.510 30.510 30.670 -0.160 18832
5169 1 17 . 1 1 52 52 ARG H H 52 8.047 8.047 8.361 -0.314 18832
5170 1 17 . 1 1 53 53 LYS N N 53 122.660 122.660 119.878 2.782 18832
5171 1 17 . 1 1 53 53 LYS HA H 53 4.616 4.616 4.572 0.044 18832
5172 1 17 . 1 1 53 53 LYS CA C 53 54.620 54.620 55.306 -0.686 18832
5173 1 17 . 1 1 53 53 LYS CB C 53 32.860 32.860 32.149 0.711 18832
5174 1 17 . 1 1 53 53 LYS H H 53 7.649 7.649 7.353 0.296 18832
5175 1 17 . 1 1 54 54 LYS N N 54 125.010 125.010 120.820 4.190 18832
5176 1 17 . 1 1 54 54 LYS HA H 54 4.090 4.090 4.105 -0.015 18832
5177 1 17 . 1 1 54 54 LYS CA C 54 58.470 58.470 58.643 -0.173 18832
5178 1 17 . 1 1 54 54 LYS CB C 54 32.130 32.130 32.651 -0.521 18832
5179 1 17 . 1 1 54 54 LYS H H 54 8.496 8.496 8.430 0.066 18832
5180 1 17 . 1 1 55 55 SER N N 55 110.240 110.240 113.770 -3.530 18832
5181 1 17 . 1 1 55 55 SER HA H 55 4.122 4.122 4.304 -0.182 18832
5182 1 17 . 1 1 55 55 SER CA C 55 58.960 58.960 59.466 -0.506 18832
5183 1 17 . 1 1 55 55 SER CB C 55 63.310 63.310 63.443 -0.133 18832
5184 1 17 . 1 1 55 55 SER H H 55 7.857 7.857 8.236 -0.379 18832
5185 1 17 . 1 1 56 56 LYS N N 56 124.070 124.070 121.044 3.026 18832
5186 1 17 . 1 1 56 56 LYS HA H 56 4.668 4.668 4.336 0.332 18832
5187 1 17 . 1 1 56 56 LYS CA C 56 54.810 54.810 56.303 -1.493 18832
5188 1 17 . 1 1 56 56 LYS CB C 56 33.250 33.250 33.221 0.029 18832
5189 1 17 . 1 1 56 56 LYS H H 56 7.473 7.473 7.917 -0.444 18832
5190 1 17 . 1 1 57 57 LYS N N 57 125.940 125.940 123.234 2.706 18832
5191 1 17 . 1 1 57 57 LYS HA H 57 5.341 5.341 4.850 0.491 18832
5192 1 17 . 1 1 57 57 LYS CA C 57 54.620 54.620 54.704 -0.084 18832
5193 1 17 . 1 1 57 57 LYS CB C 57 34.240 34.240 35.547 -1.307 18832
5194 1 17 . 1 1 57 57 LYS H H 57 8.474 8.474 8.291 0.183 18832
5195 1 17 . 1 1 58 58 GLY N N 58 109.540 109.540 111.495 -1.955 18832
5196 1 17 . 1 1 58 58 GLY CA C 58 45.620 45.620 45.101 0.519 18832
5197 1 17 . 1 1 58 58 GLY H H 58 9.075 9.075 8.988 0.087 18832
5198 1 17 . 1 1 59 59 ILE N N 59 113.900 113.900 115.227 -1.327 18832
5199 1 17 . 1 1 59 59 ILE HA H 59 6.000 6.000 5.029 0.971 18832
5200 1 17 . 1 1 59 59 ILE CA C 59 59.590 59.590 58.624 0.966 18832
5201 1 17 . 1 1 59 59 ILE CB C 59 41.140 41.140 41.502 -0.362 18832
5202 1 17 . 1 1 59 59 ILE H H 59 8.628 8.628 8.232 0.396 18832
5203 1 17 . 1 1 60 60 PHE N N 60 117.040 117.040 116.826 0.214 18832
5204 1 17 . 1 1 60 60 PHE HA H 60 5.120 5.120 5.502 -0.382 18832
5205 1 17 . 1 1 60 60 PHE CA C 60 54.060 54.060 54.870 -0.810 18832
5206 1 17 . 1 1 60 60 PHE CB C 60 37.190 37.190 39.950 -2.760 18832
5207 1 17 . 1 1 60 60 PHE H H 60 8.724 8.724 8.347 0.377 18832
5208 1 17 . 1 1 61 61 PRO HA H 61 3.480 3.480 4.677 -1.197 18832
5209 1 17 . 1 1 61 61 PRO CA C 61 62.200 62.200 62.320 -0.120 18832
5210 1 17 . 1 1 61 61 PRO CB C 61 31.190 31.190 32.796 -1.606 18832
5211 1 17 . 1 1 62 62 ALA N N 62 124.770 124.770 126.870 -2.100 18832
5212 1 17 . 1 1 62 62 ALA HA H 62 3.710 3.710 4.008 -0.298 18832
5213 1 17 . 1 1 62 62 ALA CA C 62 54.370 54.370 54.242 0.128 18832
5214 1 17 . 1 1 62 62 ALA CB C 62 17.650 17.650 18.211 -0.561 18832
5215 1 17 . 1 1 62 62 ALA H H 62 7.898 7.898 8.351 -0.453 18832
5216 1 17 . 1 1 63 63 SER N N 63 109.700 109.700 115.236 -5.536 18832
5217 1 17 . 1 1 63 63 SER HA H 63 4.200 4.200 4.096 0.104 18832
5218 1 17 . 1 1 63 63 SER CA C 63 59.400 59.400 61.122 -1.722 18832
5219 1 17 . 1 1 63 63 SER CB C 63 62.380 62.380 62.960 -0.580 18832
5220 1 17 . 1 1 63 63 SER H H 63 8.030 8.030 8.385 -0.355 18832
5221 1 17 . 1 1 64 64 TYR N N 64 120.300 120.300 112.039 8.261 18832
5222 1 17 . 1 1 64 64 TYR HA H 64 4.250 4.250 4.589 -0.339 18832
5223 1 17 . 1 1 64 64 TYR CA C 64 57.720 57.720 54.835 2.885 18832
5224 1 17 . 1 1 64 64 TYR CB C 64 37.560 37.560 37.542 0.018 18832
5225 1 17 . 1 1 64 64 TYR H H 64 7.128 7.128 6.972 0.156 18832
5226 1 17 . 1 1 65 65 ILE N N 65 118.000 118.000 121.560 -3.560 18832
5227 1 17 . 1 1 65 65 ILE HA H 65 4.810 4.810 4.557 0.253 18832
5228 1 17 . 1 1 65 65 ILE CA C 65 56.980 56.980 59.394 -2.413 18832
5229 1 17 . 1 1 65 65 ILE CB C 65 39.630 39.630 38.221 1.409 18832
5230 1 17 . 1 1 65 65 ILE H H 65 7.671 7.671 7.275 0.396 18832
5231 1 17 . 1 1 66 66 HIS N N 66 124.300 124.300 127.396 -3.096 18832
5232 1 17 . 1 1 66 66 HIS HA H 66 5.130 5.130 4.908 0.222 18832
5233 1 17 . 1 1 66 66 HIS CA C 66 53.060 53.060 54.644 -1.583 18832
5234 1 17 . 1 1 66 66 HIS CB C 66 30.510 30.510 33.261 -2.751 18832
5235 1 17 . 1 1 66 66 HIS H H 66 9.159 9.159 8.790 0.369 18832
5236 1 17 . 1 1 67 67 LEU N N 67 127.580 127.580 127.812 -0.232 18832
5237 1 17 . 1 1 67 67 LEU HA H 67 4.570 4.570 4.378 0.192 18832
5238 1 17 . 1 1 67 67 LEU CA C 67 55.300 55.300 55.259 0.041 18832
5239 1 17 . 1 1 67 67 LEU CB C 67 42.060 42.060 41.280 0.780 18832
5240 1 17 . 1 1 67 67 LEU H H 67 8.992 8.992 8.537 0.455 18832
5241 1 17 . 1 1 68 68 LYS N N 68 121.900 121.900 124.297 -2.397 18832
5242 1 17 . 1 1 68 68 LYS HA H 68 4.490 4.490 4.745 -0.255 18832
5243 1 17 . 1 1 68 68 LYS CA C 68 55.110 55.110 53.749 1.361 18832
5244 1 17 . 1 1 68 68 LYS CB C 68 34.610 34.610 34.358 0.252 18832
5245 1 17 . 1 1 68 68 LYS H H 68 8.499 8.499 8.191 0.308 18832
5246 1 17 . 1 1 69 69 GLU N N 69 122.190 122.190 120.592 1.598 18832
5247 1 17 . 1 1 69 69 GLU HA H 69 4.280 4.280 4.625 -0.345 18832
5248 1 17 . 1 1 69 69 GLU CA C 69 56.610 56.610 55.336 1.274 18832
5249 1 17 . 1 1 69 69 GLU CB C 69 30.330 30.330 28.795 1.535 18832
5250 1 17 . 1 1 69 69 GLU H H 69 8.569 8.569 8.634 -0.065 18832
5251 1 17 . 1 1 70 70 ALA N N 70 123.370 123.370 121.828 1.542 18832
5252 1 17 . 1 1 70 70 ALA HA H 70 4.200 4.200 3.565 0.635 18832
5253 1 17 . 1 1 70 70 ALA CA C 70 51.810 51.810 52.527 -0.717 18832
5254 1 17 . 1 1 70 70 ALA CB C 70 19.700 19.700 17.236 2.464 18832
5255 1 17 . 1 1 70 70 ALA H H 70 8.181 8.181 7.689 0.492 18832
5256 1 17 . 1 1 71 71 ILE N N 71 120.080 120.080 115.451 4.629 18832
5257 1 17 . 1 1 71 71 ILE HA H 71 4.070 4.070 4.289 -0.219 18832
5258 1 17 . 1 1 71 71 ILE CA C 71 60.330 60.330 61.298 -0.968 18832
5259 1 17 . 1 1 71 71 ILE CB C 71 38.690 38.690 39.066 -0.376 18832
5260 1 17 . 1 1 71 71 ILE H H 71 7.776 7.776 8.095 -0.319 18832
5261 1 17 . 1 1 72 72 VAL N N 72 124.540 124.540 121.327 3.213 18832
5262 1 17 . 1 1 72 72 VAL HA H 72 4.070 4.070 4.319 -0.249 18832
5263 1 17 . 1 1 72 72 VAL CA C 72 61.640 61.640 62.264 -0.624 18832
5264 1 17 . 1 1 72 72 VAL CB C 72 32.690 32.690 31.706 0.984 18832
5265 1 17 . 1 1 72 72 VAL H H 72 8.089 8.089 8.140 -0.051 18832
5266 1 17 . 1 1 73 73 GLU N N 73 125.940 125.940 123.400 2.540 18832
5267 1 17 . 1 1 73 73 GLU HA H 73 4.280 4.280 4.634 -0.354 18832
5268 1 17 . 1 1 73 73 GLU CA C 73 56.610 56.610 56.205 0.405 18832
5269 1 17 . 1 1 73 73 GLU CB C 73 30.710 30.710 29.658 1.052 18832
5270 1 17 . 1 1 73 73 GLU H H 73 8.464 8.464 8.520 -0.056 18832
5271 1 18 . 1 1 2 2 THR N N 2 116.400 116.400 114.422 1.978 18832
5272 1 18 . 1 1 2 2 THR HA H 2 4.120 4.120 4.554 -0.434 18832
5273 1 18 . 1 1 2 2 THR CA C 2 62.100 62.100 62.933 -0.833 18832
5274 1 18 . 1 1 2 2 THR CB C 2 69.440 69.440 69.592 -0.152 18832
5275 1 18 . 1 1 2 2 THR H H 2 8.150 8.150 9.070 -0.920 18832
5276 1 18 . 1 1 3 3 ARG HA H 3 4.310 4.310 4.527 -0.217 18832
5277 1 18 . 1 1 3 3 ARG CA C 3 55.750 55.750 56.426 -0.676 18832
5278 1 18 . 1 1 3 3 ARG CB C 3 30.620 30.620 31.119 -0.499 18832
5279 1 18 . 1 1 4 4 TRP N N 4 123.300 123.300 121.318 1.982 18832
5280 1 18 . 1 1 4 4 TRP HA H 4 4.480 4.480 4.906 -0.426 18832
5281 1 18 . 1 1 4 4 TRP CA C 4 57.560 57.560 56.152 1.408 18832
5282 1 18 . 1 1 4 4 TRP CB C 4 29.490 29.490 30.707 -1.217 18832
5283 1 18 . 1 1 4 4 TRP H H 4 8.108 8.108 7.952 0.156 18832
5284 1 18 . 1 1 5 5 VAL HA H 5 4.570 4.570 3.838 0.732 18832
5285 1 18 . 1 1 5 5 VAL CB C 5 30.840 30.840 30.730 0.110 18832
5286 1 18 . 1 1 6 6 PRO HA H 6 4.810 4.810 4.596 0.214 18832
5287 1 18 . 1 1 6 6 PRO CB C 6 32.210 32.210 32.050 0.160 18832
5288 1 18 . 1 1 7 7 THR HA H 7 4.270 4.270 4.330 -0.060 18832
5289 1 18 . 1 1 7 7 THR CA C 7 60.890 60.890 61.112 -0.222 18832
5290 1 18 . 1 1 7 7 THR CB C 7 70.140 70.140 69.673 0.467 18832
5291 1 18 . 1 1 8 8 LYS HA H 8 4.440 4.440 4.156 0.284 18832
5292 1 18 . 1 1 8 8 LYS CA C 8 55.980 55.980 56.126 -0.146 18832
5293 1 18 . 1 1 8 8 LYS CB C 8 35.050 35.050 33.251 1.799 18832
5294 1 18 . 1 1 10 10 GLU HA H 10 4.580 4.580 4.253 0.327 18832
5295 1 18 . 1 1 10 10 GLU CA C 10 55.570 55.570 56.624 -1.054 18832
5296 1 18 . 1 1 10 10 GLU CB C 10 30.780 30.780 30.312 0.468 18832
5297 1 18 . 1 1 11 11 GLU N N 11 122.500 122.500 118.143 4.357 18832
5298 1 18 . 1 1 11 11 GLU HA H 11 4.340 4.340 4.013 0.327 18832
5299 1 18 . 1 1 11 11 GLU CA C 11 57.140 57.140 57.466 -0.326 18832
5300 1 18 . 1 1 11 11 GLU CB C 11 29.400 29.400 29.855 -0.455 18832
5301 1 18 . 1 1 11 11 GLU H H 11 8.271 8.271 8.594 -0.323 18832
5302 1 18 . 1 1 12 12 LYS HA H 12 4.380 4.380 3.732 0.648 18832
5303 1 18 . 1 1 12 12 LYS CA C 12 55.790 55.790 57.455 -1.665 18832
5304 1 18 . 1 1 12 12 LYS CB C 12 33.600 33.600 32.444 1.156 18832
5305 1 18 . 1 1 13 13 TYR HA H 13 5.560 5.560 4.590 0.970 18832
5306 1 18 . 1 1 13 13 TYR CA C 13 55.860 55.860 55.244 0.616 18832
5307 1 18 . 1 1 13 13 TYR CB C 13 42.440 42.440 40.203 2.237 18832
5308 1 18 . 1 1 14 14 GLY N N 14 105.320 105.320 106.902 -1.582 18832
5309 1 18 . 1 1 14 14 GLY CA C 14 45.240 45.240 43.625 1.615 18832
5310 1 18 . 1 1 14 14 GLY H H 14 8.401 8.401 9.121 -0.720 18832
5311 1 18 . 1 1 15 15 VAL N N 15 118.900 118.900 118.436 0.464 18832
5312 1 18 . 1 1 15 15 VAL HA H 15 5.341 5.341 4.491 0.850 18832
5313 1 18 . 1 1 15 15 VAL CA C 15 59.210 59.210 60.756 -1.546 18832
5314 1 18 . 1 1 15 15 VAL CB C 15 35.740 35.740 36.535 -0.795 18832
5315 1 18 . 1 1 15 15 VAL H H 15 8.851 8.851 8.615 0.236 18832
5316 1 18 . 1 1 16 16 ALA N N 16 129.460 129.460 126.145 3.315 18832
5317 1 18 . 1 1 16 16 ALA HA H 16 5.000 5.000 5.559 -0.559 18832
5318 1 18 . 1 1 16 16 ALA CA C 16 52.000 52.000 49.893 2.107 18832
5319 1 18 . 1 1 16 16 ALA CB C 16 19.330 19.330 21.224 -1.894 18832
5320 1 18 . 1 1 16 16 ALA H H 16 9.113 9.113 8.463 0.650 18832
5321 1 18 . 1 1 17 17 PHE N N 17 124.070 124.070 122.525 1.545 18832
5322 1 18 . 1 1 17 17 PHE HA H 17 4.801 4.801 4.876 -0.075 18832
5323 1 18 . 1 1 17 17 PHE CA C 17 56.230 56.230 56.521 -0.291 18832
5324 1 18 . 1 1 17 17 PHE CB C 17 40.000 40.000 38.594 1.406 18832
5325 1 18 . 1 1 17 17 PHE H H 17 8.787 8.787 7.625 1.162 18832
5326 1 18 . 1 1 18 18 TYR N N 18 118.210 118.210 122.308 -4.098 18832
5327 1 18 . 1 1 18 18 TYR HA H 18 4.483 4.483 4.390 0.093 18832
5328 1 18 . 1 1 18 18 TYR CA C 18 55.300 55.300 57.453 -2.153 18832
5329 1 18 . 1 1 18 18 TYR CB C 18 42.810 42.810 42.075 0.735 18832
5330 1 18 . 1 1 18 18 TYR H H 18 7.281 7.281 7.575 -0.294 18832
5331 1 18 . 1 1 19 19 ASN N N 19 116.800 116.800 119.244 -2.444 18832
5332 1 18 . 1 1 19 19 ASN HA H 19 4.710 4.710 4.806 -0.096 18832
5333 1 18 . 1 1 19 19 ASN CA C 19 52.940 52.940 52.927 0.013 18832
5334 1 18 . 1 1 19 19 ASN CB C 19 39.060 39.060 38.631 0.429 18832
5335 1 18 . 1 1 19 19 ASN H H 19 8.134 8.134 8.208 -0.074 18832
5336 1 18 . 1 1 20 20 TYR N N 20 122.190 122.190 122.921 -0.731 18832
5337 1 18 . 1 1 20 20 TYR HA H 20 4.687 4.687 4.487 0.200 18832
5338 1 18 . 1 1 20 20 TYR CA C 20 57.720 57.720 58.608 -0.888 18832
5339 1 18 . 1 1 20 20 TYR CB C 20 42.250 42.250 39.692 2.558 18832
5340 1 18 . 1 1 20 20 TYR H H 20 8.993 8.993 7.906 1.087 18832
5341 1 18 . 1 1 21 21 ASP N N 21 128.520 128.520 128.445 0.075 18832
5342 1 18 . 1 1 21 21 ASP HA H 21 4.790 4.790 4.967 -0.177 18832
5343 1 18 . 1 1 21 21 ASP CA C 21 52.370 52.370 53.233 -0.862 18832
5344 1 18 . 1 1 21 21 ASP CB C 21 41.130 41.130 42.225 -1.095 18832
5345 1 18 . 1 1 21 21 ASP H H 21 7.838 7.838 8.475 -0.637 18832
5346 1 18 . 1 1 22 22 ALA N N 22 125.240 125.240 123.497 1.743 18832
5347 1 18 . 1 1 22 22 ALA HA H 22 4.051 4.051 4.562 -0.511 18832
5348 1 18 . 1 1 22 22 ALA CA C 22 52.940 52.940 52.565 0.375 18832
5349 1 18 . 1 1 22 22 ALA CB C 22 20.450 20.450 19.908 0.542 18832
5350 1 18 . 1 1 22 22 ALA H H 22 8.103 8.103 8.595 -0.492 18832
5351 1 18 . 1 1 23 23 ARG N N 23 122.190 122.190 120.691 1.499 18832
5352 1 18 . 1 1 23 23 ARG HA H 23 4.346 4.346 4.560 -0.214 18832
5353 1 18 . 1 1 23 23 ARG CA C 23 55.490 55.490 55.690 -0.199 18832
5354 1 18 . 1 1 23 23 ARG CB C 23 30.700 30.700 31.487 -0.787 18832
5355 1 18 . 1 1 23 23 ARG H H 23 8.887 8.887 8.976 -0.089 18832
5356 1 18 . 1 1 24 24 GLY N N 24 105.320 105.320 106.385 -1.065 18832
5357 1 18 . 1 1 24 24 GLY CA C 24 44.500 44.500 44.994 -0.494 18832
5358 1 18 . 1 1 24 24 GLY H H 24 7.258 7.258 7.611 -0.352 18832
5359 1 18 . 1 1 25 25 ALA N N 25 122.190 122.190 121.345 0.845 18832
5360 1 18 . 1 1 25 25 ALA HA H 25 4.166 4.166 4.245 -0.079 18832
5361 1 18 . 1 1 25 25 ALA CA C 25 54.440 54.440 53.897 0.543 18832
5362 1 18 . 1 1 25 25 ALA CB C 25 18.770 18.770 19.459 -0.689 18832
5363 1 18 . 1 1 25 25 ALA H H 25 8.627 8.627 8.334 0.293 18832
5364 1 18 . 1 1 26 26 ASP N N 26 114.690 114.690 117.014 -2.324 18832
5365 1 18 . 1 1 26 26 ASP HA H 26 4.700 4.700 4.438 0.262 18832
5366 1 18 . 1 1 26 26 ASP CA C 26 53.870 53.870 55.969 -2.099 18832
5367 1 18 . 1 1 26 26 ASP CB C 26 40.390 40.390 40.991 -0.601 18832
5368 1 18 . 1 1 26 26 ASP H H 26 8.955 8.955 8.682 0.273 18832
5369 1 18 . 1 1 27 27 GLU N N 27 118.910 118.910 116.984 1.926 18832
5370 1 18 . 1 1 27 27 GLU HA H 27 5.202 5.202 4.483 0.719 18832
5371 1 18 . 1 1 27 27 GLU CA C 27 54.930 54.930 55.429 -0.499 18832
5372 1 18 . 1 1 27 27 GLU CB C 27 32.880 32.880 32.092 0.788 18832
5373 1 18 . 1 1 27 27 GLU H H 27 7.537 7.537 7.848 -0.311 18832
5374 1 18 . 1 1 28 28 LEU N N 28 121.490 121.490 120.386 1.104 18832
5375 1 18 . 1 1 28 28 LEU HA H 28 4.756 4.756 4.684 0.072 18832
5376 1 18 . 1 1 28 28 LEU CA C 28 53.120 53.120 53.754 -0.634 18832
5377 1 18 . 1 1 28 28 LEU CB C 28 44.500 44.500 45.645 -1.145 18832
5378 1 18 . 1 1 28 28 LEU H H 28 8.890 8.890 8.415 0.475 18832
5379 1 18 . 1 1 29 29 SER N N 29 115.870 115.870 119.485 -3.615 18832
5380 1 18 . 1 1 29 29 SER HA H 29 5.009 5.009 4.800 0.209 18832
5381 1 18 . 1 1 29 29 SER CA C 29 58.470 58.470 58.318 0.152 18832
5382 1 18 . 1 1 29 29 SER CB C 29 63.690 63.690 63.445 0.245 18832
5383 1 18 . 1 1 29 29 SER H H 29 7.948 7.948 8.483 -0.535 18832
5384 1 18 . 1 1 30 30 LEU N N 30 121.260 121.260 125.599 -4.339 18832
5385 1 18 . 1 1 30 30 LEU HA H 30 4.776 4.776 4.775 0.001 18832
5386 1 18 . 1 1 30 30 LEU CA C 30 52.940 52.940 54.055 -1.115 18832
5387 1 18 . 1 1 30 30 LEU CB C 30 46.370 46.370 45.304 1.066 18832
5388 1 18 . 1 1 30 30 LEU H H 30 9.500 9.500 8.224 1.276 18832
5389 1 18 . 1 1 31 31 GLN N N 31 123.130 123.130 118.551 4.579 18832
5390 1 18 . 1 1 31 31 GLN HA H 31 5.065 5.065 5.385 -0.320 18832
5391 1 18 . 1 1 31 31 GLN CA C 31 52.940 52.940 53.250 -0.310 18832
5392 1 18 . 1 1 31 31 GLN CB C 31 31.190 31.190 33.316 -2.126 18832
5393 1 18 . 1 1 31 31 GLN H H 31 9.147 9.147 8.186 0.961 18832
5394 1 18 . 1 1 32 32 ILE N N 32 120.790 120.790 120.072 0.718 18832
5395 1 18 . 1 1 32 32 ILE HA H 32 3.032 3.032 4.076 -1.044 18832
5396 1 18 . 1 1 32 32 ILE CA C 32 64.250 64.250 63.403 0.847 18832
5397 1 18 . 1 1 32 32 ILE CB C 32 37.940 37.940 37.790 0.150 18832
5398 1 18 . 1 1 32 32 ILE H H 32 8.016 8.016 8.316 -0.300 18832
5399 1 18 . 1 1 33 33 GLY N N 33 115.870 115.870 115.489 0.381 18832
5400 1 18 . 1 1 33 33 GLY CA C 33 44.500 44.500 44.668 -0.168 18832
5401 1 18 . 1 1 33 33 GLY H H 33 8.775 8.775 9.032 -0.257 18832
5402 1 18 . 1 1 34 34 ASP N N 34 122.430 122.430 122.305 0.125 18832
5403 1 18 . 1 1 34 34 ASP HA H 34 4.634 4.634 4.927 -0.293 18832
5404 1 18 . 1 1 34 34 ASP CA C 34 55.860 55.860 54.035 1.825 18832
5405 1 18 . 1 1 34 34 ASP CB C 34 41.310 41.310 42.426 -1.117 18832
5406 1 18 . 1 1 34 34 ASP H H 34 8.686 8.686 7.853 0.833 18832
5407 1 18 . 1 1 35 35 THR N N 35 117.980 117.980 117.181 0.799 18832
5408 1 18 . 1 1 35 35 THR HA H 35 5.154 5.154 4.773 0.381 18832
5409 1 18 . 1 1 35 35 THR CA C 35 61.450 61.450 62.010 -0.560 18832
5410 1 18 . 1 1 35 35 THR CB C 35 69.090 69.090 69.906 -0.816 18832
5411 1 18 . 1 1 35 35 THR H H 35 8.392 8.392 8.514 -0.122 18832
5412 1 18 . 1 1 36 36 VAL N N 36 118.200 118.200 117.610 0.590 18832
5413 1 18 . 1 1 36 36 VAL HA H 36 5.152 5.152 4.506 0.646 18832
5414 1 18 . 1 1 36 36 VAL CA C 36 57.910 57.910 59.772 -1.862 18832
5415 1 18 . 1 1 36 36 VAL CB C 36 34.190 34.190 34.816 -0.626 18832
5416 1 18 . 1 1 36 36 VAL H H 36 9.016 9.016 8.667 0.349 18832
5417 1 18 . 1 1 37 37 HIS N N 37 122.190 122.190 125.810 -3.620 18832
5418 1 18 . 1 1 37 37 HIS HA H 37 4.811 4.811 4.906 -0.095 18832
5419 1 18 . 1 1 37 37 HIS CA C 37 52.560 52.560 54.013 -1.453 18832
5420 1 18 . 1 1 37 37 HIS CB C 37 31.260 31.260 29.783 1.477 18832
5421 1 18 . 1 1 37 37 HIS H H 37 8.491 8.491 7.971 0.520 18832
5422 1 18 . 1 1 38 38 ILE N N 38 126.650 126.650 128.307 -1.657 18832
5423 1 18 . 1 1 38 38 ILE HA H 38 3.750 3.750 3.885 -0.135 18832
5424 1 18 . 1 1 38 38 ILE CA C 38 61.640 61.640 62.901 -1.261 18832
5425 1 18 . 1 1 38 38 ILE CB C 38 38.880 38.880 37.310 1.570 18832
5426 1 18 . 1 1 38 38 ILE H H 38 8.638 8.638 8.618 0.020 18832
5427 1 18 . 1 1 39 39 LEU N N 39 126.180 126.180 129.294 -3.114 18832
5428 1 18 . 1 1 39 39 LEU HA H 39 4.380 4.380 4.576 -0.196 18832
5429 1 18 . 1 1 39 39 LEU CA C 39 55.490 55.490 56.551 -1.061 18832
5430 1 18 . 1 1 39 39 LEU CB C 39 43.750 43.750 44.079 -0.329 18832
5431 1 18 . 1 1 39 39 LEU H H 39 9.163 9.163 8.994 0.169 18832
5432 1 18 . 1 1 40 40 GLU N N 40 115.160 115.160 114.810 0.350 18832
5433 1 18 . 1 1 40 40 GLU HA H 40 5.020 5.020 4.738 0.282 18832
5434 1 18 . 1 1 40 40 GLU CA C 40 55.090 55.090 54.775 0.315 18832
5435 1 18 . 1 1 40 40 GLU CB C 40 35.730 35.730 33.717 2.013 18832
5436 1 18 . 1 1 40 40 GLU H H 40 7.852 7.852 8.233 -0.381 18832
5437 1 18 . 1 1 41 41 THR HA H 41 4.270 4.270 4.577 -0.307 18832
5438 1 18 . 1 1 41 41 THR CA C 41 61.250 61.250 59.967 1.283 18832
5439 1 18 . 1 1 41 41 THR CB C 41 71.410 71.410 69.717 1.693 18832
5440 1 18 . 1 1 42 42 TYR HA H 42 4.550 4.550 4.532 0.018 18832
5441 1 18 . 1 1 43 43 GLU N N 43 124.100 124.100 121.225 2.875 18832
5442 1 18 . 1 1 43 43 GLU HA H 43 3.740 3.740 4.594 -0.854 18832
5443 1 18 . 1 1 43 43 GLU H H 43 8.590 8.590 8.593 -0.003 18832
5444 1 18 . 1 1 44 44 GLY N N 44 110.789 110.789 113.545 -2.756 18832
5445 1 18 . 1 1 44 44 GLY CA C 44 45.440 45.440 45.711 -0.271 18832
5446 1 18 . 1 1 44 44 GLY H H 44 8.432 8.432 8.789 -0.357 18832
5447 1 18 . 1 1 45 45 TRP HA H 45 4.690 4.690 4.601 0.089 18832
5448 1 18 . 1 1 45 45 TRP CA C 45 57.550 57.550 55.863 1.687 18832
5449 1 18 . 1 1 46 46 TYR HA H 46 5.600 5.600 5.129 0.471 18832
5450 1 18 . 1 1 46 46 TYR CA C 46 54.060 54.060 54.605 -0.545 18832
5451 1 18 . 1 1 46 46 TYR CB C 46 42.650 42.650 41.039 1.611 18832
5452 1 18 . 1 1 47 47 ARG N N 47 118.100 118.100 122.162 -4.062 18832
5453 1 18 . 1 1 47 47 ARG HA H 47 5.094 5.094 4.730 0.364 18832
5454 1 18 . 1 1 47 47 ARG CA C 47 54.060 54.060 54.597 -0.537 18832
5455 1 18 . 1 1 47 47 ARG CB C 47 33.250 33.250 33.274 -0.024 18832
5456 1 18 . 1 1 47 47 ARG H H 47 8.492 8.492 8.636 -0.144 18832
5457 1 18 . 1 1 48 48 GLY N N 48 114.000 114.000 111.849 2.151 18832
5458 1 18 . 1 1 48 48 GLY CA C 48 46.560 46.560 45.605 0.956 18832
5459 1 18 . 1 1 48 48 GLY H H 48 9.183 9.183 9.013 0.170 18832
5460 1 18 . 1 1 49 49 TYR N N 49 116.100 116.100 115.128 0.972 18832
5461 1 18 . 1 1 49 49 TYR HA H 49 5.373 5.373 5.223 0.150 18832
5462 1 18 . 1 1 49 49 TYR CA C 49 55.110 55.110 55.746 -0.636 18832
5463 1 18 . 1 1 49 49 TYR CB C 49 40.750 40.750 40.607 0.143 18832
5464 1 18 . 1 1 49 49 TYR H H 49 8.194 8.194 8.039 0.155 18832
5465 1 18 . 1 1 50 50 THR N N 50 112.350 112.350 116.166 -3.816 18832
5466 1 18 . 1 1 50 50 THR HA H 50 5.105 5.105 4.489 0.616 18832
5467 1 18 . 1 1 50 50 THR CA C 50 59.770 59.770 60.937 -1.167 18832
5468 1 18 . 1 1 50 50 THR CB C 50 69.460 69.460 69.794 -0.334 18832
5469 1 18 . 1 1 50 50 THR H H 50 9.441 9.441 8.829 0.612 18832
5470 1 18 . 1 1 51 51 LEU N N 51 121.260 121.260 120.815 0.445 18832
5471 1 18 . 1 1 51 51 LEU HA H 51 4.236 4.236 4.143 0.093 18832
5472 1 18 . 1 1 51 51 LEU CA C 51 56.790 56.790 56.816 -0.026 18832
5473 1 18 . 1 1 51 51 LEU CB C 51 40.000 40.000 41.086 -1.086 18832
5474 1 18 . 1 1 51 51 LEU H H 51 8.310 8.310 7.925 0.385 18832
5475 1 18 . 1 1 52 52 ARG N N 52 116.570 116.570 118.598 -2.028 18832
5476 1 18 . 1 1 52 52 ARG HA H 52 4.250 4.250 4.134 0.116 18832
5477 1 18 . 1 1 52 52 ARG CA C 52 57.350 57.350 58.513 -1.163 18832
5478 1 18 . 1 1 52 52 ARG CB C 52 30.510 30.510 30.380 0.130 18832
5479 1 18 . 1 1 52 52 ARG H H 52 8.047 8.047 8.426 -0.379 18832
5480 1 18 . 1 1 53 53 LYS N N 53 122.660 122.660 117.242 5.418 18832
5481 1 18 . 1 1 53 53 LYS HA H 53 4.616 4.616 4.645 -0.029 18832
5482 1 18 . 1 1 53 53 LYS CA C 53 54.620 54.620 55.366 -0.746 18832
5483 1 18 . 1 1 53 53 LYS CB C 53 32.860 32.860 31.535 1.325 18832
5484 1 18 . 1 1 53 53 LYS H H 53 7.649 7.649 8.014 -0.365 18832
5485 1 18 . 1 1 54 54 LYS N N 54 125.010 125.010 120.972 4.038 18832
5486 1 18 . 1 1 54 54 LYS HA H 54 4.090 4.090 4.310 -0.220 18832
5487 1 18 . 1 1 54 54 LYS CA C 54 58.470 58.470 58.697 -0.227 18832
5488 1 18 . 1 1 54 54 LYS CB C 54 32.130 32.130 32.444 -0.314 18832
5489 1 18 . 1 1 54 54 LYS H H 54 8.496 8.496 8.435 0.061 18832
5490 1 18 . 1 1 55 55 SER N N 55 110.240 110.240 115.337 -5.097 18832
5491 1 18 . 1 1 55 55 SER HA H 55 4.122 4.122 4.176 -0.054 18832
5492 1 18 . 1 1 55 55 SER CA C 55 58.960 58.960 60.213 -1.253 18832
5493 1 18 . 1 1 55 55 SER CB C 55 63.310 63.310 63.145 0.165 18832
5494 1 18 . 1 1 55 55 SER H H 55 7.857 7.857 8.133 -0.276 18832
5495 1 18 . 1 1 56 56 LYS N N 56 124.070 124.070 123.458 0.612 18832
5496 1 18 . 1 1 56 56 LYS HA H 56 4.668 4.668 4.206 0.462 18832
5497 1 18 . 1 1 56 56 LYS CA C 56 54.810 54.810 56.151 -1.341 18832
5498 1 18 . 1 1 56 56 LYS CB C 56 33.250 33.250 32.564 0.686 18832
5499 1 18 . 1 1 56 56 LYS H H 56 7.473 7.473 8.009 -0.536 18832
5500 1 18 . 1 1 57 57 LYS N N 57 125.940 125.940 125.269 0.671 18832
5501 1 18 . 1 1 57 57 LYS HA H 57 5.341 5.341 4.652 0.689 18832
5502 1 18 . 1 1 57 57 LYS CA C 57 54.620 54.620 55.951 -1.331 18832
5503 1 18 . 1 1 57 57 LYS CB C 57 34.240 34.240 34.732 -0.492 18832
5504 1 18 . 1 1 57 57 LYS H H 57 8.474 8.474 8.143 0.331 18832
5505 1 18 . 1 1 58 58 GLY N N 58 109.540 109.540 108.015 1.525 18832
5506 1 18 . 1 1 58 58 GLY CA C 58 45.620 45.620 44.783 0.837 18832
5507 1 18 . 1 1 58 58 GLY H H 58 9.075 9.075 8.548 0.527 18832
5508 1 18 . 1 1 59 59 ILE N N 59 113.900 113.900 115.379 -1.479 18832
5509 1 18 . 1 1 59 59 ILE HA H 59 6.000 6.000 4.871 1.129 18832
5510 1 18 . 1 1 59 59 ILE CA C 59 59.590 59.590 58.425 1.165 18832
5511 1 18 . 1 1 59 59 ILE CB C 59 41.140 41.140 40.707 0.433 18832
5512 1 18 . 1 1 59 59 ILE H H 59 8.628 8.628 7.728 0.900 18832
5513 1 18 . 1 1 60 60 PHE N N 60 117.040 117.040 116.798 0.242 18832
5514 1 18 . 1 1 60 60 PHE HA H 60 5.120 5.120 5.303 -0.183 18832
5515 1 18 . 1 1 60 60 PHE CA C 60 54.060 54.060 54.511 -0.451 18832
5516 1 18 . 1 1 60 60 PHE CB C 60 37.190 37.190 39.781 -2.591 18832
5517 1 18 . 1 1 60 60 PHE H H 60 8.724 8.724 8.549 0.175 18832
5518 1 18 . 1 1 61 61 PRO HA H 61 3.480 3.480 4.671 -1.191 18832
5519 1 18 . 1 1 61 61 PRO CA C 61 62.200 62.200 62.173 0.027 18832
5520 1 18 . 1 1 61 61 PRO CB C 61 31.190 31.190 32.574 -1.384 18832
5521 1 18 . 1 1 62 62 ALA N N 62 124.770 124.770 125.929 -1.159 18832
5522 1 18 . 1 1 62 62 ALA HA H 62 3.710 3.710 4.000 -0.290 18832
5523 1 18 . 1 1 62 62 ALA CA C 62 54.370 54.370 54.251 0.119 18832
5524 1 18 . 1 1 62 62 ALA CB C 62 17.650 17.650 17.933 -0.283 18832
5525 1 18 . 1 1 62 62 ALA H H 62 7.898 7.898 8.296 -0.398 18832
5526 1 18 . 1 1 63 63 SER N N 63 109.700 109.700 113.928 -4.228 18832
5527 1 18 . 1 1 63 63 SER HA H 63 4.200 4.200 4.222 -0.022 18832
5528 1 18 . 1 1 63 63 SER CA C 63 59.400 59.400 60.159 -0.759 18832
5529 1 18 . 1 1 63 63 SER CB C 63 62.380 62.380 62.659 -0.279 18832
5530 1 18 . 1 1 63 63 SER H H 63 8.030 8.030 8.166 -0.136 18832
5531 1 18 . 1 1 64 64 TYR N N 64 120.300 120.300 115.291 5.009 18832
5532 1 18 . 1 1 64 64 TYR HA H 64 4.250 4.250 4.309 -0.059 18832
5533 1 18 . 1 1 64 64 TYR CA C 64 57.720 57.720 55.457 2.263 18832
5534 1 18 . 1 1 64 64 TYR CB C 64 37.560 37.560 37.730 -0.170 18832
5535 1 18 . 1 1 64 64 TYR H H 64 7.128 7.128 6.836 0.292 18832
5536 1 18 . 1 1 65 65 ILE N N 65 118.000 118.000 121.197 -3.197 18832
5537 1 18 . 1 1 65 65 ILE HA H 65 4.810 4.810 5.015 -0.205 18832
5538 1 18 . 1 1 65 65 ILE CA C 65 56.980 56.980 59.240 -2.260 18832
5539 1 18 . 1 1 65 65 ILE CB C 65 39.630 39.630 39.546 0.084 18832
5540 1 18 . 1 1 65 65 ILE H H 65 7.671 7.671 7.446 0.225 18832
5541 1 18 . 1 1 66 66 HIS N N 66 124.300 124.300 127.174 -2.874 18832
5542 1 18 . 1 1 66 66 HIS HA H 66 5.130 5.130 4.900 0.230 18832
5543 1 18 . 1 1 66 66 HIS CA C 66 53.060 53.060 54.682 -1.622 18832
5544 1 18 . 1 1 66 66 HIS CB C 66 30.510 30.510 33.198 -2.688 18832
5545 1 18 . 1 1 66 66 HIS H H 66 9.159 9.159 8.868 0.291 18832
5546 1 18 . 1 1 67 67 LEU N N 67 127.580 127.580 128.180 -0.600 18832
5547 1 18 . 1 1 67 67 LEU HA H 67 4.570 4.570 4.303 0.267 18832
5548 1 18 . 1 1 67 67 LEU CA C 67 55.300 55.300 56.445 -1.145 18832
5549 1 18 . 1 1 67 67 LEU CB C 67 42.060 42.060 42.269 -0.209 18832
5550 1 18 . 1 1 67 67 LEU H H 67 8.992 8.992 8.753 0.239 18832
5551 1 18 . 1 1 68 68 LYS N N 68 121.900 121.900 122.568 -0.668 18832
5552 1 18 . 1 1 68 68 LYS HA H 68 4.490 4.490 4.651 -0.161 18832
5553 1 18 . 1 1 68 68 LYS CA C 68 55.110 55.110 54.403 0.708 18832
5554 1 18 . 1 1 68 68 LYS CB C 68 34.610 34.610 36.013 -1.403 18832
5555 1 18 . 1 1 68 68 LYS H H 68 8.499 8.499 8.393 0.105 18832
5556 1 18 . 1 1 69 69 GLU N N 69 122.190 122.190 121.465 0.725 18832
5557 1 18 . 1 1 69 69 GLU HA H 69 4.280 4.280 4.166 0.114 18832
5558 1 18 . 1 1 69 69 GLU CA C 69 56.610 56.610 56.051 0.559 18832
5559 1 18 . 1 1 69 69 GLU CB C 69 30.330 30.330 29.516 0.814 18832
5560 1 18 . 1 1 69 69 GLU H H 69 8.569 8.569 8.638 -0.069 18832
5561 1 18 . 1 1 70 70 ALA N N 70 123.370 123.370 127.845 -4.475 18832
5562 1 18 . 1 1 70 70 ALA HA H 70 4.200 4.200 4.046 0.154 18832
5563 1 18 . 1 1 70 70 ALA CA C 70 51.810 51.810 51.398 0.412 18832
5564 1 18 . 1 1 70 70 ALA CB C 70 19.700 19.700 18.488 1.212 18832
5565 1 18 . 1 1 70 70 ALA H H 70 8.181 8.181 8.007 0.174 18832
5566 1 18 . 1 1 71 71 ILE N N 71 120.080 120.080 122.221 -2.141 18832
5567 1 18 . 1 1 71 71 ILE HA H 71 4.070 4.070 4.177 -0.107 18832
5568 1 18 . 1 1 71 71 ILE CA C 71 60.330 60.330 61.898 -1.569 18832
5569 1 18 . 1 1 71 71 ILE CB C 71 38.690 38.690 38.380 0.310 18832
5570 1 18 . 1 1 71 71 ILE H H 71 7.776 7.776 7.879 -0.103 18832
5571 1 18 . 1 1 72 72 VAL N N 72 124.540 124.540 127.103 -2.563 18832
5572 1 18 . 1 1 72 72 VAL HA H 72 4.070 4.070 4.211 -0.141 18832
5573 1 18 . 1 1 72 72 VAL CA C 72 61.640 61.640 61.748 -0.108 18832
5574 1 18 . 1 1 72 72 VAL CB C 72 32.690 32.690 30.983 1.707 18832
5575 1 18 . 1 1 72 72 VAL H H 72 8.089 8.089 8.365 -0.276 18832
5576 1 18 . 1 1 73 73 GLU N N 73 125.940 125.940 124.415 1.525 18832
5577 1 18 . 1 1 73 73 GLU HA H 73 4.280 4.280 4.162 0.118 18832
5578 1 18 . 1 1 73 73 GLU CA C 73 56.610 56.610 56.350 0.260 18832
5579 1 18 . 1 1 73 73 GLU CB C 73 30.710 30.710 29.956 0.754 18832
5580 1 18 . 1 1 73 73 GLU H H 73 8.464 8.464 8.601 -0.137 18832
5581 1 19 . 1 1 2 2 THR N N 2 116.400 116.400 115.088 1.312 18832
5582 1 19 . 1 1 2 2 THR HA H 2 4.120 4.120 4.278 -0.158 18832
5583 1 19 . 1 1 2 2 THR CA C 2 62.100 62.100 62.616 -0.516 18832
5584 1 19 . 1 1 2 2 THR CB C 2 69.440 69.440 69.560 -0.120 18832
5585 1 19 . 1 1 2 2 THR H H 2 8.150 8.150 7.878 0.272 18832
5586 1 19 . 1 1 3 3 ARG HA H 3 4.310 4.310 4.408 -0.098 18832
5587 1 19 . 1 1 3 3 ARG CA C 3 55.750 55.750 56.292 -0.542 18832
5588 1 19 . 1 1 3 3 ARG CB C 3 30.620 30.620 30.476 0.144 18832
5589 1 19 . 1 1 4 4 TRP N N 4 123.300 123.300 122.703 0.597 18832
5590 1 19 . 1 1 4 4 TRP HA H 4 4.480 4.480 4.702 -0.222 18832
5591 1 19 . 1 1 4 4 TRP CA C 4 57.560 57.560 56.675 0.885 18832
5592 1 19 . 1 1 4 4 TRP CB C 4 29.490 29.490 30.689 -1.199 18832
5593 1 19 . 1 1 4 4 TRP H H 4 8.108 8.108 8.046 0.062 18832
5594 1 19 . 1 1 5 5 VAL HA H 5 4.570 4.570 4.296 0.274 18832
5595 1 19 . 1 1 5 5 VAL CB C 5 30.840 30.840 33.910 -3.070 18832
5596 1 19 . 1 1 6 6 PRO HA H 6 4.810 4.810 4.468 0.342 18832
5597 1 19 . 1 1 6 6 PRO CB C 6 32.210 32.210 32.653 -0.443 18832
5598 1 19 . 1 1 7 7 THR HA H 7 4.270 4.270 4.076 0.194 18832
5599 1 19 . 1 1 7 7 THR CA C 7 60.890 60.890 62.202 -1.312 18832
5600 1 19 . 1 1 7 7 THR CB C 7 70.140 70.140 68.262 1.878 18832
5601 1 19 . 1 1 8 8 LYS HA H 8 4.440 4.440 4.323 0.117 18832
5602 1 19 . 1 1 8 8 LYS CA C 8 55.980 55.980 56.590 -0.610 18832
5603 1 19 . 1 1 8 8 LYS CB C 8 35.050 35.050 31.136 3.914 18832
5604 1 19 . 1 1 10 10 GLU HA H 10 4.580 4.580 3.944 0.636 18832
5605 1 19 . 1 1 10 10 GLU CA C 10 55.570 55.570 58.770 -3.200 18832
5606 1 19 . 1 1 10 10 GLU CB C 10 30.780 30.780 29.276 1.504 18832
5607 1 19 . 1 1 11 11 GLU N N 11 122.500 122.500 117.059 5.441 18832
5608 1 19 . 1 1 11 11 GLU HA H 11 4.340 4.340 4.364 -0.024 18832
5609 1 19 . 1 1 11 11 GLU CA C 11 57.140 57.140 55.404 1.736 18832
5610 1 19 . 1 1 11 11 GLU CB C 11 29.400 29.400 30.979 -1.579 18832
5611 1 19 . 1 1 11 11 GLU H H 11 8.271 8.271 8.215 0.056 18832
5612 1 19 . 1 1 12 12 LYS HA H 12 4.380 4.380 3.977 0.403 18832
5613 1 19 . 1 1 12 12 LYS CA C 12 55.790 55.790 58.611 -2.821 18832
5614 1 19 . 1 1 12 12 LYS CB C 12 33.600 33.600 32.525 1.075 18832
5615 1 19 . 1 1 13 13 TYR HA H 13 5.560 5.560 4.548 1.012 18832
5616 1 19 . 1 1 13 13 TYR CA C 13 55.860 55.860 55.415 0.445 18832
5617 1 19 . 1 1 13 13 TYR CB C 13 42.440 42.440 39.873 2.567 18832
5618 1 19 . 1 1 14 14 GLY N N 14 105.320 105.320 106.790 -1.470 18832
5619 1 19 . 1 1 14 14 GLY CA C 14 45.240 45.240 44.621 0.619 18832
5620 1 19 . 1 1 14 14 GLY H H 14 8.401 8.401 8.918 -0.517 18832
5621 1 19 . 1 1 15 15 VAL N N 15 118.900 118.900 118.573 0.327 18832
5622 1 19 . 1 1 15 15 VAL HA H 15 5.341 5.341 4.690 0.651 18832
5623 1 19 . 1 1 15 15 VAL CA C 15 59.210 59.210 60.729 -1.519 18832
5624 1 19 . 1 1 15 15 VAL CB C 15 35.740 35.740 36.345 -0.605 18832
5625 1 19 . 1 1 15 15 VAL H H 15 8.851 8.851 8.863 -0.012 18832
5626 1 19 . 1 1 16 16 ALA N N 16 129.460 129.460 124.993 4.467 18832
5627 1 19 . 1 1 16 16 ALA HA H 16 5.000 5.000 5.382 -0.382 18832
5628 1 19 . 1 1 16 16 ALA CA C 16 52.000 52.000 50.357 1.643 18832
5629 1 19 . 1 1 16 16 ALA CB C 16 19.330 19.330 21.413 -2.083 18832
5630 1 19 . 1 1 16 16 ALA H H 16 9.113 9.113 8.641 0.472 18832
5631 1 19 . 1 1 17 17 PHE N N 17 124.070 124.070 122.215 1.855 18832
5632 1 19 . 1 1 17 17 PHE HA H 17 4.801 4.801 5.053 -0.252 18832
5633 1 19 . 1 1 17 17 PHE CA C 17 56.230 56.230 56.204 0.026 18832
5634 1 19 . 1 1 17 17 PHE CB C 17 40.000 40.000 38.544 1.456 18832
5635 1 19 . 1 1 17 17 PHE H H 17 8.787 8.787 8.018 0.769 18832
5636 1 19 . 1 1 18 18 TYR N N 18 118.210 118.210 122.785 -4.575 18832
5637 1 19 . 1 1 18 18 TYR HA H 18 4.483 4.483 4.379 0.104 18832
5638 1 19 . 1 1 18 18 TYR CA C 18 55.300 55.300 57.456 -2.156 18832
5639 1 19 . 1 1 18 18 TYR CB C 18 42.810 42.810 42.280 0.530 18832
5640 1 19 . 1 1 18 18 TYR H H 18 7.281 7.281 7.548 -0.267 18832
5641 1 19 . 1 1 19 19 ASN N N 19 116.800 116.800 119.269 -2.469 18832
5642 1 19 . 1 1 19 19 ASN HA H 19 4.710 4.710 4.830 -0.120 18832
5643 1 19 . 1 1 19 19 ASN CA C 19 52.940 52.940 52.725 0.215 18832
5644 1 19 . 1 1 19 19 ASN CB C 19 39.060 39.060 38.913 0.147 18832
5645 1 19 . 1 1 19 19 ASN H H 19 8.134 8.134 8.136 -0.002 18832
5646 1 19 . 1 1 20 20 TYR N N 20 122.190 122.190 123.706 -1.516 18832
5647 1 19 . 1 1 20 20 TYR HA H 20 4.687 4.687 4.652 0.035 18832
5648 1 19 . 1 1 20 20 TYR CA C 20 57.720 57.720 56.411 1.309 18832
5649 1 19 . 1 1 20 20 TYR CB C 20 42.250 42.250 40.568 1.682 18832
5650 1 19 . 1 1 20 20 TYR H H 20 8.993 8.993 8.122 0.871 18832
5651 1 19 . 1 1 21 21 ASP N N 21 128.520 128.520 124.881 3.639 18832
5652 1 19 . 1 1 21 21 ASP HA H 21 4.790 4.790 4.711 0.079 18832
5653 1 19 . 1 1 21 21 ASP CA C 21 52.370 52.370 52.105 0.265 18832
5654 1 19 . 1 1 21 21 ASP CB C 21 41.130 41.130 42.460 -1.330 18832
5655 1 19 . 1 1 21 21 ASP H H 21 7.838 7.838 8.364 -0.526 18832
5656 1 19 . 1 1 22 22 ALA N N 22 125.240 125.240 125.190 0.050 18832
5657 1 19 . 1 1 22 22 ALA HA H 22 4.051 4.051 4.085 -0.034 18832
5658 1 19 . 1 1 22 22 ALA CA C 22 52.940 52.940 51.833 1.107 18832
5659 1 19 . 1 1 22 22 ALA CB C 22 20.450 20.450 20.136 0.315 18832
5660 1 19 . 1 1 22 22 ALA H H 22 8.103 8.103 8.193 -0.090 18832
5661 1 19 . 1 1 23 23 ARG N N 23 122.190 122.190 121.683 0.507 18832
5662 1 19 . 1 1 23 23 ARG HA H 23 4.346 4.346 4.303 0.043 18832
5663 1 19 . 1 1 23 23 ARG CA C 23 55.490 55.490 56.482 -0.992 18832
5664 1 19 . 1 1 23 23 ARG CB C 23 30.700 30.700 30.928 -0.228 18832
5665 1 19 . 1 1 23 23 ARG H H 23 8.887 8.887 8.624 0.263 18832
5666 1 19 . 1 1 24 24 GLY N N 24 105.320 105.320 106.160 -0.840 18832
5667 1 19 . 1 1 24 24 GLY CA C 24 44.500 44.500 45.039 -0.539 18832
5668 1 19 . 1 1 24 24 GLY H H 24 7.258 7.258 7.548 -0.290 18832
5669 1 19 . 1 1 25 25 ALA N N 25 122.190 122.190 121.957 0.233 18832
5670 1 19 . 1 1 25 25 ALA HA H 25 4.166 4.166 4.222 -0.056 18832
5671 1 19 . 1 1 25 25 ALA CA C 25 54.440 54.440 53.869 0.571 18832
5672 1 19 . 1 1 25 25 ALA CB C 25 18.770 18.770 19.121 -0.351 18832
5673 1 19 . 1 1 25 25 ALA H H 25 8.627 8.627 8.372 0.255 18832
5674 1 19 . 1 1 26 26 ASP N N 26 114.690 114.690 116.887 -2.197 18832
5675 1 19 . 1 1 26 26 ASP HA H 26 4.700 4.700 4.406 0.294 18832
5676 1 19 . 1 1 26 26 ASP CA C 26 53.870 53.870 56.466 -2.596 18832
5677 1 19 . 1 1 26 26 ASP CB C 26 40.390 40.390 40.998 -0.608 18832
5678 1 19 . 1 1 26 26 ASP H H 26 8.955 8.955 8.680 0.275 18832
5679 1 19 . 1 1 27 27 GLU N N 27 118.910 118.910 116.745 2.165 18832
5680 1 19 . 1 1 27 27 GLU HA H 27 5.202 5.202 4.634 0.568 18832
5681 1 19 . 1 1 27 27 GLU CA C 27 54.930 54.930 55.587 -0.657 18832
5682 1 19 . 1 1 27 27 GLU CB C 27 32.880 32.880 33.141 -0.261 18832
5683 1 19 . 1 1 27 27 GLU H H 27 7.537 7.537 7.598 -0.061 18832
5684 1 19 . 1 1 28 28 LEU N N 28 121.490 121.490 119.170 2.320 18832
5685 1 19 . 1 1 28 28 LEU HA H 28 4.756 4.756 4.693 0.063 18832
5686 1 19 . 1 1 28 28 LEU CA C 28 53.120 53.120 53.739 -0.619 18832
5687 1 19 . 1 1 28 28 LEU CB C 28 44.500 44.500 45.777 -1.277 18832
5688 1 19 . 1 1 28 28 LEU H H 28 8.890 8.890 8.741 0.149 18832
5689 1 19 . 1 1 29 29 SER N N 29 115.870 115.870 118.832 -2.962 18832
5690 1 19 . 1 1 29 29 SER HA H 29 5.009 5.009 4.396 0.613 18832
5691 1 19 . 1 1 29 29 SER CA C 29 58.470 58.470 58.270 0.200 18832
5692 1 19 . 1 1 29 29 SER CB C 29 63.690 63.690 63.234 0.456 18832
5693 1 19 . 1 1 29 29 SER H H 29 7.948 7.948 8.397 -0.449 18832
5694 1 19 . 1 1 30 30 LEU N N 30 121.260 121.260 128.593 -7.333 18832
5695 1 19 . 1 1 30 30 LEU HA H 30 4.776 4.776 4.744 0.032 18832
5696 1 19 . 1 1 30 30 LEU CA C 30 52.940 52.940 53.664 -0.724 18832
5697 1 19 . 1 1 30 30 LEU CB C 30 46.370 46.370 44.574 1.796 18832
5698 1 19 . 1 1 30 30 LEU H H 30 9.500 9.500 8.267 1.233 18832
5699 1 19 . 1 1 31 31 GLN N N 31 123.130 123.130 119.646 3.484 18832
5700 1 19 . 1 1 31 31 GLN HA H 31 5.065 5.065 5.146 -0.081 18832
5701 1 19 . 1 1 31 31 GLN CA C 31 52.940 52.940 53.815 -0.875 18832
5702 1 19 . 1 1 31 31 GLN CB C 31 31.190 31.190 32.851 -1.661 18832
5703 1 19 . 1 1 31 31 GLN H H 31 9.147 9.147 8.458 0.689 18832
5704 1 19 . 1 1 32 32 ILE N N 32 120.790 120.790 121.317 -0.527 18832
5705 1 19 . 1 1 32 32 ILE HA H 32 3.032 3.032 4.074 -1.042 18832
5706 1 19 . 1 1 32 32 ILE CA C 32 64.250 64.250 62.778 1.472 18832
5707 1 19 . 1 1 32 32 ILE CB C 32 37.940 37.940 37.935 0.005 18832
5708 1 19 . 1 1 32 32 ILE H H 32 8.016 8.016 8.204 -0.188 18832
5709 1 19 . 1 1 33 33 GLY N N 33 115.870 115.870 114.941 0.929 18832
5710 1 19 . 1 1 33 33 GLY CA C 33 44.500 44.500 44.705 -0.205 18832
5711 1 19 . 1 1 33 33 GLY H H 33 8.775 8.775 8.793 -0.018 18832
5712 1 19 . 1 1 34 34 ASP N N 34 122.430 122.430 122.605 -0.175 18832
5713 1 19 . 1 1 34 34 ASP HA H 34 4.634 4.634 4.936 -0.302 18832
5714 1 19 . 1 1 34 34 ASP CA C 34 55.860 55.860 53.753 2.107 18832
5715 1 19 . 1 1 34 34 ASP CB C 34 41.310 41.310 42.040 -0.730 18832
5716 1 19 . 1 1 34 34 ASP H H 34 8.686 8.686 7.819 0.867 18832
5717 1 19 . 1 1 35 35 THR N N 35 117.980 117.980 118.038 -0.058 18832
5718 1 19 . 1 1 35 35 THR HA H 35 5.154 5.154 4.744 0.410 18832
5719 1 19 . 1 1 35 35 THR CA C 35 61.450 61.450 62.175 -0.725 18832
5720 1 19 . 1 1 35 35 THR CB C 35 69.090 69.090 69.405 -0.315 18832
5721 1 19 . 1 1 35 35 THR H H 35 8.392 8.392 8.552 -0.160 18832
5722 1 19 . 1 1 36 36 VAL N N 36 118.200 118.200 119.325 -1.125 18832
5723 1 19 . 1 1 36 36 VAL HA H 36 5.152 5.152 4.558 0.594 18832
5724 1 19 . 1 1 36 36 VAL CA C 36 57.910 57.910 60.102 -2.192 18832
5725 1 19 . 1 1 36 36 VAL CB C 36 34.190 34.190 34.486 -0.296 18832
5726 1 19 . 1 1 36 36 VAL H H 36 9.016 9.016 8.740 0.276 18832
5727 1 19 . 1 1 37 37 HIS N N 37 122.190 122.190 126.496 -4.306 18832
5728 1 19 . 1 1 37 37 HIS HA H 37 4.811 4.811 5.050 -0.239 18832
5729 1 19 . 1 1 37 37 HIS CA C 37 52.560 52.560 54.000 -1.440 18832
5730 1 19 . 1 1 37 37 HIS CB C 37 31.260 31.260 30.547 0.713 18832
5731 1 19 . 1 1 37 37 HIS H H 37 8.491 8.491 8.956 -0.465 18832
5732 1 19 . 1 1 38 38 ILE N N 38 126.650 126.650 127.023 -0.373 18832
5733 1 19 . 1 1 38 38 ILE HA H 38 3.750 3.750 3.909 -0.159 18832
5734 1 19 . 1 1 38 38 ILE CA C 38 61.640 61.640 63.257 -1.617 18832
5735 1 19 . 1 1 38 38 ILE CB C 38 38.880 38.880 38.318 0.562 18832
5736 1 19 . 1 1 38 38 ILE H H 38 8.638 8.638 8.741 -0.103 18832
5737 1 19 . 1 1 39 39 LEU N N 39 126.180 126.180 126.284 -0.104 18832
5738 1 19 . 1 1 39 39 LEU HA H 39 4.380 4.380 4.589 -0.209 18832
5739 1 19 . 1 1 39 39 LEU CA C 39 55.490 55.490 54.835 0.655 18832
5740 1 19 . 1 1 39 39 LEU CB C 39 43.750 43.750 44.565 -0.815 18832
5741 1 19 . 1 1 39 39 LEU H H 39 9.163 9.163 8.863 0.300 18832
5742 1 19 . 1 1 40 40 GLU N N 40 115.160 115.160 117.491 -2.331 18832
5743 1 19 . 1 1 40 40 GLU HA H 40 5.020 5.020 4.496 0.524 18832
5744 1 19 . 1 1 40 40 GLU CA C 40 55.090 55.090 55.447 -0.357 18832
5745 1 19 . 1 1 40 40 GLU CB C 40 35.730 35.730 33.922 1.808 18832
5746 1 19 . 1 1 40 40 GLU H H 40 7.852 7.852 8.372 -0.520 18832
5747 1 19 . 1 1 41 41 THR HA H 41 4.270 4.270 4.684 -0.414 18832
5748 1 19 . 1 1 41 41 THR CA C 41 61.250 61.250 59.909 1.341 18832
5749 1 19 . 1 1 41 41 THR CB C 41 71.410 71.410 70.900 0.510 18832
5750 1 19 . 1 1 42 42 TYR HA H 42 4.550 4.550 4.394 0.156 18832
5751 1 19 . 1 1 43 43 GLU N N 43 124.100 124.100 119.982 4.118 18832
5752 1 19 . 1 1 43 43 GLU HA H 43 3.740 3.740 4.128 -0.388 18832
5753 1 19 . 1 1 43 43 GLU H H 43 8.590 8.590 8.276 0.314 18832
5754 1 19 . 1 1 44 44 GLY N N 44 110.789 110.789 110.886 -0.097 18832
5755 1 19 . 1 1 44 44 GLY CA C 44 45.440 45.440 45.154 0.286 18832
5756 1 19 . 1 1 44 44 GLY H H 44 8.432 8.432 8.669 -0.237 18832
5757 1 19 . 1 1 45 45 TRP HA H 45 4.690 4.690 4.541 0.149 18832
5758 1 19 . 1 1 45 45 TRP CA C 45 57.550 57.550 56.328 1.222 18832
5759 1 19 . 1 1 46 46 TYR HA H 46 5.600 5.600 4.957 0.643 18832
5760 1 19 . 1 1 46 46 TYR CA C 46 54.060 54.060 54.542 -0.482 18832
5761 1 19 . 1 1 46 46 TYR CB C 46 42.650 42.650 41.468 1.182 18832
5762 1 19 . 1 1 47 47 ARG N N 47 118.100 118.100 121.952 -3.852 18832
5763 1 19 . 1 1 47 47 ARG HA H 47 5.094 5.094 5.090 0.004 18832
5764 1 19 . 1 1 47 47 ARG CA C 47 54.060 54.060 54.306 -0.246 18832
5765 1 19 . 1 1 47 47 ARG CB C 47 33.250 33.250 33.850 -0.600 18832
5766 1 19 . 1 1 47 47 ARG H H 47 8.492 8.492 8.933 -0.441 18832
5767 1 19 . 1 1 48 48 GLY N N 48 114.000 114.000 113.086 0.914 18832
5768 1 19 . 1 1 48 48 GLY CA C 48 46.560 46.560 45.835 0.725 18832
5769 1 19 . 1 1 48 48 GLY H H 48 9.183 9.183 9.035 0.148 18832
5770 1 19 . 1 1 49 49 TYR N N 49 116.100 116.100 115.831 0.269 18832
5771 1 19 . 1 1 49 49 TYR HA H 49 5.373 5.373 5.499 -0.126 18832
5772 1 19 . 1 1 49 49 TYR CA C 49 55.110 55.110 54.780 0.330 18832
5773 1 19 . 1 1 49 49 TYR CB C 49 40.750 40.750 40.597 0.153 18832
5774 1 19 . 1 1 49 49 TYR H H 49 8.194 8.194 7.911 0.283 18832
5775 1 19 . 1 1 50 50 THR N N 50 112.350 112.350 114.925 -2.575 18832
5776 1 19 . 1 1 50 50 THR HA H 50 5.105 5.105 4.713 0.392 18832
5777 1 19 . 1 1 50 50 THR CA C 50 59.770 59.770 61.381 -1.611 18832
5778 1 19 . 1 1 50 50 THR CB C 50 69.460 69.460 70.163 -0.703 18832
5779 1 19 . 1 1 50 50 THR H H 50 9.441 9.441 8.793 0.648 18832
5780 1 19 . 1 1 51 51 LEU N N 51 121.260 121.260 121.113 0.147 18832
5781 1 19 . 1 1 51 51 LEU HA H 51 4.236 4.236 4.208 0.028 18832
5782 1 19 . 1 1 51 51 LEU CA C 51 56.790 56.790 57.465 -0.675 18832
5783 1 19 . 1 1 51 51 LEU CB C 51 40.000 40.000 41.040 -1.040 18832
5784 1 19 . 1 1 51 51 LEU H H 51 8.310 8.310 8.226 0.084 18832
5785 1 19 . 1 1 52 52 ARG N N 52 116.570 116.570 118.050 -1.480 18832
5786 1 19 . 1 1 52 52 ARG HA H 52 4.250 4.250 4.121 0.129 18832
5787 1 19 . 1 1 52 52 ARG CA C 52 57.350 57.350 58.017 -0.667 18832
5788 1 19 . 1 1 52 52 ARG CB C 52 30.510 30.510 30.485 0.025 18832
5789 1 19 . 1 1 52 52 ARG H H 52 8.047 8.047 8.552 -0.505 18832
5790 1 19 . 1 1 53 53 LYS N N 53 122.660 122.660 116.470 6.190 18832
5791 1 19 . 1 1 53 53 LYS HA H 53 4.616 4.616 4.576 0.040 18832
5792 1 19 . 1 1 53 53 LYS CA C 53 54.620 54.620 55.590 -0.970 18832
5793 1 19 . 1 1 53 53 LYS CB C 53 32.860 32.860 32.831 0.029 18832
5794 1 19 . 1 1 53 53 LYS H H 53 7.649 7.649 7.262 0.387 18832
5795 1 19 . 1 1 54 54 LYS N N 54 125.010 125.010 123.461 1.549 18832
5796 1 19 . 1 1 54 54 LYS HA H 54 4.090 4.090 4.059 0.031 18832
5797 1 19 . 1 1 54 54 LYS CA C 54 58.470 58.470 58.417 0.053 18832
5798 1 19 . 1 1 54 54 LYS CB C 54 32.130 32.130 31.640 0.490 18832
5799 1 19 . 1 1 54 54 LYS H H 54 8.496 8.496 8.697 -0.201 18832
5800 1 19 . 1 1 55 55 SER N N 55 110.240 110.240 112.104 -1.864 18832
5801 1 19 . 1 1 55 55 SER HA H 55 4.122 4.122 4.239 -0.117 18832
5802 1 19 . 1 1 55 55 SER CA C 55 58.960 58.960 60.077 -1.117 18832
5803 1 19 . 1 1 55 55 SER CB C 55 63.310 63.310 63.016 0.294 18832
5804 1 19 . 1 1 55 55 SER H H 55 7.857 7.857 7.962 -0.105 18832
5805 1 19 . 1 1 56 56 LYS N N 56 124.070 124.070 121.154 2.916 18832
5806 1 19 . 1 1 56 56 LYS HA H 56 4.668 4.668 4.310 0.358 18832
5807 1 19 . 1 1 56 56 LYS CA C 56 54.810 54.810 56.240 -1.430 18832
5808 1 19 . 1 1 56 56 LYS CB C 56 33.250 33.250 33.513 -0.263 18832
5809 1 19 . 1 1 56 56 LYS H H 56 7.473 7.473 7.325 0.148 18832
5810 1 19 . 1 1 57 57 LYS N N 57 125.940 125.940 124.805 1.135 18832
5811 1 19 . 1 1 57 57 LYS HA H 57 5.341 5.341 4.776 0.565 18832
5812 1 19 . 1 1 57 57 LYS CA C 57 54.620 54.620 55.074 -0.454 18832
5813 1 19 . 1 1 57 57 LYS CB C 57 34.240 34.240 35.419 -1.179 18832
5814 1 19 . 1 1 57 57 LYS H H 57 8.474 8.474 8.346 0.128 18832
5815 1 19 . 1 1 58 58 GLY N N 58 109.540 109.540 112.589 -3.049 18832
5816 1 19 . 1 1 58 58 GLY CA C 58 45.620 45.620 44.559 1.061 18832
5817 1 19 . 1 1 58 58 GLY H H 58 9.075 9.075 8.788 0.287 18832
5818 1 19 . 1 1 59 59 ILE N N 59 113.900 113.900 115.500 -1.600 18832
5819 1 19 . 1 1 59 59 ILE HA H 59 6.000 6.000 5.089 0.911 18832
5820 1 19 . 1 1 59 59 ILE CA C 59 59.590 59.590 58.538 1.052 18832
5821 1 19 . 1 1 59 59 ILE CB C 59 41.140 41.140 40.841 0.299 18832
5822 1 19 . 1 1 59 59 ILE H H 59 8.628 8.628 8.191 0.437 18832
5823 1 19 . 1 1 60 60 PHE N N 60 117.040 117.040 116.949 0.091 18832
5824 1 19 . 1 1 60 60 PHE HA H 60 5.120 5.120 5.514 -0.394 18832
5825 1 19 . 1 1 60 60 PHE CA C 60 54.060 54.060 55.023 -0.963 18832
5826 1 19 . 1 1 60 60 PHE CB C 60 37.190 37.190 40.397 -3.207 18832
5827 1 19 . 1 1 60 60 PHE H H 60 8.724 8.724 8.728 -0.004 18832
5828 1 19 . 1 1 61 61 PRO HA H 61 3.480 3.480 4.634 -1.154 18832
5829 1 19 . 1 1 61 61 PRO CA C 61 62.200 62.200 62.082 0.118 18832
5830 1 19 . 1 1 61 61 PRO CB C 61 31.190 31.190 32.948 -1.758 18832
5831 1 19 . 1 1 62 62 ALA N N 62 124.770 124.770 125.534 -0.764 18832
5832 1 19 . 1 1 62 62 ALA HA H 62 3.710 3.710 3.987 -0.277 18832
5833 1 19 . 1 1 62 62 ALA CA C 62 54.370 54.370 54.288 0.082 18832
5834 1 19 . 1 1 62 62 ALA CB C 62 17.650 17.650 17.981 -0.331 18832
5835 1 19 . 1 1 62 62 ALA H H 62 7.898 7.898 8.274 -0.376 18832
5836 1 19 . 1 1 63 63 SER N N 63 109.700 109.700 115.596 -5.896 18832
5837 1 19 . 1 1 63 63 SER HA H 63 4.200 4.200 4.208 -0.008 18832
5838 1 19 . 1 1 63 63 SER CA C 63 59.400 59.400 60.511 -1.111 18832
5839 1 19 . 1 1 63 63 SER CB C 63 62.380 62.380 62.427 -0.047 18832
5840 1 19 . 1 1 63 63 SER H H 63 8.030 8.030 8.460 -0.430 18832
5841 1 19 . 1 1 64 64 TYR N N 64 120.300 120.300 113.365 6.935 18832
5842 1 19 . 1 1 64 64 TYR HA H 64 4.250 4.250 4.417 -0.167 18832
5843 1 19 . 1 1 64 64 TYR CA C 64 57.720 57.720 54.494 3.226 18832
5844 1 19 . 1 1 64 64 TYR CB C 64 37.560 37.560 37.849 -0.289 18832
5845 1 19 . 1 1 64 64 TYR H H 64 7.128 7.128 6.857 0.271 18832
5846 1 19 . 1 1 65 65 ILE N N 65 118.000 118.000 121.591 -3.591 18832
5847 1 19 . 1 1 65 65 ILE HA H 65 4.810 4.810 4.721 0.089 18832
5848 1 19 . 1 1 65 65 ILE CA C 65 56.980 56.980 59.810 -2.830 18832
5849 1 19 . 1 1 65 65 ILE CB C 65 39.630 39.630 38.714 0.916 18832
5850 1 19 . 1 1 65 65 ILE H H 65 7.671 7.671 7.356 0.315 18832
5851 1 19 . 1 1 66 66 HIS N N 66 124.300 124.300 126.557 -2.257 18832
5852 1 19 . 1 1 66 66 HIS HA H 66 5.130 5.130 4.885 0.245 18832
5853 1 19 . 1 1 66 66 HIS CA C 66 53.060 53.060 55.278 -2.218 18832
5854 1 19 . 1 1 66 66 HIS CB C 66 30.510 30.510 32.607 -2.097 18832
5855 1 19 . 1 1 66 66 HIS H H 66 9.159 9.159 8.876 0.283 18832
5856 1 19 . 1 1 67 67 LEU N N 67 127.580 127.580 127.613 -0.033 18832
5857 1 19 . 1 1 67 67 LEU HA H 67 4.570 4.570 4.220 0.350 18832
5858 1 19 . 1 1 67 67 LEU CA C 67 55.300 55.300 55.651 -0.351 18832
5859 1 19 . 1 1 67 67 LEU CB C 67 42.060 42.060 41.435 0.625 18832
5860 1 19 . 1 1 67 67 LEU H H 67 8.992 8.992 8.485 0.507 18832
5861 1 19 . 1 1 68 68 LYS N N 68 121.900 121.900 123.639 -1.739 18832
5862 1 19 . 1 1 68 68 LYS HA H 68 4.490 4.490 4.563 -0.073 18832
5863 1 19 . 1 1 68 68 LYS CA C 68 55.110 55.110 55.137 -0.027 18832
5864 1 19 . 1 1 68 68 LYS CB C 68 34.610 34.610 33.683 0.927 18832
5865 1 19 . 1 1 68 68 LYS H H 68 8.499 8.499 8.208 0.291 18832
5866 1 19 . 1 1 69 69 GLU N N 69 122.190 122.190 120.672 1.518 18832
5867 1 19 . 1 1 69 69 GLU HA H 69 4.280 4.280 4.270 0.010 18832
5868 1 19 . 1 1 69 69 GLU CA C 69 56.610 56.610 56.006 0.604 18832
5869 1 19 . 1 1 69 69 GLU CB C 69 30.330 30.330 29.354 0.976 18832
5870 1 19 . 1 1 69 69 GLU H H 69 8.569 8.569 8.643 -0.074 18832
5871 1 19 . 1 1 70 70 ALA N N 70 123.370 123.370 129.530 -6.160 18832
5872 1 19 . 1 1 70 70 ALA HA H 70 4.200 4.200 4.147 0.053 18832
5873 1 19 . 1 1 70 70 ALA CA C 70 51.810 51.810 53.091 -1.281 18832
5874 1 19 . 1 1 70 70 ALA CB C 70 19.700 19.700 18.979 0.721 18832
5875 1 19 . 1 1 70 70 ALA H H 70 8.181 8.181 8.235 -0.054 18832
5876 1 19 . 1 1 71 71 ILE N N 71 120.080 120.080 122.057 -1.977 18832
5877 1 19 . 1 1 71 71 ILE HA H 71 4.070 4.070 4.503 -0.433 18832
5878 1 19 . 1 1 71 71 ILE CA C 71 60.330 60.330 59.336 0.994 18832
5879 1 19 . 1 1 71 71 ILE CB C 71 38.690 38.690 40.106 -1.417 18832
5880 1 19 . 1 1 71 71 ILE H H 71 7.776 7.776 7.983 -0.207 18832
5881 1 19 . 1 1 72 72 VAL N N 72 124.540 124.540 124.104 0.436 18832
5882 1 19 . 1 1 72 72 VAL HA H 72 4.070 4.070 4.218 -0.148 18832
5883 1 19 . 1 1 72 72 VAL CA C 72 61.640 61.640 62.660 -1.020 18832
5884 1 19 . 1 1 72 72 VAL CB C 72 32.690 32.690 32.473 0.217 18832
5885 1 19 . 1 1 72 72 VAL H H 72 8.089 8.089 8.131 -0.042 18832
5886 1 19 . 1 1 73 73 GLU N N 73 125.940 125.940 127.963 -2.023 18832
5887 1 19 . 1 1 73 73 GLU HA H 73 4.280 4.280 4.579 -0.299 18832
5888 1 19 . 1 1 73 73 GLU CA C 73 56.610 56.610 56.107 0.503 18832
5889 1 19 . 1 1 73 73 GLU CB C 73 30.710 30.710 30.647 0.063 18832
5890 1 19 . 1 1 73 73 GLU H H 73 8.464 8.464 8.645 -0.181 18832
5891 1 20 . 1 1 2 2 THR N N 2 116.400 116.400 113.692 2.708 18832
5892 1 20 . 1 1 2 2 THR HA H 2 4.120 4.120 4.120 0.000 18832
5893 1 20 . 1 1 2 2 THR CA C 2 62.100 62.100 62.298 -0.198 18832
5894 1 20 . 1 1 2 2 THR CB C 2 69.440 69.440 68.922 0.518 18832
5895 1 20 . 1 1 2 2 THR H H 2 8.150 8.150 8.115 0.035 18832
5896 1 20 . 1 1 3 3 ARG HA H 3 4.310 4.310 4.527 -0.217 18832
5897 1 20 . 1 1 3 3 ARG CA C 3 55.750 55.750 55.254 0.496 18832
5898 1 20 . 1 1 3 3 ARG CB C 3 30.620 30.620 32.986 -2.366 18832
5899 1 20 . 1 1 4 4 TRP N N 4 123.300 123.300 124.311 -1.011 18832
5900 1 20 . 1 1 4 4 TRP HA H 4 4.480 4.480 4.313 0.167 18832
5901 1 20 . 1 1 4 4 TRP CA C 4 57.560 57.560 57.470 0.090 18832
5902 1 20 . 1 1 4 4 TRP CB C 4 29.490 29.490 29.352 0.139 18832
5903 1 20 . 1 1 4 4 TRP H H 4 8.108 8.108 8.382 -0.274 18832
5904 1 20 . 1 1 5 5 VAL HA H 5 4.570 4.570 4.180 0.390 18832
5905 1 20 . 1 1 5 5 VAL CB C 5 30.840 30.840 32.125 -1.285 18832
5906 1 20 . 1 1 6 6 PRO HA H 6 4.810 4.810 5.069 -0.259 18832
5907 1 20 . 1 1 6 6 PRO CB C 6 32.210 32.210 30.886 1.324 18832
5908 1 20 . 1 1 7 7 THR HA H 7 4.270 4.270 3.827 0.443 18832
5909 1 20 . 1 1 7 7 THR CA C 7 60.890 60.890 63.001 -2.111 18832
5910 1 20 . 1 1 7 7 THR CB C 7 70.140 70.140 68.924 1.216 18832
5911 1 20 . 1 1 8 8 LYS HA H 8 4.440 4.440 4.371 0.069 18832
5912 1 20 . 1 1 8 8 LYS CA C 8 55.980 55.980 55.603 0.377 18832
5913 1 20 . 1 1 8 8 LYS CB C 8 35.050 35.050 33.130 1.920 18832
5914 1 20 . 1 1 10 10 GLU HA H 10 4.580 4.580 4.306 0.274 18832
5915 1 20 . 1 1 10 10 GLU CA C 10 55.570 55.570 55.548 0.022 18832
5916 1 20 . 1 1 10 10 GLU CB C 10 30.780 30.780 30.931 -0.151 18832
5917 1 20 . 1 1 11 11 GLU N N 11 122.500 122.500 120.199 2.301 18832
5918 1 20 . 1 1 11 11 GLU HA H 11 4.340 4.340 4.379 -0.039 18832
5919 1 20 . 1 1 11 11 GLU CA C 11 57.140 57.140 57.852 -0.713 18832
5920 1 20 . 1 1 11 11 GLU CB C 11 29.400 29.400 30.552 -1.153 18832
5921 1 20 . 1 1 11 11 GLU H H 11 8.271 8.271 8.706 -0.435 18832
5922 1 20 . 1 1 12 12 LYS HA H 12 4.380 4.380 4.101 0.279 18832
5923 1 20 . 1 1 12 12 LYS CA C 12 55.790 55.790 56.790 -1.000 18832
5924 1 20 . 1 1 12 12 LYS CB C 12 33.600 33.600 34.127 -0.527 18832
5925 1 20 . 1 1 13 13 TYR HA H 13 5.560 5.560 4.759 0.801 18832
5926 1 20 . 1 1 13 13 TYR CA C 13 55.860 55.860 55.962 -0.102 18832
5927 1 20 . 1 1 13 13 TYR CB C 13 42.440 42.440 39.960 2.480 18832
5928 1 20 . 1 1 14 14 GLY N N 14 105.320 105.320 106.841 -1.521 18832
5929 1 20 . 1 1 14 14 GLY CA C 14 45.240 45.240 43.849 1.391 18832
5930 1 20 . 1 1 14 14 GLY H H 14 8.401 8.401 8.821 -0.420 18832
5931 1 20 . 1 1 15 15 VAL N N 15 118.900 118.900 118.466 0.434 18832
5932 1 20 . 1 1 15 15 VAL HA H 15 5.341 5.341 4.527 0.814 18832
5933 1 20 . 1 1 15 15 VAL CA C 15 59.210 59.210 61.071 -1.861 18832
5934 1 20 . 1 1 15 15 VAL CB C 15 35.740 35.740 34.457 1.283 18832
5935 1 20 . 1 1 15 15 VAL H H 15 8.851 8.851 8.827 0.024 18832
5936 1 20 . 1 1 16 16 ALA N N 16 129.460 129.460 126.050 3.410 18832
5937 1 20 . 1 1 16 16 ALA HA H 16 5.000 5.000 4.823 0.177 18832
5938 1 20 . 1 1 16 16 ALA CA C 16 52.000 52.000 50.304 1.696 18832
5939 1 20 . 1 1 16 16 ALA CB C 16 19.330 19.330 20.704 -1.374 18832
5940 1 20 . 1 1 16 16 ALA H H 16 9.113 9.113 8.518 0.595 18832
5941 1 20 . 1 1 17 17 PHE N N 17 124.070 124.070 121.912 2.158 18832
5942 1 20 . 1 1 17 17 PHE HA H 17 4.801 4.801 5.081 -0.280 18832
5943 1 20 . 1 1 17 17 PHE CA C 17 56.230 56.230 55.908 0.322 18832
5944 1 20 . 1 1 17 17 PHE CB C 17 40.000 40.000 38.450 1.550 18832
5945 1 20 . 1 1 17 17 PHE H H 17 8.787 8.787 7.491 1.296 18832
5946 1 20 . 1 1 18 18 TYR N N 18 118.210 118.210 123.913 -5.703 18832
5947 1 20 . 1 1 18 18 TYR HA H 18 4.483 4.483 4.469 0.014 18832
5948 1 20 . 1 1 18 18 TYR CA C 18 55.300 55.300 57.850 -2.550 18832
5949 1 20 . 1 1 18 18 TYR CB C 18 42.810 42.810 42.842 -0.032 18832
5950 1 20 . 1 1 18 18 TYR H H 18 7.281 7.281 7.622 -0.341 18832
5951 1 20 . 1 1 19 19 ASN N N 19 116.800 116.800 120.595 -3.795 18832
5952 1 20 . 1 1 19 19 ASN HA H 19 4.710 4.710 4.813 -0.103 18832
5953 1 20 . 1 1 19 19 ASN CA C 19 52.940 52.940 52.471 0.469 18832
5954 1 20 . 1 1 19 19 ASN CB C 19 39.060 39.060 38.569 0.491 18832
5955 1 20 . 1 1 19 19 ASN H H 19 8.134 8.134 7.592 0.542 18832
5956 1 20 . 1 1 20 20 TYR N N 20 122.190 122.190 122.808 -0.618 18832
5957 1 20 . 1 1 20 20 TYR HA H 20 4.687 4.687 4.601 0.086 18832
5958 1 20 . 1 1 20 20 TYR CA C 20 57.720 57.720 58.728 -1.008 18832
5959 1 20 . 1 1 20 20 TYR CB C 20 42.250 42.250 40.034 2.216 18832
5960 1 20 . 1 1 20 20 TYR H H 20 8.993 8.993 8.090 0.903 18832
5961 1 20 . 1 1 21 21 ASP N N 21 128.520 128.520 128.746 -0.226 18832
5962 1 20 . 1 1 21 21 ASP HA H 21 4.790 4.790 4.889 -0.099 18832
5963 1 20 . 1 1 21 21 ASP CA C 21 52.370 52.370 52.257 0.113 18832
5964 1 20 . 1 1 21 21 ASP CB C 21 41.130 41.130 41.982 -0.852 18832
5965 1 20 . 1 1 21 21 ASP H H 21 7.838 7.838 8.533 -0.695 18832
5966 1 20 . 1 1 22 22 ALA N N 22 125.240 125.240 125.745 -0.505 18832
5967 1 20 . 1 1 22 22 ALA HA H 22 4.051 4.051 4.567 -0.516 18832
5968 1 20 . 1 1 22 22 ALA CA C 22 52.940 52.940 53.348 -0.408 18832
5969 1 20 . 1 1 22 22 ALA CB C 22 20.450 20.450 19.637 0.813 18832
5970 1 20 . 1 1 22 22 ALA H H 22 8.103 8.103 8.040 0.063 18832
5971 1 20 . 1 1 23 23 ARG N N 23 122.190 122.190 123.687 -1.497 18832
5972 1 20 . 1 1 23 23 ARG HA H 23 4.346 4.346 4.521 -0.175 18832
5973 1 20 . 1 1 23 23 ARG CA C 23 55.490 55.490 55.887 -0.397 18832
5974 1 20 . 1 1 23 23 ARG CB C 23 30.700 30.700 30.462 0.238 18832
5975 1 20 . 1 1 23 23 ARG H H 23 8.887 8.887 8.605 0.282 18832
5976 1 20 . 1 1 24 24 GLY N N 24 105.320 105.320 105.939 -0.619 18832
5977 1 20 . 1 1 24 24 GLY CA C 24 44.500 44.500 45.432 -0.932 18832
5978 1 20 . 1 1 24 24 GLY H H 24 7.258 7.258 7.480 -0.222 18832
5979 1 20 . 1 1 25 25 ALA N N 25 122.190 122.190 121.443 0.747 18832
5980 1 20 . 1 1 25 25 ALA HA H 25 4.166 4.166 4.306 -0.140 18832
5981 1 20 . 1 1 25 25 ALA CA C 25 54.440 54.440 53.720 0.720 18832
5982 1 20 . 1 1 25 25 ALA CB C 25 18.770 18.770 19.354 -0.584 18832
5983 1 20 . 1 1 25 25 ALA H H 25 8.627 8.627 8.314 0.313 18832
5984 1 20 . 1 1 26 26 ASP N N 26 114.690 114.690 117.091 -2.401 18832
5985 1 20 . 1 1 26 26 ASP HA H 26 4.700 4.700 4.424 0.276 18832
5986 1 20 . 1 1 26 26 ASP CA C 26 53.870 53.870 56.043 -2.173 18832
5987 1 20 . 1 1 26 26 ASP CB C 26 40.390 40.390 41.058 -0.668 18832
5988 1 20 . 1 1 26 26 ASP H H 26 8.955 8.955 8.520 0.435 18832
5989 1 20 . 1 1 27 27 GLU N N 27 118.910 118.910 116.171 2.739 18832
5990 1 20 . 1 1 27 27 GLU HA H 27 5.202 5.202 4.449 0.753 18832
5991 1 20 . 1 1 27 27 GLU CA C 27 54.930 54.930 55.832 -0.902 18832
5992 1 20 . 1 1 27 27 GLU CB C 27 32.880 32.880 32.392 0.488 18832
5993 1 20 . 1 1 27 27 GLU H H 27 7.537 7.537 7.597 -0.060 18832
5994 1 20 . 1 1 28 28 LEU N N 28 121.490 121.490 121.311 0.179 18832
5995 1 20 . 1 1 28 28 LEU HA H 28 4.756 4.756 4.768 -0.012 18832
5996 1 20 . 1 1 28 28 LEU CA C 28 53.120 53.120 53.720 -0.600 18832
5997 1 20 . 1 1 28 28 LEU CB C 28 44.500 44.500 44.715 -0.215 18832
5998 1 20 . 1 1 28 28 LEU H H 28 8.890 8.890 8.403 0.487 18832
5999 1 20 . 1 1 29 29 SER N N 29 115.870 115.870 119.402 -3.532 18832
6000 1 20 . 1 1 29 29 SER HA H 29 5.009 5.009 4.709 0.300 18832
6001 1 20 . 1 1 29 29 SER CA C 29 58.470 58.470 59.530 -1.060 18832
6002 1 20 . 1 1 29 29 SER CB C 29 63.690 63.690 63.552 0.138 18832
6003 1 20 . 1 1 29 29 SER H H 29 7.948 7.948 8.527 -0.579 18832
6004 1 20 . 1 1 30 30 LEU N N 30 121.260 121.260 126.066 -4.806 18832
6005 1 20 . 1 1 30 30 LEU HA H 30 4.776 4.776 4.754 0.022 18832
6006 1 20 . 1 1 30 30 LEU CA C 30 52.940 52.940 53.757 -0.817 18832
6007 1 20 . 1 1 30 30 LEU CB C 30 46.370 46.370 44.863 1.507 18832
6008 1 20 . 1 1 30 30 LEU H H 30 9.500 9.500 8.439 1.061 18832
6009 1 20 . 1 1 31 31 GLN N N 31 123.130 123.130 120.322 2.808 18832
6010 1 20 . 1 1 31 31 GLN HA H 31 5.065 5.065 4.971 0.094 18832
6011 1 20 . 1 1 31 31 GLN CA C 31 52.940 52.940 53.926 -0.986 18832
6012 1 20 . 1 1 31 31 GLN CB C 31 31.190 31.190 32.930 -1.740 18832
6013 1 20 . 1 1 31 31 GLN H H 31 9.147 9.147 8.453 0.694 18832
6014 1 20 . 1 1 32 32 ILE N N 32 120.790 120.790 121.093 -0.303 18832
6015 1 20 . 1 1 32 32 ILE HA H 32 3.032 3.032 4.037 -1.005 18832
6016 1 20 . 1 1 32 32 ILE CA C 32 64.250 64.250 63.590 0.660 18832
6017 1 20 . 1 1 32 32 ILE CB C 32 37.940 37.940 37.830 0.110 18832
6018 1 20 . 1 1 32 32 ILE H H 32 8.016 8.016 8.472 -0.456 18832
6019 1 20 . 1 1 33 33 GLY N N 33 115.870 115.870 114.757 1.113 18832
6020 1 20 . 1 1 33 33 GLY CA C 33 44.500 44.500 44.880 -0.380 18832
6021 1 20 . 1 1 33 33 GLY H H 33 8.775 8.775 8.999 -0.224 18832
6022 1 20 . 1 1 34 34 ASP N N 34 122.430 122.430 123.151 -0.721 18832
6023 1 20 . 1 1 34 34 ASP HA H 34 4.634 4.634 4.874 -0.240 18832
6024 1 20 . 1 1 34 34 ASP CA C 34 55.860 55.860 54.235 1.625 18832
6025 1 20 . 1 1 34 34 ASP CB C 34 41.310 41.310 41.904 -0.594 18832
6026 1 20 . 1 1 34 34 ASP H H 34 8.686 8.686 7.809 0.877 18832
6027 1 20 . 1 1 35 35 THR N N 35 117.980 117.980 119.510 -1.530 18832
6028 1 20 . 1 1 35 35 THR HA H 35 5.154 5.154 4.706 0.448 18832
6029 1 20 . 1 1 35 35 THR CA C 35 61.450 61.450 62.086 -0.636 18832
6030 1 20 . 1 1 35 35 THR CB C 35 69.090 69.090 69.266 -0.176 18832
6031 1 20 . 1 1 35 35 THR H H 35 8.392 8.392 8.605 -0.213 18832
6032 1 20 . 1 1 36 36 VAL N N 36 118.200 118.200 121.361 -3.161 18832
6033 1 20 . 1 1 36 36 VAL HA H 36 5.152 5.152 4.593 0.559 18832
6034 1 20 . 1 1 36 36 VAL CA C 36 57.910 57.910 59.432 -1.522 18832
6035 1 20 . 1 1 36 36 VAL CB C 36 34.190 34.190 33.788 0.402 18832
6036 1 20 . 1 1 36 36 VAL H H 36 9.016 9.016 9.014 0.002 18832
6037 1 20 . 1 1 37 37 HIS N N 37 122.190 122.190 125.774 -3.584 18832
6038 1 20 . 1 1 37 37 HIS HA H 37 4.811 4.811 4.899 -0.088 18832
6039 1 20 . 1 1 37 37 HIS CA C 37 52.560 52.560 53.403 -0.843 18832
6040 1 20 . 1 1 37 37 HIS CB C 37 31.260 31.260 30.571 0.689 18832
6041 1 20 . 1 1 37 37 HIS H H 37 8.491 8.491 8.766 -0.275 18832
6042 1 20 . 1 1 38 38 ILE N N 38 126.650 126.650 127.567 -0.917 18832
6043 1 20 . 1 1 38 38 ILE HA H 38 3.750 3.750 4.156 -0.406 18832
6044 1 20 . 1 1 38 38 ILE CA C 38 61.640 61.640 62.677 -1.037 18832
6045 1 20 . 1 1 38 38 ILE CB C 38 38.880 38.880 37.908 0.972 18832
6046 1 20 . 1 1 38 38 ILE H H 38 8.638 8.638 8.711 -0.073 18832
6047 1 20 . 1 1 39 39 LEU N N 39 126.180 126.180 124.050 2.130 18832
6048 1 20 . 1 1 39 39 LEU HA H 39 4.380 4.380 4.909 -0.529 18832
6049 1 20 . 1 1 39 39 LEU CA C 39 55.490 55.490 54.899 0.591 18832
6050 1 20 . 1 1 39 39 LEU CB C 39 43.750 43.750 43.474 0.276 18832
6051 1 20 . 1 1 39 39 LEU H H 39 9.163 9.163 8.889 0.274 18832
6052 1 20 . 1 1 40 40 GLU N N 40 115.160 115.160 117.789 -2.629 18832
6053 1 20 . 1 1 40 40 GLU HA H 40 5.020 5.020 4.983 0.037 18832
6054 1 20 . 1 1 40 40 GLU CA C 40 55.090 55.090 55.289 -0.200 18832
6055 1 20 . 1 1 40 40 GLU CB C 40 35.730 35.730 34.027 1.703 18832
6056 1 20 . 1 1 40 40 GLU H H 40 7.852 7.852 7.737 0.115 18832
6057 1 20 . 1 1 41 41 THR HA H 41 4.270 4.270 4.531 -0.261 18832
6058 1 20 . 1 1 41 41 THR CA C 41 61.250 61.250 59.642 1.608 18832
6059 1 20 . 1 1 41 41 THR CB C 41 71.410 71.410 70.171 1.239 18832
6060 1 20 . 1 1 42 42 TYR HA H 42 4.550 4.550 4.403 0.147 18832
6061 1 20 . 1 1 43 43 GLU N N 43 124.100 124.100 119.628 4.472 18832
6062 1 20 . 1 1 43 43 GLU HA H 43 3.740 3.740 4.571 -0.831 18832
6063 1 20 . 1 1 43 43 GLU H H 43 8.590 8.590 8.347 0.243 18832
6064 1 20 . 1 1 44 44 GLY N N 44 110.789 110.789 110.055 0.734 18832
6065 1 20 . 1 1 44 44 GLY CA C 44 45.440 45.440 45.424 0.016 18832
6066 1 20 . 1 1 44 44 GLY H H 44 8.432 8.432 8.709 -0.277 18832
6067 1 20 . 1 1 45 45 TRP HA H 45 4.690 4.690 4.722 -0.032 18832
6068 1 20 . 1 1 45 45 TRP CA C 45 57.550 57.550 55.958 1.592 18832
6069 1 20 . 1 1 46 46 TYR HA H 46 5.600 5.600 4.778 0.822 18832
6070 1 20 . 1 1 46 46 TYR CA C 46 54.060 54.060 54.493 -0.433 18832
6071 1 20 . 1 1 46 46 TYR CB C 46 42.650 42.650 41.713 0.937 18832
6072 1 20 . 1 1 47 47 ARG N N 47 118.100 118.100 121.020 -2.920 18832
6073 1 20 . 1 1 47 47 ARG HA H 47 5.094 5.094 5.056 0.038 18832
6074 1 20 . 1 1 47 47 ARG CA C 47 54.060 54.060 54.102 -0.042 18832
6075 1 20 . 1 1 47 47 ARG CB C 47 33.250 33.250 34.322 -1.072 18832
6076 1 20 . 1 1 47 47 ARG H H 47 8.492 8.492 8.327 0.165 18832
6077 1 20 . 1 1 48 48 GLY N N 48 114.000 114.000 111.791 2.209 18832
6078 1 20 . 1 1 48 48 GLY CA C 48 46.560 46.560 45.943 0.617 18832
6079 1 20 . 1 1 48 48 GLY H H 48 9.183 9.183 8.848 0.335 18832
6080 1 20 . 1 1 49 49 TYR N N 49 116.100 116.100 115.195 0.905 18832
6081 1 20 . 1 1 49 49 TYR HA H 49 5.373 5.373 5.301 0.072 18832
6082 1 20 . 1 1 49 49 TYR CA C 49 55.110 55.110 55.806 -0.696 18832
6083 1 20 . 1 1 49 49 TYR CB C 49 40.750 40.750 41.227 -0.477 18832
6084 1 20 . 1 1 49 49 TYR H H 49 8.194 8.194 8.111 0.083 18832
6085 1 20 . 1 1 50 50 THR N N 50 112.350 112.350 114.792 -2.442 18832
6086 1 20 . 1 1 50 50 THR HA H 50 5.105 5.105 4.752 0.353 18832
6087 1 20 . 1 1 50 50 THR CA C 50 59.770 59.770 60.845 -1.075 18832
6088 1 20 . 1 1 50 50 THR CB C 50 69.460 69.460 70.242 -0.782 18832
6089 1 20 . 1 1 50 50 THR H H 50 9.441 9.441 8.863 0.578 18832
6090 1 20 . 1 1 51 51 LEU N N 51 121.260 121.260 121.446 -0.186 18832
6091 1 20 . 1 1 51 51 LEU HA H 51 4.236 4.236 4.113 0.123 18832
6092 1 20 . 1 1 51 51 LEU CA C 51 56.790 56.790 56.485 0.305 18832
6093 1 20 . 1 1 51 51 LEU CB C 51 40.000 40.000 41.265 -1.265 18832
6094 1 20 . 1 1 51 51 LEU H H 51 8.310 8.310 8.334 -0.024 18832
6095 1 20 . 1 1 52 52 ARG N N 52 116.570 116.570 117.461 -0.891 18832
6096 1 20 . 1 1 52 52 ARG HA H 52 4.250 4.250 4.155 0.095 18832
6097 1 20 . 1 1 52 52 ARG CA C 52 57.350 57.350 58.420 -1.070 18832
6098 1 20 . 1 1 52 52 ARG CB C 52 30.510 30.510 30.611 -0.101 18832
6099 1 20 . 1 1 52 52 ARG H H 52 8.047 8.047 8.269 -0.222 18832
6100 1 20 . 1 1 53 53 LYS N N 53 122.660 122.660 119.691 2.969 18832
6101 1 20 . 1 1 53 53 LYS HA H 53 4.616 4.616 4.623 -0.007 18832
6102 1 20 . 1 1 53 53 LYS CA C 53 54.620 54.620 55.447 -0.827 18832
6103 1 20 . 1 1 53 53 LYS CB C 53 32.860 32.860 32.293 0.567 18832
6104 1 20 . 1 1 53 53 LYS H H 53 7.649 7.649 7.650 -0.001 18832
6105 1 20 . 1 1 54 54 LYS N N 54 125.010 125.010 124.009 1.001 18832
6106 1 20 . 1 1 54 54 LYS HA H 54 4.090 4.090 4.148 -0.058 18832
6107 1 20 . 1 1 54 54 LYS CA C 54 58.470 58.470 59.472 -1.002 18832
6108 1 20 . 1 1 54 54 LYS CB C 54 32.130 32.130 32.640 -0.510 18832
6109 1 20 . 1 1 54 54 LYS H H 54 8.496 8.496 8.600 -0.104 18832
6110 1 20 . 1 1 55 55 SER N N 55 110.240 110.240 114.068 -3.828 18832
6111 1 20 . 1 1 55 55 SER HA H 55 4.122 4.122 4.186 -0.064 18832
6112 1 20 . 1 1 55 55 SER CA C 55 58.960 58.960 60.099 -1.139 18832
6113 1 20 . 1 1 55 55 SER CB C 55 63.310 63.310 62.887 0.423 18832
6114 1 20 . 1 1 55 55 SER H H 55 7.857 7.857 8.336 -0.479 18832
6115 1 20 . 1 1 56 56 LYS N N 56 124.070 124.070 122.297 1.773 18832
6116 1 20 . 1 1 56 56 LYS HA H 56 4.668 4.668 4.347 0.321 18832
6117 1 20 . 1 1 56 56 LYS CA C 56 54.810 54.810 55.991 -1.181 18832
6118 1 20 . 1 1 56 56 LYS CB C 56 33.250 33.250 33.041 0.209 18832
6119 1 20 . 1 1 56 56 LYS H H 56 7.473 7.473 7.852 -0.379 18832
6120 1 20 . 1 1 57 57 LYS N N 57 125.940 125.940 123.609 2.331 18832
6121 1 20 . 1 1 57 57 LYS HA H 57 5.341 5.341 5.083 0.258 18832
6122 1 20 . 1 1 57 57 LYS CA C 57 54.620 54.620 54.663 -0.043 18832
6123 1 20 . 1 1 57 57 LYS CB C 57 34.240 34.240 36.305 -2.065 18832
6124 1 20 . 1 1 57 57 LYS H H 57 8.474 8.474 8.279 0.195 18832
6125 1 20 . 1 1 58 58 GLY N N 58 109.540 109.540 108.586 0.954 18832
6126 1 20 . 1 1 58 58 GLY CA C 58 45.620 45.620 45.190 0.430 18832
6127 1 20 . 1 1 58 58 GLY H H 58 9.075 9.075 8.504 0.571 18832
6128 1 20 . 1 1 59 59 ILE N N 59 113.900 113.900 115.522 -1.622 18832
6129 1 20 . 1 1 59 59 ILE HA H 59 6.000 6.000 5.069 0.931 18832
6130 1 20 . 1 1 59 59 ILE CA C 59 59.590 59.590 58.457 1.133 18832
6131 1 20 . 1 1 59 59 ILE CB C 59 41.140 41.140 40.637 0.503 18832
6132 1 20 . 1 1 59 59 ILE H H 59 8.628 8.628 8.088 0.540 18832
6133 1 20 . 1 1 60 60 PHE N N 60 117.040 117.040 117.386 -0.346 18832
6134 1 20 . 1 1 60 60 PHE HA H 60 5.120 5.120 5.344 -0.224 18832
6135 1 20 . 1 1 60 60 PHE CA C 60 54.060 54.060 54.620 -0.560 18832
6136 1 20 . 1 1 60 60 PHE CB C 60 37.190 37.190 39.164 -1.974 18832
6137 1 20 . 1 1 60 60 PHE H H 60 8.724 8.724 8.590 0.134 18832
6138 1 20 . 1 1 61 61 PRO HA H 61 3.480 3.480 4.469 -0.989 18832
6139 1 20 . 1 1 61 61 PRO CA C 61 62.200 62.200 62.725 -0.525 18832
6140 1 20 . 1 1 61 61 PRO CB C 61 31.190 31.190 32.395 -1.205 18832
6141 1 20 . 1 1 62 62 ALA N N 62 124.770 124.770 127.135 -2.365 18832
6142 1 20 . 1 1 62 62 ALA HA H 62 3.710 3.710 4.030 -0.320 18832
6143 1 20 . 1 1 62 62 ALA CA C 62 54.370 54.370 54.658 -0.288 18832
6144 1 20 . 1 1 62 62 ALA CB C 62 17.650 17.650 18.385 -0.735 18832
6145 1 20 . 1 1 62 62 ALA H H 62 7.898 7.898 8.192 -0.294 18832
6146 1 20 . 1 1 63 63 SER N N 63 109.700 109.700 112.134 -2.434 18832
6147 1 20 . 1 1 63 63 SER HA H 63 4.200 4.200 4.105 0.095 18832
6148 1 20 . 1 1 63 63 SER CA C 63 59.400 59.400 60.183 -0.783 18832
6149 1 20 . 1 1 63 63 SER CB C 63 62.380 62.380 62.621 -0.241 18832
6150 1 20 . 1 1 63 63 SER H H 63 8.030 8.030 8.226 -0.196 18832
6151 1 20 . 1 1 64 64 TYR N N 64 120.300 120.300 119.651 0.649 18832
6152 1 20 . 1 1 64 64 TYR HA H 64 4.250 4.250 4.320 -0.070 18832
6153 1 20 . 1 1 64 64 TYR CA C 64 57.720 57.720 56.733 0.987 18832
6154 1 20 . 1 1 64 64 TYR CB C 64 37.560 37.560 37.396 0.164 18832
6155 1 20 . 1 1 64 64 TYR H H 64 7.128 7.128 6.970 0.158 18832
6156 1 20 . 1 1 65 65 ILE N N 65 118.000 118.000 117.918 0.082 18832
6157 1 20 . 1 1 65 65 ILE HA H 65 4.810 4.810 4.527 0.283 18832
6158 1 20 . 1 1 65 65 ILE CA C 65 56.980 56.980 59.016 -2.036 18832
6159 1 20 . 1 1 65 65 ILE CB C 65 39.630 39.630 42.417 -2.788 18832
6160 1 20 . 1 1 65 65 ILE H H 65 7.671 7.671 7.448 0.223 18832
6161 1 20 . 1 1 66 66 HIS N N 66 124.300 124.300 122.767 1.533 18832
6162 1 20 . 1 1 66 66 HIS HA H 66 5.130 5.130 4.873 0.257 18832
6163 1 20 . 1 1 66 66 HIS CA C 66 53.060 53.060 54.985 -1.925 18832
6164 1 20 . 1 1 66 66 HIS CB C 66 30.510 30.510 33.105 -2.595 18832
6165 1 20 . 1 1 66 66 HIS H H 66 9.159 9.159 8.863 0.296 18832
6166 1 20 . 1 1 67 67 LEU N N 67 127.580 127.580 127.362 0.218 18832
6167 1 20 . 1 1 67 67 LEU HA H 67 4.570 4.570 4.265 0.305 18832
6168 1 20 . 1 1 67 67 LEU CA C 67 55.300 55.300 55.767 -0.467 18832
6169 1 20 . 1 1 67 67 LEU CB C 67 42.060 42.060 41.115 0.945 18832
6170 1 20 . 1 1 67 67 LEU H H 67 8.992 8.992 8.527 0.465 18832
6171 1 20 . 1 1 68 68 LYS N N 68 121.900 121.900 125.653 -3.753 18832
6172 1 20 . 1 1 68 68 LYS HA H 68 4.490 4.490 4.666 -0.176 18832
6173 1 20 . 1 1 68 68 LYS CA C 68 55.110 55.110 54.925 0.185 18832
6174 1 20 . 1 1 68 68 LYS CB C 68 34.610 34.610 34.145 0.465 18832
6175 1 20 . 1 1 68 68 LYS H H 68 8.499 8.499 7.979 0.520 18832
6176 1 20 . 1 1 69 69 GLU N N 69 122.190 122.190 119.078 3.112 18832
6177 1 20 . 1 1 69 69 GLU HA H 69 4.280 4.280 4.245 0.035 18832
6178 1 20 . 1 1 69 69 GLU CA C 69 56.610 56.610 57.031 -0.421 18832
6179 1 20 . 1 1 69 69 GLU CB C 69 30.330 30.330 30.223 0.107 18832
6180 1 20 . 1 1 69 69 GLU H H 69 8.569 8.569 8.759 -0.190 18832
6181 1 20 . 1 1 70 70 ALA N N 70 123.370 123.370 121.466 1.904 18832
6182 1 20 . 1 1 70 70 ALA HA H 70 4.200 4.200 4.068 0.132 18832
6183 1 20 . 1 1 70 70 ALA CA C 70 51.810 51.810 52.409 -0.599 18832
6184 1 20 . 1 1 70 70 ALA CB C 70 19.700 19.700 17.984 1.716 18832
6185 1 20 . 1 1 70 70 ALA H H 70 8.181 8.181 8.014 0.167 18832
6186 1 20 . 1 1 71 71 ILE N N 71 120.080 120.080 118.279 1.801 18832
6187 1 20 . 1 1 71 71 ILE HA H 71 4.070 4.070 3.801 0.269 18832
6188 1 20 . 1 1 71 71 ILE CA C 71 60.330 60.330 61.780 -1.450 18832
6189 1 20 . 1 1 71 71 ILE CB C 71 38.690 38.690 37.797 0.893 18832
6190 1 20 . 1 1 71 71 ILE H H 71 7.776 7.776 8.410 -0.634 18832
6191 1 20 . 1 1 72 72 VAL N N 72 124.540 124.540 126.766 -2.226 18832
6192 1 20 . 1 1 72 72 VAL HA H 72 4.070 4.070 4.291 -0.221 18832
6193 1 20 . 1 1 72 72 VAL CA C 72 61.640 61.640 61.492 0.148 18832
6194 1 20 . 1 1 72 72 VAL CB C 72 32.690 32.690 31.643 1.047 18832
6195 1 20 . 1 1 72 72 VAL H H 72 8.089 8.089 8.203 -0.114 18832
6196 1 20 . 1 1 73 73 GLU N N 73 125.940 125.940 123.768 2.172 18832
6197 1 20 . 1 1 73 73 GLU HA H 73 4.280 4.280 4.013 0.267 18832
6198 1 20 . 1 1 73 73 GLU CA C 73 56.610 56.610 56.218 0.392 18832
6199 1 20 . 1 1 73 73 GLU CB C 73 30.710 30.710 30.035 0.675 18832
6200 1 20 . 1 1 73 73 GLU H H 73 8.464 8.464 8.719 -0.255 18832
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 58 2.790 -0.112 2.812 18832
2 1 1 "Average Difference" HA 77 0.424 -0.002 0.427 18832
3 1 1 "Average Difference" C 0 0.000 0.000 0.000 18832
4 1 1 "Average Difference" CA 67 1.082 0.233 1.065 18832
5 1 1 "Average Difference" CB 62 1.106 0.077 1.112 18832
6 1 1 "Average Difference" HN 58 0.461 -0.102 0.453 18832
7 1 2 "Average Difference" N 58 2.831 0.203 2.848 18832
8 1 2 "Average Difference" HA 77 0.432 0.025 0.434 18832
9 1 2 "Average Difference" C 0 0.000 0.000 0.000 18832
10 1 2 "Average Difference" CA 67 1.161 0.212 1.150 18832
11 1 2 "Average Difference" CB 62 1.322 0.052 1.332 18832
12 1 2 "Average Difference" HN 58 0.460 -0.097 0.454 18832
13 1 3 "Average Difference" N 58 2.794 0.039 2.818 18832
14 1 3 "Average Difference" HA 77 0.419 -0.001 0.422 18832
15 1 3 "Average Difference" C 0 0.000 0.000 0.000 18832
16 1 3 "Average Difference" CA 67 1.113 0.212 1.100 18832
17 1 3 "Average Difference" CB 62 1.118 0.085 1.124 18832
18 1 3 "Average Difference" HN 58 0.395 -0.094 0.387 18832
19 1 4 "Average Difference" N 58 2.878 -0.167 2.898 18832
20 1 4 "Average Difference" HA 77 0.437 -0.038 0.438 18832
21 1 4 "Average Difference" C 0 0.000 0.000 0.000 18832
22 1 4 "Average Difference" CA 67 1.219 0.326 1.183 18832
23 1 4 "Average Difference" CB 62 1.240 0.042 1.249 18832
24 1 4 "Average Difference" HN 58 0.451 -0.127 0.436 18832
25 1 5 "Average Difference" N 58 2.413 -0.130 2.430 18832
26 1 5 "Average Difference" HA 77 0.423 0.019 0.425 18832
27 1 5 "Average Difference" C 0 0.000 0.000 0.000 18832
28 1 5 "Average Difference" CA 67 1.119 0.282 1.091 18832
29 1 5 "Average Difference" CB 62 1.342 -0.002 1.353 18832
30 1 5 "Average Difference" HN 58 0.487 -0.083 0.485 18832
31 1 6 "Average Difference" N 58 2.845 -0.160 2.865 18832
32 1 6 "Average Difference" HA 77 0.418 -0.015 0.420 18832
33 1 6 "Average Difference" C 0 0.000 0.000 0.000 18832
34 1 6 "Average Difference" CA 67 1.105 0.168 1.100 18832
35 1 6 "Average Difference" CB 62 1.235 -0.021 1.245 18832
36 1 6 "Average Difference" HN 58 0.475 -0.064 0.475 18832
37 1 7 "Average Difference" N 58 2.608 -0.239 2.620 18832
38 1 7 "Average Difference" HA 77 0.428 0.003 0.431 18832
39 1 7 "Average Difference" C 0 0.000 0.000 0.000 18832
40 1 7 "Average Difference" CA 67 1.072 0.279 1.043 18832
41 1 7 "Average Difference" CB 62 1.196 0.130 1.199 18832
42 1 7 "Average Difference" HN 58 0.463 -0.140 0.445 18832
43 1 8 "Average Difference" N 58 2.833 0.158 2.853 18832
44 1 8 "Average Difference" HA 77 0.423 -0.023 0.425 18832
45 1 8 "Average Difference" C 0 0.000 0.000 0.000 18832
46 1 8 "Average Difference" CA 67 1.141 0.263 1.118 18832
47 1 8 "Average Difference" CB 62 1.266 0.018 1.276 18832
48 1 8 "Average Difference" HN 58 0.428 -0.064 0.427 18832
49 1 9 "Average Difference" N 58 2.569 0.037 2.591 18832
50 1 9 "Average Difference" HA 77 0.395 -0.030 0.396 18832
51 1 9 "Average Difference" C 0 0.000 0.000 0.000 18832
52 1 9 "Average Difference" CA 67 1.097 0.330 1.054 18832
53 1 9 "Average Difference" CB 62 1.347 -0.051 1.357 18832
54 1 9 "Average Difference" HN 58 0.452 -0.079 0.449 18832
55 1 10 "Average Difference" N 58 2.871 0.271 2.883 18832
56 1 10 "Average Difference" HA 77 0.423 0.004 0.425 18832
57 1 10 "Average Difference" C 0 0.000 0.000 0.000 18832
58 1 10 "Average Difference" CA 67 1.154 0.313 1.119 18832
59 1 10 "Average Difference" CB 62 1.213 -0.005 1.222 18832
60 1 10 "Average Difference" HN 58 0.441 -0.090 0.436 18832
61 1 11 "Average Difference" N 58 2.633 0.079 2.654 18832
62 1 11 "Average Difference" HA 77 0.414 -0.014 0.417 18832
63 1 11 "Average Difference" C 0 0.000 0.000 0.000 18832
64 1 11 "Average Difference" CA 67 1.107 0.302 1.073 18832
65 1 11 "Average Difference" CB 62 1.156 0.130 1.158 18832
66 1 11 "Average Difference" HN 58 0.446 -0.072 0.444 18832
67 1 12 "Average Difference" N 58 2.940 0.511 2.921 18832
68 1 12 "Average Difference" HA 77 0.422 -0.035 0.423 18832
69 1 12 "Average Difference" C 0 0.000 0.000 0.000 18832
70 1 12 "Average Difference" CA 67 1.066 0.185 1.057 18832
71 1 12 "Average Difference" CB 62 1.277 -0.070 1.285 18832
72 1 12 "Average Difference" HN 58 0.460 -0.078 0.457 18832
73 1 13 "Average Difference" N 58 3.125 -0.127 3.150 18832
74 1 13 "Average Difference" HA 77 0.412 -0.032 0.414 18832
75 1 13 "Average Difference" C 0 0.000 0.000 0.000 18832
76 1 13 "Average Difference" CA 67 1.199 0.259 1.179 18832
77 1 13 "Average Difference" CB 62 1.213 0.121 1.216 18832
78 1 13 "Average Difference" HN 58 0.421 -0.085 0.416 18832
79 1 14 "Average Difference" N 58 2.653 -0.112 2.674 18832
80 1 14 "Average Difference" HA 77 0.430 0.008 0.433 18832
81 1 14 "Average Difference" C 0 0.000 0.000 0.000 18832
82 1 14 "Average Difference" CA 67 1.061 0.170 1.055 18832
83 1 14 "Average Difference" CB 62 1.208 0.028 1.218 18832
84 1 14 "Average Difference" HN 58 0.458 -0.072 0.456 18832
85 1 15 "Average Difference" N 58 2.716 0.151 2.735 18832
86 1 15 "Average Difference" HA 77 0.403 -0.010 0.406 18832
87 1 15 "Average Difference" C 0 0.000 0.000 0.000 18832
88 1 15 "Average Difference" CA 67 1.088 0.259 1.064 18832
89 1 15 "Average Difference" CB 62 1.109 -0.038 1.118 18832
90 1 15 "Average Difference" HN 58 0.469 -0.092 0.464 18832
91 1 16 "Average Difference" N 58 3.064 -0.319 3.074 18832
92 1 16 "Average Difference" HA 77 0.418 0.002 0.421 18832
93 1 16 "Average Difference" C 0 0.000 0.000 0.000 18832
94 1 16 "Average Difference" CA 67 1.203 0.343 1.162 18832
95 1 16 "Average Difference" CB 62 1.186 0.063 1.194 18832
96 1 16 "Average Difference" HN 58 0.441 -0.094 0.435 18832
97 1 17 "Average Difference" N 58 2.809 -0.266 2.821 18832
98 1 17 "Average Difference" HA 77 0.444 -0.023 0.446 18832
99 1 17 "Average Difference" C 0 0.000 0.000 0.000 18832
100 1 17 "Average Difference" CA 67 1.145 0.213 1.134 18832
101 1 17 "Average Difference" CB 62 1.206 0.010 1.216 18832
102 1 17 "Average Difference" HN 58 0.436 -0.128 0.420 18832
103 1 18 "Average Difference" N 58 2.611 0.261 2.620 18832
104 1 18 "Average Difference" HA 77 0.452 -0.025 0.454 18832
105 1 18 "Average Difference" C 0 0.000 0.000 0.000 18832
106 1 18 "Average Difference" CA 67 1.084 0.290 1.052 18832
107 1 18 "Average Difference" CB 62 1.140 -0.078 1.146 18832
108 1 18 "Average Difference" HN 58 0.479 -0.071 0.478 18832
109 1 19 "Average Difference" N 58 2.869 0.306 2.877 18832
110 1 19 "Average Difference" HA 77 0.413 -0.033 0.414 18832
111 1 19 "Average Difference" C 0 0.000 0.000 0.000 18832
112 1 19 "Average Difference" CA 67 1.282 0.281 1.260 18832
113 1 19 "Average Difference" CB 62 1.252 0.031 1.262 18832
114 1 19 "Average Difference" HN 58 0.392 -0.083 0.387 18832
115 1 20 "Average Difference" N 58 2.320 0.216 2.330 18832
116 1 20 "Average Difference" HA 77 0.407 -0.034 0.408 18832
117 1 20 "Average Difference" C 0 0.000 0.000 0.000 18832
118 1 20 "Average Difference" CA 67 1.012 0.343 0.959 18832
119 1 20 "Average Difference" CB 62 1.166 -0.046 1.175 18832
120 1 20 "Average Difference" HN 58 0.437 -0.090 0.431 18832
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 18832
_Entity_delta_chem_shifts.ID 2
_Entity_delta_chem_shifts.Details
;
This saveframe contains the averaged SPARTA chemical shift over all the models used.
;
loop_
_Delta_CS.Atom_chem_shift_ID
_Delta_CS.Entity_delta_chem_shifts_ID
_Delta_CS.Assembly_atom_ID
_Delta_CS.Entity_assembly_ID
_Delta_CS.Entity_ID
_Delta_CS.Comp_index_ID
_Delta_CS.Seq_ID
_Delta_CS.Comp_ID
_Delta_CS.Atom_ID
_Delta_CS.Atom_type
_Delta_CS.Auth_seq_ID
_Delta_CS.Original_CS_value
_Delta_CS.Corrected_CS_value
_Delta_CS.Sparta_CS_value
_Delta_CS.Delta_CS_value
_Delta_CS.Entry_ID
1 1 . 1 1 2 2 THR N N 2 116.400 116.400 115.433 0.967 18832
2 1 . 1 1 2 2 THR HA H 2 4.120 4.120 4.495 -0.375 18832
3 1 . 1 1 2 2 THR CA C 2 62.100 62.100 62.145 -0.045 18832
4 1 . 1 1 2 2 THR CB C 2 69.440 69.440 69.445 -0.005 18832
5 1 . 1 1 2 2 THR H H 2 8.150 8.150 8.233 -0.083 18832
6 1 . 1 1 3 3 ARG HA H 3 4.310 4.310 4.498 -0.188 18832
7 1 . 1 1 3 3 ARG CA C 3 55.750 55.750 55.998 -0.248 18832
8 1 . 1 1 3 3 ARG CB C 3 30.620 30.620 30.812 -0.192 18832
9 1 . 1 1 4 4 TRP N N 4 123.300 123.300 122.472 0.828 18832
10 1 . 1 1 4 4 TRP HA H 4 4.480 4.480 4.671 -0.191 18832
11 1 . 1 1 4 4 TRP CA C 4 57.560 57.560 56.872 0.688 18832
12 1 . 1 1 4 4 TRP CB C 4 29.490 29.490 30.257 -0.767 18832
13 1 . 1 1 4 4 TRP H H 4 8.108 8.108 8.233 -0.125 18832
14 1 . 1 1 5 5 VAL HA H 5 4.570 4.570 4.340 0.230 18832
15 1 . 1 1 5 5 VAL CB C 5 30.840 30.840 32.775 -1.935 18832
16 1 . 1 1 6 6 PRO HA H 6 4.810 4.810 4.702 0.108 18832
17 1 . 1 1 6 6 PRO CB C 6 32.210 32.210 31.844 0.366 18832
18 1 . 1 1 7 7 THR HA H 7 4.270 4.270 4.005 0.265 18832
19 1 . 1 1 7 7 THR CA C 7 60.890 60.890 62.554 -1.664 18832
20 1 . 1 1 7 7 THR CB C 7 70.140 70.140 68.694 1.446 18832
21 1 . 1 1 8 8 LYS HA H 8 4.440 4.440 4.338 0.102 18832
22 1 . 1 1 8 8 LYS CA C 8 55.980 55.980 55.901 0.079 18832
23 1 . 1 1 8 8 LYS CB C 8 35.050 35.050 33.082 1.968 18832
24 1 . 1 1 10 10 GLU HA H 10 4.580 4.580 4.299 0.281 18832
25 1 . 1 1 10 10 GLU CA C 10 55.570 55.570 56.215 -0.645 18832
26 1 . 1 1 10 10 GLU CB C 10 30.780 30.780 30.677 0.103 18832
27 1 . 1 1 11 11 GLU N N 11 122.500 122.500 120.572 1.928 18832
28 1 . 1 1 11 11 GLU HA H 11 4.340 4.340 4.231 0.109 18832
29 1 . 1 1 11 11 GLU CA C 11 57.140 57.140 57.456 -0.316 18832
30 1 . 1 1 11 11 GLU CB C 11 29.400 29.400 29.845 -0.446 18832
31 1 . 1 1 11 11 GLU H H 11 8.271 8.271 8.615 -0.344 18832
32 1 . 1 1 12 12 LYS HA H 12 4.380 4.380 4.172 0.208 18832
33 1 . 1 1 12 12 LYS CA C 12 55.790 55.790 56.467 -0.677 18832
34 1 . 1 1 12 12 LYS CB C 12 33.600 33.600 34.194 -0.594 18832
35 1 . 1 1 13 13 TYR HA H 13 5.560 5.560 4.734 0.826 18832
36 1 . 1 1 13 13 TYR CA C 13 55.860 55.860 55.674 0.186 18832
37 1 . 1 1 13 13 TYR CB C 13 42.440 42.440 40.132 2.308 18832
38 1 . 1 1 14 14 GLY N N 14 105.320 105.320 106.431 -1.111 18832
39 1 . 1 1 14 14 GLY CA C 14 45.240 45.240 44.312 0.928 18832
40 1 . 1 1 14 14 GLY H H 14 8.401 8.401 8.781 -0.380 18832
41 1 . 1 1 15 15 VAL N N 15 118.900 118.900 118.838 0.062 18832
42 1 . 1 1 15 15 VAL HA H 15 5.341 5.341 4.625 0.716 18832
43 1 . 1 1 15 15 VAL CA C 15 59.210 59.210 60.699 -1.489 18832
44 1 . 1 1 15 15 VAL CB C 15 35.740 35.740 35.476 0.264 18832
45 1 . 1 1 15 15 VAL H H 15 8.851 8.851 8.767 0.084 18832
46 1 . 1 1 16 16 ALA N N 16 129.460 129.460 126.535 2.925 18832
47 1 . 1 1 16 16 ALA HA H 16 5.000 5.000 5.203 -0.203 18832
48 1 . 1 1 16 16 ALA CA C 16 52.000 52.000 50.106 1.894 18832
49 1 . 1 1 16 16 ALA CB C 16 19.330 19.330 21.084 -1.754 18832
50 1 . 1 1 16 16 ALA H H 16 9.113 9.113 8.544 0.569 18832
51 1 . 1 1 17 17 PHE N N 17 124.070 124.070 121.237 2.833 18832
52 1 . 1 1 17 17 PHE HA H 17 4.801 4.801 4.981 -0.180 18832
53 1 . 1 1 17 17 PHE CA C 17 56.230 56.230 55.966 0.264 18832
54 1 . 1 1 17 17 PHE CB C 17 40.000 40.000 38.595 1.405 18832
55 1 . 1 1 17 17 PHE H H 17 8.787 8.787 7.771 1.016 18832
56 1 . 1 1 18 18 TYR N N 18 118.210 118.210 123.324 -5.114 18832
57 1 . 1 1 18 18 TYR HA H 18 4.483 4.483 4.379 0.104 18832
58 1 . 1 1 18 18 TYR CA C 18 55.300 55.300 57.470 -2.170 18832
59 1 . 1 1 18 18 TYR CB C 18 42.810 42.810 42.275 0.535 18832
60 1 . 1 1 18 18 TYR H H 18 7.281 7.281 7.656 -0.375 18832
61 1 . 1 1 19 19 ASN N N 19 116.800 116.800 119.511 -2.711 18832
62 1 . 1 1 19 19 ASN HA H 19 4.710 4.710 4.826 -0.116 18832
63 1 . 1 1 19 19 ASN CA C 19 52.940 52.940 52.716 0.224 18832
64 1 . 1 1 19 19 ASN CB C 19 39.060 39.060 38.540 0.520 18832
65 1 . 1 1 19 19 ASN H H 19 8.134 8.134 8.124 0.010 18832
66 1 . 1 1 20 20 TYR N N 20 122.190 122.190 122.565 -0.375 18832
67 1 . 1 1 20 20 TYR HA H 20 4.687 4.687 4.580 0.107 18832
68 1 . 1 1 20 20 TYR CA C 20 57.720 57.720 58.176 -0.456 18832
69 1 . 1 1 20 20 TYR CB C 20 42.250 42.250 40.258 1.992 18832
70 1 . 1 1 20 20 TYR H H 20 8.993 8.993 8.017 0.976 18832
71 1 . 1 1 21 21 ASP N N 21 128.520 128.520 126.662 1.858 18832
72 1 . 1 1 21 21 ASP HA H 21 4.790 4.790 4.769 0.021 18832
73 1 . 1 1 21 21 ASP CA C 21 52.370 52.370 52.501 -0.131 18832
74 1 . 1 1 21 21 ASP CB C 21 41.130 41.130 42.899 -1.769 18832
75 1 . 1 1 21 21 ASP H H 21 7.838 7.838 8.253 -0.416 18832
76 1 . 1 1 22 22 ALA N N 22 125.240 125.240 125.380 -0.140 18832
77 1 . 1 1 22 22 ALA HA H 22 4.051 4.051 4.339 -0.288 18832
78 1 . 1 1 22 22 ALA CA C 22 52.940 52.940 52.727 0.212 18832
79 1 . 1 1 22 22 ALA CB C 22 20.450 20.450 19.762 0.688 18832
80 1 . 1 1 22 22 ALA H H 22 8.103 8.103 8.421 -0.318 18832
81 1 . 1 1 23 23 ARG N N 23 122.190 122.190 122.234 -0.044 18832
82 1 . 1 1 23 23 ARG HA H 23 4.346 4.346 4.433 -0.087 18832
83 1 . 1 1 23 23 ARG CA C 23 55.490 55.490 56.122 -0.632 18832
84 1 . 1 1 23 23 ARG CB C 23 30.700 30.700 30.726 -0.026 18832
85 1 . 1 1 23 23 ARG H H 23 8.887 8.887 8.730 0.157 18832
86 1 . 1 1 24 24 GLY N N 24 105.320 105.320 106.114 -0.794 18832
87 1 . 1 1 24 24 GLY CA C 24 44.500 44.500 45.021 -0.521 18832
88 1 . 1 1 24 24 GLY H H 24 7.258 7.258 7.504 -0.245 18832
89 1 . 1 1 25 25 ALA N N 25 122.190 122.190 121.566 0.624 18832
90 1 . 1 1 25 25 ALA HA H 25 4.166 4.166 4.258 -0.092 18832
91 1 . 1 1 25 25 ALA CA C 25 54.440 54.440 53.885 0.554 18832
92 1 . 1 1 25 25 ALA CB C 25 18.770 18.770 19.240 -0.470 18832
93 1 . 1 1 25 25 ALA H H 25 8.627 8.627 8.373 0.254 18832
94 1 . 1 1 26 26 ASP N N 26 114.690 114.690 116.630 -1.940 18832
95 1 . 1 1 26 26 ASP HA H 26 4.700 4.700 4.432 0.268 18832
96 1 . 1 1 26 26 ASP CA C 26 53.870 53.870 56.107 -2.237 18832
97 1 . 1 1 26 26 ASP CB C 26 40.390 40.390 41.055 -0.665 18832
98 1 . 1 1 26 26 ASP H H 26 8.955 8.955 8.591 0.364 18832
99 1 . 1 1 27 27 GLU N N 27 118.910 118.910 116.422 2.488 18832
100 1 . 1 1 27 27 GLU HA H 27 5.202 5.202 4.616 0.586 18832
101 1 . 1 1 27 27 GLU CA C 27 54.930 54.930 55.472 -0.542 18832
102 1 . 1 1 27 27 GLU CB C 27 32.880 32.880 32.600 0.281 18832
103 1 . 1 1 27 27 GLU H H 27 7.537 7.537 7.556 -0.019 18832
104 1 . 1 1 28 28 LEU N N 28 121.490 121.490 120.983 0.507 18832
105 1 . 1 1 28 28 LEU HA H 28 4.756 4.756 4.708 0.048 18832
106 1 . 1 1 28 28 LEU CA C 28 53.120 53.120 53.869 -0.749 18832
107 1 . 1 1 28 28 LEU CB C 28 44.500 44.500 45.131 -0.631 18832
108 1 . 1 1 28 28 LEU H H 28 8.890 8.890 8.496 0.394 18832
109 1 . 1 1 29 29 SER N N 29 115.870 115.870 119.240 -3.370 18832
110 1 . 1 1 29 29 SER HA H 29 5.009 5.009 4.568 0.441 18832
111 1 . 1 1 29 29 SER CA C 29 58.470 58.470 58.743 -0.273 18832
112 1 . 1 1 29 29 SER CB C 29 63.690 63.690 63.687 0.003 18832
113 1 . 1 1 29 29 SER H H 29 7.948 7.948 8.443 -0.495 18832
114 1 . 1 1 30 30 LEU N N 30 121.260 121.260 126.456 -5.196 18832
115 1 . 1 1 30 30 LEU HA H 30 4.776 4.776 4.737 0.039 18832
116 1 . 1 1 30 30 LEU CA C 30 52.940 52.940 54.081 -1.141 18832
117 1 . 1 1 30 30 LEU CB C 30 46.370 46.370 45.121 1.249 18832
118 1 . 1 1 30 30 LEU H H 30 9.500 9.500 8.251 1.249 18832
119 1 . 1 1 31 31 GLN N N 31 123.130 123.130 119.816 3.314 18832
120 1 . 1 1 31 31 GLN HA H 31 5.065 5.065 5.125 -0.060 18832
121 1 . 1 1 31 31 GLN CA C 31 52.940 52.940 53.722 -0.782 18832
122 1 . 1 1 31 31 GLN CB C 31 31.190 31.190 32.879 -1.689 18832
123 1 . 1 1 31 31 GLN H H 31 9.147 9.147 8.451 0.696 18832
124 1 . 1 1 32 32 ILE N N 32 120.790 120.790 120.822 -0.032 18832
125 1 . 1 1 32 32 ILE HA H 32 3.032 3.032 4.100 -1.068 18832
126 1 . 1 1 32 32 ILE CA C 32 64.250 64.250 63.238 1.012 18832
127 1 . 1 1 32 32 ILE CB C 32 37.940 37.940 37.838 0.102 18832
128 1 . 1 1 32 32 ILE H H 32 8.016 8.016 8.397 -0.381 18832
129 1 . 1 1 33 33 GLY N N 33 115.870 115.870 115.210 0.660 18832
130 1 . 1 1 33 33 GLY CA C 33 44.500 44.500 44.792 -0.292 18832
131 1 . 1 1 33 33 GLY H H 33 8.775 8.775 8.969 -0.194 18832
132 1 . 1 1 34 34 ASP N N 34 122.430 122.430 122.270 0.160 18832
133 1 . 1 1 34 34 ASP HA H 34 4.634 4.634 4.942 -0.308 18832
134 1 . 1 1 34 34 ASP CA C 34 55.860 55.860 53.953 1.907 18832
135 1 . 1 1 34 34 ASP CB C 34 41.310 41.310 42.269 -0.959 18832
136 1 . 1 1 34 34 ASP H H 34 8.686 8.686 7.794 0.892 18832
137 1 . 1 1 35 35 THR N N 35 117.980 117.980 117.417 0.564 18832
138 1 . 1 1 35 35 THR HA H 35 5.154 5.154 4.905 0.249 18832
139 1 . 1 1 35 35 THR CA C 35 61.450 61.450 61.962 -0.512 18832
140 1 . 1 1 35 35 THR CB C 35 69.090 69.090 69.962 -0.872 18832
141 1 . 1 1 35 35 THR H H 35 8.392 8.392 8.486 -0.094 18832
142 1 . 1 1 36 36 VAL N N 36 118.200 118.200 118.000 0.200 18832
143 1 . 1 1 36 36 VAL HA H 36 5.152 5.152 4.611 0.541 18832
144 1 . 1 1 36 36 VAL CA C 36 57.910 57.910 60.023 -2.113 18832
145 1 . 1 1 36 36 VAL CB C 36 34.190 34.190 34.761 -0.571 18832
146 1 . 1 1 36 36 VAL H H 36 9.016 9.016 8.883 0.133 18832
147 1 . 1 1 37 37 HIS N N 37 122.190 122.190 125.837 -3.647 18832
148 1 . 1 1 37 37 HIS HA H 37 4.811 4.811 4.932 -0.121 18832
149 1 . 1 1 37 37 HIS CA C 37 52.560 52.560 53.818 -1.258 18832
150 1 . 1 1 37 37 HIS CB C 37 31.260 31.260 30.529 0.731 18832
151 1 . 1 1 37 37 HIS H H 37 8.491 8.491 8.541 -0.050 18832
152 1 . 1 1 38 38 ILE N N 38 126.650 126.650 127.230 -0.580 18832
153 1 . 1 1 38 38 ILE HA H 38 3.750 3.750 4.048 -0.298 18832
154 1 . 1 1 38 38 ILE CA C 38 61.640 61.640 62.247 -0.607 18832
155 1 . 1 1 38 38 ILE CB C 38 38.880 38.880 37.658 1.222 18832
156 1 . 1 1 38 38 ILE H H 38 8.638 8.638 8.630 0.008 18832
157 1 . 1 1 39 39 LEU N N 39 126.180 126.180 125.121 1.059 18832
158 1 . 1 1 39 39 LEU HA H 39 4.380 4.380 4.724 -0.344 18832
159 1 . 1 1 39 39 LEU CA C 39 55.490 55.490 55.242 0.248 18832
160 1 . 1 1 39 39 LEU CB C 39 43.750 43.750 43.726 0.024 18832
161 1 . 1 1 39 39 LEU H H 39 9.163 9.163 8.796 0.367 18832
162 1 . 1 1 40 40 GLU N N 40 115.160 115.160 117.114 -1.954 18832
163 1 . 1 1 40 40 GLU HA H 40 5.020 5.020 4.751 0.269 18832
164 1 . 1 1 40 40 GLU CA C 40 55.090 55.090 55.327 -0.237 18832
165 1 . 1 1 40 40 GLU CB C 40 35.730 35.730 33.965 1.765 18832
166 1 . 1 1 40 40 GLU H H 40 7.852 7.852 7.903 -0.051 18832
167 1 . 1 1 41 41 THR HA H 41 4.270 4.270 4.509 -0.239 18832
168 1 . 1 1 41 41 THR CA C 41 61.250 61.250 59.978 1.272 18832
169 1 . 1 1 41 41 THR CB C 41 71.410 71.410 70.361 1.049 18832
170 1 . 1 1 42 42 TYR HA H 42 4.550 4.550 4.336 0.214 18832
171 1 . 1 1 43 43 GLU N N 43 124.100 124.100 119.939 4.161 18832
172 1 . 1 1 43 43 GLU HA H 43 3.740 3.740 4.335 -0.595 18832
173 1 . 1 1 43 43 GLU H H 43 8.590 8.590 8.277 0.313 18832
174 1 . 1 1 44 44 GLY N N 44 110.789 110.789 110.514 0.275 18832
175 1 . 1 1 44 44 GLY CA C 44 45.440 45.440 45.328 0.112 18832
176 1 . 1 1 44 44 GLY H H 44 8.432 8.432 8.522 -0.090 18832
177 1 . 1 1 45 45 TRP HA H 45 4.690 4.690 4.631 0.059 18832
178 1 . 1 1 45 45 TRP CA C 45 57.550 57.550 56.028 1.522 18832
179 1 . 1 1 46 46 TYR HA H 46 5.600 5.600 4.748 0.852 18832
180 1 . 1 1 46 46 TYR CA C 46 54.060 54.060 54.734 -0.674 18832
181 1 . 1 1 46 46 TYR CB C 46 42.650 42.650 41.260 1.390 18832
182 1 . 1 1 47 47 ARG N N 47 118.100 118.100 121.070 -2.970 18832
183 1 . 1 1 47 47 ARG HA H 47 5.094 5.094 4.988 0.106 18832
184 1 . 1 1 47 47 ARG CA C 47 54.060 54.060 54.357 -0.297 18832
185 1 . 1 1 47 47 ARG CB C 47 33.250 33.250 33.875 -0.625 18832
186 1 . 1 1 47 47 ARG H H 47 8.492 8.492 8.470 0.022 18832
187 1 . 1 1 48 48 GLY N N 48 114.000 114.000 111.843 2.157 18832
188 1 . 1 1 48 48 GLY CA C 48 46.560 46.560 45.580 0.980 18832
189 1 . 1 1 48 48 GLY H H 48 9.183 9.183 8.817 0.366 18832
190 1 . 1 1 49 49 TYR N N 49 116.100 116.100 115.362 0.738 18832
191 1 . 1 1 49 49 TYR HA H 49 5.373 5.373 5.238 0.135 18832
192 1 . 1 1 49 49 TYR CA C 49 55.110 55.110 55.630 -0.520 18832
193 1 . 1 1 49 49 TYR CB C 49 40.750 40.750 40.534 0.216 18832
194 1 . 1 1 49 49 TYR H H 49 8.194 8.194 8.092 0.102 18832
195 1 . 1 1 50 50 THR N N 50 112.350 112.350 115.626 -3.276 18832
196 1 . 1 1 50 50 THR HA H 50 5.105 5.105 4.570 0.535 18832
197 1 . 1 1 50 50 THR CA C 50 59.770 59.770 61.405 -1.635 18832
198 1 . 1 1 50 50 THR CB C 50 69.460 69.460 69.811 -0.351 18832
199 1 . 1 1 50 50 THR H H 50 9.441 9.441 8.783 0.658 18832
200 1 . 1 1 51 51 LEU N N 51 121.260 121.260 121.647 -0.387 18832
201 1 . 1 1 51 51 LEU HA H 51 4.236 4.236 4.091 0.145 18832
202 1 . 1 1 51 51 LEU CA C 51 56.790 56.790 57.272 -0.483 18832
203 1 . 1 1 51 51 LEU CB C 51 40.000 40.000 41.159 -1.159 18832
204 1 . 1 1 51 51 LEU H H 51 8.310 8.310 8.265 0.045 18832
205 1 . 1 1 52 52 ARG N N 52 116.570 116.570 117.976 -1.406 18832
206 1 . 1 1 52 52 ARG HA H 52 4.250 4.250 4.169 0.081 18832
207 1 . 1 1 52 52 ARG CA C 52 57.350 57.350 58.098 -0.748 18832
208 1 . 1 1 52 52 ARG CB C 52 30.510 30.510 30.520 -0.010 18832
209 1 . 1 1 52 52 ARG H H 52 8.047 8.047 8.359 -0.312 18832
210 1 . 1 1 53 53 LYS N N 53 122.660 122.660 118.590 4.070 18832
211 1 . 1 1 53 53 LYS HA H 53 4.616 4.616 4.580 0.036 18832
212 1 . 1 1 53 53 LYS CA C 53 54.620 54.620 55.442 -0.822 18832
213 1 . 1 1 53 53 LYS CB C 53 32.860 32.860 31.820 1.040 18832
214 1 . 1 1 53 53 LYS H H 53 7.649 7.649 7.856 -0.207 18832
215 1 . 1 1 54 54 LYS N N 54 125.010 125.010 121.742 3.268 18832
216 1 . 1 1 54 54 LYS HA H 54 4.090 4.090 4.229 -0.139 18832
217 1 . 1 1 54 54 LYS CA C 54 58.470 58.470 58.680 -0.210 18832
218 1 . 1 1 54 54 LYS CB C 54 32.130 32.130 32.395 -0.265 18832
219 1 . 1 1 54 54 LYS H H 54 8.496 8.496 8.416 0.080 18832
220 1 . 1 1 55 55 SER N N 55 110.240 110.240 113.654 -3.414 18832
221 1 . 1 1 55 55 SER HA H 55 4.122 4.122 4.234 -0.112 18832
222 1 . 1 1 55 55 SER CA C 55 58.960 58.960 59.927 -0.967 18832
223 1 . 1 1 55 55 SER CB C 55 63.310 63.310 63.343 -0.033 18832
224 1 . 1 1 55 55 SER H H 55 7.857 7.857 8.195 -0.338 18832
225 1 . 1 1 56 56 LYS N N 56 124.070 124.070 121.433 2.637 18832
226 1 . 1 1 56 56 LYS HA H 56 4.668 4.668 4.325 0.343 18832
227 1 . 1 1 56 56 LYS CA C 56 54.810 54.810 56.227 -1.417 18832
228 1 . 1 1 56 56 LYS CB C 56 33.250 33.250 33.376 -0.126 18832
229 1 . 1 1 56 56 LYS H H 56 7.473 7.473 7.768 -0.295 18832
230 1 . 1 1 57 57 LYS N N 57 125.940 125.940 122.073 3.867 18832
231 1 . 1 1 57 57 LYS HA H 57 5.341 5.341 4.903 0.438 18832
232 1 . 1 1 57 57 LYS CA C 57 54.620 54.620 54.934 -0.314 18832
233 1 . 1 1 57 57 LYS CB C 57 34.240 34.240 36.015 -1.775 18832
234 1 . 1 1 57 57 LYS H H 57 8.474 8.474 8.229 0.245 18832
235 1 . 1 1 58 58 GLY N N 58 109.540 109.540 109.127 0.413 18832
236 1 . 1 1 58 58 GLY CA C 58 45.620 45.620 44.944 0.676 18832
237 1 . 1 1 58 58 GLY H H 58 9.075 9.075 8.728 0.347 18832
238 1 . 1 1 59 59 ILE N N 59 113.900 113.900 115.392 -1.492 18832
239 1 . 1 1 59 59 ILE HA H 59 6.000 6.000 5.040 0.960 18832
240 1 . 1 1 59 59 ILE CA C 59 59.590 59.590 58.532 1.058 18832
241 1 . 1 1 59 59 ILE CB C 59 41.140 41.140 41.064 0.076 18832
242 1 . 1 1 59 59 ILE H H 59 8.628 8.628 8.014 0.614 18832
243 1 . 1 1 60 60 PHE N N 60 117.040 117.040 116.719 0.321 18832
244 1 . 1 1 60 60 PHE HA H 60 5.120 5.120 5.384 -0.264 18832
245 1 . 1 1 60 60 PHE CA C 60 54.060 54.060 54.878 -0.818 18832
246 1 . 1 1 60 60 PHE CB C 60 37.190 37.190 39.774 -2.584 18832
247 1 . 1 1 60 60 PHE H H 60 8.724 8.724 8.493 0.232 18832
248 1 . 1 1 61 61 PRO HA H 61 3.480 3.480 4.613 -1.133 18832
249 1 . 1 1 61 61 PRO CA C 61 62.200 62.200 62.301 -0.100 18832
250 1 . 1 1 61 61 PRO CB C 61 31.190 31.190 32.620 -1.430 18832
251 1 . 1 1 62 62 ALA N N 62 124.770 124.770 126.485 -1.715 18832
252 1 . 1 1 62 62 ALA HA H 62 3.710 3.710 4.012 -0.302 18832
253 1 . 1 1 62 62 ALA CA C 62 54.370 54.370 54.311 0.059 18832
254 1 . 1 1 62 62 ALA CB C 62 17.650 17.650 18.111 -0.461 18832
255 1 . 1 1 62 62 ALA H H 62 7.898 7.898 8.280 -0.382 18832
256 1 . 1 1 63 63 SER N N 63 109.700 109.700 114.358 -4.658 18832
257 1 . 1 1 63 63 SER HA H 63 4.200 4.200 4.191 0.009 18832
258 1 . 1 1 63 63 SER CA C 63 59.400 59.400 60.338 -0.938 18832
259 1 . 1 1 63 63 SER CB C 63 62.380 62.380 62.801 -0.421 18832
260 1 . 1 1 63 63 SER H H 63 8.030 8.030 8.377 -0.348 18832
261 1 . 1 1 64 64 TYR N N 64 120.300 120.300 114.397 5.903 18832
262 1 . 1 1 64 64 TYR HA H 64 4.250 4.250 4.504 -0.254 18832
263 1 . 1 1 64 64 TYR CA C 64 57.720 57.720 55.324 2.396 18832
264 1 . 1 1 64 64 TYR CB C 64 37.560 37.560 37.691 -0.131 18832
265 1 . 1 1 64 64 TYR H H 64 7.128 7.128 7.034 0.093 18832
266 1 . 1 1 65 65 ILE N N 65 118.000 118.000 120.619 -2.619 18832
267 1 . 1 1 65 65 ILE HA H 65 4.810 4.810 4.747 0.063 18832
268 1 . 1 1 65 65 ILE CA C 65 56.980 56.980 59.230 -2.250 18832
269 1 . 1 1 65 65 ILE CB C 65 39.630 39.630 39.809 -0.179 18832
270 1 . 1 1 65 65 ILE H H 65 7.671 7.671 7.418 0.253 18832
271 1 . 1 1 66 66 HIS N N 66 124.300 124.300 125.898 -1.598 18832
272 1 . 1 1 66 66 HIS HA H 66 5.130 5.130 4.914 0.216 18832
273 1 . 1 1 66 66 HIS CA C 66 53.060 53.060 54.807 -1.747 18832
274 1 . 1 1 66 66 HIS CB C 66 30.510 30.510 33.039 -2.529 18832
275 1 . 1 1 66 66 HIS H H 66 9.159 9.159 8.854 0.305 18832
276 1 . 1 1 67 67 LEU N N 67 127.580 127.580 127.819 -0.239 18832
277 1 . 1 1 67 67 LEU HA H 67 4.570 4.570 4.335 0.235 18832
278 1 . 1 1 67 67 LEU CA C 67 55.300 55.300 55.631 -0.331 18832
279 1 . 1 1 67 67 LEU CB C 67 42.060 42.060 41.652 0.408 18832
280 1 . 1 1 67 67 LEU H H 67 8.992 8.992 8.577 0.415 18832
281 1 . 1 1 68 68 LYS N N 68 121.900 121.900 123.890 -1.990 18832
282 1 . 1 1 68 68 LYS HA H 68 4.490 4.490 4.620 -0.130 18832
283 1 . 1 1 68 68 LYS CA C 68 55.110 55.110 54.609 0.502 18832
284 1 . 1 1 68 68 LYS CB C 68 34.610 34.610 34.270 0.341 18832
285 1 . 1 1 68 68 LYS H H 68 8.499 8.499 8.173 0.326 18832
286 1 . 1 1 69 69 GLU N N 69 122.190 122.190 120.089 2.101 18832
287 1 . 1 1 69 69 GLU HA H 69 4.280 4.280 4.350 -0.070 18832
288 1 . 1 1 69 69 GLU CA C 69 56.610 56.610 55.970 0.640 18832
289 1 . 1 1 69 69 GLU CB C 69 30.330 30.330 29.674 0.656 18832
290 1 . 1 1 69 69 GLU H H 69 8.569 8.569 8.615 -0.046 18832
291 1 . 1 1 70 70 ALA N N 70 123.370 123.370 124.557 -1.187 18832
292 1 . 1 1 70 70 ALA HA H 70 4.200 4.200 4.139 0.061 18832
293 1 . 1 1 70 70 ALA CA C 70 51.810 51.810 52.278 -0.468 18832
294 1 . 1 1 70 70 ALA CB C 70 19.700 19.700 18.661 1.039 18832
295 1 . 1 1 70 70 ALA H H 70 8.181 8.181 8.102 0.079 18832
296 1 . 1 1 71 71 ILE N N 71 120.080 120.080 120.490 -0.410 18832
297 1 . 1 1 71 71 ILE HA H 71 4.070 4.070 4.304 -0.234 18832
298 1 . 1 1 71 71 ILE CA C 71 60.330 60.330 60.973 -0.643 18832
299 1 . 1 1 71 71 ILE CB C 71 38.690 38.690 38.817 -0.127 18832
300 1 . 1 1 71 71 ILE H H 71 7.776 7.776 8.200 -0.424 18832
301 1 . 1 1 72 72 VAL N N 72 124.540 124.540 123.680 0.860 18832
302 1 . 1 1 72 72 VAL HA H 72 4.070 4.070 4.361 -0.291 18832
303 1 . 1 1 72 72 VAL CA C 72 61.640 61.640 61.838 -0.198 18832
304 1 . 1 1 72 72 VAL CB C 72 32.690 32.690 32.462 0.228 18832
305 1 . 1 1 72 72 VAL H H 72 8.089 8.089 8.272 -0.183 18832
306 1 . 1 1 73 73 GLU N N 73 125.940 125.940 125.060 0.880 18832
307 1 . 1 1 73 73 GLU HA H 73 4.280 4.280 4.469 -0.189 18832
308 1 . 1 1 73 73 GLU CA C 73 56.610 56.610 56.346 0.264 18832
309 1 . 1 1 73 73 GLU CB C 73 30.710 30.710 30.052 0.658 18832
310 1 . 1 1 73 73 GLU H H 73 8.464 8.464 8.697 -0.233 18832
stop_
save_