data_19947
save_entry_information
_Entry.Sf_category entry_information
_Entry.NMR_STAR_version 3.0.9.13
_Entry.Entry_ID 19947
_Entry.PDB_ID 2MOP
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 19947
_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 PRO HA H 2 4.820 4.820 4.549 0.271 19947
2 1 1 . 1 1 2 2 PRO CA C 2 61.900 61.900 62.193 -0.293 19947
3 1 1 . 1 1 2 2 PRO CB C 2 30.700 30.700 31.584 -0.884 19947
4 1 1 . 1 1 3 3 PRO HA H 3 4.540 4.540 4.405 0.135 19947
5 1 1 . 1 1 3 3 PRO CA C 3 62.900 62.900 62.546 0.354 19947
6 1 1 . 1 1 3 3 PRO CB C 3 32.100 32.100 32.133 -0.033 19947
7 1 1 . 1 1 4 4 VAL N N 4 121.900 121.900 122.453 -0.553 19947
8 1 1 . 1 1 4 4 VAL HA H 4 4.200 4.200 4.145 0.055 19947
9 1 1 . 1 1 4 4 VAL CA C 4 62.300 62.300 62.233 0.068 19947
10 1 1 . 1 1 4 4 VAL CB C 4 32.800 32.800 29.561 3.239 19947
11 1 1 . 1 1 4 4 VAL H H 4 8.330 8.330 8.341 -0.011 19947
12 1 1 . 1 1 5 5 CYS N N 5 120.900 120.900 125.913 -5.013 19947
13 1 1 . 1 1 5 5 CYS HA H 5 4.700 4.700 4.430 0.270 19947
14 1 1 . 1 1 5 5 CYS CA C 5 53.600 53.600 58.415 -4.815 19947
15 1 1 . 1 1 5 5 CYS H H 5 8.500 8.500 8.698 -0.198 19947
16 1 1 . 1 1 6 6 GLY N N 6 110.200 110.200 113.870 -3.670 19947
17 1 1 . 1 1 6 6 GLY CA C 6 46.300 46.300 44.738 1.562 19947
18 1 1 . 1 1 6 6 GLY H H 6 8.490 8.490 8.386 0.104 19947
19 1 1 . 1 1 7 7 ASN N N 7 120.100 120.100 117.144 2.956 19947
20 1 1 . 1 1 7 7 ASN HA H 7 4.730 4.730 4.362 0.368 19947
21 1 1 . 1 1 7 7 ASN CA C 7 53.200 53.200 53.827 -0.627 19947
22 1 1 . 1 1 7 7 ASN CB C 7 38.700 38.700 38.889 -0.189 19947
23 1 1 . 1 1 7 7 ASN H H 7 8.320 8.320 8.299 0.021 19947
24 1 1 . 1 1 8 8 LYS N N 8 121.300 121.300 122.083 -0.783 19947
25 1 1 . 1 1 8 8 LYS HA H 8 4.340 4.340 4.272 0.068 19947
26 1 1 . 1 1 8 8 LYS CA C 8 56.600 56.600 56.597 0.003 19947
27 1 1 . 1 1 8 8 LYS CB C 8 32.900 32.900 31.756 1.144 19947
28 1 1 . 1 1 8 8 LYS H H 8 8.260 8.260 8.302 -0.042 19947
29 1 1 . 1 1 9 9 ILE N N 9 136.600 136.600 123.494 13.106 19947
30 1 1 . 1 1 9 9 ILE HA H 9 4.140 4.140 3.906 0.234 19947
31 1 1 . 1 1 9 9 ILE CA C 9 61.300 61.300 62.428 -1.129 19947
32 1 1 . 1 1 9 9 ILE CB C 9 38.200 38.200 37.913 0.287 19947
33 1 1 . 1 1 9 9 ILE H H 9 8.150 8.150 8.291 -0.141 19947
34 1 1 . 1 1 10 10 LEU N N 10 125.700 125.700 122.747 2.953 19947
35 1 1 . 1 1 10 10 LEU HA H 10 4.420 4.420 4.440 -0.020 19947
36 1 1 . 1 1 10 10 LEU CA C 10 55.200 55.200 55.904 -0.704 19947
37 1 1 . 1 1 10 10 LEU CB C 10 42.300 42.300 40.564 1.736 19947
38 1 1 . 1 1 10 10 LEU H H 10 8.230 8.230 8.443 -0.213 19947
39 1 1 . 1 1 11 11 GLU N N 11 120.600 120.600 113.798 6.802 19947
40 1 1 . 1 1 11 11 GLU HA H 11 4.470 4.470 4.171 0.299 19947
41 1 1 . 1 1 11 11 GLU CA C 11 55.500 55.500 56.583 -1.083 19947
42 1 1 . 1 1 11 11 GLU CB C 11 28.900 28.900 27.959 0.941 19947
43 1 1 . 1 1 11 11 GLU H H 11 8.250 8.250 7.954 0.296 19947
44 1 1 . 1 1 12 12 GLN N N 12 121.600 121.600 118.970 2.630 19947
45 1 1 . 1 1 12 12 GLN HA H 12 4.350 4.350 4.461 -0.111 19947
46 1 1 . 1 1 12 12 GLN CA C 12 56.600 56.600 56.009 0.591 19947
47 1 1 . 1 1 12 12 GLN CB C 12 29.200 29.200 29.634 -0.434 19947
48 1 1 . 1 1 12 12 GLN H H 12 8.460 8.460 7.876 0.584 19947
49 1 1 . 1 1 13 13 GLY N N 13 110.700 110.700 107.232 3.468 19947
50 1 1 . 1 1 13 13 GLY CA C 13 45.700 45.700 45.605 0.095 19947
51 1 1 . 1 1 13 13 GLY H H 13 8.660 8.660 8.700 -0.040 19947
52 1 1 . 1 1 14 14 GLU N N 14 118.900 118.900 114.487 4.413 19947
53 1 1 . 1 1 14 14 GLU HA H 14 4.530 4.530 4.183 0.347 19947
54 1 1 . 1 1 14 14 GLU CA C 14 55.600 55.600 56.856 -1.256 19947
55 1 1 . 1 1 14 14 GLU CB C 14 29.700 29.700 29.741 -0.041 19947
56 1 1 . 1 1 14 14 GLU H H 14 8.230 8.230 8.233 -0.003 19947
57 1 1 . 1 1 15 15 ASP N N 15 118.400 118.400 120.118 -1.718 19947
58 1 1 . 1 1 15 15 ASP HA H 15 4.990 4.990 4.486 0.504 19947
59 1 1 . 1 1 15 15 ASP CA C 15 53.500 53.500 56.984 -3.484 19947
60 1 1 . 1 1 15 15 ASP CB C 15 39.700 39.700 41.418 -1.718 19947
61 1 1 . 1 1 15 15 ASP H H 15 8.330 8.330 8.485 -0.155 19947
62 1 1 . 1 1 16 16 CYS HA H 16 4.340 4.340 4.452 -0.112 19947
63 1 1 . 1 1 16 16 CYS H H 16 8.510 8.510 8.120 0.390 19947
64 1 1 . 1 1 17 17 ASP N N 17 116.700 116.700 120.852 -4.152 19947
65 1 1 . 1 1 17 17 ASP HA H 17 4.740 4.740 4.212 0.528 19947
66 1 1 . 1 1 17 17 ASP CA C 17 53.100 53.100 55.992 -2.892 19947
67 1 1 . 1 1 17 17 ASP CB C 17 38.600 38.600 39.270 -0.670 19947
68 1 1 . 1 1 17 17 ASP H H 17 8.180 8.180 8.873 -0.693 19947
69 1 1 . 1 1 18 18 CYS HA H 18 4.730 4.730 3.993 0.737 19947
70 1 1 . 1 1 18 18 CYS CB C 18 41.900 41.900 26.605 15.295 19947
71 1 1 . 1 1 19 19 GLY H H 19 8.220 8.220 8.603 -0.383 19947
72 1 1 . 1 1 20 20 SER HA H 20 4.920 4.920 4.407 0.513 19947
73 1 1 . 1 1 20 20 SER CA C 20 55.700 55.700 56.923 -1.223 19947
74 1 1 . 1 1 20 20 SER CB C 20 63.500 63.500 63.181 0.319 19947
75 1 1 . 1 1 20 20 SER H H 20 7.830 7.830 8.423 -0.593 19947
76 1 1 . 1 1 21 21 PRO HA H 21 4.240 4.240 4.152 0.088 19947
77 1 1 . 1 1 21 21 PRO CA C 21 63.400 63.400 65.037 -1.637 19947
78 1 1 . 1 1 21 21 PRO CB C 21 31.800 31.800 31.446 0.354 19947
79 1 1 . 1 1 22 22 ALA N N 22 119.900 119.900 117.033 2.867 19947
80 1 1 . 1 1 22 22 ALA HA H 22 4.220 4.220 4.047 0.173 19947
81 1 1 . 1 1 22 22 ALA CA C 22 54.200 54.200 53.787 0.413 19947
82 1 1 . 1 1 22 22 ALA CB C 22 18.500 18.500 18.872 -0.372 19947
83 1 1 . 1 1 22 22 ALA H H 22 8.180 8.180 8.325 -0.145 19947
84 1 1 . 1 1 23 23 ASN N N 23 116.300 116.300 112.673 3.627 19947
85 1 1 . 1 1 23 23 ASN HA H 23 4.670 4.670 4.967 -0.297 19947
86 1 1 . 1 1 23 23 ASN CA C 23 53.200 53.200 52.993 0.207 19947
87 1 1 . 1 1 23 23 ASN CB C 23 39.300 39.300 39.876 -0.576 19947
88 1 1 . 1 1 23 23 ASN H H 23 7.960 7.960 8.283 -0.323 19947
89 1 1 . 1 1 24 24 CYS HA H 24 4.720 4.720 4.254 0.466 19947
90 1 1 . 1 1 24 24 CYS H H 24 8.510 8.510 7.456 1.054 19947
91 1 1 . 1 1 25 25 GLN HA H 25 4.460 4.460 3.943 0.517 19947
92 1 1 . 1 1 25 25 GLN H H 25 8.320 8.320 8.881 -0.561 19947
93 1 1 . 1 1 26 26 ASP HA H 26 4.740 4.740 4.609 0.131 19947
94 1 1 . 1 1 26 26 ASP H H 26 8.580 8.580 8.049 0.531 19947
95 1 1 . 1 1 27 27 ARG HA H 27 4.680 4.680 4.327 0.353 19947
96 1 1 . 1 1 27 27 ARG CA C 27 54.700 54.700 56.052 -1.352 19947
97 1 1 . 1 1 27 27 ARG H H 27 8.550 8.550 8.400 0.150 19947
98 1 1 . 1 1 28 28 CYS HA H 28 4.120 4.120 4.130 -0.010 19947
99 1 1 . 1 1 28 28 CYS CA C 28 54.400 54.400 59.139 -4.739 19947
100 1 1 . 1 1 28 28 CYS CB C 28 19.000 19.000 23.784 -4.784 19947
101 1 1 . 1 1 28 28 CYS H H 28 8.910 8.910 8.058 0.852 19947
102 1 1 . 1 1 29 29 CYS N N 29 113.300 113.300 119.013 -5.713 19947
103 1 1 . 1 1 29 29 CYS HA H 29 5.010 5.010 4.593 0.417 19947
104 1 1 . 1 1 29 29 CYS CA C 29 54.300 54.300 58.565 -4.265 19947
105 1 1 . 1 1 29 29 CYS H H 29 7.730 7.730 7.923 -0.193 19947
106 1 1 . 1 1 30 30 ASN HA H 30 4.730 4.730 5.061 -0.331 19947
107 1 1 . 1 1 30 30 ASN CB C 30 38.700 38.700 40.050 -1.350 19947
108 1 1 . 1 1 30 30 ASN H H 30 8.870 8.870 9.008 -0.138 19947
109 1 1 . 1 1 31 31 ALA N N 31 129.400 129.400 126.526 2.874 19947
110 1 1 . 1 1 31 31 ALA HA H 31 4.120 4.120 4.322 -0.202 19947
111 1 1 . 1 1 31 31 ALA CA C 31 54.400 54.400 54.528 -0.128 19947
112 1 1 . 1 1 31 31 ALA CB C 31 19.000 19.000 19.131 -0.131 19947
113 1 1 . 1 1 31 31 ALA H H 31 8.890 8.890 8.576 0.314 19947
114 1 1 . 1 1 32 32 ALA N N 32 116.400 116.400 118.090 -1.690 19947
115 1 1 . 1 1 32 32 ALA HA H 32 4.340 4.340 4.340 -0.000 19947
116 1 1 . 1 1 32 32 ALA CA C 32 53.800 53.800 53.739 0.061 19947
117 1 1 . 1 1 32 32 ALA CB C 32 19.100 19.100 18.407 0.693 19947
118 1 1 . 1 1 32 32 ALA H H 32 8.250 8.250 8.300 -0.050 19947
119 1 1 . 1 1 33 33 THR N N 33 104.300 104.300 109.709 -5.409 19947
120 1 1 . 1 1 33 33 THR HA H 33 4.430 4.430 4.400 0.030 19947
121 1 1 . 1 1 33 33 THR CA C 33 60.500 60.500 60.653 -0.153 19947
122 1 1 . 1 1 33 33 THR CB C 33 70.600 70.600 69.958 0.642 19947
123 1 1 . 1 1 33 33 THR H H 33 7.320 7.320 7.378 -0.058 19947
124 1 1 . 1 1 34 34 CYS N N 34 123.400 123.400 121.310 2.090 19947
125 1 1 . 1 1 34 34 CYS HA H 34 4.170 4.170 4.255 -0.085 19947
126 1 1 . 1 1 34 34 CYS CA C 34 56.500 56.500 60.195 -3.695 19947
127 1 1 . 1 1 34 34 CYS H H 34 8.710 8.710 8.270 0.440 19947
128 1 1 . 1 1 35 35 LYS N N 35 116.900 116.900 116.950 -0.050 19947
129 1 1 . 1 1 35 35 LYS HA H 35 4.960 4.960 4.815 0.145 19947
130 1 1 . 1 1 35 35 LYS CA C 35 53.900 53.900 55.511 -1.611 19947
131 1 1 . 1 1 35 35 LYS CB C 35 35.900 35.900 35.801 0.099 19947
132 1 1 . 1 1 35 35 LYS H H 35 7.450 7.450 7.858 -0.408 19947
133 1 1 . 1 1 36 36 LEU N N 36 119.300 119.300 117.356 1.944 19947
134 1 1 . 1 1 36 36 LEU HA H 36 4.800 4.800 4.748 0.052 19947
135 1 1 . 1 1 36 36 LEU CB C 36 42.400 42.400 43.135 -0.735 19947
136 1 1 . 1 1 36 36 LEU H H 36 8.290 8.290 8.425 -0.135 19947
137 1 1 . 1 1 37 37 THR HA H 37 4.340 4.340 4.776 -0.436 19947
138 1 1 . 1 1 37 37 THR CA C 37 60.200 60.200 58.707 1.493 19947
139 1 1 . 1 1 37 37 THR CB C 37 67.700 67.700 68.792 -1.092 19947
140 1 1 . 1 1 37 37 THR H H 37 8.380 8.380 8.121 0.259 19947
141 1 1 . 1 1 38 38 PRO HA H 38 4.380 4.380 4.114 0.266 19947
142 1 1 . 1 1 38 38 PRO CA C 38 64.800 64.800 64.268 0.532 19947
143 1 1 . 1 1 38 38 PRO CB C 38 31.500 31.500 31.706 -0.206 19947
144 1 1 . 1 1 39 39 GLY N N 39 113.300 113.300 111.145 2.155 19947
145 1 1 . 1 1 39 39 GLY CA C 39 45.100 45.100 45.106 -0.006 19947
146 1 1 . 1 1 39 39 GLY H H 39 8.830 8.830 8.414 0.416 19947
147 1 1 . 1 1 40 40 SER N N 40 116.700 116.700 117.462 -0.762 19947
148 1 1 . 1 1 40 40 SER HA H 40 4.610 4.610 4.760 -0.150 19947
149 1 1 . 1 1 40 40 SER CA C 40 58.800 58.800 58.240 0.560 19947
150 1 1 . 1 1 40 40 SER CB C 40 63.800 63.800 63.063 0.737 19947
151 1 1 . 1 1 40 40 SER H H 40 8.280 8.280 7.776 0.504 19947
152 1 1 . 1 1 41 41 GLN N N 41 120.600 120.600 124.758 -4.158 19947
153 1 1 . 1 1 41 41 GLN HA H 41 4.110 4.110 4.048 0.062 19947
154 1 1 . 1 1 41 41 GLN CA C 41 55.200 55.200 57.451 -2.251 19947
155 1 1 . 1 1 41 41 GLN CB C 41 31.100 31.100 29.053 2.047 19947
156 1 1 . 1 1 41 41 GLN H H 41 9.190 9.190 7.920 1.270 19947
157 1 1 . 1 1 42 42 CYS N N 42 113.200 113.200 116.479 -3.279 19947
158 1 1 . 1 1 42 42 CYS HA H 42 4.630 4.630 4.510 0.120 19947
159 1 1 . 1 1 42 42 CYS CA C 42 53.700 53.700 57.238 -3.538 19947
160 1 1 . 1 1 42 42 CYS CB C 42 45.500 45.500 29.952 15.548 19947
161 1 1 . 1 1 42 42 CYS H H 42 7.710 7.710 7.849 -0.139 19947
162 1 1 . 1 1 43 43 ASN N N 43 114.200 114.200 122.745 -8.545 19947
163 1 1 . 1 1 43 43 ASN HA H 43 4.940 4.940 4.621 0.319 19947
164 1 1 . 1 1 43 43 ASN CA C 43 53.000 53.000 54.848 -1.848 19947
165 1 1 . 1 1 43 43 ASN CB C 43 39.300 39.300 38.878 0.422 19947
166 1 1 . 1 1 43 43 ASN H H 43 8.870 8.870 8.629 0.241 19947
167 1 1 . 1 1 44 44 TYR N N 44 118.400 118.400 114.661 3.739 19947
168 1 1 . 1 1 44 44 TYR HA H 44 4.850 4.850 4.597 0.253 19947
169 1 1 . 1 1 44 44 TYR CA C 44 55.300 55.300 57.871 -2.571 19947
170 1 1 . 1 1 44 44 TYR CB C 44 40.700 40.700 39.770 0.930 19947
171 1 1 . 1 1 44 44 TYR H H 44 7.840 7.840 7.266 0.574 19947
172 1 1 . 1 1 45 45 GLY N N 45 110.600 110.600 108.074 2.526 19947
173 1 1 . 1 1 45 45 GLY CA C 45 44.000 44.000 44.924 -0.924 19947
174 1 1 . 1 1 45 45 GLY H H 45 7.960 7.960 8.234 -0.274 19947
175 1 1 . 1 1 46 46 GLU N N 46 120.700 120.700 120.097 0.603 19947
176 1 1 . 1 1 46 46 GLU HA H 46 4.280 4.280 4.118 0.162 19947
177 1 1 . 1 1 46 46 GLU CA C 46 58.500 58.500 59.231 -0.731 19947
178 1 1 . 1 1 46 46 GLU CB C 46 29.300 29.300 30.057 -0.757 19947
179 1 1 . 1 1 46 46 GLU H H 46 9.160 9.160 8.707 0.453 19947
180 1 1 . 1 1 47 47 CYS N N 47 112.400 112.400 117.789 -5.389 19947
181 1 1 . 1 1 47 47 CYS HA H 47 4.850 4.850 4.664 0.186 19947
182 1 1 . 1 1 47 47 CYS CA C 47 57.100 57.100 58.013 -0.913 19947
183 1 1 . 1 1 47 47 CYS CB C 47 41.200 41.200 26.010 15.190 19947
184 1 1 . 1 1 47 47 CYS H H 47 8.510 8.510 7.541 0.969 19947
185 1 1 . 1 1 48 48 CYS N N 48 123.200 123.200 120.522 2.678 19947
186 1 1 . 1 1 48 48 CYS HA H 48 5.160 5.160 5.106 0.054 19947
187 1 1 . 1 1 48 48 CYS CA C 48 54.700 54.700 58.188 -3.488 19947
188 1 1 . 1 1 48 48 CYS CB C 48 45.700 45.700 29.059 16.641 19947
189 1 1 . 1 1 48 48 CYS H H 48 7.810 7.810 7.645 0.165 19947
190 1 1 . 1 1 49 49 ASP N N 49 127.400 127.400 123.717 3.683 19947
191 1 1 . 1 1 49 49 ASP HA H 49 4.890 4.890 4.989 -0.099 19947
192 1 1 . 1 1 49 49 ASP CA C 49 53.500 53.500 53.637 -0.137 19947
193 1 1 . 1 1 49 49 ASP CB C 49 42.400 42.400 44.247 -1.847 19947
194 1 1 . 1 1 49 49 ASP H H 49 9.670 9.670 8.457 1.213 19947
195 1 1 . 1 1 50 50 GLN N N 50 127.000 127.000 122.456 4.544 19947
196 1 1 . 1 1 50 50 GLN HA H 50 3.940 3.940 3.978 -0.038 19947
197 1 1 . 1 1 50 50 GLN CA C 50 56.800 56.800 58.853 -2.053 19947
198 1 1 . 1 1 50 50 GLN CB C 50 26.500 26.500 27.967 -1.467 19947
199 1 1 . 1 1 50 50 GLN H H 50 9.450 9.450 8.916 0.534 19947
200 1 1 . 1 1 51 51 CYS N N 51 106.100 106.100 117.742 -11.642 19947
201 1 1 . 1 1 51 51 CYS HA H 51 4.760 4.760 4.804 -0.044 19947
202 1 1 . 1 1 51 51 CYS CB C 51 43.200 43.200 28.526 14.674 19947
203 1 1 . 1 1 51 51 CYS H H 51 8.700 8.700 8.203 0.497 19947
204 1 1 . 1 1 52 52 ARG N N 52 121.000 121.000 119.154 1.846 19947
205 1 1 . 1 1 52 52 ARG HA H 52 4.690 4.690 4.460 0.230 19947
206 1 1 . 1 1 52 52 ARG CA C 52 55.400 55.400 54.925 0.476 19947
207 1 1 . 1 1 52 52 ARG CB C 52 33.100 33.100 34.524 -1.424 19947
208 1 1 . 1 1 52 52 ARG H H 52 7.960 7.960 7.812 0.148 19947
209 1 1 . 1 1 53 53 PHE N N 53 120.300 120.300 120.670 -0.370 19947
210 1 1 . 1 1 53 53 PHE HA H 53 5.050 5.050 5.204 -0.154 19947
211 1 1 . 1 1 53 53 PHE CA C 53 56.100 56.100 56.751 -0.651 19947
212 1 1 . 1 1 53 53 PHE CB C 53 38.200 38.200 39.149 -0.949 19947
213 1 1 . 1 1 53 53 PHE H H 53 8.400 8.400 8.376 0.024 19947
214 1 1 . 1 1 54 54 LYS N N 54 123.300 123.300 124.943 -1.643 19947
215 1 1 . 1 1 54 54 LYS HA H 54 4.250 4.250 4.186 0.064 19947
216 1 1 . 1 1 54 54 LYS CA C 54 57.500 57.500 55.637 1.863 19947
217 1 1 . 1 1 54 54 LYS CB C 54 34.300 34.300 31.303 2.997 19947
218 1 1 . 1 1 54 54 LYS H H 54 8.540 8.540 8.315 0.225 19947
219 1 1 . 1 1 55 55 LYS N N 55 119.400 119.400 124.719 -5.319 19947
220 1 1 . 1 1 55 55 LYS HA H 55 4.110 4.110 3.939 0.171 19947
221 1 1 . 1 1 55 55 LYS CA C 55 56.500 56.500 56.811 -0.311 19947
222 1 1 . 1 1 55 55 LYS CB C 55 33.400 33.400 33.255 0.145 19947
223 1 1 . 1 1 55 55 LYS H H 55 8.440 8.440 8.008 0.431 19947
224 1 1 . 1 1 56 56 ALA N N 56 126.700 126.700 127.471 -0.771 19947
225 1 1 . 1 1 56 56 ALA HA H 56 3.920 3.920 4.037 -0.117 19947
226 1 1 . 1 1 56 56 ALA CA C 56 52.900 52.900 53.573 -0.673 19947
227 1 1 . 1 1 56 56 ALA CB C 56 18.100 18.100 18.516 -0.416 19947
228 1 1 . 1 1 56 56 ALA H H 56 8.930 8.930 8.645 0.285 19947
229 1 1 . 1 1 57 57 GLY N N 57 109.300 109.300 111.449 -2.149 19947
230 1 1 . 1 1 57 57 GLY CA C 57 45.100 45.100 44.853 0.247 19947
231 1 1 . 1 1 57 57 GLY H H 57 8.460 8.460 8.444 0.017 19947
232 1 1 . 1 1 58 58 THR N N 58 117.200 117.200 119.941 -2.741 19947
233 1 1 . 1 1 58 58 THR HA H 58 4.260 4.260 4.394 -0.134 19947
234 1 1 . 1 1 58 58 THR CA C 58 63.300 63.300 63.461 -0.161 19947
235 1 1 . 1 1 58 58 THR CB C 58 69.600 69.600 68.938 0.662 19947
236 1 1 . 1 1 58 58 THR H H 58 7.660 7.660 7.812 -0.152 19947
237 1 1 . 1 1 59 59 VAL N N 59 130.400 130.400 127.282 3.118 19947
238 1 1 . 1 1 59 59 VAL HA H 59 3.900 3.900 3.594 0.306 19947
239 1 1 . 1 1 59 59 VAL CA C 59 64.400 64.400 63.114 1.286 19947
240 1 1 . 1 1 59 59 VAL CB C 59 31.900 31.900 31.707 0.193 19947
241 1 1 . 1 1 59 59 VAL H H 59 9.190 9.190 8.687 0.503 19947
242 1 1 . 1 1 60 60 CYS N N 60 121.800 121.800 126.022 -4.222 19947
243 1 1 . 1 1 60 60 CYS HA H 60 5.050 5.050 4.566 0.484 19947
244 1 1 . 1 1 60 60 CYS CA C 60 54.400 54.400 58.003 -3.603 19947
245 1 1 . 1 1 60 60 CYS CB C 60 43.000 43.000 27.497 15.503 19947
246 1 1 . 1 1 60 60 CYS H H 60 9.130 9.130 8.147 0.983 19947
247 1 1 . 1 1 61 61 ARG N N 61 124.100 124.100 117.186 6.914 19947
248 1 1 . 1 1 61 61 ARG HA H 61 4.360 4.360 4.654 -0.294 19947
249 1 1 . 1 1 61 61 ARG CA C 61 56.800 56.800 55.053 1.747 19947
250 1 1 . 1 1 61 61 ARG CB C 61 32.800 32.800 33.803 -1.004 19947
251 1 1 . 1 1 61 61 ARG H H 61 7.580 7.580 7.370 0.210 19947
252 1 1 . 1 1 62 62 ILE N N 62 126.200 126.200 116.246 9.954 19947
253 1 1 . 1 1 62 62 ILE HA H 62 4.090 4.090 4.499 -0.409 19947
254 1 1 . 1 1 62 62 ILE CA C 62 60.300 60.300 60.856 -0.556 19947
255 1 1 . 1 1 62 62 ILE CB C 62 38.700 38.700 41.361 -2.661 19947
256 1 1 . 1 1 62 62 ILE H H 62 8.490 8.490 8.341 0.149 19947
257 1 1 . 1 1 63 63 ALA N N 63 129.400 129.400 131.878 -2.478 19947
258 1 1 . 1 1 63 63 ALA HA H 63 4.310 4.310 4.358 -0.048 19947
259 1 1 . 1 1 63 63 ALA CA C 63 51.900 51.900 54.350 -2.450 19947
260 1 1 . 1 1 63 63 ALA CB C 63 20.600 20.600 19.520 1.080 19947
261 1 1 . 1 1 63 63 ALA H H 63 8.100 8.100 8.643 -0.543 19947
262 1 1 . 1 1 64 64 ARG N N 64 120.500 120.500 121.149 -0.649 19947
263 1 1 . 1 1 64 64 ARG HA H 64 4.290 4.290 4.513 -0.223 19947
264 1 1 . 1 1 64 64 ARG CA C 64 56.200 56.200 55.951 0.249 19947
265 1 1 . 1 1 64 64 ARG CB C 64 30.500 30.500 30.190 0.310 19947
266 1 1 . 1 1 64 64 ARG H H 64 8.140 8.140 8.865 -0.725 19947
267 1 1 . 1 1 65 65 GLY N N 65 110.500 110.500 112.700 -2.200 19947
268 1 1 . 1 1 65 65 GLY CA C 65 45.100 45.100 44.607 0.493 19947
269 1 1 . 1 1 65 65 GLY H H 65 8.040 8.040 8.431 -0.391 19947
270 1 1 . 1 1 66 66 ASP N N 66 120.700 120.700 119.614 1.086 19947
271 1 1 . 1 1 66 66 ASP HA H 66 4.610 4.610 4.431 0.179 19947
272 1 1 . 1 1 66 66 ASP CA C 66 53.300 53.300 53.515 -0.215 19947
273 1 1 . 1 1 66 66 ASP CB C 66 37.600 37.600 40.208 -2.608 19947
274 1 1 . 1 1 66 66 ASP H H 66 8.380 8.380 7.203 1.177 19947
275 1 1 . 1 1 67 67 TRP N N 67 120.100 120.100 123.395 -3.295 19947
276 1 1 . 1 1 67 67 TRP HA H 67 4.760 4.760 4.999 -0.239 19947
277 1 1 . 1 1 67 67 TRP CA C 67 57.200 57.200 57.939 -0.739 19947
278 1 1 . 1 1 67 67 TRP CB C 67 29.100 29.100 29.335 -0.235 19947
279 1 1 . 1 1 67 67 TRP H H 67 7.950 7.950 7.811 0.139 19947
280 1 1 . 1 1 68 68 ASN N N 68 118.400 118.400 117.916 0.484 19947
281 1 1 . 1 1 68 68 ASN HA H 68 4.790 4.790 4.959 -0.169 19947
282 1 1 . 1 1 68 68 ASN CA C 68 52.800 52.800 53.654 -0.855 19947
283 1 1 . 1 1 68 68 ASN CB C 68 39.300 39.300 40.443 -1.143 19947
284 1 1 . 1 1 68 68 ASN H H 68 8.180 8.180 8.717 -0.537 19947
285 1 1 . 1 1 69 69 ASP N N 69 118.500 118.500 118.937 -0.437 19947
286 1 1 . 1 1 69 69 ASP HA H 69 4.620 4.620 4.422 0.198 19947
287 1 1 . 1 1 69 69 ASP CA C 69 53.200 53.200 56.089 -2.889 19947
288 1 1 . 1 1 69 69 ASP CB C 69 38.000 38.000 41.211 -3.211 19947
289 1 1 . 1 1 69 69 ASP H H 69 8.130 8.130 8.609 -0.479 19947
290 1 1 . 1 1 70 70 ASP N N 70 120.500 120.500 121.178 -0.678 19947
291 1 1 . 1 1 70 70 ASP HA H 70 5.100 5.100 5.027 0.073 19947
292 1 1 . 1 1 70 70 ASP CA C 70 52.500 52.500 53.605 -1.105 19947
293 1 1 . 1 1 70 70 ASP CB C 70 42.600 42.600 42.035 0.565 19947
294 1 1 . 1 1 70 70 ASP H H 70 8.140 8.140 8.196 -0.056 19947
295 1 1 . 1 1 71 71 TYR N N 71 118.900 118.900 124.140 -5.240 19947
296 1 1 . 1 1 71 71 TYR HA H 71 5.210 5.210 4.878 0.332 19947
297 1 1 . 1 1 71 71 TYR CA C 71 56.300 56.300 57.142 -0.842 19947
298 1 1 . 1 1 71 71 TYR CB C 71 42.200 42.200 42.869 -0.669 19947
299 1 1 . 1 1 71 71 TYR H H 71 8.450 8.450 8.290 0.160 19947
300 1 1 . 1 1 72 72 CYS N N 72 119.800 119.800 120.883 -1.083 19947
301 1 1 . 1 1 72 72 CYS HA H 72 4.900 4.900 4.541 0.359 19947
302 1 1 . 1 1 72 72 CYS CA C 72 53.400 53.400 58.987 -5.587 19947
303 1 1 . 1 1 72 72 CYS CB C 72 37.200 37.200 28.877 8.323 19947
304 1 1 . 1 1 72 72 CYS H H 72 9.330 9.330 8.482 0.848 19947
305 1 1 . 1 1 73 73 THR N N 73 112.700 112.700 114.105 -1.405 19947
306 1 1 . 1 1 73 73 THR HA H 73 4.430 4.430 4.426 0.004 19947
307 1 1 . 1 1 73 73 THR CA C 73 62.300 62.300 60.934 1.366 19947
308 1 1 . 1 1 73 73 THR CB C 73 71.300 71.300 69.686 1.614 19947
309 1 1 . 1 1 73 73 THR H H 73 9.980 9.980 8.717 1.263 19947
310 1 1 . 1 1 74 74 GLY N N 74 111.500 111.500 110.267 1.233 19947
311 1 1 . 1 1 74 74 GLY CA C 74 45.300 45.300 46.481 -1.181 19947
312 1 1 . 1 1 74 74 GLY H H 74 8.580 8.580 7.734 0.846 19947
313 1 1 . 1 1 75 75 LYS N N 75 115.900 115.900 116.834 -0.934 19947
314 1 1 . 1 1 75 75 LYS HA H 75 4.140 4.140 4.504 -0.364 19947
315 1 1 . 1 1 75 75 LYS CA C 75 54.800 54.800 55.626 -0.826 19947
316 1 1 . 1 1 75 75 LYS CB C 75 34.200 34.200 34.219 -0.019 19947
317 1 1 . 1 1 75 75 LYS H H 75 7.900 7.900 7.597 0.303 19947
318 1 1 . 1 1 76 76 SER N N 76 111.000 111.000 112.570 -1.570 19947
319 1 1 . 1 1 76 76 SER HA H 76 4.160 4.160 3.870 0.290 19947
320 1 1 . 1 1 76 76 SER CA C 76 61.400 61.400 56.835 4.565 19947
321 1 1 . 1 1 76 76 SER CB C 76 64.300 64.300 65.474 -1.174 19947
322 1 1 . 1 1 76 76 SER H H 76 6.520 6.520 6.837 -0.317 19947
323 1 1 . 1 1 77 77 SER N N 77 117.100 117.100 114.512 2.588 19947
324 1 1 . 1 1 77 77 SER HA H 77 4.220 4.220 4.497 -0.277 19947
325 1 1 . 1 1 77 77 SER CA C 77 59.800 59.800 59.262 0.538 19947
326 1 1 . 1 1 77 77 SER CB C 77 64.400 64.400 63.831 0.569 19947
327 1 1 . 1 1 77 77 SER H H 77 9.030 9.030 8.216 0.814 19947
328 1 1 . 1 1 78 78 ASP N N 78 122.100 122.100 122.333 -0.233 19947
329 1 1 . 1 1 78 78 ASP HA H 78 4.930 4.930 4.701 0.229 19947
330 1 1 . 1 1 78 78 ASP CA C 78 52.400 52.400 53.656 -1.256 19947
331 1 1 . 1 1 78 78 ASP CB C 78 40.800 40.800 44.157 -3.357 19947
332 1 1 . 1 1 78 78 ASP H H 78 8.340 8.340 7.348 0.992 19947
333 1 1 . 1 1 79 79 CYS N N 79 122.200 122.200 121.767 0.433 19947
334 1 1 . 1 1 79 79 CYS HA H 79 5.320 5.320 4.883 0.437 19947
335 1 1 . 1 1 79 79 CYS CA C 79 52.000 52.000 55.486 -3.486 19947
336 1 1 . 1 1 79 79 CYS CB C 79 39.300 39.300 27.852 11.448 19947
337 1 1 . 1 1 79 79 CYS H H 79 8.960 8.960 8.226 0.734 19947
338 1 1 . 1 1 80 80 PRO HA H 80 4.410 4.410 4.086 0.324 19947
339 1 1 . 1 1 80 80 PRO CA C 80 63.500 63.500 62.940 0.560 19947
340 1 1 . 1 1 80 80 PRO CB C 80 32.400 32.400 32.755 -0.354 19947
341 1 1 . 1 1 81 81 TRP N N 81 120.500 120.500 121.413 -0.913 19947
342 1 1 . 1 1 81 81 TRP HA H 81 4.550 4.550 4.251 0.299 19947
343 1 1 . 1 1 81 81 TRP CA C 81 56.400 56.400 57.984 -1.584 19947
344 1 1 . 1 1 81 81 TRP CB C 81 29.500 29.500 28.608 0.892 19947
345 1 1 . 1 1 81 81 TRP H H 81 8.400 8.400 7.546 0.854 19947
346 1 1 . 1 1 82 82 ASN N N 82 120.400 120.400 114.658 5.742 19947
347 1 1 . 1 1 82 82 ASN HA H 82 4.750 4.750 4.509 0.241 19947
348 1 1 . 1 1 82 82 ASN CA C 82 53.100 53.100 53.655 -0.555 19947
349 1 1 . 1 1 82 82 ASN CB C 82 39.000 39.000 37.267 1.733 19947
350 1 1 . 1 1 82 82 ASN H H 82 8.040 8.040 8.256 -0.216 19947
351 1 2 . 1 1 2 2 PRO HA H 2 4.820 4.820 4.647 0.173 19947
352 1 2 . 1 1 2 2 PRO CA C 2 61.900 61.900 62.265 -0.365 19947
353 1 2 . 1 1 2 2 PRO CB C 2 30.700 30.700 31.612 -0.912 19947
354 1 2 . 1 1 3 3 PRO HA H 3 4.540 4.540 4.446 0.094 19947
355 1 2 . 1 1 3 3 PRO CA C 3 62.900 62.900 62.383 0.518 19947
356 1 2 . 1 1 3 3 PRO CB C 3 32.100 32.100 32.378 -0.278 19947
357 1 2 . 1 1 4 4 VAL N N 4 121.900 121.900 122.942 -1.042 19947
358 1 2 . 1 1 4 4 VAL HA H 4 4.200 4.200 4.163 0.037 19947
359 1 2 . 1 1 4 4 VAL CA C 4 62.300 62.300 61.847 0.452 19947
360 1 2 . 1 1 4 4 VAL CB C 4 32.800 32.800 29.795 3.005 19947
361 1 2 . 1 1 4 4 VAL H H 4 8.330 8.330 8.309 0.021 19947
362 1 2 . 1 1 5 5 CYS N N 5 120.900 120.900 127.153 -6.253 19947
363 1 2 . 1 1 5 5 CYS HA H 5 4.700 4.700 4.342 0.358 19947
364 1 2 . 1 1 5 5 CYS CA C 5 53.600 53.600 59.452 -5.852 19947
365 1 2 . 1 1 5 5 CYS H H 5 8.500 8.500 8.495 0.005 19947
366 1 2 . 1 1 6 6 GLY N N 6 110.200 110.200 114.095 -3.895 19947
367 1 2 . 1 1 6 6 GLY CA C 6 46.300 46.300 44.778 1.522 19947
368 1 2 . 1 1 6 6 GLY H H 6 8.490 8.490 8.407 0.083 19947
369 1 2 . 1 1 7 7 ASN N N 7 120.100 120.100 117.291 2.809 19947
370 1 2 . 1 1 7 7 ASN HA H 7 4.730 4.730 4.358 0.372 19947
371 1 2 . 1 1 7 7 ASN CA C 7 53.200 53.200 54.686 -1.486 19947
372 1 2 . 1 1 7 7 ASN CB C 7 38.700 38.700 39.430 -0.730 19947
373 1 2 . 1 1 7 7 ASN H H 7 8.320 8.320 8.162 0.158 19947
374 1 2 . 1 1 8 8 LYS N N 8 121.300 121.300 119.767 1.533 19947
375 1 2 . 1 1 8 8 LYS HA H 8 4.340 4.340 4.343 -0.003 19947
376 1 2 . 1 1 8 8 LYS CA C 8 56.600 56.600 56.886 -0.286 19947
377 1 2 . 1 1 8 8 LYS CB C 8 32.900 32.900 31.914 0.986 19947
378 1 2 . 1 1 8 8 LYS H H 8 8.260 8.260 8.273 -0.013 19947
379 1 2 . 1 1 9 9 ILE N N 9 136.600 136.600 123.146 13.454 19947
380 1 2 . 1 1 9 9 ILE HA H 9 4.140 4.140 3.988 0.152 19947
381 1 2 . 1 1 9 9 ILE CA C 9 61.300 61.300 62.143 -0.843 19947
382 1 2 . 1 1 9 9 ILE CB C 9 38.200 38.200 37.789 0.411 19947
383 1 2 . 1 1 9 9 ILE H H 9 8.150 8.150 8.769 -0.619 19947
384 1 2 . 1 1 10 10 LEU N N 10 125.700 125.700 124.307 1.393 19947
385 1 2 . 1 1 10 10 LEU HA H 10 4.420 4.420 4.413 0.007 19947
386 1 2 . 1 1 10 10 LEU CA C 10 55.200 55.200 55.858 -0.658 19947
387 1 2 . 1 1 10 10 LEU CB C 10 42.300 42.300 40.547 1.753 19947
388 1 2 . 1 1 10 10 LEU H H 10 8.230 8.230 8.327 -0.097 19947
389 1 2 . 1 1 11 11 GLU N N 11 120.600 120.600 113.134 7.466 19947
390 1 2 . 1 1 11 11 GLU HA H 11 4.470 4.470 4.140 0.330 19947
391 1 2 . 1 1 11 11 GLU CA C 11 55.500 55.500 56.813 -1.313 19947
392 1 2 . 1 1 11 11 GLU CB C 11 28.900 28.900 28.154 0.746 19947
393 1 2 . 1 1 11 11 GLU H H 11 8.250 8.250 7.921 0.329 19947
394 1 2 . 1 1 12 12 GLN N N 12 121.600 121.600 119.232 2.368 19947
395 1 2 . 1 1 12 12 GLN HA H 12 4.350 4.350 4.470 -0.120 19947
396 1 2 . 1 1 12 12 GLN CA C 12 56.600 56.600 56.011 0.589 19947
397 1 2 . 1 1 12 12 GLN CB C 12 29.200 29.200 29.372 -0.171 19947
398 1 2 . 1 1 12 12 GLN H H 12 8.460 8.460 7.776 0.684 19947
399 1 2 . 1 1 13 13 GLY N N 13 110.700 110.700 106.906 3.794 19947
400 1 2 . 1 1 13 13 GLY CA C 13 45.700 45.700 45.805 -0.105 19947
401 1 2 . 1 1 13 13 GLY H H 13 8.660 8.660 8.633 0.027 19947
402 1 2 . 1 1 14 14 GLU N N 14 118.900 118.900 114.856 4.044 19947
403 1 2 . 1 1 14 14 GLU HA H 14 4.530 4.530 4.141 0.389 19947
404 1 2 . 1 1 14 14 GLU CA C 14 55.600 55.600 56.864 -1.264 19947
405 1 2 . 1 1 14 14 GLU CB C 14 29.700 29.700 29.654 0.046 19947
406 1 2 . 1 1 14 14 GLU H H 14 8.230 8.230 8.250 -0.020 19947
407 1 2 . 1 1 15 15 ASP N N 15 118.400 118.400 120.194 -1.794 19947
408 1 2 . 1 1 15 15 ASP HA H 15 4.990 4.990 4.470 0.520 19947
409 1 2 . 1 1 15 15 ASP CA C 15 53.500 53.500 57.184 -3.684 19947
410 1 2 . 1 1 15 15 ASP CB C 15 39.700 39.700 41.345 -1.645 19947
411 1 2 . 1 1 15 15 ASP H H 15 8.330 8.330 8.469 -0.139 19947
412 1 2 . 1 1 16 16 CYS HA H 16 4.340 4.340 4.491 -0.151 19947
413 1 2 . 1 1 16 16 CYS H H 16 8.510 8.510 7.941 0.569 19947
414 1 2 . 1 1 17 17 ASP N N 17 116.700 116.700 120.353 -3.653 19947
415 1 2 . 1 1 17 17 ASP HA H 17 4.740 4.740 4.226 0.514 19947
416 1 2 . 1 1 17 17 ASP CA C 17 53.100 53.100 55.733 -2.633 19947
417 1 2 . 1 1 17 17 ASP CB C 17 38.600 38.600 39.117 -0.517 19947
418 1 2 . 1 1 17 17 ASP H H 17 8.180 8.180 8.890 -0.710 19947
419 1 2 . 1 1 18 18 CYS HA H 18 4.730 4.730 3.964 0.766 19947
420 1 2 . 1 1 18 18 CYS CB C 18 41.900 41.900 26.896 15.004 19947
421 1 2 . 1 1 19 19 GLY H H 19 8.220 8.220 8.587 -0.367 19947
422 1 2 . 1 1 20 20 SER HA H 20 4.920 4.920 4.430 0.490 19947
423 1 2 . 1 1 20 20 SER CA C 20 55.700 55.700 57.788 -2.088 19947
424 1 2 . 1 1 20 20 SER CB C 20 63.500 63.500 62.982 0.518 19947
425 1 2 . 1 1 20 20 SER H H 20 7.830 7.830 8.389 -0.559 19947
426 1 2 . 1 1 21 21 PRO HA H 21 4.240 4.240 4.108 0.132 19947
427 1 2 . 1 1 21 21 PRO CA C 21 63.400 63.400 65.582 -2.182 19947
428 1 2 . 1 1 21 21 PRO CB C 21 31.800 31.800 31.336 0.464 19947
429 1 2 . 1 1 22 22 ALA N N 22 119.900 119.900 119.004 0.896 19947
430 1 2 . 1 1 22 22 ALA HA H 22 4.220 4.220 4.122 0.098 19947
431 1 2 . 1 1 22 22 ALA CA C 22 54.200 54.200 54.020 0.180 19947
432 1 2 . 1 1 22 22 ALA CB C 22 18.500 18.500 18.417 0.083 19947
433 1 2 . 1 1 22 22 ALA H H 22 8.180 8.180 8.415 -0.235 19947
434 1 2 . 1 1 23 23 ASN N N 23 116.300 116.300 112.424 3.876 19947
435 1 2 . 1 1 23 23 ASN HA H 23 4.670 4.670 4.990 -0.320 19947
436 1 2 . 1 1 23 23 ASN CA C 23 53.200 53.200 51.926 1.274 19947
437 1 2 . 1 1 23 23 ASN CB C 23 39.300 39.300 40.133 -0.833 19947
438 1 2 . 1 1 23 23 ASN H H 23 7.960 7.960 8.203 -0.243 19947
439 1 2 . 1 1 24 24 CYS HA H 24 4.720 4.720 4.585 0.135 19947
440 1 2 . 1 1 24 24 CYS H H 24 8.510 8.510 8.281 0.229 19947
441 1 2 . 1 1 25 25 GLN HA H 25 4.460 4.460 3.891 0.569 19947
442 1 2 . 1 1 25 25 GLN H H 25 8.320 8.320 8.704 -0.384 19947
443 1 2 . 1 1 26 26 ASP HA H 26 4.740 4.740 4.602 0.138 19947
444 1 2 . 1 1 26 26 ASP H H 26 8.580 8.580 8.657 -0.077 19947
445 1 2 . 1 1 27 27 ARG HA H 27 4.680 4.680 4.377 0.303 19947
446 1 2 . 1 1 27 27 ARG CA C 27 54.700 54.700 58.023 -3.323 19947
447 1 2 . 1 1 27 27 ARG H H 27 8.550 8.550 8.517 0.033 19947
448 1 2 . 1 1 28 28 CYS HA H 28 4.120 4.120 4.742 -0.622 19947
449 1 2 . 1 1 28 28 CYS CA C 28 54.400 54.400 58.355 -3.955 19947
450 1 2 . 1 1 28 28 CYS CB C 28 19.000 19.000 26.863 -7.863 19947
451 1 2 . 1 1 28 28 CYS H H 28 8.910 8.910 8.414 0.496 19947
452 1 2 . 1 1 29 29 CYS N N 29 113.300 113.300 120.471 -7.171 19947
453 1 2 . 1 1 29 29 CYS HA H 29 5.010 5.010 4.636 0.374 19947
454 1 2 . 1 1 29 29 CYS CA C 29 54.300 54.300 57.697 -3.397 19947
455 1 2 . 1 1 29 29 CYS H H 29 7.730 7.730 7.867 -0.137 19947
456 1 2 . 1 1 30 30 ASN HA H 30 4.730 4.730 5.053 -0.323 19947
457 1 2 . 1 1 30 30 ASN CB C 30 38.700 38.700 40.223 -1.523 19947
458 1 2 . 1 1 30 30 ASN H H 30 8.870 8.870 8.945 -0.075 19947
459 1 2 . 1 1 31 31 ALA N N 31 129.400 129.400 126.891 2.509 19947
460 1 2 . 1 1 31 31 ALA HA H 31 4.120 4.120 4.344 -0.224 19947
461 1 2 . 1 1 31 31 ALA CA C 31 54.400 54.400 54.671 -0.271 19947
462 1 2 . 1 1 31 31 ALA CB C 31 19.000 19.000 19.248 -0.248 19947
463 1 2 . 1 1 31 31 ALA H H 31 8.890 8.890 8.628 0.262 19947
464 1 2 . 1 1 32 32 ALA N N 32 116.400 116.400 118.480 -2.080 19947
465 1 2 . 1 1 32 32 ALA HA H 32 4.340 4.340 4.243 0.097 19947
466 1 2 . 1 1 32 32 ALA CA C 32 53.800 53.800 53.477 0.323 19947
467 1 2 . 1 1 32 32 ALA CB C 32 19.100 19.100 18.880 0.221 19947
468 1 2 . 1 1 32 32 ALA H H 32 8.250 8.250 8.325 -0.075 19947
469 1 2 . 1 1 33 33 THR N N 33 104.300 104.300 110.822 -6.522 19947
470 1 2 . 1 1 33 33 THR HA H 33 4.430 4.430 4.364 0.066 19947
471 1 2 . 1 1 33 33 THR CA C 33 60.500 60.500 61.310 -0.810 19947
472 1 2 . 1 1 33 33 THR CB C 33 70.600 70.600 69.167 1.433 19947
473 1 2 . 1 1 33 33 THR H H 33 7.320 7.320 7.591 -0.271 19947
474 1 2 . 1 1 34 34 CYS N N 34 123.400 123.400 121.588 1.812 19947
475 1 2 . 1 1 34 34 CYS HA H 34 4.170 4.170 4.251 -0.081 19947
476 1 2 . 1 1 34 34 CYS CA C 34 56.500 56.500 60.341 -3.841 19947
477 1 2 . 1 1 34 34 CYS H H 34 8.710 8.710 8.286 0.424 19947
478 1 2 . 1 1 35 35 LYS N N 35 116.900 116.900 116.846 0.054 19947
479 1 2 . 1 1 35 35 LYS HA H 35 4.960 4.960 4.862 0.098 19947
480 1 2 . 1 1 35 35 LYS CA C 35 53.900 53.900 55.493 -1.593 19947
481 1 2 . 1 1 35 35 LYS CB C 35 35.900 35.900 35.715 0.185 19947
482 1 2 . 1 1 35 35 LYS H H 35 7.450 7.450 7.844 -0.394 19947
483 1 2 . 1 1 36 36 LEU N N 36 119.300 119.300 117.270 2.030 19947
484 1 2 . 1 1 36 36 LEU HA H 36 4.800 4.800 4.561 0.239 19947
485 1 2 . 1 1 36 36 LEU CB C 36 42.400 42.400 42.779 -0.379 19947
486 1 2 . 1 1 36 36 LEU H H 36 8.290 8.290 8.448 -0.158 19947
487 1 2 . 1 1 37 37 THR HA H 37 4.340 4.340 4.792 -0.452 19947
488 1 2 . 1 1 37 37 THR CA C 37 60.200 60.200 58.578 1.622 19947
489 1 2 . 1 1 37 37 THR CB C 37 67.700 67.700 68.925 -1.225 19947
490 1 2 . 1 1 37 37 THR H H 37 8.380 8.380 8.122 0.258 19947
491 1 2 . 1 1 38 38 PRO HA H 38 4.380 4.380 4.103 0.277 19947
492 1 2 . 1 1 38 38 PRO CA C 38 64.800 64.800 64.162 0.638 19947
493 1 2 . 1 1 38 38 PRO CB C 38 31.500 31.500 31.799 -0.299 19947
494 1 2 . 1 1 39 39 GLY N N 39 113.300 113.300 110.310 2.990 19947
495 1 2 . 1 1 39 39 GLY CA C 39 45.100 45.100 45.169 -0.069 19947
496 1 2 . 1 1 39 39 GLY H H 39 8.830 8.830 8.447 0.383 19947
497 1 2 . 1 1 40 40 SER N N 40 116.700 116.700 116.682 0.018 19947
498 1 2 . 1 1 40 40 SER HA H 40 4.610 4.610 4.684 -0.074 19947
499 1 2 . 1 1 40 40 SER CA C 40 58.800 58.800 56.708 2.092 19947
500 1 2 . 1 1 40 40 SER CB C 40 63.800 63.800 63.511 0.289 19947
501 1 2 . 1 1 40 40 SER H H 40 8.280 8.280 7.630 0.650 19947
502 1 2 . 1 1 41 41 GLN N N 41 120.600 120.600 125.696 -5.096 19947
503 1 2 . 1 1 41 41 GLN HA H 41 4.110 4.110 3.976 0.134 19947
504 1 2 . 1 1 41 41 GLN CA C 41 55.200 55.200 57.022 -1.821 19947
505 1 2 . 1 1 41 41 GLN CB C 41 31.100 31.100 28.931 2.169 19947
506 1 2 . 1 1 41 41 GLN H H 41 9.190 9.190 8.132 1.058 19947
507 1 2 . 1 1 42 42 CYS N N 42 113.200 113.200 116.238 -3.038 19947
508 1 2 . 1 1 42 42 CYS HA H 42 4.630 4.630 4.569 0.061 19947
509 1 2 . 1 1 42 42 CYS CA C 42 53.700 53.700 57.693 -3.993 19947
510 1 2 . 1 1 42 42 CYS CB C 42 45.500 45.500 29.928 15.572 19947
511 1 2 . 1 1 42 42 CYS H H 42 7.710 7.710 7.498 0.212 19947
512 1 2 . 1 1 43 43 ASN N N 43 114.200 114.200 123.025 -8.825 19947
513 1 2 . 1 1 43 43 ASN HA H 43 4.940 4.940 4.727 0.213 19947
514 1 2 . 1 1 43 43 ASN CA C 43 53.000 53.000 54.526 -1.526 19947
515 1 2 . 1 1 43 43 ASN CB C 43 39.300 39.300 39.343 -0.043 19947
516 1 2 . 1 1 43 43 ASN H H 43 8.870 8.870 8.672 0.198 19947
517 1 2 . 1 1 44 44 TYR N N 44 118.400 118.400 113.737 4.663 19947
518 1 2 . 1 1 44 44 TYR HA H 44 4.850 4.850 4.635 0.215 19947
519 1 2 . 1 1 44 44 TYR CA C 44 55.300 55.300 57.888 -2.588 19947
520 1 2 . 1 1 44 44 TYR CB C 44 40.700 40.700 39.320 1.380 19947
521 1 2 . 1 1 44 44 TYR H H 44 7.840 7.840 7.302 0.538 19947
522 1 2 . 1 1 45 45 GLY N N 45 110.600 110.600 108.128 2.472 19947
523 1 2 . 1 1 45 45 GLY CA C 45 44.000 44.000 45.018 -1.018 19947
524 1 2 . 1 1 45 45 GLY H H 45 7.960 7.960 8.183 -0.223 19947
525 1 2 . 1 1 46 46 GLU N N 46 120.700 120.700 120.266 0.434 19947
526 1 2 . 1 1 46 46 GLU HA H 46 4.280 4.280 4.115 0.165 19947
527 1 2 . 1 1 46 46 GLU CA C 46 58.500 58.500 59.747 -1.247 19947
528 1 2 . 1 1 46 46 GLU CB C 46 29.300 29.300 30.147 -0.847 19947
529 1 2 . 1 1 46 46 GLU H H 46 9.160 9.160 8.736 0.424 19947
530 1 2 . 1 1 47 47 CYS N N 47 112.400 112.400 117.718 -5.318 19947
531 1 2 . 1 1 47 47 CYS HA H 47 4.850 4.850 4.767 0.083 19947
532 1 2 . 1 1 47 47 CYS CA C 47 57.100 57.100 58.076 -0.976 19947
533 1 2 . 1 1 47 47 CYS CB C 47 41.200 41.200 25.808 15.392 19947
534 1 2 . 1 1 47 47 CYS H H 47 8.510 8.510 7.592 0.918 19947
535 1 2 . 1 1 48 48 CYS N N 48 123.200 123.200 121.058 2.142 19947
536 1 2 . 1 1 48 48 CYS HA H 48 5.160 5.160 5.164 -0.004 19947
537 1 2 . 1 1 48 48 CYS CA C 48 54.700 54.700 58.424 -3.724 19947
538 1 2 . 1 1 48 48 CYS CB C 48 45.700 45.700 29.388 16.312 19947
539 1 2 . 1 1 48 48 CYS H H 48 7.810 7.810 7.668 0.142 19947
540 1 2 . 1 1 49 49 ASP N N 49 127.400 127.400 122.852 4.548 19947
541 1 2 . 1 1 49 49 ASP HA H 49 4.890 4.890 4.991 -0.101 19947
542 1 2 . 1 1 49 49 ASP CA C 49 53.500 53.500 54.135 -0.635 19947
543 1 2 . 1 1 49 49 ASP CB C 49 42.400 42.400 44.824 -2.424 19947
544 1 2 . 1 1 49 49 ASP H H 49 9.670 9.670 8.639 1.031 19947
545 1 2 . 1 1 50 50 GLN N N 50 127.000 127.000 123.256 3.744 19947
546 1 2 . 1 1 50 50 GLN HA H 50 3.940 3.940 3.931 0.009 19947
547 1 2 . 1 1 50 50 GLN CA C 50 56.800 56.800 58.366 -1.566 19947
548 1 2 . 1 1 50 50 GLN CB C 50 26.500 26.500 27.869 -1.369 19947
549 1 2 . 1 1 50 50 GLN H H 50 9.450 9.450 8.869 0.581 19947
550 1 2 . 1 1 51 51 CYS N N 51 106.100 106.100 117.413 -11.313 19947
551 1 2 . 1 1 51 51 CYS HA H 51 4.760 4.760 4.786 -0.026 19947
552 1 2 . 1 1 51 51 CYS CB C 51 43.200 43.200 27.880 15.320 19947
553 1 2 . 1 1 51 51 CYS H H 51 8.700 8.700 8.120 0.580 19947
554 1 2 . 1 1 52 52 ARG N N 52 121.000 121.000 118.793 2.207 19947
555 1 2 . 1 1 52 52 ARG HA H 52 4.690 4.690 4.528 0.162 19947
556 1 2 . 1 1 52 52 ARG CA C 52 55.400 55.400 54.827 0.573 19947
557 1 2 . 1 1 52 52 ARG CB C 52 33.100 33.100 35.020 -1.920 19947
558 1 2 . 1 1 52 52 ARG H H 52 7.960 7.960 8.246 -0.286 19947
559 1 2 . 1 1 53 53 PHE N N 53 120.300 120.300 119.936 0.364 19947
560 1 2 . 1 1 53 53 PHE HA H 53 5.050 5.050 5.137 -0.087 19947
561 1 2 . 1 1 53 53 PHE CA C 53 56.100 56.100 56.292 -0.192 19947
562 1 2 . 1 1 53 53 PHE CB C 53 38.200 38.200 39.178 -0.978 19947
563 1 2 . 1 1 53 53 PHE H H 53 8.400 8.400 8.179 0.221 19947
564 1 2 . 1 1 54 54 LYS N N 54 123.300 123.300 125.847 -2.547 19947
565 1 2 . 1 1 54 54 LYS HA H 54 4.250 4.250 4.096 0.154 19947
566 1 2 . 1 1 54 54 LYS CA C 54 57.500 57.500 56.831 0.669 19947
567 1 2 . 1 1 54 54 LYS CB C 54 34.300 34.300 31.713 2.587 19947
568 1 2 . 1 1 54 54 LYS H H 54 8.540 8.540 8.601 -0.061 19947
569 1 2 . 1 1 55 55 LYS N N 55 119.400 119.400 124.045 -4.645 19947
570 1 2 . 1 1 55 55 LYS HA H 55 4.110 4.110 4.005 0.105 19947
571 1 2 . 1 1 55 55 LYS CA C 55 56.500 56.500 57.028 -0.528 19947
572 1 2 . 1 1 55 55 LYS CB C 55 33.400 33.400 33.119 0.281 19947
573 1 2 . 1 1 55 55 LYS H H 55 8.440 8.440 8.052 0.388 19947
574 1 2 . 1 1 56 56 ALA N N 56 126.700 126.700 127.745 -1.045 19947
575 1 2 . 1 1 56 56 ALA HA H 56 3.920 3.920 4.012 -0.092 19947
576 1 2 . 1 1 56 56 ALA CA C 56 52.900 52.900 53.752 -0.852 19947
577 1 2 . 1 1 56 56 ALA CB C 56 18.100 18.100 18.436 -0.336 19947
578 1 2 . 1 1 56 56 ALA H H 56 8.930 8.930 8.557 0.373 19947
579 1 2 . 1 1 57 57 GLY N N 57 109.300 109.300 110.978 -1.678 19947
580 1 2 . 1 1 57 57 GLY CA C 57 45.100 45.100 44.897 0.203 19947
581 1 2 . 1 1 57 57 GLY H H 57 8.460 8.460 8.460 0.000 19947
582 1 2 . 1 1 58 58 THR N N 58 117.200 117.200 119.947 -2.747 19947
583 1 2 . 1 1 58 58 THR HA H 58 4.260 4.260 4.475 -0.215 19947
584 1 2 . 1 1 58 58 THR CA C 58 63.300 63.300 62.793 0.507 19947
585 1 2 . 1 1 58 58 THR CB C 58 69.600 69.600 69.049 0.551 19947
586 1 2 . 1 1 58 58 THR H H 58 7.660 7.660 7.778 -0.118 19947
587 1 2 . 1 1 59 59 VAL N N 59 130.400 130.400 127.584 2.816 19947
588 1 2 . 1 1 59 59 VAL HA H 59 3.900 3.900 4.049 -0.149 19947
589 1 2 . 1 1 59 59 VAL CA C 59 64.400 64.400 63.161 1.239 19947
590 1 2 . 1 1 59 59 VAL CB C 59 31.900 31.900 32.227 -0.328 19947
591 1 2 . 1 1 59 59 VAL H H 59 9.190 9.190 8.660 0.530 19947
592 1 2 . 1 1 60 60 CYS N N 60 121.800 121.800 127.297 -5.497 19947
593 1 2 . 1 1 60 60 CYS HA H 60 5.050 5.050 4.606 0.444 19947
594 1 2 . 1 1 60 60 CYS CA C 60 54.400 54.400 58.336 -3.936 19947
595 1 2 . 1 1 60 60 CYS CB C 60 43.000 43.000 27.288 15.712 19947
596 1 2 . 1 1 60 60 CYS H H 60 9.130 9.130 8.339 0.791 19947
597 1 2 . 1 1 61 61 ARG N N 61 124.100 124.100 118.674 5.426 19947
598 1 2 . 1 1 61 61 ARG HA H 61 4.360 4.360 4.640 -0.280 19947
599 1 2 . 1 1 61 61 ARG CA C 61 56.800 56.800 55.384 1.416 19947
600 1 2 . 1 1 61 61 ARG CB C 61 32.800 32.800 34.448 -1.648 19947
601 1 2 . 1 1 61 61 ARG H H 61 7.580 7.580 7.560 0.020 19947
602 1 2 . 1 1 62 62 ILE N N 62 126.200 126.200 116.541 9.659 19947
603 1 2 . 1 1 62 62 ILE HA H 62 4.090 4.090 4.548 -0.458 19947
604 1 2 . 1 1 62 62 ILE CA C 62 60.300 60.300 61.424 -1.124 19947
605 1 2 . 1 1 62 62 ILE CB C 62 38.700 38.700 40.767 -2.067 19947
606 1 2 . 1 1 62 62 ILE H H 62 8.490 8.490 8.523 -0.033 19947
607 1 2 . 1 1 63 63 ALA N N 63 129.400 129.400 131.885 -2.485 19947
608 1 2 . 1 1 63 63 ALA HA H 63 4.310 4.310 4.440 -0.130 19947
609 1 2 . 1 1 63 63 ALA CA C 63 51.900 51.900 54.182 -2.282 19947
610 1 2 . 1 1 63 63 ALA CB C 63 20.600 20.600 19.107 1.494 19947
611 1 2 . 1 1 63 63 ALA H H 63 8.100 8.100 8.574 -0.474 19947
612 1 2 . 1 1 64 64 ARG N N 64 120.500 120.500 120.936 -0.436 19947
613 1 2 . 1 1 64 64 ARG HA H 64 4.290 4.290 4.506 -0.216 19947
614 1 2 . 1 1 64 64 ARG CA C 64 56.200 56.200 55.859 0.341 19947
615 1 2 . 1 1 64 64 ARG CB C 64 30.500 30.500 30.099 0.401 19947
616 1 2 . 1 1 64 64 ARG H H 64 8.140 8.140 8.768 -0.628 19947
617 1 2 . 1 1 65 65 GLY N N 65 110.500 110.500 111.510 -1.010 19947
618 1 2 . 1 1 65 65 GLY CA C 65 45.100 45.100 44.490 0.610 19947
619 1 2 . 1 1 65 65 GLY H H 65 8.040 8.040 8.332 -0.292 19947
620 1 2 . 1 1 66 66 ASP N N 66 120.700 120.700 119.390 1.310 19947
621 1 2 . 1 1 66 66 ASP HA H 66 4.610 4.610 4.398 0.212 19947
622 1 2 . 1 1 66 66 ASP CA C 66 53.300 53.300 54.195 -0.895 19947
623 1 2 . 1 1 66 66 ASP CB C 66 37.600 37.600 40.873 -3.273 19947
624 1 2 . 1 1 66 66 ASP H H 66 8.380 8.380 7.176 1.204 19947
625 1 2 . 1 1 67 67 TRP N N 67 120.100 120.100 123.251 -3.151 19947
626 1 2 . 1 1 67 67 TRP HA H 67 4.760 4.760 5.130 -0.370 19947
627 1 2 . 1 1 67 67 TRP CA C 67 57.200 57.200 58.045 -0.845 19947
628 1 2 . 1 1 67 67 TRP CB C 67 29.100 29.100 29.526 -0.426 19947
629 1 2 . 1 1 67 67 TRP H H 67 7.950 7.950 7.784 0.166 19947
630 1 2 . 1 1 68 68 ASN N N 68 118.400 118.400 118.112 0.288 19947
631 1 2 . 1 1 68 68 ASN HA H 68 4.790 4.790 4.967 -0.177 19947
632 1 2 . 1 1 68 68 ASN CA C 68 52.800 52.800 53.855 -1.056 19947
633 1 2 . 1 1 68 68 ASN CB C 68 39.300 39.300 40.084 -0.784 19947
634 1 2 . 1 1 68 68 ASN H H 68 8.180 8.180 8.705 -0.525 19947
635 1 2 . 1 1 69 69 ASP N N 69 118.500 118.500 117.951 0.549 19947
636 1 2 . 1 1 69 69 ASP HA H 69 4.620 4.620 4.445 0.175 19947
637 1 2 . 1 1 69 69 ASP CA C 69 53.200 53.200 55.946 -2.746 19947
638 1 2 . 1 1 69 69 ASP CB C 69 38.000 38.000 40.642 -2.642 19947
639 1 2 . 1 1 69 69 ASP H H 69 8.130 8.130 8.327 -0.197 19947
640 1 2 . 1 1 70 70 ASP N N 70 120.500 120.500 120.903 -0.403 19947
641 1 2 . 1 1 70 70 ASP HA H 70 5.100 5.100 5.304 -0.204 19947
642 1 2 . 1 1 70 70 ASP CA C 70 52.500 52.500 52.866 -0.366 19947
643 1 2 . 1 1 70 70 ASP CB C 70 42.600 42.600 42.876 -0.276 19947
644 1 2 . 1 1 70 70 ASP H H 70 8.140 8.140 8.086 0.054 19947
645 1 2 . 1 1 71 71 TYR N N 71 118.900 118.900 123.495 -4.595 19947
646 1 2 . 1 1 71 71 TYR HA H 71 5.210 5.210 5.108 0.102 19947
647 1 2 . 1 1 71 71 TYR CA C 71 56.300 56.300 56.825 -0.525 19947
648 1 2 . 1 1 71 71 TYR CB C 71 42.200 42.200 42.438 -0.238 19947
649 1 2 . 1 1 71 71 TYR H H 71 8.450 8.450 8.157 0.293 19947
650 1 2 . 1 1 72 72 CYS N N 72 119.800 119.800 121.823 -2.023 19947
651 1 2 . 1 1 72 72 CYS HA H 72 4.900 4.900 4.445 0.455 19947
652 1 2 . 1 1 72 72 CYS CA C 72 53.400 53.400 59.913 -6.513 19947
653 1 2 . 1 1 72 72 CYS CB C 72 37.200 37.200 28.957 8.243 19947
654 1 2 . 1 1 72 72 CYS H H 72 9.330 9.330 8.650 0.680 19947
655 1 2 . 1 1 73 73 THR N N 73 112.700 112.700 114.002 -1.302 19947
656 1 2 . 1 1 73 73 THR HA H 73 4.430 4.430 4.469 -0.039 19947
657 1 2 . 1 1 73 73 THR CA C 73 62.300 62.300 60.873 1.427 19947
658 1 2 . 1 1 73 73 THR CB C 73 71.300 71.300 69.609 1.691 19947
659 1 2 . 1 1 73 73 THR H H 73 9.980 9.980 8.710 1.270 19947
660 1 2 . 1 1 74 74 GLY N N 74 111.500 111.500 110.347 1.153 19947
661 1 2 . 1 1 74 74 GLY CA C 74 45.300 45.300 46.580 -1.280 19947
662 1 2 . 1 1 74 74 GLY H H 74 8.580 8.580 7.779 0.801 19947
663 1 2 . 1 1 75 75 LYS N N 75 115.900 115.900 117.123 -1.223 19947
664 1 2 . 1 1 75 75 LYS HA H 75 4.140 4.140 4.612 -0.472 19947
665 1 2 . 1 1 75 75 LYS CA C 75 54.800 54.800 55.633 -0.833 19947
666 1 2 . 1 1 75 75 LYS CB C 75 34.200 34.200 33.988 0.212 19947
667 1 2 . 1 1 75 75 LYS H H 75 7.900 7.900 7.527 0.373 19947
668 1 2 . 1 1 76 76 SER N N 76 111.000 111.000 113.489 -2.489 19947
669 1 2 . 1 1 76 76 SER HA H 76 4.160 4.160 4.037 0.123 19947
670 1 2 . 1 1 76 76 SER CA C 76 61.400 61.400 56.746 4.654 19947
671 1 2 . 1 1 76 76 SER CB C 76 64.300 64.300 65.215 -0.914 19947
672 1 2 . 1 1 76 76 SER H H 76 6.520 6.520 7.171 -0.651 19947
673 1 2 . 1 1 77 77 SER N N 77 117.100 117.100 114.971 2.129 19947
674 1 2 . 1 1 77 77 SER HA H 77 4.220 4.220 4.419 -0.199 19947
675 1 2 . 1 1 77 77 SER CA C 77 59.800 59.800 58.557 1.243 19947
676 1 2 . 1 1 77 77 SER CB C 77 64.400 64.400 63.663 0.737 19947
677 1 2 . 1 1 77 77 SER H H 77 9.030 9.030 8.302 0.728 19947
678 1 2 . 1 1 78 78 ASP N N 78 122.100 122.100 118.966 3.134 19947
679 1 2 . 1 1 78 78 ASP HA H 78 4.930 4.930 4.960 -0.030 19947
680 1 2 . 1 1 78 78 ASP CA C 78 52.400 52.400 52.085 0.315 19947
681 1 2 . 1 1 78 78 ASP CB C 78 40.800 40.800 43.856 -3.056 19947
682 1 2 . 1 1 78 78 ASP H H 78 8.340 8.340 7.444 0.896 19947
683 1 2 . 1 1 79 79 CYS N N 79 122.200 122.200 120.219 1.981 19947
684 1 2 . 1 1 79 79 CYS HA H 79 5.320 5.320 4.925 0.395 19947
685 1 2 . 1 1 79 79 CYS CA C 79 52.000 52.000 56.221 -4.221 19947
686 1 2 . 1 1 79 79 CYS CB C 79 39.300 39.300 27.736 11.563 19947
687 1 2 . 1 1 79 79 CYS H H 79 8.960 8.960 8.362 0.598 19947
688 1 2 . 1 1 80 80 PRO HA H 80 4.410 4.410 4.552 -0.142 19947
689 1 2 . 1 1 80 80 PRO CA C 80 63.500 63.500 63.077 0.423 19947
690 1 2 . 1 1 80 80 PRO CB C 80 32.400 32.400 32.176 0.224 19947
691 1 2 . 1 1 81 81 TRP N N 81 120.500 120.500 121.846 -1.346 19947
692 1 2 . 1 1 81 81 TRP HA H 81 4.550 4.550 4.664 -0.114 19947
693 1 2 . 1 1 81 81 TRP CA C 81 56.400 56.400 53.975 2.425 19947
694 1 2 . 1 1 81 81 TRP CB C 81 29.500 29.500 28.451 1.049 19947
695 1 2 . 1 1 81 81 TRP H H 81 8.400 8.400 8.376 0.024 19947
696 1 2 . 1 1 82 82 ASN N N 82 120.400 120.400 116.305 4.095 19947
697 1 2 . 1 1 82 82 ASN HA H 82 4.750 4.750 4.431 0.319 19947
698 1 2 . 1 1 82 82 ASN CA C 82 53.100 53.100 53.995 -0.895 19947
699 1 2 . 1 1 82 82 ASN CB C 82 39.000 39.000 36.705 2.295 19947
700 1 2 . 1 1 82 82 ASN H H 82 8.040 8.040 8.475 -0.435 19947
701 1 3 . 1 1 2 2 PRO HA H 2 4.820 4.820 4.591 0.229 19947
702 1 3 . 1 1 2 2 PRO CA C 2 61.900 61.900 62.468 -0.568 19947
703 1 3 . 1 1 2 2 PRO CB C 2 30.700 30.700 31.637 -0.937 19947
704 1 3 . 1 1 3 3 PRO HA H 3 4.540 4.540 4.533 0.007 19947
705 1 3 . 1 1 3 3 PRO CA C 3 62.900 62.900 62.193 0.707 19947
706 1 3 . 1 1 3 3 PRO CB C 3 32.100 32.100 33.067 -0.967 19947
707 1 3 . 1 1 4 4 VAL N N 4 121.900 121.900 122.578 -0.678 19947
708 1 3 . 1 1 4 4 VAL HA H 4 4.200 4.200 4.096 0.104 19947
709 1 3 . 1 1 4 4 VAL CA C 4 62.300 62.300 62.369 -0.069 19947
710 1 3 . 1 1 4 4 VAL CB C 4 32.800 32.800 30.399 2.401 19947
711 1 3 . 1 1 4 4 VAL H H 4 8.330 8.330 8.393 -0.063 19947
712 1 3 . 1 1 5 5 CYS N N 5 120.900 120.900 128.064 -7.164 19947
713 1 3 . 1 1 5 5 CYS HA H 5 4.700 4.700 4.363 0.337 19947
714 1 3 . 1 1 5 5 CYS CA C 5 53.600 53.600 59.620 -6.019 19947
715 1 3 . 1 1 5 5 CYS H H 5 8.500 8.500 8.732 -0.232 19947
716 1 3 . 1 1 6 6 GLY N N 6 110.200 110.200 114.206 -4.006 19947
717 1 3 . 1 1 6 6 GLY CA C 6 46.300 46.300 44.922 1.378 19947
718 1 3 . 1 1 6 6 GLY H H 6 8.490 8.490 8.469 0.021 19947
719 1 3 . 1 1 7 7 ASN N N 7 120.100 120.100 116.271 3.829 19947
720 1 3 . 1 1 7 7 ASN HA H 7 4.730 4.730 4.373 0.357 19947
721 1 3 . 1 1 7 7 ASN CA C 7 53.200 53.200 54.021 -0.821 19947
722 1 3 . 1 1 7 7 ASN CB C 7 38.700 38.700 39.127 -0.427 19947
723 1 3 . 1 1 7 7 ASN H H 7 8.320 8.320 8.175 0.145 19947
724 1 3 . 1 1 8 8 LYS N N 8 121.300 121.300 121.842 -0.542 19947
725 1 3 . 1 1 8 8 LYS HA H 8 4.340 4.340 4.270 0.070 19947
726 1 3 . 1 1 8 8 LYS CA C 8 56.600 56.600 56.356 0.244 19947
727 1 3 . 1 1 8 8 LYS CB C 8 32.900 32.900 31.665 1.235 19947
728 1 3 . 1 1 8 8 LYS H H 8 8.260 8.260 8.331 -0.071 19947
729 1 3 . 1 1 9 9 ILE N N 9 136.600 136.600 122.895 13.705 19947
730 1 3 . 1 1 9 9 ILE HA H 9 4.140 4.140 3.899 0.241 19947
731 1 3 . 1 1 9 9 ILE CA C 9 61.300 61.300 62.791 -1.490 19947
732 1 3 . 1 1 9 9 ILE CB C 9 38.200 38.200 38.106 0.094 19947
733 1 3 . 1 1 9 9 ILE H H 9 8.150 8.150 8.143 0.007 19947
734 1 3 . 1 1 10 10 LEU N N 10 125.700 125.700 122.049 3.651 19947
735 1 3 . 1 1 10 10 LEU HA H 10 4.420 4.420 4.496 -0.076 19947
736 1 3 . 1 1 10 10 LEU CA C 10 55.200 55.200 55.474 -0.273 19947
737 1 3 . 1 1 10 10 LEU CB C 10 42.300 42.300 41.097 1.203 19947
738 1 3 . 1 1 10 10 LEU H H 10 8.230 8.230 8.298 -0.068 19947
739 1 3 . 1 1 11 11 GLU N N 11 120.600 120.600 114.491 6.109 19947
740 1 3 . 1 1 11 11 GLU HA H 11 4.470 4.470 4.157 0.313 19947
741 1 3 . 1 1 11 11 GLU CA C 11 55.500 55.500 56.451 -0.951 19947
742 1 3 . 1 1 11 11 GLU CB C 11 28.900 28.900 29.496 -0.596 19947
743 1 3 . 1 1 11 11 GLU H H 11 8.250 8.250 7.775 0.475 19947
744 1 3 . 1 1 12 12 GLN N N 12 121.600 121.600 118.302 3.298 19947
745 1 3 . 1 1 12 12 GLN HA H 12 4.350 4.350 4.496 -0.146 19947
746 1 3 . 1 1 12 12 GLN CA C 12 56.600 56.600 56.070 0.530 19947
747 1 3 . 1 1 12 12 GLN CB C 12 29.200 29.200 29.582 -0.382 19947
748 1 3 . 1 1 12 12 GLN H H 12 8.460 8.460 7.787 0.673 19947
749 1 3 . 1 1 13 13 GLY N N 13 110.700 110.700 106.798 3.902 19947
750 1 3 . 1 1 13 13 GLY CA C 13 45.700 45.700 45.547 0.152 19947
751 1 3 . 1 1 13 13 GLY H H 13 8.660 8.660 8.701 -0.042 19947
752 1 3 . 1 1 14 14 GLU N N 14 118.900 118.900 115.711 3.189 19947
753 1 3 . 1 1 14 14 GLU HA H 14 4.530 4.530 4.278 0.252 19947
754 1 3 . 1 1 14 14 GLU CA C 14 55.600 55.600 57.011 -1.411 19947
755 1 3 . 1 1 14 14 GLU CB C 14 29.700 29.700 29.920 -0.220 19947
756 1 3 . 1 1 14 14 GLU H H 14 8.230 8.230 8.286 -0.056 19947
757 1 3 . 1 1 15 15 ASP N N 15 118.400 118.400 119.968 -1.568 19947
758 1 3 . 1 1 15 15 ASP HA H 15 4.990 4.990 4.545 0.445 19947
759 1 3 . 1 1 15 15 ASP CA C 15 53.500 53.500 57.252 -3.752 19947
760 1 3 . 1 1 15 15 ASP CB C 15 39.700 39.700 42.086 -2.386 19947
761 1 3 . 1 1 15 15 ASP H H 15 8.330 8.330 8.543 -0.213 19947
762 1 3 . 1 1 16 16 CYS HA H 16 4.340 4.340 4.386 -0.046 19947
763 1 3 . 1 1 16 16 CYS H H 16 8.510 8.510 7.795 0.715 19947
764 1 3 . 1 1 17 17 ASP N N 17 116.700 116.700 120.709 -4.009 19947
765 1 3 . 1 1 17 17 ASP HA H 17 4.740 4.740 4.230 0.510 19947
766 1 3 . 1 1 17 17 ASP CA C 17 53.100 53.100 55.719 -2.619 19947
767 1 3 . 1 1 17 17 ASP CB C 17 38.600 38.600 39.080 -0.480 19947
768 1 3 . 1 1 17 17 ASP H H 17 8.180 8.180 8.901 -0.721 19947
769 1 3 . 1 1 18 18 CYS HA H 18 4.730 4.730 3.973 0.757 19947
770 1 3 . 1 1 18 18 CYS CB C 18 41.900 41.900 26.863 15.037 19947
771 1 3 . 1 1 19 19 GLY H H 19 8.220 8.220 8.856 -0.636 19947
772 1 3 . 1 1 20 20 SER HA H 20 4.920 4.920 4.397 0.523 19947
773 1 3 . 1 1 20 20 SER CA C 20 55.700 55.700 56.612 -0.912 19947
774 1 3 . 1 1 20 20 SER CB C 20 63.500 63.500 63.075 0.425 19947
775 1 3 . 1 1 20 20 SER H H 20 7.830 7.830 8.470 -0.640 19947
776 1 3 . 1 1 21 21 PRO HA H 21 4.240 4.240 4.187 0.053 19947
777 1 3 . 1 1 21 21 PRO CA C 21 63.400 63.400 64.973 -1.573 19947
778 1 3 . 1 1 21 21 PRO CB C 21 31.800 31.800 31.486 0.314 19947
779 1 3 . 1 1 22 22 ALA N N 22 119.900 119.900 116.852 3.048 19947
780 1 3 . 1 1 22 22 ALA HA H 22 4.220 4.220 4.107 0.113 19947
781 1 3 . 1 1 22 22 ALA CA C 22 54.200 54.200 53.776 0.424 19947
782 1 3 . 1 1 22 22 ALA CB C 22 18.500 18.500 18.660 -0.160 19947
783 1 3 . 1 1 22 22 ALA H H 22 8.180 8.180 8.331 -0.151 19947
784 1 3 . 1 1 23 23 ASN N N 23 116.300 116.300 111.930 4.370 19947
785 1 3 . 1 1 23 23 ASN HA H 23 4.670 4.670 4.857 -0.187 19947
786 1 3 . 1 1 23 23 ASN CA C 23 53.200 53.200 53.079 0.121 19947
787 1 3 . 1 1 23 23 ASN CB C 23 39.300 39.300 41.220 -1.920 19947
788 1 3 . 1 1 23 23 ASN H H 23 7.960 7.960 8.014 -0.054 19947
789 1 3 . 1 1 24 24 CYS HA H 24 4.720 4.720 4.226 0.494 19947
790 1 3 . 1 1 24 24 CYS H H 24 8.510 8.510 7.721 0.789 19947
791 1 3 . 1 1 25 25 GLN HA H 25 4.460 4.460 3.824 0.636 19947
792 1 3 . 1 1 25 25 GLN H H 25 8.320 8.320 8.731 -0.411 19947
793 1 3 . 1 1 26 26 ASP HA H 26 4.740 4.740 4.663 0.077 19947
794 1 3 . 1 1 26 26 ASP H H 26 8.580 8.580 8.231 0.349 19947
795 1 3 . 1 1 27 27 ARG HA H 27 4.680 4.680 4.237 0.443 19947
796 1 3 . 1 1 27 27 ARG CA C 27 54.700 54.700 58.115 -3.415 19947
797 1 3 . 1 1 27 27 ARG H H 27 8.550 8.550 8.331 0.219 19947
798 1 3 . 1 1 28 28 CYS HA H 28 4.120 4.120 4.692 -0.572 19947
799 1 3 . 1 1 28 28 CYS CA C 28 54.400 54.400 58.081 -3.681 19947
800 1 3 . 1 1 28 28 CYS CB C 28 19.000 19.000 26.418 -7.418 19947
801 1 3 . 1 1 28 28 CYS H H 28 8.910 8.910 8.367 0.543 19947
802 1 3 . 1 1 29 29 CYS N N 29 113.300 113.300 119.628 -6.328 19947
803 1 3 . 1 1 29 29 CYS HA H 29 5.010 5.010 4.822 0.188 19947
804 1 3 . 1 1 29 29 CYS CA C 29 54.300 54.300 56.588 -2.288 19947
805 1 3 . 1 1 29 29 CYS H H 29 7.730 7.730 7.891 -0.161 19947
806 1 3 . 1 1 30 30 ASN HA H 30 4.730 4.730 5.032 -0.302 19947
807 1 3 . 1 1 30 30 ASN CB C 30 38.700 38.700 39.718 -1.018 19947
808 1 3 . 1 1 30 30 ASN H H 30 8.870 8.870 8.927 -0.057 19947
809 1 3 . 1 1 31 31 ALA N N 31 129.400 129.400 125.507 3.893 19947
810 1 3 . 1 1 31 31 ALA HA H 31 4.120 4.120 4.315 -0.195 19947
811 1 3 . 1 1 31 31 ALA CA C 31 54.400 54.400 54.721 -0.321 19947
812 1 3 . 1 1 31 31 ALA CB C 31 19.000 19.000 19.285 -0.285 19947
813 1 3 . 1 1 31 31 ALA H H 31 8.890 8.890 8.204 0.686 19947
814 1 3 . 1 1 32 32 ALA N N 32 116.400 116.400 117.631 -1.231 19947
815 1 3 . 1 1 32 32 ALA HA H 32 4.340 4.340 4.278 0.062 19947
816 1 3 . 1 1 32 32 ALA CA C 32 53.800 53.800 53.223 0.577 19947
817 1 3 . 1 1 32 32 ALA CB C 32 19.100 19.100 18.878 0.222 19947
818 1 3 . 1 1 32 32 ALA H H 32 8.250 8.250 8.360 -0.110 19947
819 1 3 . 1 1 33 33 THR N N 33 104.300 104.300 109.858 -5.558 19947
820 1 3 . 1 1 33 33 THR HA H 33 4.430 4.430 4.398 0.032 19947
821 1 3 . 1 1 33 33 THR CA C 33 60.500 60.500 60.714 -0.214 19947
822 1 3 . 1 1 33 33 THR CB C 33 70.600 70.600 70.115 0.485 19947
823 1 3 . 1 1 33 33 THR H H 33 7.320 7.320 7.355 -0.035 19947
824 1 3 . 1 1 34 34 CYS N N 34 123.400 123.400 121.151 2.249 19947
825 1 3 . 1 1 34 34 CYS HA H 34 4.170 4.170 4.277 -0.107 19947
826 1 3 . 1 1 34 34 CYS CA C 34 56.500 56.500 60.199 -3.699 19947
827 1 3 . 1 1 34 34 CYS H H 34 8.710 8.710 8.310 0.400 19947
828 1 3 . 1 1 35 35 LYS N N 35 116.900 116.900 116.853 0.047 19947
829 1 3 . 1 1 35 35 LYS HA H 35 4.960 4.960 4.823 0.137 19947
830 1 3 . 1 1 35 35 LYS CA C 35 53.900 53.900 55.425 -1.524 19947
831 1 3 . 1 1 35 35 LYS CB C 35 35.900 35.900 35.962 -0.061 19947
832 1 3 . 1 1 35 35 LYS H H 35 7.450 7.450 7.922 -0.472 19947
833 1 3 . 1 1 36 36 LEU N N 36 119.300 119.300 117.096 2.204 19947
834 1 3 . 1 1 36 36 LEU HA H 36 4.800 4.800 4.596 0.204 19947
835 1 3 . 1 1 36 36 LEU CB C 36 42.400 42.400 42.755 -0.355 19947
836 1 3 . 1 1 36 36 LEU H H 36 8.290 8.290 8.451 -0.161 19947
837 1 3 . 1 1 37 37 THR HA H 37 4.340 4.340 4.796 -0.456 19947
838 1 3 . 1 1 37 37 THR CA C 37 60.200 60.200 59.215 0.985 19947
839 1 3 . 1 1 37 37 THR CB C 37 67.700 67.700 68.500 -0.800 19947
840 1 3 . 1 1 37 37 THR H H 37 8.380 8.380 8.124 0.256 19947
841 1 3 . 1 1 38 38 PRO HA H 38 4.380 4.380 4.138 0.242 19947
842 1 3 . 1 1 38 38 PRO CA C 38 64.800 64.800 64.178 0.622 19947
843 1 3 . 1 1 38 38 PRO CB C 38 31.500 31.500 31.814 -0.315 19947
844 1 3 . 1 1 39 39 GLY N N 39 113.300 113.300 113.337 -0.037 19947
845 1 3 . 1 1 39 39 GLY CA C 39 45.100 45.100 44.802 0.298 19947
846 1 3 . 1 1 39 39 GLY H H 39 8.830 8.830 8.394 0.436 19947
847 1 3 . 1 1 40 40 SER N N 40 116.700 116.700 117.331 -0.631 19947
848 1 3 . 1 1 40 40 SER HA H 40 4.610 4.610 4.473 0.137 19947
849 1 3 . 1 1 40 40 SER CA C 40 58.800 58.800 58.773 0.027 19947
850 1 3 . 1 1 40 40 SER CB C 40 63.800 63.800 63.773 0.027 19947
851 1 3 . 1 1 40 40 SER H H 40 8.280 8.280 7.709 0.571 19947
852 1 3 . 1 1 41 41 GLN N N 41 120.600 120.600 124.058 -3.458 19947
853 1 3 . 1 1 41 41 GLN HA H 41 4.110 4.110 4.248 -0.138 19947
854 1 3 . 1 1 41 41 GLN CA C 41 55.200 55.200 56.698 -1.498 19947
855 1 3 . 1 1 41 41 GLN CB C 41 31.100 31.100 29.706 1.394 19947
856 1 3 . 1 1 41 41 GLN H H 41 9.190 9.190 7.917 1.274 19947
857 1 3 . 1 1 42 42 CYS N N 42 113.200 113.200 115.299 -2.099 19947
858 1 3 . 1 1 42 42 CYS HA H 42 4.630 4.630 4.793 -0.163 19947
859 1 3 . 1 1 42 42 CYS CA C 42 53.700 53.700 56.583 -2.883 19947
860 1 3 . 1 1 42 42 CYS CB C 42 45.500 45.500 30.878 14.622 19947
861 1 3 . 1 1 42 42 CYS H H 42 7.710 7.710 7.443 0.267 19947
862 1 3 . 1 1 43 43 ASN N N 43 114.200 114.200 118.894 -4.694 19947
863 1 3 . 1 1 43 43 ASN HA H 43 4.940 4.940 4.464 0.476 19947
864 1 3 . 1 1 43 43 ASN CA C 43 53.000 53.000 54.408 -1.408 19947
865 1 3 . 1 1 43 43 ASN CB C 43 39.300 39.300 39.285 0.015 19947
866 1 3 . 1 1 43 43 ASN H H 43 8.870 8.870 8.837 0.033 19947
867 1 3 . 1 1 44 44 TYR N N 44 118.400 118.400 113.196 5.204 19947
868 1 3 . 1 1 44 44 TYR HA H 44 4.850 4.850 4.606 0.244 19947
869 1 3 . 1 1 44 44 TYR CA C 44 55.300 55.300 57.373 -2.073 19947
870 1 3 . 1 1 44 44 TYR CB C 44 40.700 40.700 39.633 1.067 19947
871 1 3 . 1 1 44 44 TYR H H 44 7.840 7.840 7.128 0.712 19947
872 1 3 . 1 1 45 45 GLY N N 45 110.600 110.600 107.565 3.035 19947
873 1 3 . 1 1 45 45 GLY CA C 45 44.000 44.000 44.847 -0.847 19947
874 1 3 . 1 1 45 45 GLY H H 45 7.960 7.960 7.920 0.040 19947
875 1 3 . 1 1 46 46 GLU N N 46 120.700 120.700 119.125 1.575 19947
876 1 3 . 1 1 46 46 GLU HA H 46 4.280 4.280 4.042 0.238 19947
877 1 3 . 1 1 46 46 GLU CA C 46 58.500 58.500 60.248 -1.748 19947
878 1 3 . 1 1 46 46 GLU CB C 46 29.300 29.300 29.999 -0.699 19947
879 1 3 . 1 1 46 46 GLU H H 46 9.160 9.160 8.557 0.603 19947
880 1 3 . 1 1 47 47 CYS N N 47 112.400 112.400 115.629 -3.229 19947
881 1 3 . 1 1 47 47 CYS HA H 47 4.850 4.850 4.573 0.277 19947
882 1 3 . 1 1 47 47 CYS CA C 47 57.100 57.100 59.769 -2.669 19947
883 1 3 . 1 1 47 47 CYS CB C 47 41.200 41.200 26.559 14.641 19947
884 1 3 . 1 1 47 47 CYS H H 47 8.510 8.510 7.557 0.953 19947
885 1 3 . 1 1 48 48 CYS N N 48 123.200 123.200 119.914 3.286 19947
886 1 3 . 1 1 48 48 CYS HA H 48 5.160 5.160 4.909 0.251 19947
887 1 3 . 1 1 48 48 CYS CA C 48 54.700 54.700 60.709 -6.009 19947
888 1 3 . 1 1 48 48 CYS CB C 48 45.700 45.700 28.415 17.285 19947
889 1 3 . 1 1 48 48 CYS H H 48 7.810 7.810 8.106 -0.296 19947
890 1 3 . 1 1 49 49 ASP N N 49 127.400 127.400 125.173 2.227 19947
891 1 3 . 1 1 49 49 ASP HA H 49 4.890 4.890 4.972 -0.082 19947
892 1 3 . 1 1 49 49 ASP CA C 49 53.500 53.500 54.425 -0.925 19947
893 1 3 . 1 1 49 49 ASP CB C 49 42.400 42.400 43.574 -1.174 19947
894 1 3 . 1 1 49 49 ASP H H 49 9.670 9.670 8.538 1.132 19947
895 1 3 . 1 1 50 50 GLN N N 50 127.000 127.000 122.810 4.190 19947
896 1 3 . 1 1 50 50 GLN HA H 50 3.940 3.940 3.936 0.004 19947
897 1 3 . 1 1 50 50 GLN CA C 50 56.800 56.800 58.890 -2.090 19947
898 1 3 . 1 1 50 50 GLN CB C 50 26.500 26.500 28.158 -1.658 19947
899 1 3 . 1 1 50 50 GLN H H 50 9.450 9.450 8.929 0.521 19947
900 1 3 . 1 1 51 51 CYS N N 51 106.100 106.100 113.396 -7.296 19947
901 1 3 . 1 1 51 51 CYS HA H 51 4.760 4.760 4.987 -0.227 19947
902 1 3 . 1 1 51 51 CYS CB C 51 43.200 43.200 28.141 15.059 19947
903 1 3 . 1 1 51 51 CYS H H 51 8.700 8.700 8.379 0.321 19947
904 1 3 . 1 1 52 52 ARG N N 52 121.000 121.000 118.183 2.817 19947
905 1 3 . 1 1 52 52 ARG HA H 52 4.690 4.690 4.543 0.147 19947
906 1 3 . 1 1 52 52 ARG CA C 52 55.400 55.400 54.628 0.772 19947
907 1 3 . 1 1 52 52 ARG CB C 52 33.100 33.100 34.992 -1.891 19947
908 1 3 . 1 1 52 52 ARG H H 52 7.960 7.960 7.698 0.262 19947
909 1 3 . 1 1 53 53 PHE N N 53 120.300 120.300 119.436 0.864 19947
910 1 3 . 1 1 53 53 PHE HA H 53 5.050 5.050 5.029 0.021 19947
911 1 3 . 1 1 53 53 PHE CA C 53 56.100 56.100 56.572 -0.472 19947
912 1 3 . 1 1 53 53 PHE CB C 53 38.200 38.200 39.504 -1.304 19947
913 1 3 . 1 1 53 53 PHE H H 53 8.400 8.400 8.526 -0.126 19947
914 1 3 . 1 1 54 54 LYS N N 54 123.300 123.300 124.473 -1.173 19947
915 1 3 . 1 1 54 54 LYS HA H 54 4.250 4.250 4.248 0.002 19947
916 1 3 . 1 1 54 54 LYS CA C 54 57.500 57.500 56.314 1.186 19947
917 1 3 . 1 1 54 54 LYS CB C 54 34.300 34.300 32.520 1.780 19947
918 1 3 . 1 1 54 54 LYS H H 54 8.540 8.540 8.938 -0.399 19947
919 1 3 . 1 1 55 55 LYS N N 55 119.400 119.400 125.253 -5.853 19947
920 1 3 . 1 1 55 55 LYS HA H 55 4.110 4.110 4.027 0.083 19947
921 1 3 . 1 1 55 55 LYS CA C 55 56.500 56.500 56.951 -0.451 19947
922 1 3 . 1 1 55 55 LYS CB C 55 33.400 33.400 33.160 0.240 19947
923 1 3 . 1 1 55 55 LYS H H 55 8.440 8.440 8.424 0.016 19947
924 1 3 . 1 1 56 56 ALA N N 56 126.700 126.700 127.003 -0.303 19947
925 1 3 . 1 1 56 56 ALA HA H 56 3.920 3.920 4.056 -0.136 19947
926 1 3 . 1 1 56 56 ALA CA C 56 52.900 52.900 53.660 -0.760 19947
927 1 3 . 1 1 56 56 ALA CB C 56 18.100 18.100 18.247 -0.147 19947
928 1 3 . 1 1 56 56 ALA H H 56 8.930 8.930 8.564 0.366 19947
929 1 3 . 1 1 57 57 GLY N N 57 109.300 109.300 111.467 -2.167 19947
930 1 3 . 1 1 57 57 GLY CA C 57 45.100 45.100 44.813 0.287 19947
931 1 3 . 1 1 57 57 GLY H H 57 8.460 8.460 8.439 0.021 19947
932 1 3 . 1 1 58 58 THR N N 58 117.200 117.200 119.924 -2.724 19947
933 1 3 . 1 1 58 58 THR HA H 58 4.260 4.260 4.503 -0.243 19947
934 1 3 . 1 1 58 58 THR CA C 58 63.300 63.300 62.855 0.445 19947
935 1 3 . 1 1 58 58 THR CB C 58 69.600 69.600 68.937 0.663 19947
936 1 3 . 1 1 58 58 THR H H 58 7.660 7.660 7.789 -0.129 19947
937 1 3 . 1 1 59 59 VAL N N 59 130.400 130.400 127.872 2.528 19947
938 1 3 . 1 1 59 59 VAL HA H 59 3.900 3.900 4.092 -0.192 19947
939 1 3 . 1 1 59 59 VAL CA C 59 64.400 64.400 62.337 2.063 19947
940 1 3 . 1 1 59 59 VAL CB C 59 31.900 31.900 31.844 0.056 19947
941 1 3 . 1 1 59 59 VAL H H 59 9.190 9.190 8.881 0.309 19947
942 1 3 . 1 1 60 60 CYS N N 60 121.800 121.800 126.420 -4.620 19947
943 1 3 . 1 1 60 60 CYS HA H 60 5.050 5.050 4.607 0.443 19947
944 1 3 . 1 1 60 60 CYS CA C 60 54.400 54.400 58.445 -4.045 19947
945 1 3 . 1 1 60 60 CYS CB C 60 43.000 43.000 27.824 15.176 19947
946 1 3 . 1 1 60 60 CYS H H 60 9.130 9.130 8.522 0.608 19947
947 1 3 . 1 1 61 61 ARG N N 61 124.100 124.100 118.911 5.189 19947
948 1 3 . 1 1 61 61 ARG HA H 61 4.360 4.360 4.611 -0.251 19947
949 1 3 . 1 1 61 61 ARG CA C 61 56.800 56.800 55.550 1.250 19947
950 1 3 . 1 1 61 61 ARG CB C 61 32.800 32.800 34.222 -1.422 19947
951 1 3 . 1 1 61 61 ARG H H 61 7.580 7.580 7.525 0.055 19947
952 1 3 . 1 1 62 62 ILE N N 62 126.200 126.200 116.758 9.442 19947
953 1 3 . 1 1 62 62 ILE HA H 62 4.090 4.090 4.542 -0.452 19947
954 1 3 . 1 1 62 62 ILE CA C 62 60.300 60.300 61.451 -1.151 19947
955 1 3 . 1 1 62 62 ILE CB C 62 38.700 38.700 40.723 -2.023 19947
956 1 3 . 1 1 62 62 ILE H H 62 8.490 8.490 8.511 -0.021 19947
957 1 3 . 1 1 63 63 ALA N N 63 129.400 129.400 131.646 -2.246 19947
958 1 3 . 1 1 63 63 ALA HA H 63 4.310 4.310 4.335 -0.025 19947
959 1 3 . 1 1 63 63 ALA CA C 63 51.900 51.900 53.994 -2.094 19947
960 1 3 . 1 1 63 63 ALA CB C 63 20.600 20.600 19.125 1.475 19947
961 1 3 . 1 1 63 63 ALA H H 63 8.100 8.100 8.637 -0.537 19947
962 1 3 . 1 1 64 64 ARG N N 64 120.500 120.500 120.594 -0.094 19947
963 1 3 . 1 1 64 64 ARG HA H 64 4.290 4.290 4.435 -0.145 19947
964 1 3 . 1 1 64 64 ARG CA C 64 56.200 56.200 55.636 0.564 19947
965 1 3 . 1 1 64 64 ARG CB C 64 30.500 30.500 29.942 0.558 19947
966 1 3 . 1 1 64 64 ARG H H 64 8.140 8.140 8.798 -0.658 19947
967 1 3 . 1 1 65 65 GLY N N 65 110.500 110.500 111.344 -0.844 19947
968 1 3 . 1 1 65 65 GLY CA C 65 45.100 45.100 44.451 0.649 19947
969 1 3 . 1 1 65 65 GLY H H 65 8.040 8.040 8.269 -0.229 19947
970 1 3 . 1 1 66 66 ASP N N 66 120.700 120.700 119.765 0.935 19947
971 1 3 . 1 1 66 66 ASP HA H 66 4.610 4.610 4.430 0.180 19947
972 1 3 . 1 1 66 66 ASP CA C 66 53.300 53.300 54.111 -0.811 19947
973 1 3 . 1 1 66 66 ASP CB C 66 37.600 37.600 40.763 -3.163 19947
974 1 3 . 1 1 66 66 ASP H H 66 8.380 8.380 7.206 1.174 19947
975 1 3 . 1 1 67 67 TRP N N 67 120.100 120.100 123.355 -3.255 19947
976 1 3 . 1 1 67 67 TRP HA H 67 4.760 4.760 5.108 -0.348 19947
977 1 3 . 1 1 67 67 TRP CA C 67 57.200 57.200 58.011 -0.811 19947
978 1 3 . 1 1 67 67 TRP CB C 67 29.100 29.100 29.517 -0.417 19947
979 1 3 . 1 1 67 67 TRP H H 67 7.950 7.950 8.013 -0.063 19947
980 1 3 . 1 1 68 68 ASN N N 68 118.400 118.400 118.052 0.348 19947
981 1 3 . 1 1 68 68 ASN HA H 68 4.790 4.790 4.940 -0.150 19947
982 1 3 . 1 1 68 68 ASN CA C 68 52.800 52.800 53.868 -1.068 19947
983 1 3 . 1 1 68 68 ASN CB C 68 39.300 39.300 40.063 -0.763 19947
984 1 3 . 1 1 68 68 ASN H H 68 8.180 8.180 8.716 -0.536 19947
985 1 3 . 1 1 69 69 ASP N N 69 118.500 118.500 117.866 0.634 19947
986 1 3 . 1 1 69 69 ASP HA H 69 4.620 4.620 4.451 0.169 19947
987 1 3 . 1 1 69 69 ASP CA C 69 53.200 53.200 55.868 -2.668 19947
988 1 3 . 1 1 69 69 ASP CB C 69 38.000 38.000 40.620 -2.620 19947
989 1 3 . 1 1 69 69 ASP H H 69 8.130 8.130 8.330 -0.200 19947
990 1 3 . 1 1 70 70 ASP N N 70 120.500 120.500 120.948 -0.448 19947
991 1 3 . 1 1 70 70 ASP HA H 70 5.100 5.100 5.301 -0.201 19947
992 1 3 . 1 1 70 70 ASP CA C 70 52.500 52.500 52.895 -0.395 19947
993 1 3 . 1 1 70 70 ASP CB C 70 42.600 42.600 43.080 -0.480 19947
994 1 3 . 1 1 70 70 ASP H H 70 8.140 8.140 8.125 0.015 19947
995 1 3 . 1 1 71 71 TYR N N 71 118.900 118.900 123.720 -4.820 19947
996 1 3 . 1 1 71 71 TYR HA H 71 5.210 5.210 5.164 0.046 19947
997 1 3 . 1 1 71 71 TYR CA C 71 56.300 56.300 56.829 -0.529 19947
998 1 3 . 1 1 71 71 TYR CB C 71 42.200 42.200 42.658 -0.458 19947
999 1 3 . 1 1 71 71 TYR H H 71 8.450 8.450 8.326 0.124 19947
1000 1 3 . 1 1 72 72 CYS N N 72 119.800 119.800 121.832 -2.032 19947
1001 1 3 . 1 1 72 72 CYS HA H 72 4.900 4.900 4.550 0.350 19947
1002 1 3 . 1 1 72 72 CYS CA C 72 53.400 53.400 59.193 -5.793 19947
1003 1 3 . 1 1 72 72 CYS CB C 72 37.200 37.200 28.902 8.298 19947
1004 1 3 . 1 1 72 72 CYS H H 72 9.330 9.330 8.682 0.648 19947
1005 1 3 . 1 1 73 73 THR N N 73 112.700 112.700 114.330 -1.630 19947
1006 1 3 . 1 1 73 73 THR HA H 73 4.430 4.430 4.477 -0.047 19947
1007 1 3 . 1 1 73 73 THR CA C 73 62.300 62.300 60.815 1.485 19947
1008 1 3 . 1 1 73 73 THR CB C 73 71.300 71.300 69.350 1.950 19947
1009 1 3 . 1 1 73 73 THR H H 73 9.980 9.980 8.718 1.262 19947
1010 1 3 . 1 1 74 74 GLY N N 74 111.500 111.500 110.191 1.309 19947
1011 1 3 . 1 1 74 74 GLY CA C 74 45.300 45.300 46.623 -1.323 19947
1012 1 3 . 1 1 74 74 GLY H H 74 8.580 8.580 7.759 0.821 19947
1013 1 3 . 1 1 75 75 LYS N N 75 115.900 115.900 117.444 -1.544 19947
1014 1 3 . 1 1 75 75 LYS HA H 75 4.140 4.140 4.595 -0.455 19947
1015 1 3 . 1 1 75 75 LYS CA C 75 54.800 54.800 55.696 -0.896 19947
1016 1 3 . 1 1 75 75 LYS CB C 75 34.200 34.200 34.122 0.078 19947
1017 1 3 . 1 1 75 75 LYS H H 75 7.900 7.900 7.524 0.376 19947
1018 1 3 . 1 1 76 76 SER N N 76 111.000 111.000 112.639 -1.639 19947
1019 1 3 . 1 1 76 76 SER HA H 76 4.160 4.160 3.877 0.283 19947
1020 1 3 . 1 1 76 76 SER CA C 76 61.400 61.400 56.518 4.882 19947
1021 1 3 . 1 1 76 76 SER CB C 76 64.300 64.300 63.595 0.705 19947
1022 1 3 . 1 1 76 76 SER H H 76 6.520 6.520 7.037 -0.517 19947
1023 1 3 . 1 1 77 77 SER N N 77 117.100 117.100 116.429 0.671 19947
1024 1 3 . 1 1 77 77 SER HA H 77 4.220 4.220 4.463 -0.243 19947
1025 1 3 . 1 1 77 77 SER CA C 77 59.800 59.800 59.194 0.606 19947
1026 1 3 . 1 1 77 77 SER CB C 77 64.400 64.400 63.733 0.667 19947
1027 1 3 . 1 1 77 77 SER H H 77 9.030 9.030 8.352 0.678 19947
1028 1 3 . 1 1 78 78 ASP N N 78 122.100 122.100 121.699 0.401 19947
1029 1 3 . 1 1 78 78 ASP HA H 78 4.930 4.930 4.800 0.130 19947
1030 1 3 . 1 1 78 78 ASP CA C 78 52.400 52.400 54.148 -1.748 19947
1031 1 3 . 1 1 78 78 ASP CB C 78 40.800 40.800 44.072 -3.272 19947
1032 1 3 . 1 1 78 78 ASP H H 78 8.340 8.340 7.600 0.740 19947
1033 1 3 . 1 1 79 79 CYS N N 79 122.200 122.200 122.442 -0.242 19947
1034 1 3 . 1 1 79 79 CYS HA H 79 5.320 5.320 4.783 0.537 19947
1035 1 3 . 1 1 79 79 CYS CA C 79 52.000 52.000 55.780 -3.780 19947
1036 1 3 . 1 1 79 79 CYS CB C 79 39.300 39.300 27.640 11.660 19947
1037 1 3 . 1 1 79 79 CYS H H 79 8.960 8.960 8.735 0.225 19947
1038 1 3 . 1 1 80 80 PRO HA H 80 4.410 4.410 4.520 -0.110 19947
1039 1 3 . 1 1 80 80 PRO CA C 80 63.500 63.500 63.136 0.364 19947
1040 1 3 . 1 1 80 80 PRO CB C 80 32.400 32.400 32.226 0.174 19947
1041 1 3 . 1 1 81 81 TRP N N 81 120.500 120.500 120.666 -0.166 19947
1042 1 3 . 1 1 81 81 TRP HA H 81 4.550 4.550 4.604 -0.054 19947
1043 1 3 . 1 1 81 81 TRP CA C 81 56.400 56.400 53.628 2.772 19947
1044 1 3 . 1 1 81 81 TRP CB C 81 29.500 29.500 28.371 1.129 19947
1045 1 3 . 1 1 81 81 TRP H H 81 8.400 8.400 8.278 0.122 19947
1046 1 3 . 1 1 82 82 ASN N N 82 120.400 120.400 118.040 2.360 19947
1047 1 3 . 1 1 82 82 ASN HA H 82 4.750 4.750 4.309 0.441 19947
1048 1 3 . 1 1 82 82 ASN CA C 82 53.100 53.100 54.093 -0.994 19947
1049 1 3 . 1 1 82 82 ASN CB C 82 39.000 39.000 36.836 2.164 19947
1050 1 3 . 1 1 82 82 ASN H H 82 8.040 8.040 8.308 -0.268 19947
1051 1 4 . 1 1 2 2 PRO HA H 2 4.820 4.820 4.801 0.019 19947
1052 1 4 . 1 1 2 2 PRO CA C 2 61.900 61.900 62.278 -0.378 19947
1053 1 4 . 1 1 2 2 PRO CB C 2 30.700 30.700 31.706 -1.006 19947
1054 1 4 . 1 1 3 3 PRO HA H 3 4.540 4.540 4.604 -0.064 19947
1055 1 4 . 1 1 3 3 PRO CA C 3 62.900 62.900 62.517 0.383 19947
1056 1 4 . 1 1 3 3 PRO CB C 3 32.100 32.100 32.757 -0.657 19947
1057 1 4 . 1 1 4 4 VAL N N 4 121.900 121.900 122.633 -0.733 19947
1058 1 4 . 1 1 4 4 VAL HA H 4 4.200 4.200 4.521 -0.321 19947
1059 1 4 . 1 1 4 4 VAL CA C 4 62.300 62.300 61.369 0.931 19947
1060 1 4 . 1 1 4 4 VAL CB C 4 32.800 32.800 30.734 2.066 19947
1061 1 4 . 1 1 4 4 VAL H H 4 8.330 8.330 8.348 -0.018 19947
1062 1 4 . 1 1 5 5 CYS N N 5 120.900 120.900 127.486 -6.586 19947
1063 1 4 . 1 1 5 5 CYS HA H 5 4.700 4.700 4.411 0.289 19947
1064 1 4 . 1 1 5 5 CYS CA C 5 53.600 53.600 58.961 -5.361 19947
1065 1 4 . 1 1 5 5 CYS H H 5 8.500 8.500 8.710 -0.210 19947
1066 1 4 . 1 1 6 6 GLY N N 6 110.200 110.200 113.781 -3.581 19947
1067 1 4 . 1 1 6 6 GLY CA C 6 46.300 46.300 44.758 1.542 19947
1068 1 4 . 1 1 6 6 GLY H H 6 8.490 8.490 8.394 0.096 19947
1069 1 4 . 1 1 7 7 ASN N N 7 120.100 120.100 116.720 3.380 19947
1070 1 4 . 1 1 7 7 ASN HA H 7 4.730 4.730 4.332 0.398 19947
1071 1 4 . 1 1 7 7 ASN CA C 7 53.200 53.200 54.093 -0.893 19947
1072 1 4 . 1 1 7 7 ASN CB C 7 38.700 38.700 39.193 -0.493 19947
1073 1 4 . 1 1 7 7 ASN H H 7 8.320 8.320 8.180 0.140 19947
1074 1 4 . 1 1 8 8 LYS N N 8 121.300 121.300 122.702 -1.402 19947
1075 1 4 . 1 1 8 8 LYS HA H 8 4.340 4.340 4.331 0.009 19947
1076 1 4 . 1 1 8 8 LYS CA C 8 56.600 56.600 56.699 -0.099 19947
1077 1 4 . 1 1 8 8 LYS CB C 8 32.900 32.900 31.695 1.206 19947
1078 1 4 . 1 1 8 8 LYS H H 8 8.260 8.260 8.429 -0.169 19947
1079 1 4 . 1 1 9 9 ILE N N 9 136.600 136.600 122.040 14.560 19947
1080 1 4 . 1 1 9 9 ILE HA H 9 4.140 4.140 3.955 0.185 19947
1081 1 4 . 1 1 9 9 ILE CA C 9 61.300 61.300 61.966 -0.666 19947
1082 1 4 . 1 1 9 9 ILE CB C 9 38.200 38.200 37.700 0.500 19947
1083 1 4 . 1 1 9 9 ILE H H 9 8.150 8.150 7.887 0.263 19947
1084 1 4 . 1 1 10 10 LEU N N 10 125.700 125.700 123.077 2.623 19947
1085 1 4 . 1 1 10 10 LEU HA H 10 4.420 4.420 4.409 0.011 19947
1086 1 4 . 1 1 10 10 LEU CA C 10 55.200 55.200 55.844 -0.644 19947
1087 1 4 . 1 1 10 10 LEU CB C 10 42.300 42.300 40.129 2.171 19947
1088 1 4 . 1 1 10 10 LEU H H 10 8.230 8.230 8.491 -0.261 19947
1089 1 4 . 1 1 11 11 GLU N N 11 120.600 120.600 114.503 6.097 19947
1090 1 4 . 1 1 11 11 GLU HA H 11 4.470 4.470 4.175 0.295 19947
1091 1 4 . 1 1 11 11 GLU CA C 11 55.500 55.500 56.126 -0.626 19947
1092 1 4 . 1 1 11 11 GLU CB C 11 28.900 28.900 28.678 0.222 19947
1093 1 4 . 1 1 11 11 GLU H H 11 8.250 8.250 7.955 0.295 19947
1094 1 4 . 1 1 12 12 GLN N N 12 121.600 121.600 117.788 3.812 19947
1095 1 4 . 1 1 12 12 GLN HA H 12 4.350 4.350 4.254 0.096 19947
1096 1 4 . 1 1 12 12 GLN CA C 12 56.600 56.600 55.549 1.051 19947
1097 1 4 . 1 1 12 12 GLN CB C 12 29.200 29.200 29.866 -0.666 19947
1098 1 4 . 1 1 12 12 GLN H H 12 8.460 8.460 7.283 1.177 19947
1099 1 4 . 1 1 13 13 GLY N N 13 110.700 110.700 111.612 -0.912 19947
1100 1 4 . 1 1 13 13 GLY CA C 13 45.700 45.700 45.015 0.685 19947
1101 1 4 . 1 1 13 13 GLY H H 13 8.660 8.660 8.777 -0.117 19947
1102 1 4 . 1 1 14 14 GLU N N 14 118.900 118.900 117.739 1.161 19947
1103 1 4 . 1 1 14 14 GLU HA H 14 4.530 4.530 4.283 0.247 19947
1104 1 4 . 1 1 14 14 GLU CA C 14 55.600 55.600 57.089 -1.489 19947
1105 1 4 . 1 1 14 14 GLU CB C 14 29.700 29.700 30.196 -0.496 19947
1106 1 4 . 1 1 14 14 GLU H H 14 8.230 8.230 7.919 0.311 19947
1107 1 4 . 1 1 15 15 ASP N N 15 118.400 118.400 120.050 -1.650 19947
1108 1 4 . 1 1 15 15 ASP HA H 15 4.990 4.990 4.517 0.473 19947
1109 1 4 . 1 1 15 15 ASP CA C 15 53.500 53.500 56.505 -3.005 19947
1110 1 4 . 1 1 15 15 ASP CB C 15 39.700 39.700 41.719 -2.019 19947
1111 1 4 . 1 1 15 15 ASP H H 15 8.330 8.330 8.444 -0.114 19947
1112 1 4 . 1 1 16 16 CYS HA H 16 4.340 4.340 4.471 -0.131 19947
1113 1 4 . 1 1 16 16 CYS H H 16 8.510 8.510 7.700 0.810 19947
1114 1 4 . 1 1 17 17 ASP N N 17 116.700 116.700 124.204 -7.504 19947
1115 1 4 . 1 1 17 17 ASP HA H 17 4.740 4.740 4.305 0.435 19947
1116 1 4 . 1 1 17 17 ASP CA C 17 53.100 53.100 55.275 -2.175 19947
1117 1 4 . 1 1 17 17 ASP CB C 17 38.600 38.600 39.416 -0.816 19947
1118 1 4 . 1 1 17 17 ASP H H 17 8.180 8.180 8.749 -0.569 19947
1119 1 4 . 1 1 18 18 CYS HA H 18 4.730 4.730 3.987 0.743 19947
1120 1 4 . 1 1 18 18 CYS CB C 18 41.900 41.900 26.957 14.943 19947
1121 1 4 . 1 1 19 19 GLY H H 19 8.220 8.220 8.254 -0.034 19947
1122 1 4 . 1 1 20 20 SER HA H 20 4.920 4.920 4.443 0.477 19947
1123 1 4 . 1 1 20 20 SER CA C 20 55.700 55.700 56.822 -1.122 19947
1124 1 4 . 1 1 20 20 SER CB C 20 63.500 63.500 62.737 0.763 19947
1125 1 4 . 1 1 20 20 SER H H 20 7.830 7.830 8.404 -0.574 19947
1126 1 4 . 1 1 21 21 PRO HA H 21 4.240 4.240 4.202 0.038 19947
1127 1 4 . 1 1 21 21 PRO CA C 21 63.400 63.400 64.816 -1.416 19947
1128 1 4 . 1 1 21 21 PRO CB C 21 31.800 31.800 31.600 0.200 19947
1129 1 4 . 1 1 22 22 ALA N N 22 119.900 119.900 116.412 3.488 19947
1130 1 4 . 1 1 22 22 ALA HA H 22 4.220 4.220 4.038 0.182 19947
1131 1 4 . 1 1 22 22 ALA CA C 22 54.200 54.200 54.394 -0.194 19947
1132 1 4 . 1 1 22 22 ALA CB C 22 18.500 18.500 18.909 -0.409 19947
1133 1 4 . 1 1 22 22 ALA H H 22 8.180 8.180 8.015 0.165 19947
1134 1 4 . 1 1 23 23 ASN N N 23 116.300 116.300 112.242 4.058 19947
1135 1 4 . 1 1 23 23 ASN HA H 23 4.670 4.670 4.931 -0.261 19947
1136 1 4 . 1 1 23 23 ASN CA C 23 53.200 53.200 51.935 1.265 19947
1137 1 4 . 1 1 23 23 ASN CB C 23 39.300 39.300 40.295 -0.995 19947
1138 1 4 . 1 1 23 23 ASN H H 23 7.960 7.960 8.058 -0.098 19947
1139 1 4 . 1 1 24 24 CYS HA H 24 4.720 4.720 4.220 0.500 19947
1140 1 4 . 1 1 24 24 CYS H H 24 8.510 8.510 7.621 0.889 19947
1141 1 4 . 1 1 25 25 GLN HA H 25 4.460 4.460 3.947 0.513 19947
1142 1 4 . 1 1 25 25 GLN H H 25 8.320 8.320 8.778 -0.458 19947
1143 1 4 . 1 1 26 26 ASP HA H 26 4.740 4.740 4.785 -0.045 19947
1144 1 4 . 1 1 26 26 ASP H H 26 8.580 8.580 7.826 0.754 19947
1145 1 4 . 1 1 27 27 ARG HA H 27 4.680 4.680 3.999 0.681 19947
1146 1 4 . 1 1 27 27 ARG CA C 27 54.700 54.700 58.504 -3.804 19947
1147 1 4 . 1 1 27 27 ARG H H 27 8.550 8.550 8.572 -0.022 19947
1148 1 4 . 1 1 28 28 CYS HA H 28 4.120 4.120 4.742 -0.622 19947
1149 1 4 . 1 1 28 28 CYS CA C 28 54.400 54.400 58.385 -3.985 19947
1150 1 4 . 1 1 28 28 CYS CB C 28 19.000 19.000 27.098 -8.098 19947
1151 1 4 . 1 1 28 28 CYS H H 28 8.910 8.910 8.197 0.713 19947
1152 1 4 . 1 1 29 29 CYS N N 29 113.300 113.300 119.405 -6.105 19947
1153 1 4 . 1 1 29 29 CYS HA H 29 5.010 5.010 4.810 0.200 19947
1154 1 4 . 1 1 29 29 CYS CA C 29 54.300 54.300 56.653 -2.353 19947
1155 1 4 . 1 1 29 29 CYS H H 29 7.730 7.730 7.854 -0.124 19947
1156 1 4 . 1 1 30 30 ASN HA H 30 4.730 4.730 4.964 -0.234 19947
1157 1 4 . 1 1 30 30 ASN CB C 30 38.700 38.700 39.900 -1.200 19947
1158 1 4 . 1 1 30 30 ASN H H 30 8.870 8.870 8.906 -0.036 19947
1159 1 4 . 1 1 31 31 ALA N N 31 129.400 129.400 126.057 3.343 19947
1160 1 4 . 1 1 31 31 ALA HA H 31 4.120 4.120 4.314 -0.194 19947
1161 1 4 . 1 1 31 31 ALA CA C 31 54.400 54.400 54.788 -0.388 19947
1162 1 4 . 1 1 31 31 ALA CB C 31 19.000 19.000 19.235 -0.235 19947
1163 1 4 . 1 1 31 31 ALA H H 31 8.890 8.890 8.395 0.495 19947
1164 1 4 . 1 1 32 32 ALA N N 32 116.400 116.400 117.964 -1.564 19947
1165 1 4 . 1 1 32 32 ALA HA H 32 4.340 4.340 4.333 0.007 19947
1166 1 4 . 1 1 32 32 ALA CA C 32 53.800 53.800 53.381 0.419 19947
1167 1 4 . 1 1 32 32 ALA CB C 32 19.100 19.100 18.819 0.281 19947
1168 1 4 . 1 1 32 32 ALA H H 32 8.250 8.250 8.421 -0.171 19947
1169 1 4 . 1 1 33 33 THR N N 33 104.300 104.300 109.741 -5.441 19947
1170 1 4 . 1 1 33 33 THR HA H 33 4.430 4.430 4.380 0.050 19947
1171 1 4 . 1 1 33 33 THR CA C 33 60.500 60.500 60.681 -0.181 19947
1172 1 4 . 1 1 33 33 THR CB C 33 70.600 70.600 69.829 0.771 19947
1173 1 4 . 1 1 33 33 THR H H 33 7.320 7.320 7.298 0.022 19947
1174 1 4 . 1 1 34 34 CYS N N 34 123.400 123.400 121.287 2.113 19947
1175 1 4 . 1 1 34 34 CYS HA H 34 4.170 4.170 4.249 -0.079 19947
1176 1 4 . 1 1 34 34 CYS CA C 34 56.500 56.500 60.123 -3.623 19947
1177 1 4 . 1 1 34 34 CYS H H 34 8.710 8.710 8.169 0.541 19947
1178 1 4 . 1 1 35 35 LYS N N 35 116.900 116.900 116.442 0.458 19947
1179 1 4 . 1 1 35 35 LYS HA H 35 4.960 4.960 4.860 0.100 19947
1180 1 4 . 1 1 35 35 LYS CA C 35 53.900 53.900 55.375 -1.475 19947
1181 1 4 . 1 1 35 35 LYS CB C 35 35.900 35.900 35.887 0.013 19947
1182 1 4 . 1 1 35 35 LYS H H 35 7.450 7.450 7.826 -0.376 19947
1183 1 4 . 1 1 36 36 LEU N N 36 119.300 119.300 117.032 2.268 19947
1184 1 4 . 1 1 36 36 LEU HA H 36 4.800 4.800 4.553 0.247 19947
1185 1 4 . 1 1 36 36 LEU CB C 36 42.400 42.400 42.756 -0.356 19947
1186 1 4 . 1 1 36 36 LEU H H 36 8.290 8.290 8.493 -0.203 19947
1187 1 4 . 1 1 37 37 THR HA H 37 4.340 4.340 4.819 -0.479 19947
1188 1 4 . 1 1 37 37 THR CA C 37 60.200 60.200 59.600 0.600 19947
1189 1 4 . 1 1 37 37 THR CB C 37 67.700 67.700 68.637 -0.937 19947
1190 1 4 . 1 1 37 37 THR H H 37 8.380 8.380 8.089 0.291 19947
1191 1 4 . 1 1 38 38 PRO HA H 38 4.380 4.380 4.132 0.248 19947
1192 1 4 . 1 1 38 38 PRO CA C 38 64.800 64.800 64.233 0.567 19947
1193 1 4 . 1 1 38 38 PRO CB C 38 31.500 31.500 31.621 -0.121 19947
1194 1 4 . 1 1 39 39 GLY N N 39 113.300 113.300 113.425 -0.125 19947
1195 1 4 . 1 1 39 39 GLY CA C 39 45.100 45.100 45.179 -0.079 19947
1196 1 4 . 1 1 39 39 GLY H H 39 8.830 8.830 8.520 0.310 19947
1197 1 4 . 1 1 40 40 SER N N 40 116.700 116.700 116.895 -0.195 19947
1198 1 4 . 1 1 40 40 SER HA H 40 4.610 4.610 4.524 0.086 19947
1199 1 4 . 1 1 40 40 SER CA C 40 58.800 58.800 58.460 0.340 19947
1200 1 4 . 1 1 40 40 SER CB C 40 63.800 63.800 64.245 -0.445 19947
1201 1 4 . 1 1 40 40 SER H H 40 8.280 8.280 7.638 0.642 19947
1202 1 4 . 1 1 41 41 GLN N N 41 120.600 120.600 120.473 0.127 19947
1203 1 4 . 1 1 41 41 GLN HA H 41 4.110 4.110 4.162 -0.052 19947
1204 1 4 . 1 1 41 41 GLN CA C 41 55.200 55.200 56.378 -1.178 19947
1205 1 4 . 1 1 41 41 GLN CB C 41 31.100 31.100 29.670 1.430 19947
1206 1 4 . 1 1 41 41 GLN H H 41 9.190 9.190 7.960 1.230 19947
1207 1 4 . 1 1 42 42 CYS N N 42 113.200 113.200 117.998 -4.798 19947
1208 1 4 . 1 1 42 42 CYS HA H 42 4.630 4.630 4.479 0.151 19947
1209 1 4 . 1 1 42 42 CYS CA C 42 53.700 53.700 57.187 -3.487 19947
1210 1 4 . 1 1 42 42 CYS CB C 42 45.500 45.500 29.471 16.029 19947
1211 1 4 . 1 1 42 42 CYS H H 42 7.710 7.710 7.575 0.135 19947
1212 1 4 . 1 1 43 43 ASN N N 43 114.200 114.200 123.813 -9.613 19947
1213 1 4 . 1 1 43 43 ASN HA H 43 4.940 4.940 4.777 0.163 19947
1214 1 4 . 1 1 43 43 ASN CA C 43 53.000 53.000 54.490 -1.490 19947
1215 1 4 . 1 1 43 43 ASN CB C 43 39.300 39.300 39.250 0.050 19947
1216 1 4 . 1 1 43 43 ASN H H 43 8.870 8.870 8.692 0.178 19947
1217 1 4 . 1 1 44 44 TYR N N 44 118.400 118.400 113.486 4.914 19947
1218 1 4 . 1 1 44 44 TYR HA H 44 4.850 4.850 4.604 0.246 19947
1219 1 4 . 1 1 44 44 TYR CA C 44 55.300 55.300 57.807 -2.507 19947
1220 1 4 . 1 1 44 44 TYR CB C 44 40.700 40.700 39.400 1.300 19947
1221 1 4 . 1 1 44 44 TYR H H 44 7.840 7.840 7.289 0.551 19947
1222 1 4 . 1 1 45 45 GLY N N 45 110.600 110.600 108.207 2.393 19947
1223 1 4 . 1 1 45 45 GLY CA C 45 44.000 44.000 45.047 -1.047 19947
1224 1 4 . 1 1 45 45 GLY H H 45 7.960 7.960 8.151 -0.191 19947
1225 1 4 . 1 1 46 46 GLU N N 46 120.700 120.700 120.246 0.454 19947
1226 1 4 . 1 1 46 46 GLU HA H 46 4.280 4.280 4.067 0.213 19947
1227 1 4 . 1 1 46 46 GLU CA C 46 58.500 58.500 60.163 -1.663 19947
1228 1 4 . 1 1 46 46 GLU CB C 46 29.300 29.300 30.149 -0.849 19947
1229 1 4 . 1 1 46 46 GLU H H 46 9.160 9.160 8.658 0.502 19947
1230 1 4 . 1 1 47 47 CYS N N 47 112.400 112.400 117.029 -4.629 19947
1231 1 4 . 1 1 47 47 CYS HA H 47 4.850 4.850 4.658 0.192 19947
1232 1 4 . 1 1 47 47 CYS CA C 47 57.100 57.100 58.396 -1.296 19947
1233 1 4 . 1 1 47 47 CYS CB C 47 41.200 41.200 25.556 15.644 19947
1234 1 4 . 1 1 47 47 CYS H H 47 8.510 8.510 7.503 1.007 19947
1235 1 4 . 1 1 48 48 CYS N N 48 123.200 123.200 119.920 3.280 19947
1236 1 4 . 1 1 48 48 CYS HA H 48 5.160 5.160 5.286 -0.126 19947
1237 1 4 . 1 1 48 48 CYS CA C 48 54.700 54.700 58.005 -3.305 19947
1238 1 4 . 1 1 48 48 CYS CB C 48 45.700 45.700 29.001 16.699 19947
1239 1 4 . 1 1 48 48 CYS H H 48 7.810 7.810 7.683 0.127 19947
1240 1 4 . 1 1 49 49 ASP N N 49 127.400 127.400 123.936 3.464 19947
1241 1 4 . 1 1 49 49 ASP HA H 49 4.890 4.890 5.016 -0.126 19947
1242 1 4 . 1 1 49 49 ASP CA C 49 53.500 53.500 53.512 -0.012 19947
1243 1 4 . 1 1 49 49 ASP CB C 49 42.400 42.400 44.501 -2.101 19947
1244 1 4 . 1 1 49 49 ASP H H 49 9.670 9.670 8.323 1.347 19947
1245 1 4 . 1 1 50 50 GLN N N 50 127.000 127.000 122.466 4.534 19947
1246 1 4 . 1 1 50 50 GLN HA H 50 3.940 3.940 4.009 -0.069 19947
1247 1 4 . 1 1 50 50 GLN CA C 50 56.800 56.800 58.519 -1.719 19947
1248 1 4 . 1 1 50 50 GLN CB C 50 26.500 26.500 28.008 -1.508 19947
1249 1 4 . 1 1 50 50 GLN H H 50 9.450 9.450 9.000 0.450 19947
1250 1 4 . 1 1 51 51 CYS N N 51 106.100 106.100 119.483 -13.383 19947
1251 1 4 . 1 1 51 51 CYS HA H 51 4.760 4.760 4.577 0.183 19947
1252 1 4 . 1 1 51 51 CYS CB C 51 43.200 43.200 27.924 15.276 19947
1253 1 4 . 1 1 51 51 CYS H H 51 8.700 8.700 8.426 0.274 19947
1254 1 4 . 1 1 52 52 ARG N N 52 121.000 121.000 118.474 2.526 19947
1255 1 4 . 1 1 52 52 ARG HA H 52 4.690 4.690 4.527 0.163 19947
1256 1 4 . 1 1 52 52 ARG CA C 52 55.400 55.400 54.698 0.702 19947
1257 1 4 . 1 1 52 52 ARG CB C 52 33.100 33.100 35.174 -2.074 19947
1258 1 4 . 1 1 52 52 ARG H H 52 7.960 7.960 7.768 0.192 19947
1259 1 4 . 1 1 53 53 PHE N N 53 120.300 120.300 120.373 -0.073 19947
1260 1 4 . 1 1 53 53 PHE HA H 53 5.050 5.050 5.118 -0.068 19947
1261 1 4 . 1 1 53 53 PHE CA C 53 56.100 56.100 56.091 0.009 19947
1262 1 4 . 1 1 53 53 PHE CB C 53 38.200 38.200 39.142 -0.941 19947
1263 1 4 . 1 1 53 53 PHE H H 53 8.400 8.400 8.380 0.020 19947
1264 1 4 . 1 1 54 54 LYS N N 54 123.300 123.300 125.829 -2.529 19947
1265 1 4 . 1 1 54 54 LYS HA H 54 4.250 4.250 4.141 0.109 19947
1266 1 4 . 1 1 54 54 LYS CA C 54 57.500 57.500 55.790 1.710 19947
1267 1 4 . 1 1 54 54 LYS CB C 54 34.300 34.300 31.078 3.222 19947
1268 1 4 . 1 1 54 54 LYS H H 54 8.540 8.540 8.228 0.312 19947
1269 1 4 . 1 1 55 55 LYS N N 55 119.400 119.400 123.827 -4.427 19947
1270 1 4 . 1 1 55 55 LYS HA H 55 4.110 4.110 3.954 0.156 19947
1271 1 4 . 1 1 55 55 LYS CA C 55 56.500 56.500 57.075 -0.575 19947
1272 1 4 . 1 1 55 55 LYS CB C 55 33.400 33.400 33.172 0.228 19947
1273 1 4 . 1 1 55 55 LYS H H 55 8.440 8.440 8.067 0.373 19947
1274 1 4 . 1 1 56 56 ALA N N 56 126.700 126.700 127.228 -0.528 19947
1275 1 4 . 1 1 56 56 ALA HA H 56 3.920 3.920 4.106 -0.186 19947
1276 1 4 . 1 1 56 56 ALA CA C 56 52.900 52.900 53.664 -0.764 19947
1277 1 4 . 1 1 56 56 ALA CB C 56 18.100 18.100 18.045 0.055 19947
1278 1 4 . 1 1 56 56 ALA H H 56 8.930 8.930 8.596 0.334 19947
1279 1 4 . 1 1 57 57 GLY N N 57 109.300 109.300 112.039 -2.739 19947
1280 1 4 . 1 1 57 57 GLY CA C 57 45.100 45.100 44.889 0.211 19947
1281 1 4 . 1 1 57 57 GLY H H 57 8.460 8.460 8.461 -0.001 19947
1282 1 4 . 1 1 58 58 THR N N 58 117.200 117.200 119.721 -2.521 19947
1283 1 4 . 1 1 58 58 THR HA H 58 4.260 4.260 4.439 -0.179 19947
1284 1 4 . 1 1 58 58 THR CA C 58 63.300 63.300 63.089 0.211 19947
1285 1 4 . 1 1 58 58 THR CB C 58 69.600 69.600 69.094 0.506 19947
1286 1 4 . 1 1 58 58 THR H H 58 7.660 7.660 7.785 -0.125 19947
1287 1 4 . 1 1 59 59 VAL N N 59 130.400 130.400 126.814 3.586 19947
1288 1 4 . 1 1 59 59 VAL HA H 59 3.900 3.900 3.614 0.286 19947
1289 1 4 . 1 1 59 59 VAL CA C 59 64.400 64.400 62.965 1.435 19947
1290 1 4 . 1 1 59 59 VAL CB C 59 31.900 31.900 31.728 0.172 19947
1291 1 4 . 1 1 59 59 VAL H H 59 9.190 9.190 8.632 0.558 19947
1292 1 4 . 1 1 60 60 CYS N N 60 121.800 121.800 125.296 -3.496 19947
1293 1 4 . 1 1 60 60 CYS HA H 60 5.050 5.050 4.639 0.411 19947
1294 1 4 . 1 1 60 60 CYS CA C 60 54.400 54.400 57.466 -3.066 19947
1295 1 4 . 1 1 60 60 CYS CB C 60 43.000 43.000 27.622 15.378 19947
1296 1 4 . 1 1 60 60 CYS H H 60 9.130 9.130 8.183 0.947 19947
1297 1 4 . 1 1 61 61 ARG N N 61 124.100 124.100 118.768 5.332 19947
1298 1 4 . 1 1 61 61 ARG HA H 61 4.360 4.360 4.636 -0.276 19947
1299 1 4 . 1 1 61 61 ARG CA C 61 56.800 56.800 55.573 1.227 19947
1300 1 4 . 1 1 61 61 ARG CB C 61 32.800 32.800 34.483 -1.683 19947
1301 1 4 . 1 1 61 61 ARG H H 61 7.580 7.580 7.368 0.212 19947
1302 1 4 . 1 1 62 62 ILE N N 62 126.200 126.200 113.616 12.584 19947
1303 1 4 . 1 1 62 62 ILE HA H 62 4.090 4.090 4.582 -0.492 19947
1304 1 4 . 1 1 62 62 ILE CA C 62 60.300 60.300 60.223 0.077 19947
1305 1 4 . 1 1 62 62 ILE CB C 62 38.700 38.700 39.812 -1.112 19947
1306 1 4 . 1 1 62 62 ILE H H 62 8.490 8.490 8.383 0.107 19947
1307 1 4 . 1 1 63 63 ALA N N 63 129.400 129.400 129.662 -0.262 19947
1308 1 4 . 1 1 63 63 ALA HA H 63 4.310 4.310 4.428 -0.118 19947
1309 1 4 . 1 1 63 63 ALA CA C 63 51.900 51.900 54.604 -2.704 19947
1310 1 4 . 1 1 63 63 ALA CB C 63 20.600 20.600 19.641 0.959 19947
1311 1 4 . 1 1 63 63 ALA H H 63 8.100 8.100 8.986 -0.886 19947
1312 1 4 . 1 1 64 64 ARG N N 64 120.500 120.500 120.431 0.069 19947
1313 1 4 . 1 1 64 64 ARG HA H 64 4.290 4.290 4.470 -0.180 19947
1314 1 4 . 1 1 64 64 ARG CA C 64 56.200 56.200 55.683 0.517 19947
1315 1 4 . 1 1 64 64 ARG CB C 64 30.500 30.500 29.977 0.523 19947
1316 1 4 . 1 1 64 64 ARG H H 64 8.140 8.140 8.833 -0.693 19947
1317 1 4 . 1 1 65 65 GLY N N 65 110.500 110.500 112.882 -2.382 19947
1318 1 4 . 1 1 65 65 GLY CA C 65 45.100 45.100 44.593 0.507 19947
1319 1 4 . 1 1 65 65 GLY H H 65 8.040 8.040 8.404 -0.364 19947
1320 1 4 . 1 1 66 66 ASP N N 66 120.700 120.700 119.287 1.413 19947
1321 1 4 . 1 1 66 66 ASP HA H 66 4.610 4.610 4.489 0.121 19947
1322 1 4 . 1 1 66 66 ASP CA C 66 53.300 53.300 53.657 -0.357 19947
1323 1 4 . 1 1 66 66 ASP CB C 66 37.600 37.600 40.212 -2.612 19947
1324 1 4 . 1 1 66 66 ASP H H 66 8.380 8.380 7.271 1.109 19947
1325 1 4 . 1 1 67 67 TRP N N 67 120.100 120.100 123.647 -3.547 19947
1326 1 4 . 1 1 67 67 TRP HA H 67 4.760 4.760 4.983 -0.223 19947
1327 1 4 . 1 1 67 67 TRP CA C 67 57.200 57.200 57.926 -0.726 19947
1328 1 4 . 1 1 67 67 TRP CB C 67 29.100 29.100 29.240 -0.140 19947
1329 1 4 . 1 1 67 67 TRP H H 67 7.950 7.950 7.866 0.084 19947
1330 1 4 . 1 1 68 68 ASN N N 68 118.400 118.400 118.512 -0.112 19947
1331 1 4 . 1 1 68 68 ASN HA H 68 4.790 4.790 4.902 -0.112 19947
1332 1 4 . 1 1 68 68 ASN CA C 68 52.800 52.800 53.894 -1.094 19947
1333 1 4 . 1 1 68 68 ASN CB C 68 39.300 39.300 39.717 -0.417 19947
1334 1 4 . 1 1 68 68 ASN H H 68 8.180 8.180 8.640 -0.460 19947
1335 1 4 . 1 1 69 69 ASP N N 69 118.500 118.500 118.470 0.030 19947
1336 1 4 . 1 1 69 69 ASP HA H 69 4.620 4.620 4.407 0.213 19947
1337 1 4 . 1 1 69 69 ASP CA C 69 53.200 53.200 56.291 -3.091 19947
1338 1 4 . 1 1 69 69 ASP CB C 69 38.000 38.000 41.228 -3.228 19947
1339 1 4 . 1 1 69 69 ASP H H 69 8.130 8.130 8.450 -0.320 19947
1340 1 4 . 1 1 70 70 ASP N N 70 120.500 120.500 121.183 -0.683 19947
1341 1 4 . 1 1 70 70 ASP HA H 70 5.100 5.100 4.920 0.180 19947
1342 1 4 . 1 1 70 70 ASP CA C 70 52.500 52.500 53.864 -1.364 19947
1343 1 4 . 1 1 70 70 ASP CB C 70 42.600 42.600 42.007 0.593 19947
1344 1 4 . 1 1 70 70 ASP H H 70 8.140 8.140 8.128 0.012 19947
1345 1 4 . 1 1 71 71 TYR N N 71 118.900 118.900 124.259 -5.359 19947
1346 1 4 . 1 1 71 71 TYR HA H 71 5.210 5.210 4.846 0.364 19947
1347 1 4 . 1 1 71 71 TYR CA C 71 56.300 56.300 57.232 -0.932 19947
1348 1 4 . 1 1 71 71 TYR CB C 71 42.200 42.200 42.630 -0.430 19947
1349 1 4 . 1 1 71 71 TYR H H 71 8.450 8.450 8.126 0.324 19947
1350 1 4 . 1 1 72 72 CYS N N 72 119.800 119.800 122.688 -2.888 19947
1351 1 4 . 1 1 72 72 CYS HA H 72 4.900 4.900 4.488 0.412 19947
1352 1 4 . 1 1 72 72 CYS CA C 72 53.400 53.400 59.411 -6.011 19947
1353 1 4 . 1 1 72 72 CYS CB C 72 37.200 37.200 29.186 8.014 19947
1354 1 4 . 1 1 72 72 CYS H H 72 9.330 9.330 8.413 0.917 19947
1355 1 4 . 1 1 73 73 THR N N 73 112.700 112.700 114.790 -2.090 19947
1356 1 4 . 1 1 73 73 THR HA H 73 4.430 4.430 4.412 0.018 19947
1357 1 4 . 1 1 73 73 THR CA C 73 62.300 62.300 60.781 1.519 19947
1358 1 4 . 1 1 73 73 THR CB C 73 71.300 71.300 69.065 2.235 19947
1359 1 4 . 1 1 73 73 THR H H 73 9.980 9.980 8.802 1.178 19947
1360 1 4 . 1 1 74 74 GLY N N 74 111.500 111.500 110.955 0.545 19947
1361 1 4 . 1 1 74 74 GLY CA C 74 45.300 45.300 46.600 -1.300 19947
1362 1 4 . 1 1 74 74 GLY H H 74 8.580 8.580 7.703 0.877 19947
1363 1 4 . 1 1 75 75 LYS N N 75 115.900 115.900 117.203 -1.303 19947
1364 1 4 . 1 1 75 75 LYS HA H 75 4.140 4.140 4.473 -0.333 19947
1365 1 4 . 1 1 75 75 LYS CA C 75 54.800 54.800 55.545 -0.745 19947
1366 1 4 . 1 1 75 75 LYS CB C 75 34.200 34.200 33.983 0.217 19947
1367 1 4 . 1 1 75 75 LYS H H 75 7.900 7.900 7.542 0.358 19947
1368 1 4 . 1 1 76 76 SER N N 76 111.000 111.000 112.392 -1.392 19947
1369 1 4 . 1 1 76 76 SER HA H 76 4.160 4.160 3.806 0.354 19947
1370 1 4 . 1 1 76 76 SER CA C 76 61.400 61.400 56.502 4.898 19947
1371 1 4 . 1 1 76 76 SER CB C 76 64.300 64.300 65.144 -0.844 19947
1372 1 4 . 1 1 76 76 SER H H 76 6.520 6.520 6.822 -0.302 19947
1373 1 4 . 1 1 77 77 SER N N 77 117.100 117.100 112.910 4.190 19947
1374 1 4 . 1 1 77 77 SER HA H 77 4.220 4.220 4.638 -0.418 19947
1375 1 4 . 1 1 77 77 SER CA C 77 59.800 59.800 58.722 1.078 19947
1376 1 4 . 1 1 77 77 SER CB C 77 64.400 64.400 63.793 0.607 19947
1377 1 4 . 1 1 77 77 SER H H 77 9.030 9.030 8.335 0.695 19947
1378 1 4 . 1 1 78 78 ASP N N 78 122.100 122.100 122.126 -0.026 19947
1379 1 4 . 1 1 78 78 ASP HA H 78 4.930 4.930 4.718 0.212 19947
1380 1 4 . 1 1 78 78 ASP CA C 78 52.400 52.400 54.352 -1.952 19947
1381 1 4 . 1 1 78 78 ASP CB C 78 40.800 40.800 44.348 -3.548 19947
1382 1 4 . 1 1 78 78 ASP H H 78 8.340 8.340 7.168 1.172 19947
1383 1 4 . 1 1 79 79 CYS N N 79 122.200 122.200 122.298 -0.098 19947
1384 1 4 . 1 1 79 79 CYS HA H 79 5.320 5.320 4.865 0.455 19947
1385 1 4 . 1 1 79 79 CYS CA C 79 52.000 52.000 55.266 -3.266 19947
1386 1 4 . 1 1 79 79 CYS CB C 79 39.300 39.300 27.070 12.230 19947
1387 1 4 . 1 1 79 79 CYS H H 79 8.960 8.960 8.129 0.831 19947
1388 1 4 . 1 1 80 80 PRO HA H 80 4.410 4.410 4.161 0.249 19947
1389 1 4 . 1 1 80 80 PRO CA C 80 63.500 63.500 62.895 0.605 19947
1390 1 4 . 1 1 80 80 PRO CB C 80 32.400 32.400 32.619 -0.219 19947
1391 1 4 . 1 1 81 81 TRP N N 81 120.500 120.500 122.993 -2.493 19947
1392 1 4 . 1 1 81 81 TRP HA H 81 4.550 4.550 4.132 0.418 19947
1393 1 4 . 1 1 81 81 TRP CA C 81 56.400 56.400 58.983 -2.583 19947
1394 1 4 . 1 1 81 81 TRP CB C 81 29.500 29.500 28.477 1.022 19947
1395 1 4 . 1 1 81 81 TRP H H 81 8.400 8.400 7.335 1.065 19947
1396 1 4 . 1 1 82 82 ASN N N 82 120.400 120.400 112.787 7.613 19947
1397 1 4 . 1 1 82 82 ASN HA H 82 4.750 4.750 4.493 0.257 19947
1398 1 4 . 1 1 82 82 ASN CA C 82 53.100 53.100 53.283 -0.184 19947
1399 1 4 . 1 1 82 82 ASN CB C 82 39.000 39.000 37.886 1.114 19947
1400 1 4 . 1 1 82 82 ASN H H 82 8.040 8.040 8.325 -0.285 19947
1401 1 5 . 1 1 2 2 PRO HA H 2 4.820 4.820 4.681 0.139 19947
1402 1 5 . 1 1 2 2 PRO CA C 2 61.900 61.900 62.230 -0.330 19947
1403 1 5 . 1 1 2 2 PRO CB C 2 30.700 30.700 31.635 -0.935 19947
1404 1 5 . 1 1 3 3 PRO HA H 3 4.540 4.540 4.461 0.079 19947
1405 1 5 . 1 1 3 3 PRO CA C 3 62.900 62.900 62.946 -0.046 19947
1406 1 5 . 1 1 3 3 PRO CB C 3 32.100 32.100 32.394 -0.294 19947
1407 1 5 . 1 1 4 4 VAL N N 4 121.900 121.900 119.652 2.248 19947
1408 1 5 . 1 1 4 4 VAL HA H 4 4.200 4.200 4.541 -0.341 19947
1409 1 5 . 1 1 4 4 VAL CA C 4 62.300 62.300 60.959 1.341 19947
1410 1 5 . 1 1 4 4 VAL CB C 4 32.800 32.800 33.096 -0.296 19947
1411 1 5 . 1 1 4 4 VAL H H 4 8.330 8.330 7.913 0.417 19947
1412 1 5 . 1 1 5 5 CYS N N 5 120.900 120.900 124.808 -3.908 19947
1413 1 5 . 1 1 5 5 CYS HA H 5 4.700 4.700 4.650 0.050 19947
1414 1 5 . 1 1 5 5 CYS CA C 5 53.600 53.600 57.920 -4.320 19947
1415 1 5 . 1 1 5 5 CYS H H 5 8.500 8.500 8.975 -0.475 19947
1416 1 5 . 1 1 6 6 GLY N N 6 110.200 110.200 114.069 -3.869 19947
1417 1 5 . 1 1 6 6 GLY CA C 6 46.300 46.300 44.764 1.536 19947
1418 1 5 . 1 1 6 6 GLY H H 6 8.490 8.490 8.330 0.160 19947
1419 1 5 . 1 1 7 7 ASN N N 7 120.100 120.100 117.093 3.007 19947
1420 1 5 . 1 1 7 7 ASN HA H 7 4.730 4.730 4.329 0.401 19947
1421 1 5 . 1 1 7 7 ASN CA C 7 53.200 53.200 54.161 -0.961 19947
1422 1 5 . 1 1 7 7 ASN CB C 7 38.700 38.700 39.196 -0.496 19947
1423 1 5 . 1 1 7 7 ASN H H 7 8.320 8.320 8.295 0.025 19947
1424 1 5 . 1 1 8 8 LYS N N 8 121.300 121.300 123.970 -2.670 19947
1425 1 5 . 1 1 8 8 LYS HA H 8 4.340 4.340 4.113 0.227 19947
1426 1 5 . 1 1 8 8 LYS CA C 8 56.600 56.600 56.985 -0.385 19947
1427 1 5 . 1 1 8 8 LYS CB C 8 32.900 32.900 31.640 1.260 19947
1428 1 5 . 1 1 8 8 LYS H H 8 8.260 8.260 8.478 -0.218 19947
1429 1 5 . 1 1 9 9 ILE N N 9 136.600 136.600 123.282 13.318 19947
1430 1 5 . 1 1 9 9 ILE HA H 9 4.140 4.140 3.939 0.201 19947
1431 1 5 . 1 1 9 9 ILE CA C 9 61.300 61.300 62.345 -1.045 19947
1432 1 5 . 1 1 9 9 ILE CB C 9 38.200 38.200 37.561 0.639 19947
1433 1 5 . 1 1 9 9 ILE H H 9 8.150 8.150 8.130 0.020 19947
1434 1 5 . 1 1 10 10 LEU N N 10 125.700 125.700 124.116 1.584 19947
1435 1 5 . 1 1 10 10 LEU HA H 10 4.420 4.420 4.373 0.047 19947
1436 1 5 . 1 1 10 10 LEU CA C 10 55.200 55.200 55.809 -0.609 19947
1437 1 5 . 1 1 10 10 LEU CB C 10 42.300 42.300 40.258 2.042 19947
1438 1 5 . 1 1 10 10 LEU H H 10 8.230 8.230 8.291 -0.061 19947
1439 1 5 . 1 1 11 11 GLU N N 11 120.600 120.600 114.608 5.992 19947
1440 1 5 . 1 1 11 11 GLU HA H 11 4.470 4.470 4.099 0.371 19947
1441 1 5 . 1 1 11 11 GLU CA C 11 55.500 55.500 56.386 -0.886 19947
1442 1 5 . 1 1 11 11 GLU CB C 11 28.900 28.900 28.673 0.227 19947
1443 1 5 . 1 1 11 11 GLU H H 11 8.250 8.250 7.920 0.330 19947
1444 1 5 . 1 1 12 12 GLN N N 12 121.600 121.600 119.377 2.223 19947
1445 1 5 . 1 1 12 12 GLN HA H 12 4.350 4.350 4.547 -0.197 19947
1446 1 5 . 1 1 12 12 GLN CA C 12 56.600 56.600 55.854 0.746 19947
1447 1 5 . 1 1 12 12 GLN CB C 12 29.200 29.200 29.888 -0.688 19947
1448 1 5 . 1 1 12 12 GLN H H 12 8.460 8.460 7.763 0.697 19947
1449 1 5 . 1 1 13 13 GLY N N 13 110.700 110.700 107.349 3.351 19947
1450 1 5 . 1 1 13 13 GLY CA C 13 45.700 45.700 45.440 0.260 19947
1451 1 5 . 1 1 13 13 GLY H H 13 8.660 8.660 8.329 0.331 19947
1452 1 5 . 1 1 14 14 GLU N N 14 118.900 118.900 114.556 4.344 19947
1453 1 5 . 1 1 14 14 GLU HA H 14 4.530 4.530 4.166 0.364 19947
1454 1 5 . 1 1 14 14 GLU CA C 14 55.600 55.600 56.843 -1.243 19947
1455 1 5 . 1 1 14 14 GLU CB C 14 29.700 29.700 29.881 -0.181 19947
1456 1 5 . 1 1 14 14 GLU H H 14 8.230 8.230 8.284 -0.054 19947
1457 1 5 . 1 1 15 15 ASP N N 15 118.400 118.400 120.843 -2.443 19947
1458 1 5 . 1 1 15 15 ASP HA H 15 4.990 4.990 4.474 0.516 19947
1459 1 5 . 1 1 15 15 ASP CA C 15 53.500 53.500 58.288 -4.788 19947
1460 1 5 . 1 1 15 15 ASP CB C 15 39.700 39.700 41.597 -1.897 19947
1461 1 5 . 1 1 15 15 ASP H H 15 8.330 8.330 8.220 0.110 19947
1462 1 5 . 1 1 16 16 CYS HA H 16 4.340 4.340 4.495 -0.155 19947
1463 1 5 . 1 1 16 16 CYS H H 16 8.510 8.510 7.892 0.618 19947
1464 1 5 . 1 1 17 17 ASP N N 17 116.700 116.700 125.700 -9.000 19947
1465 1 5 . 1 1 17 17 ASP HA H 17 4.740 4.740 4.383 0.357 19947
1466 1 5 . 1 1 17 17 ASP CA C 17 53.100 53.100 54.942 -1.842 19947
1467 1 5 . 1 1 17 17 ASP CB C 17 38.600 38.600 39.671 -1.071 19947
1468 1 5 . 1 1 17 17 ASP H H 17 8.180 8.180 8.590 -0.410 19947
1469 1 5 . 1 1 18 18 CYS HA H 18 4.730 4.730 4.036 0.694 19947
1470 1 5 . 1 1 18 18 CYS CB C 18 41.900 41.900 26.921 14.979 19947
1471 1 5 . 1 1 19 19 GLY H H 19 8.220 8.220 8.288 -0.068 19947
1472 1 5 . 1 1 20 20 SER HA H 20 4.920 4.920 4.465 0.455 19947
1473 1 5 . 1 1 20 20 SER CA C 20 55.700 55.700 57.091 -1.391 19947
1474 1 5 . 1 1 20 20 SER CB C 20 63.500 63.500 62.540 0.960 19947
1475 1 5 . 1 1 20 20 SER H H 20 7.830 7.830 8.229 -0.399 19947
1476 1 5 . 1 1 21 21 PRO HA H 21 4.240 4.240 4.263 -0.023 19947
1477 1 5 . 1 1 21 21 PRO CA C 21 63.400 63.400 64.853 -1.454 19947
1478 1 5 . 1 1 21 21 PRO CB C 21 31.800 31.800 31.595 0.205 19947
1479 1 5 . 1 1 22 22 ALA N N 22 119.900 119.900 118.350 1.550 19947
1480 1 5 . 1 1 22 22 ALA HA H 22 4.220 4.220 4.067 0.153 19947
1481 1 5 . 1 1 22 22 ALA CA C 22 54.200 54.200 54.118 0.082 19947
1482 1 5 . 1 1 22 22 ALA CB C 22 18.500 18.500 18.325 0.175 19947
1483 1 5 . 1 1 22 22 ALA H H 22 8.180 8.180 8.612 -0.432 19947
1484 1 5 . 1 1 23 23 ASN N N 23 116.300 116.300 112.048 4.252 19947
1485 1 5 . 1 1 23 23 ASN HA H 23 4.670 4.670 4.898 -0.228 19947
1486 1 5 . 1 1 23 23 ASN CA C 23 53.200 53.200 52.458 0.742 19947
1487 1 5 . 1 1 23 23 ASN CB C 23 39.300 39.300 40.684 -1.383 19947
1488 1 5 . 1 1 23 23 ASN H H 23 7.960 7.960 7.829 0.131 19947
1489 1 5 . 1 1 24 24 CYS HA H 24 4.720 4.720 4.293 0.427 19947
1490 1 5 . 1 1 24 24 CYS H H 24 8.510 8.510 7.964 0.546 19947
1491 1 5 . 1 1 25 25 GLN HA H 25 4.460 4.460 3.945 0.515 19947
1492 1 5 . 1 1 25 25 GLN H H 25 8.320 8.320 8.553 -0.233 19947
1493 1 5 . 1 1 26 26 ASP HA H 26 4.740 4.740 4.631 0.109 19947
1494 1 5 . 1 1 26 26 ASP H H 26 8.580 8.580 8.362 0.218 19947
1495 1 5 . 1 1 27 27 ARG HA H 27 4.680 4.680 4.262 0.418 19947
1496 1 5 . 1 1 27 27 ARG CA C 27 54.700 54.700 58.183 -3.483 19947
1497 1 5 . 1 1 27 27 ARG H H 27 8.550 8.550 8.131 0.419 19947
1498 1 5 . 1 1 28 28 CYS HA H 28 4.120 4.120 4.785 -0.665 19947
1499 1 5 . 1 1 28 28 CYS CA C 28 54.400 54.400 58.378 -3.978 19947
1500 1 5 . 1 1 28 28 CYS CB C 28 19.000 19.000 26.512 -7.511 19947
1501 1 5 . 1 1 28 28 CYS H H 28 8.910 8.910 8.588 0.322 19947
1502 1 5 . 1 1 29 29 CYS N N 29 113.300 113.300 118.907 -5.607 19947
1503 1 5 . 1 1 29 29 CYS HA H 29 5.010 5.010 4.839 0.171 19947
1504 1 5 . 1 1 29 29 CYS CA C 29 54.300 54.300 56.672 -2.372 19947
1505 1 5 . 1 1 29 29 CYS H H 29 7.730 7.730 7.781 -0.051 19947
1506 1 5 . 1 1 30 30 ASN HA H 30 4.730 4.730 4.980 -0.250 19947
1507 1 5 . 1 1 30 30 ASN CB C 30 38.700 38.700 39.952 -1.252 19947
1508 1 5 . 1 1 30 30 ASN H H 30 8.870 8.870 8.604 0.266 19947
1509 1 5 . 1 1 31 31 ALA N N 31 129.400 129.400 126.761 2.639 19947
1510 1 5 . 1 1 31 31 ALA HA H 31 4.120 4.120 4.260 -0.140 19947
1511 1 5 . 1 1 31 31 ALA CA C 31 54.400 54.400 54.625 -0.225 19947
1512 1 5 . 1 1 31 31 ALA CB C 31 19.000 19.000 19.204 -0.204 19947
1513 1 5 . 1 1 31 31 ALA H H 31 8.890 8.890 8.610 0.280 19947
1514 1 5 . 1 1 32 32 ALA N N 32 116.400 116.400 117.706 -1.306 19947
1515 1 5 . 1 1 32 32 ALA HA H 32 4.340 4.340 4.261 0.079 19947
1516 1 5 . 1 1 32 32 ALA CA C 32 53.800 53.800 53.734 0.065 19947
1517 1 5 . 1 1 32 32 ALA CB C 32 19.100 19.100 18.797 0.303 19947
1518 1 5 . 1 1 32 32 ALA H H 32 8.250 8.250 8.315 -0.065 19947
1519 1 5 . 1 1 33 33 THR N N 33 104.300 104.300 110.235 -5.935 19947
1520 1 5 . 1 1 33 33 THR HA H 33 4.430 4.430 4.397 0.033 19947
1521 1 5 . 1 1 33 33 THR CA C 33 60.500 60.500 60.798 -0.298 19947
1522 1 5 . 1 1 33 33 THR CB C 33 70.600 70.600 69.100 1.500 19947
1523 1 5 . 1 1 33 33 THR H H 33 7.320 7.320 7.512 -0.192 19947
1524 1 5 . 1 1 34 34 CYS N N 34 123.400 123.400 119.969 3.431 19947
1525 1 5 . 1 1 34 34 CYS HA H 34 4.170 4.170 4.306 -0.136 19947
1526 1 5 . 1 1 34 34 CYS CA C 34 56.500 56.500 60.031 -3.531 19947
1527 1 5 . 1 1 34 34 CYS H H 34 8.710 8.710 8.447 0.263 19947
1528 1 5 . 1 1 35 35 LYS N N 35 116.900 116.900 118.741 -1.841 19947
1529 1 5 . 1 1 35 35 LYS HA H 35 4.960 4.960 4.853 0.107 19947
1530 1 5 . 1 1 35 35 LYS CA C 35 53.900 53.900 55.255 -1.355 19947
1531 1 5 . 1 1 35 35 LYS CB C 35 35.900 35.900 36.010 -0.110 19947
1532 1 5 . 1 1 35 35 LYS H H 35 7.450 7.450 7.746 -0.296 19947
1533 1 5 . 1 1 36 36 LEU N N 36 119.300 119.300 120.268 -0.968 19947
1534 1 5 . 1 1 36 36 LEU HA H 36 4.800 4.800 4.356 0.444 19947
1535 1 5 . 1 1 36 36 LEU CB C 36 42.400 42.400 41.893 0.507 19947
1536 1 5 . 1 1 36 36 LEU H H 36 8.290 8.290 8.182 0.108 19947
1537 1 5 . 1 1 37 37 THR HA H 37 4.340 4.340 4.696 -0.356 19947
1538 1 5 . 1 1 37 37 THR CA C 37 60.200 60.200 59.927 0.273 19947
1539 1 5 . 1 1 37 37 THR CB C 37 67.700 67.700 68.685 -0.985 19947
1540 1 5 . 1 1 37 37 THR H H 37 8.380 8.380 8.021 0.359 19947
1541 1 5 . 1 1 38 38 PRO HA H 38 4.380 4.380 4.335 0.045 19947
1542 1 5 . 1 1 38 38 PRO CA C 38 64.800 64.800 64.291 0.509 19947
1543 1 5 . 1 1 38 38 PRO CB C 38 31.500 31.500 31.728 -0.228 19947
1544 1 5 . 1 1 39 39 GLY N N 39 113.300 113.300 111.685 1.615 19947
1545 1 5 . 1 1 39 39 GLY CA C 39 45.100 45.100 44.696 0.404 19947
1546 1 5 . 1 1 39 39 GLY H H 39 8.830 8.830 8.455 0.375 19947
1547 1 5 . 1 1 40 40 SER N N 40 116.700 116.700 117.810 -1.110 19947
1548 1 5 . 1 1 40 40 SER HA H 40 4.610 4.610 4.586 0.024 19947
1549 1 5 . 1 1 40 40 SER CA C 40 58.800 58.800 58.998 -0.198 19947
1550 1 5 . 1 1 40 40 SER CB C 40 63.800 63.800 63.606 0.194 19947
1551 1 5 . 1 1 40 40 SER H H 40 8.280 8.280 7.749 0.531 19947
1552 1 5 . 1 1 41 41 GLN N N 41 120.600 120.600 125.532 -4.932 19947
1553 1 5 . 1 1 41 41 GLN HA H 41 4.110 4.110 4.137 -0.027 19947
1554 1 5 . 1 1 41 41 GLN CA C 41 55.200 55.200 57.469 -2.269 19947
1555 1 5 . 1 1 41 41 GLN CB C 41 31.100 31.100 29.493 1.607 19947
1556 1 5 . 1 1 41 41 GLN H H 41 9.190 9.190 7.997 1.193 19947
1557 1 5 . 1 1 42 42 CYS N N 42 113.200 113.200 114.216 -1.016 19947
1558 1 5 . 1 1 42 42 CYS HA H 42 4.630 4.630 4.771 -0.141 19947
1559 1 5 . 1 1 42 42 CYS CA C 42 53.700 53.700 56.412 -2.712 19947
1560 1 5 . 1 1 42 42 CYS CB C 42 45.500 45.500 30.762 14.738 19947
1561 1 5 . 1 1 42 42 CYS H H 42 7.710 7.710 7.322 0.388 19947
1562 1 5 . 1 1 43 43 ASN N N 43 114.200 114.200 118.363 -4.163 19947
1563 1 5 . 1 1 43 43 ASN HA H 43 4.940 4.940 4.646 0.294 19947
1564 1 5 . 1 1 43 43 ASN CA C 43 53.000 53.000 54.542 -1.542 19947
1565 1 5 . 1 1 43 43 ASN CB C 43 39.300 39.300 39.409 -0.109 19947
1566 1 5 . 1 1 43 43 ASN H H 43 8.870 8.870 8.804 0.066 19947
1567 1 5 . 1 1 44 44 TYR N N 44 118.400 118.400 112.981 5.419 19947
1568 1 5 . 1 1 44 44 TYR HA H 44 4.850 4.850 4.601 0.249 19947
1569 1 5 . 1 1 44 44 TYR CA C 44 55.300 55.300 57.477 -2.177 19947
1570 1 5 . 1 1 44 44 TYR CB C 44 40.700 40.700 39.736 0.964 19947
1571 1 5 . 1 1 44 44 TYR H H 44 7.840 7.840 7.133 0.707 19947
1572 1 5 . 1 1 45 45 GLY N N 45 110.600 110.600 107.833 2.767 19947
1573 1 5 . 1 1 45 45 GLY CA C 45 44.000 44.000 44.845 -0.845 19947
1574 1 5 . 1 1 45 45 GLY H H 45 7.960 7.960 8.042 -0.082 19947
1575 1 5 . 1 1 46 46 GLU N N 46 120.700 120.700 119.265 1.435 19947
1576 1 5 . 1 1 46 46 GLU HA H 46 4.280 4.280 4.145 0.135 19947
1577 1 5 . 1 1 46 46 GLU CA C 46 58.500 58.500 59.958 -1.458 19947
1578 1 5 . 1 1 46 46 GLU CB C 46 29.300 29.300 30.038 -0.738 19947
1579 1 5 . 1 1 46 46 GLU H H 46 9.160 9.160 8.484 0.676 19947
1580 1 5 . 1 1 47 47 CYS N N 47 112.400 112.400 115.700 -3.300 19947
1581 1 5 . 1 1 47 47 CYS HA H 47 4.850 4.850 4.681 0.169 19947
1582 1 5 . 1 1 47 47 CYS CA C 47 57.100 57.100 59.247 -2.147 19947
1583 1 5 . 1 1 47 47 CYS CB C 47 41.200 41.200 26.643 14.557 19947
1584 1 5 . 1 1 47 47 CYS H H 47 8.510 8.510 7.501 1.009 19947
1585 1 5 . 1 1 48 48 CYS N N 48 123.200 123.200 119.955 3.245 19947
1586 1 5 . 1 1 48 48 CYS HA H 48 5.160 5.160 4.952 0.208 19947
1587 1 5 . 1 1 48 48 CYS CA C 48 54.700 54.700 60.174 -5.474 19947
1588 1 5 . 1 1 48 48 CYS CB C 48 45.700 45.700 27.448 18.252 19947
1589 1 5 . 1 1 48 48 CYS H H 48 7.810 7.810 8.153 -0.343 19947
1590 1 5 . 1 1 49 49 ASP N N 49 127.400 127.400 127.321 0.079 19947
1591 1 5 . 1 1 49 49 ASP HA H 49 4.890 4.890 4.947 -0.057 19947
1592 1 5 . 1 1 49 49 ASP CA C 49 53.500 53.500 53.868 -0.368 19947
1593 1 5 . 1 1 49 49 ASP CB C 49 42.400 42.400 43.383 -0.983 19947
1594 1 5 . 1 1 49 49 ASP H H 49 9.670 9.670 8.868 0.802 19947
1595 1 5 . 1 1 50 50 GLN N N 50 127.000 127.000 123.603 3.397 19947
1596 1 5 . 1 1 50 50 GLN HA H 50 3.940 3.940 3.988 -0.048 19947
1597 1 5 . 1 1 50 50 GLN CA C 50 56.800 56.800 58.756 -1.956 19947
1598 1 5 . 1 1 50 50 GLN CB C 50 26.500 26.500 28.118 -1.618 19947
1599 1 5 . 1 1 50 50 GLN H H 50 9.450 9.450 8.987 0.463 19947
1600 1 5 . 1 1 51 51 CYS N N 51 106.100 106.100 118.480 -12.380 19947
1601 1 5 . 1 1 51 51 CYS HA H 51 4.760 4.760 4.646 0.114 19947
1602 1 5 . 1 1 51 51 CYS CB C 51 43.200 43.200 27.999 15.201 19947
1603 1 5 . 1 1 51 51 CYS H H 51 8.700 8.700 8.417 0.283 19947
1604 1 5 . 1 1 52 52 ARG N N 52 121.000 121.000 118.581 2.419 19947
1605 1 5 . 1 1 52 52 ARG HA H 52 4.690 4.690 4.522 0.168 19947
1606 1 5 . 1 1 52 52 ARG CA C 52 55.400 55.400 53.974 1.426 19947
1607 1 5 . 1 1 52 52 ARG CB C 52 33.100 33.100 34.105 -1.005 19947
1608 1 5 . 1 1 52 52 ARG H H 52 7.960 7.960 7.746 0.214 19947
1609 1 5 . 1 1 53 53 PHE N N 53 120.300 120.300 120.134 0.166 19947
1610 1 5 . 1 1 53 53 PHE HA H 53 5.050 5.050 5.193 -0.143 19947
1611 1 5 . 1 1 53 53 PHE CA C 53 56.100 56.100 55.969 0.131 19947
1612 1 5 . 1 1 53 53 PHE CB C 53 38.200 38.200 39.696 -1.496 19947
1613 1 5 . 1 1 53 53 PHE H H 53 8.400 8.400 8.376 0.024 19947
1614 1 5 . 1 1 54 54 LYS N N 54 123.300 123.300 124.566 -1.266 19947
1615 1 5 . 1 1 54 54 LYS HA H 54 4.250 4.250 4.244 0.006 19947
1616 1 5 . 1 1 54 54 LYS CA C 54 57.500 57.500 55.759 1.741 19947
1617 1 5 . 1 1 54 54 LYS CB C 54 34.300 34.300 31.596 2.704 19947
1618 1 5 . 1 1 54 54 LYS H H 54 8.540 8.540 8.958 -0.418 19947
1619 1 5 . 1 1 55 55 LYS N N 55 119.400 119.400 124.790 -5.390 19947
1620 1 5 . 1 1 55 55 LYS HA H 55 4.110 4.110 3.999 0.111 19947
1621 1 5 . 1 1 55 55 LYS CA C 55 56.500 56.500 56.901 -0.401 19947
1622 1 5 . 1 1 55 55 LYS CB C 55 33.400 33.400 33.187 0.213 19947
1623 1 5 . 1 1 55 55 LYS H H 55 8.440 8.440 8.374 0.066 19947
1624 1 5 . 1 1 56 56 ALA N N 56 126.700 126.700 126.816 -0.116 19947
1625 1 5 . 1 1 56 56 ALA HA H 56 3.920 3.920 4.060 -0.140 19947
1626 1 5 . 1 1 56 56 ALA CA C 56 52.900 52.900 53.724 -0.824 19947
1627 1 5 . 1 1 56 56 ALA CB C 56 18.100 18.100 18.267 -0.167 19947
1628 1 5 . 1 1 56 56 ALA H H 56 8.930 8.930 8.567 0.363 19947
1629 1 5 . 1 1 57 57 GLY N N 57 109.300 109.300 111.974 -2.674 19947
1630 1 5 . 1 1 57 57 GLY CA C 57 45.100 45.100 44.802 0.298 19947
1631 1 5 . 1 1 57 57 GLY H H 57 8.460 8.460 8.444 0.016 19947
1632 1 5 . 1 1 58 58 THR N N 58 117.200 117.200 119.937 -2.737 19947
1633 1 5 . 1 1 58 58 THR HA H 58 4.260 4.260 4.416 -0.156 19947
1634 1 5 . 1 1 58 58 THR CA C 58 63.300 63.300 63.475 -0.175 19947
1635 1 5 . 1 1 58 58 THR CB C 58 69.600 69.600 69.508 0.092 19947
1636 1 5 . 1 1 58 58 THR H H 58 7.660 7.660 7.735 -0.075 19947
1637 1 5 . 1 1 59 59 VAL N N 59 130.400 130.400 127.491 2.909 19947
1638 1 5 . 1 1 59 59 VAL HA H 59 3.900 3.900 4.182 -0.282 19947
1639 1 5 . 1 1 59 59 VAL CA C 59 64.400 64.400 61.550 2.850 19947
1640 1 5 . 1 1 59 59 VAL CB C 59 31.900 31.900 31.924 -0.024 19947
1641 1 5 . 1 1 59 59 VAL H H 59 9.190 9.190 8.726 0.464 19947
1642 1 5 . 1 1 60 60 CYS N N 60 121.800 121.800 126.804 -5.004 19947
1643 1 5 . 1 1 60 60 CYS HA H 60 5.050 5.050 4.558 0.492 19947
1644 1 5 . 1 1 60 60 CYS CA C 60 54.400 54.400 58.492 -4.092 19947
1645 1 5 . 1 1 60 60 CYS CB C 60 43.000 43.000 27.593 15.407 19947
1646 1 5 . 1 1 60 60 CYS H H 60 9.130 9.130 8.223 0.907 19947
1647 1 5 . 1 1 61 61 ARG N N 61 124.100 124.100 118.648 5.452 19947
1648 1 5 . 1 1 61 61 ARG HA H 61 4.360 4.360 4.642 -0.282 19947
1649 1 5 . 1 1 61 61 ARG CA C 61 56.800 56.800 55.337 1.463 19947
1650 1 5 . 1 1 61 61 ARG CB C 61 32.800 32.800 34.670 -1.870 19947
1651 1 5 . 1 1 61 61 ARG H H 61 7.580 7.580 7.415 0.165 19947
1652 1 5 . 1 1 62 62 ILE N N 62 126.200 126.200 115.947 10.253 19947
1653 1 5 . 1 1 62 62 ILE HA H 62 4.090 4.090 4.612 -0.522 19947
1654 1 5 . 1 1 62 62 ILE CA C 62 60.300 60.300 61.273 -0.973 19947
1655 1 5 . 1 1 62 62 ILE CB C 62 38.700 38.700 40.689 -1.989 19947
1656 1 5 . 1 1 62 62 ILE H H 62 8.490 8.490 8.445 0.045 19947
1657 1 5 . 1 1 63 63 ALA N N 63 129.400 129.400 132.594 -3.194 19947
1658 1 5 . 1 1 63 63 ALA HA H 63 4.310 4.310 4.434 -0.124 19947
1659 1 5 . 1 1 63 63 ALA CA C 63 51.900 51.900 54.253 -2.353 19947
1660 1 5 . 1 1 63 63 ALA CB C 63 20.600 20.600 18.983 1.617 19947
1661 1 5 . 1 1 63 63 ALA H H 63 8.100 8.100 8.579 -0.479 19947
1662 1 5 . 1 1 64 64 ARG N N 64 120.500 120.500 121.020 -0.520 19947
1663 1 5 . 1 1 64 64 ARG HA H 64 4.290 4.290 4.465 -0.175 19947
1664 1 5 . 1 1 64 64 ARG CA C 64 56.200 56.200 55.950 0.250 19947
1665 1 5 . 1 1 64 64 ARG CB C 64 30.500 30.500 30.451 0.049 19947
1666 1 5 . 1 1 64 64 ARG H H 64 8.140 8.140 8.713 -0.573 19947
1667 1 5 . 1 1 65 65 GLY N N 65 110.500 110.500 112.872 -2.372 19947
1668 1 5 . 1 1 65 65 GLY CA C 65 45.100 45.100 44.560 0.540 19947
1669 1 5 . 1 1 65 65 GLY H H 65 8.040 8.040 8.333 -0.293 19947
1670 1 5 . 1 1 66 66 ASP N N 66 120.700 120.700 119.041 1.659 19947
1671 1 5 . 1 1 66 66 ASP HA H 66 4.610 4.610 4.481 0.129 19947
1672 1 5 . 1 1 66 66 ASP CA C 66 53.300 53.300 53.730 -0.430 19947
1673 1 5 . 1 1 66 66 ASP CB C 66 37.600 37.600 40.371 -2.771 19947
1674 1 5 . 1 1 66 66 ASP H H 66 8.380 8.380 7.190 1.190 19947
1675 1 5 . 1 1 67 67 TRP N N 67 120.100 120.100 123.110 -3.010 19947
1676 1 5 . 1 1 67 67 TRP HA H 67 4.760 4.760 5.058 -0.298 19947
1677 1 5 . 1 1 67 67 TRP CA C 67 57.200 57.200 57.883 -0.683 19947
1678 1 5 . 1 1 67 67 TRP CB C 67 29.100 29.100 29.502 -0.402 19947
1679 1 5 . 1 1 67 67 TRP H H 67 7.950 7.950 7.590 0.360 19947
1680 1 5 . 1 1 68 68 ASN N N 68 118.400 118.400 117.422 0.978 19947
1681 1 5 . 1 1 68 68 ASN HA H 68 4.790 4.790 4.954 -0.164 19947
1682 1 5 . 1 1 68 68 ASN CA C 68 52.800 52.800 53.723 -0.923 19947
1683 1 5 . 1 1 68 68 ASN CB C 68 39.300 39.300 40.366 -1.066 19947
1684 1 5 . 1 1 68 68 ASN H H 68 8.180 8.180 8.873 -0.693 19947
1685 1 5 . 1 1 69 69 ASP N N 69 118.500 118.500 118.105 0.395 19947
1686 1 5 . 1 1 69 69 ASP HA H 69 4.620 4.620 4.519 0.101 19947
1687 1 5 . 1 1 69 69 ASP CA C 69 53.200 53.200 56.277 -3.077 19947
1688 1 5 . 1 1 69 69 ASP CB C 69 38.000 38.000 41.188 -3.188 19947
1689 1 5 . 1 1 69 69 ASP H H 69 8.130 8.130 8.362 -0.232 19947
1690 1 5 . 1 1 70 70 ASP N N 70 120.500 120.500 120.819 -0.319 19947
1691 1 5 . 1 1 70 70 ASP HA H 70 5.100 5.100 5.265 -0.165 19947
1692 1 5 . 1 1 70 70 ASP CA C 70 52.500 52.500 52.853 -0.353 19947
1693 1 5 . 1 1 70 70 ASP CB C 70 42.600 42.600 42.897 -0.297 19947
1694 1 5 . 1 1 70 70 ASP H H 70 8.140 8.140 8.084 0.056 19947
1695 1 5 . 1 1 71 71 TYR N N 71 118.900 118.900 123.765 -4.865 19947
1696 1 5 . 1 1 71 71 TYR HA H 71 5.210 5.210 5.194 0.016 19947
1697 1 5 . 1 1 71 71 TYR CA C 71 56.300 56.300 56.806 -0.506 19947
1698 1 5 . 1 1 71 71 TYR CB C 71 42.200 42.200 42.667 -0.467 19947
1699 1 5 . 1 1 71 71 TYR H H 71 8.450 8.450 8.340 0.110 19947
1700 1 5 . 1 1 72 72 CYS N N 72 119.800 119.800 122.280 -2.480 19947
1701 1 5 . 1 1 72 72 CYS HA H 72 4.900 4.900 4.455 0.445 19947
1702 1 5 . 1 1 72 72 CYS CA C 72 53.400 53.400 59.654 -6.254 19947
1703 1 5 . 1 1 72 72 CYS CB C 72 37.200 37.200 29.107 8.093 19947
1704 1 5 . 1 1 72 72 CYS H H 72 9.330 9.330 8.831 0.499 19947
1705 1 5 . 1 1 73 73 THR N N 73 112.700 112.700 114.661 -1.961 19947
1706 1 5 . 1 1 73 73 THR HA H 73 4.430 4.430 4.450 -0.020 19947
1707 1 5 . 1 1 73 73 THR CA C 73 62.300 62.300 61.118 1.182 19947
1708 1 5 . 1 1 73 73 THR CB C 73 71.300 71.300 69.716 1.584 19947
1709 1 5 . 1 1 73 73 THR H H 73 9.980 9.980 8.770 1.210 19947
1710 1 5 . 1 1 74 74 GLY N N 74 111.500 111.500 110.699 0.801 19947
1711 1 5 . 1 1 74 74 GLY CA C 74 45.300 45.300 46.575 -1.275 19947
1712 1 5 . 1 1 74 74 GLY H H 74 8.580 8.580 7.742 0.838 19947
1713 1 5 . 1 1 75 75 LYS N N 75 115.900 115.900 116.773 -0.873 19947
1714 1 5 . 1 1 75 75 LYS HA H 75 4.140 4.140 4.601 -0.461 19947
1715 1 5 . 1 1 75 75 LYS CA C 75 54.800 54.800 55.586 -0.786 19947
1716 1 5 . 1 1 75 75 LYS CB C 75 34.200 34.200 34.187 0.013 19947
1717 1 5 . 1 1 75 75 LYS H H 75 7.900 7.900 7.624 0.276 19947
1718 1 5 . 1 1 76 76 SER N N 76 111.000 111.000 112.923 -1.923 19947
1719 1 5 . 1 1 76 76 SER HA H 76 4.160 4.160 3.925 0.235 19947
1720 1 5 . 1 1 76 76 SER CA C 76 61.400 61.400 57.007 4.393 19947
1721 1 5 . 1 1 76 76 SER CB C 76 64.300 64.300 65.226 -0.926 19947
1722 1 5 . 1 1 76 76 SER H H 76 6.520 6.520 7.133 -0.613 19947
1723 1 5 . 1 1 77 77 SER N N 77 117.100 117.100 115.877 1.223 19947
1724 1 5 . 1 1 77 77 SER HA H 77 4.220 4.220 4.341 -0.121 19947
1725 1 5 . 1 1 77 77 SER CA C 77 59.800 59.800 59.244 0.556 19947
1726 1 5 . 1 1 77 77 SER CB C 77 64.400 64.400 63.702 0.698 19947
1727 1 5 . 1 1 77 77 SER H H 77 9.030 9.030 8.339 0.691 19947
1728 1 5 . 1 1 78 78 ASP N N 78 122.100 122.100 122.244 -0.144 19947
1729 1 5 . 1 1 78 78 ASP HA H 78 4.930 4.930 4.777 0.153 19947
1730 1 5 . 1 1 78 78 ASP CA C 78 52.400 52.400 54.297 -1.897 19947
1731 1 5 . 1 1 78 78 ASP CB C 78 40.800 40.800 43.810 -3.010 19947
1732 1 5 . 1 1 78 78 ASP H H 78 8.340 8.340 7.442 0.898 19947
1733 1 5 . 1 1 79 79 CYS N N 79 122.200 122.200 122.051 0.149 19947
1734 1 5 . 1 1 79 79 CYS HA H 79 5.320 5.320 4.892 0.428 19947
1735 1 5 . 1 1 79 79 CYS CA C 79 52.000 52.000 55.803 -3.804 19947
1736 1 5 . 1 1 79 79 CYS CB C 79 39.300 39.300 27.719 11.581 19947
1737 1 5 . 1 1 79 79 CYS H H 79 8.960 8.960 8.625 0.335 19947
1738 1 5 . 1 1 80 80 PRO HA H 80 4.410 4.410 4.570 -0.160 19947
1739 1 5 . 1 1 80 80 PRO CA C 80 63.500 63.500 63.122 0.378 19947
1740 1 5 . 1 1 80 80 PRO CB C 80 32.400 32.400 32.264 0.137 19947
1741 1 5 . 1 1 81 81 TRP N N 81 120.500 120.500 121.065 -0.565 19947
1742 1 5 . 1 1 81 81 TRP HA H 81 4.550 4.550 4.670 -0.120 19947
1743 1 5 . 1 1 81 81 TRP CA C 81 56.400 56.400 53.897 2.503 19947
1744 1 5 . 1 1 81 81 TRP CB C 81 29.500 29.500 28.494 1.006 19947
1745 1 5 . 1 1 81 81 TRP H H 81 8.400 8.400 8.383 0.017 19947
1746 1 5 . 1 1 82 82 ASN N N 82 120.400 120.400 116.322 4.078 19947
1747 1 5 . 1 1 82 82 ASN HA H 82 4.750 4.750 4.429 0.321 19947
1748 1 5 . 1 1 82 82 ASN CA C 82 53.100 53.100 54.024 -0.924 19947
1749 1 5 . 1 1 82 82 ASN CB C 82 39.000 39.000 36.939 2.061 19947
1750 1 5 . 1 1 82 82 ASN H H 82 8.040 8.040 8.427 -0.387 19947
1751 1 6 . 1 1 2 2 PRO HA H 2 4.820 4.820 4.496 0.324 19947
1752 1 6 . 1 1 2 2 PRO CA C 2 61.900 61.900 62.102 -0.202 19947
1753 1 6 . 1 1 2 2 PRO CB C 2 30.700 30.700 31.710 -1.010 19947
1754 1 6 . 1 1 3 3 PRO HA H 3 4.540 4.540 4.359 0.181 19947
1755 1 6 . 1 1 3 3 PRO CA C 3 62.900 62.900 63.275 -0.375 19947
1756 1 6 . 1 1 3 3 PRO CB C 3 32.100 32.100 31.898 0.202 19947
1757 1 6 . 1 1 4 4 VAL N N 4 121.900 121.900 120.968 0.932 19947
1758 1 6 . 1 1 4 4 VAL HA H 4 4.200 4.200 4.492 -0.292 19947
1759 1 6 . 1 1 4 4 VAL CA C 4 62.300 62.300 60.094 2.206 19947
1760 1 6 . 1 1 4 4 VAL CB C 4 32.800 32.800 32.152 0.648 19947
1761 1 6 . 1 1 4 4 VAL H H 4 8.330 8.330 7.966 0.364 19947
1762 1 6 . 1 1 5 5 CYS N N 5 120.900 120.900 124.194 -3.294 19947
1763 1 6 . 1 1 5 5 CYS HA H 5 4.700 4.700 4.492 0.208 19947
1764 1 6 . 1 1 5 5 CYS CA C 5 53.600 53.600 58.934 -5.334 19947
1765 1 6 . 1 1 5 5 CYS H H 5 8.500 8.500 8.796 -0.296 19947
1766 1 6 . 1 1 6 6 GLY N N 6 110.200 110.200 115.362 -5.162 19947
1767 1 6 . 1 1 6 6 GLY CA C 6 46.300 46.300 44.853 1.447 19947
1768 1 6 . 1 1 6 6 GLY H H 6 8.490 8.490 8.338 0.152 19947
1769 1 6 . 1 1 7 7 ASN N N 7 120.100 120.100 117.031 3.069 19947
1770 1 6 . 1 1 7 7 ASN HA H 7 4.730 4.730 4.337 0.393 19947
1771 1 6 . 1 1 7 7 ASN CA C 7 53.200 53.200 54.259 -1.059 19947
1772 1 6 . 1 1 7 7 ASN CB C 7 38.700 38.700 39.016 -0.316 19947
1773 1 6 . 1 1 7 7 ASN H H 7 8.320 8.320 8.205 0.115 19947
1774 1 6 . 1 1 8 8 LYS N N 8 121.300 121.300 124.089 -2.789 19947
1775 1 6 . 1 1 8 8 LYS HA H 8 4.340 4.340 4.236 0.104 19947
1776 1 6 . 1 1 8 8 LYS CA C 8 56.600 56.600 56.862 -0.262 19947
1777 1 6 . 1 1 8 8 LYS CB C 8 32.900 32.900 32.017 0.883 19947
1778 1 6 . 1 1 8 8 LYS H H 8 8.260 8.260 8.315 -0.055 19947
1779 1 6 . 1 1 9 9 ILE N N 9 136.600 136.600 122.984 13.616 19947
1780 1 6 . 1 1 9 9 ILE HA H 9 4.140 4.140 3.887 0.253 19947
1781 1 6 . 1 1 9 9 ILE CA C 9 61.300 61.300 62.205 -0.905 19947
1782 1 6 . 1 1 9 9 ILE CB C 9 38.200 38.200 37.858 0.342 19947
1783 1 6 . 1 1 9 9 ILE H H 9 8.150 8.150 8.160 -0.010 19947
1784 1 6 . 1 1 10 10 LEU N N 10 125.700 125.700 121.086 4.614 19947
1785 1 6 . 1 1 10 10 LEU HA H 10 4.420 4.420 4.473 -0.053 19947
1786 1 6 . 1 1 10 10 LEU CA C 10 55.200 55.200 55.575 -0.376 19947
1787 1 6 . 1 1 10 10 LEU CB C 10 42.300 42.300 40.880 1.420 19947
1788 1 6 . 1 1 10 10 LEU H H 10 8.230 8.230 8.385 -0.155 19947
1789 1 6 . 1 1 11 11 GLU N N 11 120.600 120.600 113.243 7.357 19947
1790 1 6 . 1 1 11 11 GLU HA H 11 4.470 4.470 4.117 0.353 19947
1791 1 6 . 1 1 11 11 GLU CA C 11 55.500 55.500 56.707 -1.207 19947
1792 1 6 . 1 1 11 11 GLU CB C 11 28.900 28.900 28.187 0.713 19947
1793 1 6 . 1 1 11 11 GLU H H 11 8.250 8.250 7.919 0.331 19947
1794 1 6 . 1 1 12 12 GLN N N 12 121.600 121.600 119.393 2.207 19947
1795 1 6 . 1 1 12 12 GLN HA H 12 4.350 4.350 4.551 -0.201 19947
1796 1 6 . 1 1 12 12 GLN CA C 12 56.600 56.600 55.306 1.294 19947
1797 1 6 . 1 1 12 12 GLN CB C 12 29.200 29.200 30.022 -0.822 19947
1798 1 6 . 1 1 12 12 GLN H H 12 8.460 8.460 7.805 0.655 19947
1799 1 6 . 1 1 13 13 GLY N N 13 110.700 110.700 108.030 2.670 19947
1800 1 6 . 1 1 13 13 GLY CA C 13 45.700 45.700 46.070 -0.370 19947
1801 1 6 . 1 1 13 13 GLY H H 13 8.660 8.660 8.591 0.069 19947
1802 1 6 . 1 1 14 14 GLU N N 14 118.900 118.900 114.436 4.464 19947
1803 1 6 . 1 1 14 14 GLU HA H 14 4.530 4.530 4.248 0.282 19947
1804 1 6 . 1 1 14 14 GLU CA C 14 55.600 55.600 56.819 -1.219 19947
1805 1 6 . 1 1 14 14 GLU CB C 14 29.700 29.700 28.745 0.955 19947
1806 1 6 . 1 1 14 14 GLU H H 14 8.230 8.230 8.108 0.122 19947
1807 1 6 . 1 1 15 15 ASP N N 15 118.400 118.400 121.123 -2.723 19947
1808 1 6 . 1 1 15 15 ASP HA H 15 4.990 4.990 4.394 0.596 19947
1809 1 6 . 1 1 15 15 ASP CA C 15 53.500 53.500 57.870 -4.370 19947
1810 1 6 . 1 1 15 15 ASP CB C 15 39.700 39.700 41.516 -1.816 19947
1811 1 6 . 1 1 15 15 ASP H H 15 8.330 8.330 8.438 -0.108 19947
1812 1 6 . 1 1 16 16 CYS HA H 16 4.340 4.340 4.467 -0.127 19947
1813 1 6 . 1 1 16 16 CYS H H 16 8.510 8.510 8.250 0.260 19947
1814 1 6 . 1 1 17 17 ASP N N 17 116.700 116.700 122.562 -5.862 19947
1815 1 6 . 1 1 17 17 ASP HA H 17 4.740 4.740 4.443 0.297 19947
1816 1 6 . 1 1 17 17 ASP CA C 17 53.100 53.100 55.296 -2.196 19947
1817 1 6 . 1 1 17 17 ASP CB C 17 38.600 38.600 38.419 0.181 19947
1818 1 6 . 1 1 17 17 ASP H H 17 8.180 8.180 8.663 -0.483 19947
1819 1 6 . 1 1 18 18 CYS HA H 18 4.730 4.730 3.944 0.786 19947
1820 1 6 . 1 1 18 18 CYS CB C 18 41.900 41.900 27.179 14.721 19947
1821 1 6 . 1 1 19 19 GLY H H 19 8.220 8.220 8.288 -0.068 19947
1822 1 6 . 1 1 20 20 SER HA H 20 4.920 4.920 4.414 0.506 19947
1823 1 6 . 1 1 20 20 SER CA C 20 55.700 55.700 56.803 -1.103 19947
1824 1 6 . 1 1 20 20 SER CB C 20 63.500 63.500 63.405 0.095 19947
1825 1 6 . 1 1 20 20 SER H H 20 7.830 7.830 8.250 -0.420 19947
1826 1 6 . 1 1 21 21 PRO HA H 21 4.240 4.240 4.183 0.057 19947
1827 1 6 . 1 1 21 21 PRO CA C 21 63.400 63.400 65.359 -1.959 19947
1828 1 6 . 1 1 21 21 PRO CB C 21 31.800 31.800 31.546 0.254 19947
1829 1 6 . 1 1 22 22 ALA N N 22 119.900 119.900 118.417 1.483 19947
1830 1 6 . 1 1 22 22 ALA HA H 22 4.220 4.220 4.084 0.136 19947
1831 1 6 . 1 1 22 22 ALA CA C 22 54.200 54.200 54.131 0.069 19947
1832 1 6 . 1 1 22 22 ALA CB C 22 18.500 18.500 18.269 0.231 19947
1833 1 6 . 1 1 22 22 ALA H H 22 8.180 8.180 8.515 -0.335 19947
1834 1 6 . 1 1 23 23 ASN N N 23 116.300 116.300 113.222 3.078 19947
1835 1 6 . 1 1 23 23 ASN HA H 23 4.670 4.670 4.899 -0.229 19947
1836 1 6 . 1 1 23 23 ASN CA C 23 53.200 53.200 52.692 0.508 19947
1837 1 6 . 1 1 23 23 ASN CB C 23 39.300 39.300 39.525 -0.225 19947
1838 1 6 . 1 1 23 23 ASN H H 23 7.960 7.960 8.115 -0.155 19947
1839 1 6 . 1 1 24 24 CYS HA H 24 4.720 4.720 4.187 0.533 19947
1840 1 6 . 1 1 24 24 CYS H H 24 8.510 8.510 7.945 0.565 19947
1841 1 6 . 1 1 25 25 GLN HA H 25 4.460 4.460 4.640 -0.180 19947
1842 1 6 . 1 1 25 25 GLN H H 25 8.320 8.320 8.136 0.184 19947
1843 1 6 . 1 1 26 26 ASP HA H 26 4.740 4.740 4.743 -0.003 19947
1844 1 6 . 1 1 26 26 ASP H H 26 8.580 8.580 8.467 0.113 19947
1845 1 6 . 1 1 27 27 ARG HA H 27 4.680 4.680 4.389 0.291 19947
1846 1 6 . 1 1 27 27 ARG CA C 27 54.700 54.700 56.080 -1.380 19947
1847 1 6 . 1 1 27 27 ARG H H 27 8.550 8.550 7.910 0.640 19947
1848 1 6 . 1 1 28 28 CYS HA H 28 4.120 4.120 4.232 -0.112 19947
1849 1 6 . 1 1 28 28 CYS CA C 28 54.400 54.400 58.490 -4.090 19947
1850 1 6 . 1 1 28 28 CYS CB C 28 19.000 19.000 24.172 -5.172 19947
1851 1 6 . 1 1 28 28 CYS H H 28 8.910 8.910 8.339 0.571 19947
1852 1 6 . 1 1 29 29 CYS N N 29 113.300 113.300 120.625 -7.325 19947
1853 1 6 . 1 1 29 29 CYS HA H 29 5.010 5.010 4.571 0.439 19947
1854 1 6 . 1 1 29 29 CYS CA C 29 54.300 54.300 57.671 -3.371 19947
1855 1 6 . 1 1 29 29 CYS H H 29 7.730 7.730 7.743 -0.013 19947
1856 1 6 . 1 1 30 30 ASN HA H 30 4.730 4.730 5.108 -0.378 19947
1857 1 6 . 1 1 30 30 ASN CB C 30 38.700 38.700 40.630 -1.930 19947
1858 1 6 . 1 1 30 30 ASN H H 30 8.870 8.870 8.974 -0.104 19947
1859 1 6 . 1 1 31 31 ALA N N 31 129.400 129.400 127.485 1.915 19947
1860 1 6 . 1 1 31 31 ALA HA H 31 4.120 4.120 4.343 -0.223 19947
1861 1 6 . 1 1 31 31 ALA CA C 31 54.400 54.400 54.305 0.095 19947
1862 1 6 . 1 1 31 31 ALA CB C 31 19.000 19.000 19.211 -0.211 19947
1863 1 6 . 1 1 31 31 ALA H H 31 8.890 8.890 8.744 0.146 19947
1864 1 6 . 1 1 32 32 ALA N N 32 116.400 116.400 118.704 -2.304 19947
1865 1 6 . 1 1 32 32 ALA HA H 32 4.340 4.340 4.441 -0.101 19947
1866 1 6 . 1 1 32 32 ALA CA C 32 53.800 53.800 53.757 0.043 19947
1867 1 6 . 1 1 32 32 ALA CB C 32 19.100 19.100 18.796 0.304 19947
1868 1 6 . 1 1 32 32 ALA H H 32 8.250 8.250 7.605 0.645 19947
1869 1 6 . 1 1 33 33 THR N N 33 104.300 104.300 109.422 -5.122 19947
1870 1 6 . 1 1 33 33 THR HA H 33 4.430 4.430 4.409 0.021 19947
1871 1 6 . 1 1 33 33 THR CA C 33 60.500 60.500 60.569 -0.069 19947
1872 1 6 . 1 1 33 33 THR CB C 33 70.600 70.600 69.777 0.823 19947
1873 1 6 . 1 1 33 33 THR H H 33 7.320 7.320 7.412 -0.092 19947
1874 1 6 . 1 1 34 34 CYS N N 34 123.400 123.400 120.648 2.752 19947
1875 1 6 . 1 1 34 34 CYS HA H 34 4.170 4.170 4.240 -0.070 19947
1876 1 6 . 1 1 34 34 CYS CA C 34 56.500 56.500 60.057 -3.557 19947
1877 1 6 . 1 1 34 34 CYS H H 34 8.710 8.710 8.234 0.476 19947
1878 1 6 . 1 1 35 35 LYS N N 35 116.900 116.900 118.212 -1.312 19947
1879 1 6 . 1 1 35 35 LYS HA H 35 4.960 4.960 4.883 0.077 19947
1880 1 6 . 1 1 35 35 LYS CA C 35 53.900 53.900 55.373 -1.473 19947
1881 1 6 . 1 1 35 35 LYS CB C 35 35.900 35.900 36.028 -0.128 19947
1882 1 6 . 1 1 35 35 LYS H H 35 7.450 7.450 7.719 -0.269 19947
1883 1 6 . 1 1 36 36 LEU N N 36 119.300 119.300 119.011 0.289 19947
1884 1 6 . 1 1 36 36 LEU HA H 36 4.800 4.800 5.003 -0.203 19947
1885 1 6 . 1 1 36 36 LEU CB C 36 42.400 42.400 42.983 -0.583 19947
1886 1 6 . 1 1 36 36 LEU H H 36 8.290 8.290 8.473 -0.183 19947
1887 1 6 . 1 1 37 37 THR HA H 37 4.340 4.340 4.520 -0.180 19947
1888 1 6 . 1 1 37 37 THR CA C 37 60.200 60.200 60.801 -0.601 19947
1889 1 6 . 1 1 37 37 THR CB C 37 67.700 67.700 68.442 -0.742 19947
1890 1 6 . 1 1 37 37 THR H H 37 8.380 8.380 8.429 -0.049 19947
1891 1 6 . 1 1 38 38 PRO HA H 38 4.380 4.380 4.260 0.120 19947
1892 1 6 . 1 1 38 38 PRO CA C 38 64.800 64.800 64.469 0.331 19947
1893 1 6 . 1 1 38 38 PRO CB C 38 31.500 31.500 31.717 -0.217 19947
1894 1 6 . 1 1 39 39 GLY N N 39 113.300 113.300 109.714 3.586 19947
1895 1 6 . 1 1 39 39 GLY CA C 39 45.100 45.100 45.112 -0.012 19947
1896 1 6 . 1 1 39 39 GLY H H 39 8.830 8.830 8.673 0.157 19947
1897 1 6 . 1 1 40 40 SER N N 40 116.700 116.700 116.683 0.017 19947
1898 1 6 . 1 1 40 40 SER HA H 40 4.610 4.610 5.004 -0.394 19947
1899 1 6 . 1 1 40 40 SER CA C 40 58.800 58.800 57.062 1.738 19947
1900 1 6 . 1 1 40 40 SER CB C 40 63.800 63.800 64.960 -1.160 19947
1901 1 6 . 1 1 40 40 SER H H 40 8.280 8.280 7.531 0.749 19947
1902 1 6 . 1 1 41 41 GLN N N 41 120.600 120.600 125.790 -5.190 19947
1903 1 6 . 1 1 41 41 GLN HA H 41 4.110 4.110 3.833 0.277 19947
1904 1 6 . 1 1 41 41 GLN CA C 41 55.200 55.200 58.033 -2.833 19947
1905 1 6 . 1 1 41 41 GLN CB C 41 31.100 31.100 28.988 2.112 19947
1906 1 6 . 1 1 41 41 GLN H H 41 9.190 9.190 7.968 1.222 19947
1907 1 6 . 1 1 42 42 CYS N N 42 113.200 113.200 110.729 2.471 19947
1908 1 6 . 1 1 42 42 CYS HA H 42 4.630 4.630 4.495 0.135 19947
1909 1 6 . 1 1 42 42 CYS CA C 42 53.700 53.700 56.993 -3.293 19947
1910 1 6 . 1 1 42 42 CYS CB C 42 45.500 45.500 30.052 15.448 19947
1911 1 6 . 1 1 42 42 CYS H H 42 7.710 7.710 7.441 0.269 19947
1912 1 6 . 1 1 43 43 ASN N N 43 114.200 114.200 117.755 -3.555 19947
1913 1 6 . 1 1 43 43 ASN HA H 43 4.940 4.940 5.038 -0.098 19947
1914 1 6 . 1 1 43 43 ASN CA C 43 53.000 53.000 53.354 -0.354 19947
1915 1 6 . 1 1 43 43 ASN CB C 43 39.300 39.300 41.435 -2.135 19947
1916 1 6 . 1 1 43 43 ASN H H 43 8.870 8.870 8.536 0.334 19947
1917 1 6 . 1 1 44 44 TYR N N 44 118.400 118.400 114.757 3.643 19947
1918 1 6 . 1 1 44 44 TYR HA H 44 4.850 4.850 4.769 0.081 19947
1919 1 6 . 1 1 44 44 TYR CA C 44 55.300 55.300 56.361 -1.062 19947
1920 1 6 . 1 1 44 44 TYR CB C 44 40.700 40.700 40.574 0.126 19947
1921 1 6 . 1 1 44 44 TYR H H 44 7.840 7.840 7.318 0.522 19947
1922 1 6 . 1 1 45 45 GLY N N 45 110.600 110.600 110.714 -0.114 19947
1923 1 6 . 1 1 45 45 GLY CA C 45 44.000 44.000 45.048 -1.048 19947
1924 1 6 . 1 1 45 45 GLY H H 45 7.960 7.960 8.154 -0.194 19947
1925 1 6 . 1 1 46 46 GLU N N 46 120.700 120.700 119.658 1.042 19947
1926 1 6 . 1 1 46 46 GLU HA H 46 4.280 4.280 4.158 0.122 19947
1927 1 6 . 1 1 46 46 GLU CA C 46 58.500 58.500 58.614 -0.114 19947
1928 1 6 . 1 1 46 46 GLU CB C 46 29.300 29.300 29.955 -0.655 19947
1929 1 6 . 1 1 46 46 GLU H H 46 9.160 9.160 8.616 0.544 19947
1930 1 6 . 1 1 47 47 CYS N N 47 112.400 112.400 117.745 -5.345 19947
1931 1 6 . 1 1 47 47 CYS HA H 47 4.850 4.850 4.664 0.186 19947
1932 1 6 . 1 1 47 47 CYS CA C 47 57.100 57.100 58.163 -1.063 19947
1933 1 6 . 1 1 47 47 CYS CB C 47 41.200 41.200 25.459 15.741 19947
1934 1 6 . 1 1 47 47 CYS H H 47 8.510 8.510 7.446 1.064 19947
1935 1 6 . 1 1 48 48 CYS N N 48 123.200 123.200 120.553 2.647 19947
1936 1 6 . 1 1 48 48 CYS HA H 48 5.160 5.160 5.237 -0.077 19947
1937 1 6 . 1 1 48 48 CYS CA C 48 54.700 54.700 58.996 -4.296 19947
1938 1 6 . 1 1 48 48 CYS CB C 48 45.700 45.700 29.988 15.712 19947
1939 1 6 . 1 1 48 48 CYS H H 48 7.810 7.810 7.780 0.030 19947
1940 1 6 . 1 1 49 49 ASP N N 49 127.400 127.400 122.368 5.032 19947
1941 1 6 . 1 1 49 49 ASP HA H 49 4.890 4.890 4.768 0.122 19947
1942 1 6 . 1 1 49 49 ASP CA C 49 53.500 53.500 54.747 -1.247 19947
1943 1 6 . 1 1 49 49 ASP CB C 49 42.400 42.400 43.028 -0.628 19947
1944 1 6 . 1 1 49 49 ASP H H 49 9.670 9.670 8.570 1.100 19947
1945 1 6 . 1 1 50 50 GLN N N 50 127.000 127.000 121.172 5.828 19947
1946 1 6 . 1 1 50 50 GLN HA H 50 3.940 3.940 3.831 0.109 19947
1947 1 6 . 1 1 50 50 GLN CA C 50 56.800 56.800 59.245 -2.445 19947
1948 1 6 . 1 1 50 50 GLN CB C 50 26.500 26.500 28.284 -1.784 19947
1949 1 6 . 1 1 50 50 GLN H H 50 9.450 9.450 8.892 0.558 19947
1950 1 6 . 1 1 51 51 CYS N N 51 106.100 106.100 117.808 -11.708 19947
1951 1 6 . 1 1 51 51 CYS HA H 51 4.760 4.760 5.201 -0.441 19947
1952 1 6 . 1 1 51 51 CYS CB C 51 43.200 43.200 28.001 15.199 19947
1953 1 6 . 1 1 51 51 CYS H H 51 8.700 8.700 8.170 0.530 19947
1954 1 6 . 1 1 52 52 ARG N N 52 121.000 121.000 117.818 3.182 19947
1955 1 6 . 1 1 52 52 ARG HA H 52 4.690 4.690 4.744 -0.054 19947
1956 1 6 . 1 1 52 52 ARG CA C 52 55.400 55.400 54.691 0.709 19947
1957 1 6 . 1 1 52 52 ARG CB C 52 33.100 33.100 34.725 -1.625 19947
1958 1 6 . 1 1 52 52 ARG H H 52 7.960 7.960 7.875 0.085 19947
1959 1 6 . 1 1 53 53 PHE N N 53 120.300 120.300 118.744 1.556 19947
1960 1 6 . 1 1 53 53 PHE HA H 53 5.050 5.050 5.061 -0.011 19947
1961 1 6 . 1 1 53 53 PHE CA C 53 56.100 56.100 55.853 0.246 19947
1962 1 6 . 1 1 53 53 PHE CB C 53 38.200 38.200 39.763 -1.563 19947
1963 1 6 . 1 1 53 53 PHE H H 53 8.400 8.400 9.016 -0.616 19947
1964 1 6 . 1 1 54 54 LYS N N 54 123.300 123.300 124.090 -0.790 19947
1965 1 6 . 1 1 54 54 LYS HA H 54 4.250 4.250 4.190 0.060 19947
1966 1 6 . 1 1 54 54 LYS CA C 54 57.500 57.500 56.607 0.893 19947
1967 1 6 . 1 1 54 54 LYS CB C 54 34.300 34.300 32.906 1.394 19947
1968 1 6 . 1 1 54 54 LYS H H 54 8.540 8.540 8.704 -0.164 19947
1969 1 6 . 1 1 55 55 LYS N N 55 119.400 119.400 125.179 -5.779 19947
1970 1 6 . 1 1 55 55 LYS HA H 55 4.110 4.110 4.045 0.065 19947
1971 1 6 . 1 1 55 55 LYS CA C 55 56.500 56.500 56.677 -0.177 19947
1972 1 6 . 1 1 55 55 LYS CB C 55 33.400 33.400 33.288 0.112 19947
1973 1 6 . 1 1 55 55 LYS H H 55 8.440 8.440 8.610 -0.170 19947
1974 1 6 . 1 1 56 56 ALA N N 56 126.700 126.700 128.132 -1.432 19947
1975 1 6 . 1 1 56 56 ALA HA H 56 3.920 3.920 4.098 -0.178 19947
1976 1 6 . 1 1 56 56 ALA CA C 56 52.900 52.900 53.634 -0.734 19947
1977 1 6 . 1 1 56 56 ALA CB C 56 18.100 18.100 18.500 -0.400 19947
1978 1 6 . 1 1 56 56 ALA H H 56 8.930 8.930 8.621 0.309 19947
1979 1 6 . 1 1 57 57 GLY N N 57 109.300 109.300 111.195 -1.895 19947
1980 1 6 . 1 1 57 57 GLY CA C 57 45.100 45.100 44.843 0.257 19947
1981 1 6 . 1 1 57 57 GLY H H 57 8.460 8.460 8.421 0.039 19947
1982 1 6 . 1 1 58 58 THR N N 58 117.200 117.200 119.943 -2.743 19947
1983 1 6 . 1 1 58 58 THR HA H 58 4.260 4.260 4.374 -0.114 19947
1984 1 6 . 1 1 58 58 THR CA C 58 63.300 63.300 63.513 -0.213 19947
1985 1 6 . 1 1 58 58 THR CB C 58 69.600 69.600 68.909 0.691 19947
1986 1 6 . 1 1 58 58 THR H H 58 7.660 7.660 7.781 -0.121 19947
1987 1 6 . 1 1 59 59 VAL N N 59 130.400 130.400 127.767 2.633 19947
1988 1 6 . 1 1 59 59 VAL HA H 59 3.900 3.900 3.604 0.296 19947
1989 1 6 . 1 1 59 59 VAL CA C 59 64.400 64.400 63.228 1.172 19947
1990 1 6 . 1 1 59 59 VAL CB C 59 31.900 31.900 31.758 0.142 19947
1991 1 6 . 1 1 59 59 VAL H H 59 9.190 9.190 8.740 0.450 19947
1992 1 6 . 1 1 60 60 CYS N N 60 121.800 121.800 126.384 -4.584 19947
1993 1 6 . 1 1 60 60 CYS HA H 60 5.050 5.050 4.586 0.464 19947
1994 1 6 . 1 1 60 60 CYS CA C 60 54.400 54.400 58.159 -3.759 19947
1995 1 6 . 1 1 60 60 CYS CB C 60 43.000 43.000 27.500 15.500 19947
1996 1 6 . 1 1 60 60 CYS H H 60 9.130 9.130 8.135 0.995 19947
1997 1 6 . 1 1 61 61 ARG N N 61 124.100 124.100 117.172 6.928 19947
1998 1 6 . 1 1 61 61 ARG HA H 61 4.360 4.360 4.642 -0.282 19947
1999 1 6 . 1 1 61 61 ARG CA C 61 56.800 56.800 54.981 1.819 19947
2000 1 6 . 1 1 61 61 ARG CB C 61 32.800 32.800 33.729 -0.929 19947
2001 1 6 . 1 1 61 61 ARG H H 61 7.580 7.580 7.371 0.209 19947
2002 1 6 . 1 1 62 62 ILE N N 62 126.200 126.200 116.295 9.905 19947
2003 1 6 . 1 1 62 62 ILE HA H 62 4.090 4.090 4.504 -0.414 19947
2004 1 6 . 1 1 62 62 ILE CA C 62 60.300 60.300 60.779 -0.479 19947
2005 1 6 . 1 1 62 62 ILE CB C 62 38.700 38.700 41.255 -2.555 19947
2006 1 6 . 1 1 62 62 ILE H H 62 8.490 8.490 8.357 0.133 19947
2007 1 6 . 1 1 63 63 ALA N N 63 129.400 129.400 132.283 -2.883 19947
2008 1 6 . 1 1 63 63 ALA HA H 63 4.310 4.310 4.339 -0.029 19947
2009 1 6 . 1 1 63 63 ALA CA C 63 51.900 51.900 54.465 -2.565 19947
2010 1 6 . 1 1 63 63 ALA CB C 63 20.600 20.600 19.489 1.111 19947
2011 1 6 . 1 1 63 63 ALA H H 63 8.100 8.100 8.634 -0.534 19947
2012 1 6 . 1 1 64 64 ARG N N 64 120.500 120.500 120.573 -0.073 19947
2013 1 6 . 1 1 64 64 ARG HA H 64 4.290 4.290 4.499 -0.209 19947
2014 1 6 . 1 1 64 64 ARG CA C 64 56.200 56.200 56.055 0.145 19947
2015 1 6 . 1 1 64 64 ARG CB C 64 30.500 30.500 30.784 -0.284 19947
2016 1 6 . 1 1 64 64 ARG H H 64 8.140 8.140 8.804 -0.664 19947
2017 1 6 . 1 1 65 65 GLY N N 65 110.500 110.500 111.343 -0.843 19947
2018 1 6 . 1 1 65 65 GLY CA C 65 45.100 45.100 44.509 0.591 19947
2019 1 6 . 1 1 65 65 GLY H H 65 8.040 8.040 8.257 -0.217 19947
2020 1 6 . 1 1 66 66 ASP N N 66 120.700 120.700 119.139 1.561 19947
2021 1 6 . 1 1 66 66 ASP HA H 66 4.610 4.610 4.557 0.053 19947
2022 1 6 . 1 1 66 66 ASP CA C 66 53.300 53.300 54.222 -0.922 19947
2023 1 6 . 1 1 66 66 ASP CB C 66 37.600 37.600 40.952 -3.352 19947
2024 1 6 . 1 1 66 66 ASP H H 66 8.380 8.380 7.132 1.248 19947
2025 1 6 . 1 1 67 67 TRP N N 67 120.100 120.100 123.055 -2.955 19947
2026 1 6 . 1 1 67 67 TRP HA H 67 4.760 4.760 5.126 -0.366 19947
2027 1 6 . 1 1 67 67 TRP CA C 67 57.200 57.200 58.238 -1.038 19947
2028 1 6 . 1 1 67 67 TRP CB C 67 29.100 29.100 29.571 -0.471 19947
2029 1 6 . 1 1 67 67 TRP H H 67 7.950 7.950 8.011 -0.061 19947
2030 1 6 . 1 1 68 68 ASN N N 68 118.400 118.400 118.147 0.253 19947
2031 1 6 . 1 1 68 68 ASN HA H 68 4.790 4.790 4.937 -0.147 19947
2032 1 6 . 1 1 68 68 ASN CA C 68 52.800 52.800 53.861 -1.061 19947
2033 1 6 . 1 1 68 68 ASN CB C 68 39.300 39.300 40.047 -0.747 19947
2034 1 6 . 1 1 68 68 ASN H H 68 8.180 8.180 8.623 -0.443 19947
2035 1 6 . 1 1 69 69 ASP N N 69 118.500 118.500 118.443 0.057 19947
2036 1 6 . 1 1 69 69 ASP HA H 69 4.620 4.620 4.400 0.220 19947
2037 1 6 . 1 1 69 69 ASP CA C 69 53.200 53.200 56.347 -3.147 19947
2038 1 6 . 1 1 69 69 ASP CB C 69 38.000 38.000 41.225 -3.225 19947
2039 1 6 . 1 1 69 69 ASP H H 69 8.130 8.130 8.518 -0.388 19947
2040 1 6 . 1 1 70 70 ASP N N 70 120.500 120.500 121.031 -0.531 19947
2041 1 6 . 1 1 70 70 ASP HA H 70 5.100 5.100 5.012 0.088 19947
2042 1 6 . 1 1 70 70 ASP CA C 70 52.500 52.500 53.494 -0.994 19947
2043 1 6 . 1 1 70 70 ASP CB C 70 42.600 42.600 42.204 0.396 19947
2044 1 6 . 1 1 70 70 ASP H H 70 8.140 8.140 8.149 -0.009 19947
2045 1 6 . 1 1 71 71 TYR N N 71 118.900 118.900 123.973 -5.073 19947
2046 1 6 . 1 1 71 71 TYR HA H 71 5.210 5.210 4.868 0.342 19947
2047 1 6 . 1 1 71 71 TYR CA C 71 56.300 56.300 57.126 -0.826 19947
2048 1 6 . 1 1 71 71 TYR CB C 71 42.200 42.200 42.914 -0.714 19947
2049 1 6 . 1 1 71 71 TYR H H 71 8.450 8.450 8.427 0.023 19947
2050 1 6 . 1 1 72 72 CYS N N 72 119.800 119.800 121.156 -1.356 19947
2051 1 6 . 1 1 72 72 CYS HA H 72 4.900 4.900 4.534 0.366 19947
2052 1 6 . 1 1 72 72 CYS CA C 72 53.400 53.400 59.172 -5.772 19947
2053 1 6 . 1 1 72 72 CYS CB C 72 37.200 37.200 28.945 8.255 19947
2054 1 6 . 1 1 72 72 CYS H H 72 9.330 9.330 8.501 0.829 19947
2055 1 6 . 1 1 73 73 THR N N 73 112.700 112.700 114.903 -2.203 19947
2056 1 6 . 1 1 73 73 THR HA H 73 4.430 4.430 4.403 0.027 19947
2057 1 6 . 1 1 73 73 THR CA C 73 62.300 62.300 61.004 1.296 19947
2058 1 6 . 1 1 73 73 THR CB C 73 71.300 71.300 69.335 1.965 19947
2059 1 6 . 1 1 73 73 THR H H 73 9.980 9.980 8.689 1.291 19947
2060 1 6 . 1 1 74 74 GLY N N 74 111.500 111.500 111.680 -0.180 19947
2061 1 6 . 1 1 74 74 GLY CA C 74 45.300 45.300 46.600 -1.300 19947
2062 1 6 . 1 1 74 74 GLY H H 74 8.580 8.580 7.670 0.910 19947
2063 1 6 . 1 1 75 75 LYS N N 75 115.900 115.900 117.103 -1.203 19947
2064 1 6 . 1 1 75 75 LYS HA H 75 4.140 4.140 4.620 -0.480 19947
2065 1 6 . 1 1 75 75 LYS CA C 75 54.800 54.800 55.794 -0.994 19947
2066 1 6 . 1 1 75 75 LYS CB C 75 34.200 34.200 33.757 0.443 19947
2067 1 6 . 1 1 75 75 LYS H H 75 7.900 7.900 7.742 0.158 19947
2068 1 6 . 1 1 76 76 SER N N 76 111.000 111.000 112.343 -1.343 19947
2069 1 6 . 1 1 76 76 SER HA H 76 4.160 4.160 3.945 0.215 19947
2070 1 6 . 1 1 76 76 SER CA C 76 61.400 61.400 56.734 4.666 19947
2071 1 6 . 1 1 76 76 SER CB C 76 64.300 64.300 64.955 -0.655 19947
2072 1 6 . 1 1 76 76 SER H H 76 6.520 6.520 6.867 -0.347 19947
2073 1 6 . 1 1 77 77 SER N N 77 117.100 117.100 112.955 4.145 19947
2074 1 6 . 1 1 77 77 SER HA H 77 4.220 4.220 4.090 0.130 19947
2075 1 6 . 1 1 77 77 SER CA C 77 59.800 59.800 58.492 1.308 19947
2076 1 6 . 1 1 77 77 SER CB C 77 64.400 64.400 63.663 0.738 19947
2077 1 6 . 1 1 77 77 SER H H 77 9.030 9.030 8.030 1.000 19947
2078 1 6 . 1 1 78 78 ASP N N 78 122.100 122.100 121.819 0.281 19947
2079 1 6 . 1 1 78 78 ASP HA H 78 4.930 4.930 4.738 0.192 19947
2080 1 6 . 1 1 78 78 ASP CA C 78 52.400 52.400 54.178 -1.778 19947
2081 1 6 . 1 1 78 78 ASP CB C 78 40.800 40.800 44.199 -3.399 19947
2082 1 6 . 1 1 78 78 ASP H H 78 8.340 8.340 7.536 0.804 19947
2083 1 6 . 1 1 79 79 CYS N N 79 122.200 122.200 122.967 -0.767 19947
2084 1 6 . 1 1 79 79 CYS HA H 79 5.320 5.320 4.813 0.507 19947
2085 1 6 . 1 1 79 79 CYS CA C 79 52.000 52.000 55.391 -3.391 19947
2086 1 6 . 1 1 79 79 CYS CB C 79 39.300 39.300 27.669 11.632 19947
2087 1 6 . 1 1 79 79 CYS H H 79 8.960 8.960 8.585 0.375 19947
2088 1 6 . 1 1 80 80 PRO HA H 80 4.410 4.410 4.084 0.326 19947
2089 1 6 . 1 1 80 80 PRO CA C 80 63.500 63.500 62.906 0.594 19947
2090 1 6 . 1 1 80 80 PRO CB C 80 32.400 32.400 32.776 -0.376 19947
2091 1 6 . 1 1 81 81 TRP N N 81 120.500 120.500 120.862 -0.362 19947
2092 1 6 . 1 1 81 81 TRP HA H 81 4.550 4.550 4.247 0.303 19947
2093 1 6 . 1 1 81 81 TRP CA C 81 56.400 56.400 57.972 -1.572 19947
2094 1 6 . 1 1 81 81 TRP CB C 81 29.500 29.500 28.355 1.145 19947
2095 1 6 . 1 1 81 81 TRP H H 81 8.400 8.400 7.591 0.809 19947
2096 1 6 . 1 1 82 82 ASN N N 82 120.400 120.400 110.602 9.798 19947
2097 1 6 . 1 1 82 82 ASN HA H 82 4.750 4.750 4.416 0.334 19947
2098 1 6 . 1 1 82 82 ASN CA C 82 53.100 53.100 54.096 -0.996 19947
2099 1 6 . 1 1 82 82 ASN CB C 82 39.000 39.000 36.229 2.771 19947
2100 1 6 . 1 1 82 82 ASN H H 82 8.040 8.040 8.376 -0.336 19947
2101 1 7 . 1 1 2 2 PRO HA H 2 4.820 4.820 4.612 0.208 19947
2102 1 7 . 1 1 2 2 PRO CA C 2 61.900 61.900 62.334 -0.434 19947
2103 1 7 . 1 1 2 2 PRO CB C 2 30.700 30.700 31.567 -0.867 19947
2104 1 7 . 1 1 3 3 PRO HA H 3 4.540 4.540 4.478 0.062 19947
2105 1 7 . 1 1 3 3 PRO CA C 3 62.900 62.900 62.333 0.567 19947
2106 1 7 . 1 1 3 3 PRO CB C 3 32.100 32.100 32.489 -0.389 19947
2107 1 7 . 1 1 4 4 VAL N N 4 121.900 121.900 123.308 -1.408 19947
2108 1 7 . 1 1 4 4 VAL HA H 4 4.200 4.200 4.155 0.045 19947
2109 1 7 . 1 1 4 4 VAL CA C 4 62.300 62.300 61.914 0.386 19947
2110 1 7 . 1 1 4 4 VAL CB C 4 32.800 32.800 29.899 2.901 19947
2111 1 7 . 1 1 4 4 VAL H H 4 8.330 8.330 8.349 -0.019 19947
2112 1 7 . 1 1 5 5 CYS N N 5 120.900 120.900 128.419 -7.519 19947
2113 1 7 . 1 1 5 5 CYS HA H 5 4.700 4.700 4.318 0.382 19947
2114 1 7 . 1 1 5 5 CYS CA C 5 53.600 53.600 60.121 -6.521 19947
2115 1 7 . 1 1 5 5 CYS H H 5 8.500 8.500 8.524 -0.024 19947
2116 1 7 . 1 1 6 6 GLY N N 6 110.200 110.200 113.930 -3.730 19947
2117 1 7 . 1 1 6 6 GLY CA C 6 46.300 46.300 44.784 1.516 19947
2118 1 7 . 1 1 6 6 GLY H H 6 8.490 8.490 8.424 0.066 19947
2119 1 7 . 1 1 7 7 ASN N N 7 120.100 120.100 117.343 2.757 19947
2120 1 7 . 1 1 7 7 ASN HA H 7 4.730 4.730 4.380 0.350 19947
2121 1 7 . 1 1 7 7 ASN CA C 7 53.200 53.200 54.450 -1.250 19947
2122 1 7 . 1 1 7 7 ASN CB C 7 38.700 38.700 39.385 -0.685 19947
2123 1 7 . 1 1 7 7 ASN H H 7 8.320 8.320 8.156 0.164 19947
2124 1 7 . 1 1 8 8 LYS N N 8 121.300 121.300 120.309 0.991 19947
2125 1 7 . 1 1 8 8 LYS HA H 8 4.340 4.340 4.323 0.017 19947
2126 1 7 . 1 1 8 8 LYS CA C 8 56.600 56.600 56.725 -0.125 19947
2127 1 7 . 1 1 8 8 LYS CB C 8 32.900 32.900 31.984 0.916 19947
2128 1 7 . 1 1 8 8 LYS H H 8 8.260 8.260 8.318 -0.058 19947
2129 1 7 . 1 1 9 9 ILE N N 9 136.600 136.600 123.126 13.474 19947
2130 1 7 . 1 1 9 9 ILE HA H 9 4.140 4.140 3.969 0.171 19947
2131 1 7 . 1 1 9 9 ILE CA C 9 61.300 61.300 62.248 -0.948 19947
2132 1 7 . 1 1 9 9 ILE CB C 9 38.200 38.200 38.004 0.196 19947
2133 1 7 . 1 1 9 9 ILE H H 9 8.150 8.150 8.346 -0.196 19947
2134 1 7 . 1 1 10 10 LEU N N 10 125.700 125.700 121.467 4.233 19947
2135 1 7 . 1 1 10 10 LEU HA H 10 4.420 4.420 4.519 -0.099 19947
2136 1 7 . 1 1 10 10 LEU CA C 10 55.200 55.200 54.720 0.480 19947
2137 1 7 . 1 1 10 10 LEU CB C 10 42.300 42.300 41.409 0.891 19947
2138 1 7 . 1 1 10 10 LEU H H 10 8.230 8.230 8.398 -0.168 19947
2139 1 7 . 1 1 11 11 GLU N N 11 120.600 120.600 114.718 5.882 19947
2140 1 7 . 1 1 11 11 GLU HA H 11 4.470 4.470 4.225 0.245 19947
2141 1 7 . 1 1 11 11 GLU CA C 11 55.500 55.500 56.466 -0.966 19947
2142 1 7 . 1 1 11 11 GLU CB C 11 28.900 28.900 29.244 -0.344 19947
2143 1 7 . 1 1 11 11 GLU H H 11 8.250 8.250 7.815 0.435 19947
2144 1 7 . 1 1 12 12 GLN N N 12 121.600 121.600 118.448 3.152 19947
2145 1 7 . 1 1 12 12 GLN HA H 12 4.350 4.350 4.467 -0.117 19947
2146 1 7 . 1 1 12 12 GLN CA C 12 56.600 56.600 56.179 0.421 19947
2147 1 7 . 1 1 12 12 GLN CB C 12 29.200 29.200 29.546 -0.346 19947
2148 1 7 . 1 1 12 12 GLN H H 12 8.460 8.460 7.801 0.659 19947
2149 1 7 . 1 1 13 13 GLY N N 13 110.700 110.700 107.153 3.547 19947
2150 1 7 . 1 1 13 13 GLY CA C 13 45.700 45.700 45.786 -0.086 19947
2151 1 7 . 1 1 13 13 GLY H H 13 8.660 8.660 8.654 0.006 19947
2152 1 7 . 1 1 14 14 GLU N N 14 118.900 118.900 114.979 3.921 19947
2153 1 7 . 1 1 14 14 GLU HA H 14 4.530 4.530 4.174 0.356 19947
2154 1 7 . 1 1 14 14 GLU CA C 14 55.600 55.600 56.879 -1.278 19947
2155 1 7 . 1 1 14 14 GLU CB C 14 29.700 29.700 29.611 0.089 19947
2156 1 7 . 1 1 14 14 GLU H H 14 8.230 8.230 8.377 -0.147 19947
2157 1 7 . 1 1 15 15 ASP N N 15 118.400 118.400 119.672 -1.272 19947
2158 1 7 . 1 1 15 15 ASP HA H 15 4.990 4.990 4.519 0.471 19947
2159 1 7 . 1 1 15 15 ASP CA C 15 53.500 53.500 57.244 -3.744 19947
2160 1 7 . 1 1 15 15 ASP CB C 15 39.700 39.700 41.659 -1.959 19947
2161 1 7 . 1 1 15 15 ASP H H 15 8.330 8.330 8.417 -0.087 19947
2162 1 7 . 1 1 16 16 CYS HA H 16 4.340 4.340 4.517 -0.177 19947
2163 1 7 . 1 1 16 16 CYS H H 16 8.510 8.510 7.932 0.578 19947
2164 1 7 . 1 1 17 17 ASP N N 17 116.700 116.700 119.968 -3.268 19947
2165 1 7 . 1 1 17 17 ASP HA H 17 4.740 4.740 4.238 0.502 19947
2166 1 7 . 1 1 17 17 ASP CA C 17 53.100 53.100 55.598 -2.498 19947
2167 1 7 . 1 1 17 17 ASP CB C 17 38.600 38.600 38.870 -0.270 19947
2168 1 7 . 1 1 17 17 ASP H H 17 8.180 8.180 8.897 -0.717 19947
2169 1 7 . 1 1 18 18 CYS HA H 18 4.730 4.730 3.931 0.799 19947
2170 1 7 . 1 1 18 18 CYS CB C 18 41.900 41.900 27.158 14.742 19947
2171 1 7 . 1 1 19 19 GLY H H 19 8.220 8.220 8.640 -0.420 19947
2172 1 7 . 1 1 20 20 SER HA H 20 4.920 4.920 4.392 0.528 19947
2173 1 7 . 1 1 20 20 SER CA C 20 55.700 55.700 56.496 -0.796 19947
2174 1 7 . 1 1 20 20 SER CB C 20 63.500 63.500 63.076 0.424 19947
2175 1 7 . 1 1 20 20 SER H H 20 7.830 7.830 8.465 -0.635 19947
2176 1 7 . 1 1 21 21 PRO HA H 21 4.240 4.240 4.205 0.035 19947
2177 1 7 . 1 1 21 21 PRO CA C 21 63.400 63.400 65.028 -1.628 19947
2178 1 7 . 1 1 21 21 PRO CB C 21 31.800 31.800 31.442 0.357 19947
2179 1 7 . 1 1 22 22 ALA N N 22 119.900 119.900 115.669 4.231 19947
2180 1 7 . 1 1 22 22 ALA HA H 22 4.220 4.220 4.045 0.175 19947
2181 1 7 . 1 1 22 22 ALA CA C 22 54.200 54.200 54.387 -0.187 19947
2182 1 7 . 1 1 22 22 ALA CB C 22 18.500 18.500 18.764 -0.264 19947
2183 1 7 . 1 1 22 22 ALA H H 22 8.180 8.180 8.059 0.121 19947
2184 1 7 . 1 1 23 23 ASN N N 23 116.300 116.300 113.168 3.132 19947
2185 1 7 . 1 1 23 23 ASN HA H 23 4.670 4.670 4.897 -0.227 19947
2186 1 7 . 1 1 23 23 ASN CA C 23 53.200 53.200 53.684 -0.484 19947
2187 1 7 . 1 1 23 23 ASN CB C 23 39.300 39.300 41.158 -1.858 19947
2188 1 7 . 1 1 23 23 ASN H H 23 7.960 7.960 8.268 -0.308 19947
2189 1 7 . 1 1 24 24 CYS HA H 24 4.720 4.720 4.280 0.440 19947
2190 1 7 . 1 1 24 24 CYS H H 24 8.510 8.510 7.470 1.040 19947
2191 1 7 . 1 1 25 25 GLN HA H 25 4.460 4.460 4.002 0.458 19947
2192 1 7 . 1 1 25 25 GLN H H 25 8.320 8.320 8.478 -0.158 19947
2193 1 7 . 1 1 26 26 ASP HA H 26 4.740 4.740 4.688 0.052 19947
2194 1 7 . 1 1 26 26 ASP H H 26 8.580 8.580 8.235 0.345 19947
2195 1 7 . 1 1 27 27 ARG HA H 27 4.680 4.680 4.258 0.422 19947
2196 1 7 . 1 1 27 27 ARG CA C 27 54.700 54.700 56.777 -2.077 19947
2197 1 7 . 1 1 27 27 ARG H H 27 8.550 8.550 8.117 0.433 19947
2198 1 7 . 1 1 28 28 CYS HA H 28 4.120 4.120 4.616 -0.496 19947
2199 1 7 . 1 1 28 28 CYS CA C 28 54.400 54.400 58.075 -3.675 19947
2200 1 7 . 1 1 28 28 CYS CB C 28 19.000 19.000 25.097 -6.097 19947
2201 1 7 . 1 1 28 28 CYS H H 28 8.910 8.910 8.581 0.329 19947
2202 1 7 . 1 1 29 29 CYS N N 29 113.300 113.300 120.156 -6.856 19947
2203 1 7 . 1 1 29 29 CYS HA H 29 5.010 5.010 4.611 0.399 19947
2204 1 7 . 1 1 29 29 CYS CA C 29 54.300 54.300 57.970 -3.670 19947
2205 1 7 . 1 1 29 29 CYS H H 29 7.730 7.730 7.928 -0.198 19947
2206 1 7 . 1 1 30 30 ASN HA H 30 4.730 4.730 4.977 -0.247 19947
2207 1 7 . 1 1 30 30 ASN CB C 30 38.700 38.700 39.912 -1.212 19947
2208 1 7 . 1 1 30 30 ASN H H 30 8.870 8.870 8.932 -0.062 19947
2209 1 7 . 1 1 31 31 ALA N N 31 129.400 129.400 127.037 2.363 19947
2210 1 7 . 1 1 31 31 ALA HA H 31 4.120 4.120 4.375 -0.255 19947
2211 1 7 . 1 1 31 31 ALA CA C 31 54.400 54.400 54.475 -0.075 19947
2212 1 7 . 1 1 31 31 ALA CB C 31 19.000 19.000 19.111 -0.111 19947
2213 1 7 . 1 1 31 31 ALA H H 31 8.890 8.890 8.554 0.336 19947
2214 1 7 . 1 1 32 32 ALA N N 32 116.400 116.400 119.239 -2.839 19947
2215 1 7 . 1 1 32 32 ALA HA H 32 4.340 4.340 4.287 0.053 19947
2216 1 7 . 1 1 32 32 ALA CA C 32 53.800 53.800 53.331 0.469 19947
2217 1 7 . 1 1 32 32 ALA CB C 32 19.100 19.100 19.079 0.021 19947
2218 1 7 . 1 1 32 32 ALA H H 32 8.250 8.250 8.410 -0.160 19947
2219 1 7 . 1 1 33 33 THR N N 33 104.300 104.300 110.038 -5.738 19947
2220 1 7 . 1 1 33 33 THR HA H 33 4.430 4.430 4.424 0.006 19947
2221 1 7 . 1 1 33 33 THR CA C 33 60.500 60.500 60.752 -0.252 19947
2222 1 7 . 1 1 33 33 THR CB C 33 70.600 70.600 69.722 0.878 19947
2223 1 7 . 1 1 33 33 THR H H 33 7.320 7.320 7.520 -0.200 19947
2224 1 7 . 1 1 34 34 CYS N N 34 123.400 123.400 120.712 2.688 19947
2225 1 7 . 1 1 34 34 CYS HA H 34 4.170 4.170 4.261 -0.091 19947
2226 1 7 . 1 1 34 34 CYS CA C 34 56.500 56.500 60.019 -3.519 19947
2227 1 7 . 1 1 34 34 CYS H H 34 8.710 8.710 8.122 0.588 19947
2228 1 7 . 1 1 35 35 LYS N N 35 116.900 116.900 117.910 -1.010 19947
2229 1 7 . 1 1 35 35 LYS HA H 35 4.960 4.960 4.922 0.038 19947
2230 1 7 . 1 1 35 35 LYS CA C 35 53.900 53.900 55.284 -1.384 19947
2231 1 7 . 1 1 35 35 LYS CB C 35 35.900 35.900 36.041 -0.141 19947
2232 1 7 . 1 1 35 35 LYS H H 35 7.450 7.450 7.746 -0.296 19947
2233 1 7 . 1 1 36 36 LEU N N 36 119.300 119.300 117.846 1.454 19947
2234 1 7 . 1 1 36 36 LEU HA H 36 4.800 4.800 4.683 0.117 19947
2235 1 7 . 1 1 36 36 LEU CB C 36 42.400 42.400 42.473 -0.073 19947
2236 1 7 . 1 1 36 36 LEU H H 36 8.290 8.290 8.426 -0.136 19947
2237 1 7 . 1 1 37 37 THR HA H 37 4.340 4.340 4.673 -0.333 19947
2238 1 7 . 1 1 37 37 THR CA C 37 60.200 60.200 59.657 0.543 19947
2239 1 7 . 1 1 37 37 THR CB C 37 67.700 67.700 68.503 -0.803 19947
2240 1 7 . 1 1 37 37 THR H H 37 8.380 8.380 8.011 0.369 19947
2241 1 7 . 1 1 38 38 PRO HA H 38 4.380 4.380 4.274 0.106 19947
2242 1 7 . 1 1 38 38 PRO CA C 38 64.800 64.800 64.549 0.251 19947
2243 1 7 . 1 1 38 38 PRO CB C 38 31.500 31.500 31.506 -0.006 19947
2244 1 7 . 1 1 39 39 GLY N N 39 113.300 113.300 112.120 1.180 19947
2245 1 7 . 1 1 39 39 GLY CA C 39 45.100 45.100 44.985 0.115 19947
2246 1 7 . 1 1 39 39 GLY H H 39 8.830 8.830 8.578 0.252 19947
2247 1 7 . 1 1 40 40 SER N N 40 116.700 116.700 117.283 -0.583 19947
2248 1 7 . 1 1 40 40 SER HA H 40 4.610 4.610 4.272 0.338 19947
2249 1 7 . 1 1 40 40 SER CA C 40 58.800 58.800 58.759 0.041 19947
2250 1 7 . 1 1 40 40 SER CB C 40 63.800 63.800 63.548 0.252 19947
2251 1 7 . 1 1 40 40 SER H H 40 8.280 8.280 7.791 0.489 19947
2252 1 7 . 1 1 41 41 GLN N N 41 120.600 120.600 125.333 -4.733 19947
2253 1 7 . 1 1 41 41 GLN HA H 41 4.110 4.110 4.111 -0.001 19947
2254 1 7 . 1 1 41 41 GLN CA C 41 55.200 55.200 56.936 -1.736 19947
2255 1 7 . 1 1 41 41 GLN CB C 41 31.100 31.100 29.081 2.019 19947
2256 1 7 . 1 1 41 41 GLN H H 41 9.190 9.190 7.876 1.314 19947
2257 1 7 . 1 1 42 42 CYS N N 42 113.200 113.200 116.409 -3.209 19947
2258 1 7 . 1 1 42 42 CYS HA H 42 4.630 4.630 4.550 0.080 19947
2259 1 7 . 1 1 42 42 CYS CA C 42 53.700 53.700 57.149 -3.449 19947
2260 1 7 . 1 1 42 42 CYS CB C 42 45.500 45.500 30.171 15.329 19947
2261 1 7 . 1 1 42 42 CYS H H 42 7.710 7.710 7.381 0.329 19947
2262 1 7 . 1 1 43 43 ASN N N 43 114.200 114.200 121.973 -7.773 19947
2263 1 7 . 1 1 43 43 ASN HA H 43 4.940 4.940 4.648 0.292 19947
2264 1 7 . 1 1 43 43 ASN CA C 43 53.000 53.000 54.236 -1.236 19947
2265 1 7 . 1 1 43 43 ASN CB C 43 39.300 39.300 39.378 -0.078 19947
2266 1 7 . 1 1 43 43 ASN H H 43 8.870 8.870 8.651 0.219 19947
2267 1 7 . 1 1 44 44 TYR N N 44 118.400 118.400 113.667 4.733 19947
2268 1 7 . 1 1 44 44 TYR HA H 44 4.850 4.850 4.707 0.143 19947
2269 1 7 . 1 1 44 44 TYR CA C 44 55.300 55.300 57.382 -2.082 19947
2270 1 7 . 1 1 44 44 TYR CB C 44 40.700 40.700 38.956 1.744 19947
2271 1 7 . 1 1 44 44 TYR H H 44 7.840 7.840 7.259 0.581 19947
2272 1 7 . 1 1 45 45 GLY N N 45 110.600 110.600 107.671 2.929 19947
2273 1 7 . 1 1 45 45 GLY CA C 45 44.000 44.000 45.094 -1.094 19947
2274 1 7 . 1 1 45 45 GLY H H 45 7.960 7.960 7.794 0.166 19947
2275 1 7 . 1 1 46 46 GLU N N 46 120.700 120.700 119.752 0.948 19947
2276 1 7 . 1 1 46 46 GLU HA H 46 4.280 4.280 4.139 0.141 19947
2277 1 7 . 1 1 46 46 GLU CA C 46 58.500 58.500 59.739 -1.239 19947
2278 1 7 . 1 1 46 46 GLU CB C 46 29.300 29.300 30.114 -0.814 19947
2279 1 7 . 1 1 46 46 GLU H H 46 9.160 9.160 8.626 0.534 19947
2280 1 7 . 1 1 47 47 CYS N N 47 112.400 112.400 117.264 -4.864 19947
2281 1 7 . 1 1 47 47 CYS HA H 47 4.850 4.850 4.708 0.142 19947
2282 1 7 . 1 1 47 47 CYS CA C 47 57.100 57.100 58.500 -1.400 19947
2283 1 7 . 1 1 47 47 CYS CB C 47 41.200 41.200 25.684 15.515 19947
2284 1 7 . 1 1 47 47 CYS H H 47 8.510 8.510 7.544 0.966 19947
2285 1 7 . 1 1 48 48 CYS N N 48 123.200 123.200 120.632 2.568 19947
2286 1 7 . 1 1 48 48 CYS HA H 48 5.160 5.160 4.803 0.357 19947
2287 1 7 . 1 1 48 48 CYS CA C 48 54.700 54.700 59.407 -4.707 19947
2288 1 7 . 1 1 48 48 CYS CB C 48 45.700 45.700 28.674 17.026 19947
2289 1 7 . 1 1 48 48 CYS H H 48 7.810 7.810 7.717 0.093 19947
2290 1 7 . 1 1 49 49 ASP N N 49 127.400 127.400 126.989 0.411 19947
2291 1 7 . 1 1 49 49 ASP HA H 49 4.890 4.890 4.890 -0.000 19947
2292 1 7 . 1 1 49 49 ASP CA C 49 53.500 53.500 54.279 -0.779 19947
2293 1 7 . 1 1 49 49 ASP CB C 49 42.400 42.400 42.841 -0.441 19947
2294 1 7 . 1 1 49 49 ASP H H 49 9.670 9.670 8.479 1.191 19947
2295 1 7 . 1 1 50 50 GLN N N 50 127.000 127.000 123.281 3.719 19947
2296 1 7 . 1 1 50 50 GLN HA H 50 3.940 3.940 3.960 -0.020 19947
2297 1 7 . 1 1 50 50 GLN CA C 50 56.800 56.800 58.930 -2.130 19947
2298 1 7 . 1 1 50 50 GLN CB C 50 26.500 26.500 28.078 -1.578 19947
2299 1 7 . 1 1 50 50 GLN H H 50 9.450 9.450 8.845 0.605 19947
2300 1 7 . 1 1 51 51 CYS N N 51 106.100 106.100 118.429 -12.329 19947
2301 1 7 . 1 1 51 51 CYS HA H 51 4.760 4.760 4.875 -0.115 19947
2302 1 7 . 1 1 51 51 CYS CB C 51 43.200 43.200 27.813 15.387 19947
2303 1 7 . 1 1 51 51 CYS H H 51 8.700 8.700 8.172 0.528 19947
2304 1 7 . 1 1 52 52 ARG N N 52 121.000 121.000 118.988 2.012 19947
2305 1 7 . 1 1 52 52 ARG HA H 52 4.690 4.690 4.433 0.257 19947
2306 1 7 . 1 1 52 52 ARG CA C 52 55.400 55.400 55.285 0.115 19947
2307 1 7 . 1 1 52 52 ARG CB C 52 33.100 33.100 34.305 -1.205 19947
2308 1 7 . 1 1 52 52 ARG H H 52 7.960 7.960 7.781 0.179 19947
2309 1 7 . 1 1 53 53 PHE N N 53 120.300 120.300 120.368 -0.068 19947
2310 1 7 . 1 1 53 53 PHE HA H 53 5.050 5.050 5.250 -0.200 19947
2311 1 7 . 1 1 53 53 PHE CA C 53 56.100 56.100 56.771 -0.671 19947
2312 1 7 . 1 1 53 53 PHE CB C 53 38.200 38.200 39.246 -1.046 19947
2313 1 7 . 1 1 53 53 PHE H H 53 8.400 8.400 8.405 -0.005 19947
2314 1 7 . 1 1 54 54 LYS N N 54 123.300 123.300 125.581 -2.281 19947
2315 1 7 . 1 1 54 54 LYS HA H 54 4.250 4.250 4.122 0.128 19947
2316 1 7 . 1 1 54 54 LYS CA C 54 57.500 57.500 56.691 0.809 19947
2317 1 7 . 1 1 54 54 LYS CB C 54 34.300 34.300 32.100 2.200 19947
2318 1 7 . 1 1 54 54 LYS H H 54 8.540 8.540 8.553 -0.013 19947
2319 1 7 . 1 1 55 55 LYS N N 55 119.400 119.400 124.881 -5.481 19947
2320 1 7 . 1 1 55 55 LYS HA H 55 4.110 4.110 4.010 0.100 19947
2321 1 7 . 1 1 55 55 LYS CA C 55 56.500 56.500 56.941 -0.441 19947
2322 1 7 . 1 1 55 55 LYS CB C 55 33.400 33.400 33.072 0.328 19947
2323 1 7 . 1 1 55 55 LYS H H 55 8.440 8.440 8.168 0.272 19947
2324 1 7 . 1 1 56 56 ALA N N 56 126.700 126.700 127.228 -0.528 19947
2325 1 7 . 1 1 56 56 ALA HA H 56 3.920 3.920 4.069 -0.149 19947
2326 1 7 . 1 1 56 56 ALA CA C 56 52.900 52.900 53.706 -0.806 19947
2327 1 7 . 1 1 56 56 ALA CB C 56 18.100 18.100 18.288 -0.188 19947
2328 1 7 . 1 1 56 56 ALA H H 56 8.930 8.930 8.525 0.405 19947
2329 1 7 . 1 1 57 57 GLY N N 57 109.300 109.300 111.281 -1.981 19947
2330 1 7 . 1 1 57 57 GLY CA C 57 45.100 45.100 44.798 0.302 19947
2331 1 7 . 1 1 57 57 GLY H H 57 8.460 8.460 8.460 0.000 19947
2332 1 7 . 1 1 58 58 THR N N 58 117.200 117.200 119.880 -2.680 19947
2333 1 7 . 1 1 58 58 THR HA H 58 4.260 4.260 4.420 -0.160 19947
2334 1 7 . 1 1 58 58 THR CA C 58 63.300 63.300 63.716 -0.416 19947
2335 1 7 . 1 1 58 58 THR CB C 58 69.600 69.600 69.272 0.328 19947
2336 1 7 . 1 1 58 58 THR H H 58 7.660 7.660 7.804 -0.144 19947
2337 1 7 . 1 1 59 59 VAL N N 59 130.400 130.400 127.652 2.748 19947
2338 1 7 . 1 1 59 59 VAL HA H 59 3.900 3.900 4.103 -0.203 19947
2339 1 7 . 1 1 59 59 VAL CA C 59 64.400 64.400 62.411 1.989 19947
2340 1 7 . 1 1 59 59 VAL CB C 59 31.900 31.900 32.189 -0.289 19947
2341 1 7 . 1 1 59 59 VAL H H 59 9.190 9.190 8.876 0.314 19947
2342 1 7 . 1 1 60 60 CYS N N 60 121.800 121.800 125.941 -4.141 19947
2343 1 7 . 1 1 60 60 CYS HA H 60 5.050 5.050 4.568 0.482 19947
2344 1 7 . 1 1 60 60 CYS CA C 60 54.400 54.400 58.242 -3.842 19947
2345 1 7 . 1 1 60 60 CYS CB C 60 43.000 43.000 26.982 16.018 19947
2346 1 7 . 1 1 60 60 CYS H H 60 9.130 9.130 8.367 0.763 19947
2347 1 7 . 1 1 61 61 ARG N N 61 124.100 124.100 119.008 5.092 19947
2348 1 7 . 1 1 61 61 ARG HA H 61 4.360 4.360 4.604 -0.244 19947
2349 1 7 . 1 1 61 61 ARG CA C 61 56.800 56.800 55.726 1.074 19947
2350 1 7 . 1 1 61 61 ARG CB C 61 32.800 32.800 34.287 -1.487 19947
2351 1 7 . 1 1 61 61 ARG H H 61 7.580 7.580 7.470 0.110 19947
2352 1 7 . 1 1 62 62 ILE N N 62 126.200 126.200 117.403 8.797 19947
2353 1 7 . 1 1 62 62 ILE HA H 62 4.090 4.090 4.652 -0.562 19947
2354 1 7 . 1 1 62 62 ILE CA C 62 60.300 60.300 60.749 -0.450 19947
2355 1 7 . 1 1 62 62 ILE CB C 62 38.700 38.700 40.752 -2.052 19947
2356 1 7 . 1 1 62 62 ILE H H 62 8.490 8.490 8.514 -0.024 19947
2357 1 7 . 1 1 63 63 ALA N N 63 129.400 129.400 131.733 -2.333 19947
2358 1 7 . 1 1 63 63 ALA HA H 63 4.310 4.310 4.339 -0.029 19947
2359 1 7 . 1 1 63 63 ALA CA C 63 51.900 51.900 53.727 -1.827 19947
2360 1 7 . 1 1 63 63 ALA CB C 63 20.600 20.600 19.233 1.367 19947
2361 1 7 . 1 1 63 63 ALA H H 63 8.100 8.100 8.645 -0.545 19947
2362 1 7 . 1 1 64 64 ARG N N 64 120.500 120.500 121.884 -1.384 19947
2363 1 7 . 1 1 64 64 ARG HA H 64 4.290 4.290 4.419 -0.129 19947
2364 1 7 . 1 1 64 64 ARG CA C 64 56.200 56.200 55.667 0.533 19947
2365 1 7 . 1 1 64 64 ARG CB C 64 30.500 30.500 29.337 1.163 19947
2366 1 7 . 1 1 64 64 ARG H H 64 8.140 8.140 8.846 -0.706 19947
2367 1 7 . 1 1 65 65 GLY N N 65 110.500 110.500 114.156 -3.656 19947
2368 1 7 . 1 1 65 65 GLY CA C 65 45.100 45.100 44.579 0.521 19947
2369 1 7 . 1 1 65 65 GLY H H 65 8.040 8.040 8.421 -0.381 19947
2370 1 7 . 1 1 66 66 ASP N N 66 120.700 120.700 120.409 0.291 19947
2371 1 7 . 1 1 66 66 ASP HA H 66 4.610 4.610 4.668 -0.058 19947
2372 1 7 . 1 1 66 66 ASP CA C 66 53.300 53.300 53.364 -0.063 19947
2373 1 7 . 1 1 66 66 ASP CB C 66 37.600 37.600 40.338 -2.738 19947
2374 1 7 . 1 1 66 66 ASP H H 66 8.380 8.380 7.111 1.269 19947
2375 1 7 . 1 1 67 67 TRP N N 67 120.100 120.100 123.694 -3.594 19947
2376 1 7 . 1 1 67 67 TRP HA H 67 4.760 4.760 4.978 -0.218 19947
2377 1 7 . 1 1 67 67 TRP CA C 67 57.200 57.200 57.953 -0.753 19947
2378 1 7 . 1 1 67 67 TRP CB C 67 29.100 29.100 29.720 -0.620 19947
2379 1 7 . 1 1 67 67 TRP H H 67 7.950 7.950 7.939 0.011 19947
2380 1 7 . 1 1 68 68 ASN N N 68 118.400 118.400 117.241 1.159 19947
2381 1 7 . 1 1 68 68 ASN HA H 68 4.790 4.790 4.955 -0.165 19947
2382 1 7 . 1 1 68 68 ASN CA C 68 52.800 52.800 53.546 -0.746 19947
2383 1 7 . 1 1 68 68 ASN CB C 68 39.300 39.300 40.585 -1.285 19947
2384 1 7 . 1 1 68 68 ASN H H 68 8.180 8.180 8.926 -0.746 19947
2385 1 7 . 1 1 69 69 ASP N N 69 118.500 118.500 118.928 -0.428 19947
2386 1 7 . 1 1 69 69 ASP HA H 69 4.620 4.620 4.567 0.053 19947
2387 1 7 . 1 1 69 69 ASP CA C 69 53.200 53.200 56.153 -2.953 19947
2388 1 7 . 1 1 69 69 ASP CB C 69 38.000 38.000 41.389 -3.389 19947
2389 1 7 . 1 1 69 69 ASP H H 69 8.130 8.130 8.455 -0.325 19947
2390 1 7 . 1 1 70 70 ASP N N 70 120.500 120.500 120.673 -0.173 19947
2391 1 7 . 1 1 70 70 ASP HA H 70 5.100 5.100 5.250 -0.150 19947
2392 1 7 . 1 1 70 70 ASP CA C 70 52.500 52.500 52.718 -0.218 19947
2393 1 7 . 1 1 70 70 ASP CB C 70 42.600 42.600 42.605 -0.005 19947
2394 1 7 . 1 1 70 70 ASP H H 70 8.140 8.140 8.039 0.101 19947
2395 1 7 . 1 1 71 71 TYR N N 71 118.900 118.900 123.794 -4.894 19947
2396 1 7 . 1 1 71 71 TYR HA H 71 5.210 5.210 5.128 0.082 19947
2397 1 7 . 1 1 71 71 TYR CA C 71 56.300 56.300 56.874 -0.574 19947
2398 1 7 . 1 1 71 71 TYR CB C 71 42.200 42.200 42.605 -0.405 19947
2399 1 7 . 1 1 71 71 TYR H H 71 8.450 8.450 8.252 0.198 19947
2400 1 7 . 1 1 72 72 CYS N N 72 119.800 119.800 122.191 -2.391 19947
2401 1 7 . 1 1 72 72 CYS HA H 72 4.900 4.900 4.445 0.455 19947
2402 1 7 . 1 1 72 72 CYS CA C 72 53.400 53.400 59.919 -6.519 19947
2403 1 7 . 1 1 72 72 CYS CB C 72 37.200 37.200 28.993 8.207 19947
2404 1 7 . 1 1 72 72 CYS H H 72 9.330 9.330 8.747 0.583 19947
2405 1 7 . 1 1 73 73 THR N N 73 112.700 112.700 113.906 -1.206 19947
2406 1 7 . 1 1 73 73 THR HA H 73 4.430 4.430 4.462 -0.032 19947
2407 1 7 . 1 1 73 73 THR CA C 73 62.300 62.300 60.568 1.732 19947
2408 1 7 . 1 1 73 73 THR CB C 73 71.300 71.300 69.647 1.653 19947
2409 1 7 . 1 1 73 73 THR H H 73 9.980 9.980 8.706 1.274 19947
2410 1 7 . 1 1 74 74 GLY N N 74 111.500 111.500 110.373 1.127 19947
2411 1 7 . 1 1 74 74 GLY CA C 74 45.300 45.300 46.533 -1.233 19947
2412 1 7 . 1 1 74 74 GLY H H 74 8.580 8.580 7.663 0.917 19947
2413 1 7 . 1 1 75 75 LYS N N 75 115.900 115.900 116.637 -0.737 19947
2414 1 7 . 1 1 75 75 LYS HA H 75 4.140 4.140 4.555 -0.415 19947
2415 1 7 . 1 1 75 75 LYS CA C 75 54.800 54.800 55.458 -0.658 19947
2416 1 7 . 1 1 75 75 LYS CB C 75 34.200 34.200 34.556 -0.356 19947
2417 1 7 . 1 1 75 75 LYS H H 75 7.900 7.900 7.505 0.395 19947
2418 1 7 . 1 1 76 76 SER N N 76 111.000 111.000 113.463 -2.463 19947
2419 1 7 . 1 1 76 76 SER HA H 76 4.160 4.160 3.848 0.312 19947
2420 1 7 . 1 1 76 76 SER CA C 76 61.400 61.400 57.003 4.397 19947
2421 1 7 . 1 1 76 76 SER CB C 76 64.300 64.300 63.804 0.496 19947
2422 1 7 . 1 1 76 76 SER H H 76 6.520 6.520 7.006 -0.486 19947
2423 1 7 . 1 1 77 77 SER N N 77 117.100 117.100 115.691 1.409 19947
2424 1 7 . 1 1 77 77 SER HA H 77 4.220 4.220 4.464 -0.244 19947
2425 1 7 . 1 1 77 77 SER CA C 77 59.800 59.800 58.751 1.049 19947
2426 1 7 . 1 1 77 77 SER CB C 77 64.400 64.400 63.470 0.930 19947
2427 1 7 . 1 1 77 77 SER H H 77 9.030 9.030 8.359 0.671 19947
2428 1 7 . 1 1 78 78 ASP N N 78 122.100 122.100 120.692 1.408 19947
2429 1 7 . 1 1 78 78 ASP HA H 78 4.930 4.930 4.706 0.224 19947
2430 1 7 . 1 1 78 78 ASP CA C 78 52.400 52.400 53.965 -1.565 19947
2431 1 7 . 1 1 78 78 ASP CB C 78 40.800 40.800 43.896 -3.096 19947
2432 1 7 . 1 1 78 78 ASP H H 78 8.340 8.340 7.542 0.798 19947
2433 1 7 . 1 1 79 79 CYS N N 79 122.200 122.200 121.987 0.213 19947
2434 1 7 . 1 1 79 79 CYS HA H 79 5.320 5.320 4.856 0.464 19947
2435 1 7 . 1 1 79 79 CYS CA C 79 52.000 52.000 55.831 -3.831 19947
2436 1 7 . 1 1 79 79 CYS CB C 79 39.300 39.300 27.796 11.504 19947
2437 1 7 . 1 1 79 79 CYS H H 79 8.960 8.960 8.793 0.168 19947
2438 1 7 . 1 1 80 80 PRO HA H 80 4.410 4.410 4.562 -0.152 19947
2439 1 7 . 1 1 80 80 PRO CA C 80 63.500 63.500 62.828 0.672 19947
2440 1 7 . 1 1 80 80 PRO CB C 80 32.400 32.400 32.599 -0.199 19947
2441 1 7 . 1 1 81 81 TRP N N 81 120.500 120.500 121.807 -1.307 19947
2442 1 7 . 1 1 81 81 TRP HA H 81 4.550 4.550 4.647 -0.097 19947
2443 1 7 . 1 1 81 81 TRP CA C 81 56.400 56.400 54.728 1.672 19947
2444 1 7 . 1 1 81 81 TRP CB C 81 29.500 29.500 28.772 0.728 19947
2445 1 7 . 1 1 81 81 TRP H H 81 8.400 8.400 8.491 -0.091 19947
2446 1 7 . 1 1 82 82 ASN N N 82 120.400 120.400 116.564 3.836 19947
2447 1 7 . 1 1 82 82 ASN HA H 82 4.750 4.750 4.296 0.454 19947
2448 1 7 . 1 1 82 82 ASN CA C 82 53.100 53.100 54.094 -0.995 19947
2449 1 7 . 1 1 82 82 ASN CB C 82 39.000 39.000 37.143 1.857 19947
2450 1 7 . 1 1 82 82 ASN H H 82 8.040 8.040 8.476 -0.436 19947
2451 1 8 . 1 1 2 2 PRO HA H 2 4.820 4.820 4.770 0.050 19947
2452 1 8 . 1 1 2 2 PRO CA C 2 61.900 61.900 62.012 -0.112 19947
2453 1 8 . 1 1 2 2 PRO CB C 2 30.700 30.700 31.662 -0.962 19947
2454 1 8 . 1 1 3 3 PRO HA H 3 4.540 4.540 4.480 0.060 19947
2455 1 8 . 1 1 3 3 PRO CA C 3 62.900 62.900 62.427 0.473 19947
2456 1 8 . 1 1 3 3 PRO CB C 3 32.100 32.100 32.886 -0.786 19947
2457 1 8 . 1 1 4 4 VAL N N 4 121.900 121.900 124.126 -2.226 19947
2458 1 8 . 1 1 4 4 VAL HA H 4 4.200 4.200 4.067 0.133 19947
2459 1 8 . 1 1 4 4 VAL CA C 4 62.300 62.300 62.380 -0.081 19947
2460 1 8 . 1 1 4 4 VAL CB C 4 32.800 32.800 31.926 0.874 19947
2461 1 8 . 1 1 4 4 VAL H H 4 8.330 8.330 8.417 -0.087 19947
2462 1 8 . 1 1 5 5 CYS N N 5 120.900 120.900 127.887 -6.987 19947
2463 1 8 . 1 1 5 5 CYS HA H 5 4.700 4.700 4.359 0.341 19947
2464 1 8 . 1 1 5 5 CYS CA C 5 53.600 53.600 59.749 -6.149 19947
2465 1 8 . 1 1 5 5 CYS H H 5 8.500 8.500 8.640 -0.140 19947
2466 1 8 . 1 1 6 6 GLY N N 6 110.200 110.200 114.284 -4.084 19947
2467 1 8 . 1 1 6 6 GLY CA C 6 46.300 46.300 44.847 1.453 19947
2468 1 8 . 1 1 6 6 GLY H H 6 8.490 8.490 8.430 0.060 19947
2469 1 8 . 1 1 7 7 ASN N N 7 120.100 120.100 116.164 3.936 19947
2470 1 8 . 1 1 7 7 ASN HA H 7 4.730 4.730 4.343 0.387 19947
2471 1 8 . 1 1 7 7 ASN CA C 7 53.200 53.200 54.311 -1.111 19947
2472 1 8 . 1 1 7 7 ASN CB C 7 38.700 38.700 39.527 -0.827 19947
2473 1 8 . 1 1 7 7 ASN H H 7 8.320 8.320 8.027 0.293 19947
2474 1 8 . 1 1 8 8 LYS N N 8 121.300 121.300 124.488 -3.188 19947
2475 1 8 . 1 1 8 8 LYS HA H 8 4.340 4.340 4.224 0.116 19947
2476 1 8 . 1 1 8 8 LYS CA C 8 56.600 56.600 56.717 -0.117 19947
2477 1 8 . 1 1 8 8 LYS CB C 8 32.900 32.900 31.686 1.214 19947
2478 1 8 . 1 1 8 8 LYS H H 8 8.260 8.260 8.490 -0.230 19947
2479 1 8 . 1 1 9 9 ILE N N 9 136.600 136.600 124.080 12.520 19947
2480 1 8 . 1 1 9 9 ILE HA H 9 4.140 4.140 3.971 0.169 19947
2481 1 8 . 1 1 9 9 ILE CA C 9 61.300 61.300 62.458 -1.158 19947
2482 1 8 . 1 1 9 9 ILE CB C 9 38.200 38.200 37.767 0.433 19947
2483 1 8 . 1 1 9 9 ILE H H 9 8.150 8.150 7.996 0.154 19947
2484 1 8 . 1 1 10 10 LEU N N 10 125.700 125.700 120.810 4.890 19947
2485 1 8 . 1 1 10 10 LEU HA H 10 4.420 4.420 4.459 -0.039 19947
2486 1 8 . 1 1 10 10 LEU CA C 10 55.200 55.200 55.788 -0.588 19947
2487 1 8 . 1 1 10 10 LEU CB C 10 42.300 42.300 41.201 1.099 19947
2488 1 8 . 1 1 10 10 LEU H H 10 8.230 8.230 8.433 -0.203 19947
2489 1 8 . 1 1 11 11 GLU N N 11 120.600 120.600 114.085 6.515 19947
2490 1 8 . 1 1 11 11 GLU HA H 11 4.470 4.470 4.169 0.301 19947
2491 1 8 . 1 1 11 11 GLU CA C 11 55.500 55.500 56.544 -1.044 19947
2492 1 8 . 1 1 11 11 GLU CB C 11 28.900 28.900 28.381 0.519 19947
2493 1 8 . 1 1 11 11 GLU H H 11 8.250 8.250 7.847 0.403 19947
2494 1 8 . 1 1 12 12 GLN N N 12 121.600 121.600 118.713 2.887 19947
2495 1 8 . 1 1 12 12 GLN HA H 12 4.350 4.350 4.507 -0.157 19947
2496 1 8 . 1 1 12 12 GLN CA C 12 56.600 56.600 55.794 0.806 19947
2497 1 8 . 1 1 12 12 GLN CB C 12 29.200 29.200 29.921 -0.721 19947
2498 1 8 . 1 1 12 12 GLN H H 12 8.460 8.460 7.701 0.759 19947
2499 1 8 . 1 1 13 13 GLY N N 13 110.700 110.700 107.171 3.529 19947
2500 1 8 . 1 1 13 13 GLY CA C 13 45.700 45.700 45.607 0.093 19947
2501 1 8 . 1 1 13 13 GLY H H 13 8.660 8.660 8.590 0.070 19947
2502 1 8 . 1 1 14 14 GLU N N 14 118.900 118.900 114.822 4.078 19947
2503 1 8 . 1 1 14 14 GLU HA H 14 4.530 4.530 4.175 0.355 19947
2504 1 8 . 1 1 14 14 GLU CA C 14 55.600 55.600 56.519 -0.919 19947
2505 1 8 . 1 1 14 14 GLU CB C 14 29.700 29.700 29.413 0.287 19947
2506 1 8 . 1 1 14 14 GLU H H 14 8.230 8.230 8.267 -0.037 19947
2507 1 8 . 1 1 15 15 ASP N N 15 118.400 118.400 120.318 -1.918 19947
2508 1 8 . 1 1 15 15 ASP HA H 15 4.990 4.990 4.530 0.460 19947
2509 1 8 . 1 1 15 15 ASP CA C 15 53.500 53.500 56.944 -3.444 19947
2510 1 8 . 1 1 15 15 ASP CB C 15 39.700 39.700 41.858 -2.158 19947
2511 1 8 . 1 1 15 15 ASP H H 15 8.330 8.330 8.379 -0.049 19947
2512 1 8 . 1 1 16 16 CYS HA H 16 4.340 4.340 4.354 -0.014 19947
2513 1 8 . 1 1 16 16 CYS H H 16 8.510 8.510 7.838 0.672 19947
2514 1 8 . 1 1 17 17 ASP N N 17 116.700 116.700 123.482 -6.782 19947
2515 1 8 . 1 1 17 17 ASP HA H 17 4.740 4.740 4.343 0.397 19947
2516 1 8 . 1 1 17 17 ASP CA C 17 53.100 53.100 55.315 -2.215 19947
2517 1 8 . 1 1 17 17 ASP CB C 17 38.600 38.600 39.740 -1.140 19947
2518 1 8 . 1 1 17 17 ASP H H 17 8.180 8.180 8.798 -0.618 19947
2519 1 8 . 1 1 18 18 CYS HA H 18 4.730 4.730 3.997 0.733 19947
2520 1 8 . 1 1 18 18 CYS CB C 18 41.900 41.900 26.951 14.949 19947
2521 1 8 . 1 1 19 19 GLY H H 19 8.220 8.220 8.847 -0.627 19947
2522 1 8 . 1 1 20 20 SER HA H 20 4.920 4.920 4.406 0.514 19947
2523 1 8 . 1 1 20 20 SER CA C 20 55.700 55.700 57.381 -1.681 19947
2524 1 8 . 1 1 20 20 SER CB C 20 63.500 63.500 63.121 0.379 19947
2525 1 8 . 1 1 20 20 SER H H 20 7.830 7.830 8.451 -0.621 19947
2526 1 8 . 1 1 21 21 PRO HA H 21 4.240 4.240 4.173 0.067 19947
2527 1 8 . 1 1 21 21 PRO CA C 21 63.400 63.400 64.969 -1.569 19947
2528 1 8 . 1 1 21 21 PRO CB C 21 31.800 31.800 31.393 0.406 19947
2529 1 8 . 1 1 22 22 ALA N N 22 119.900 119.900 117.458 2.442 19947
2530 1 8 . 1 1 22 22 ALA HA H 22 4.220 4.220 4.099 0.121 19947
2531 1 8 . 1 1 22 22 ALA CA C 22 54.200 54.200 53.613 0.587 19947
2532 1 8 . 1 1 22 22 ALA CB C 22 18.500 18.500 18.583 -0.083 19947
2533 1 8 . 1 1 22 22 ALA H H 22 8.180 8.180 8.310 -0.130 19947
2534 1 8 . 1 1 23 23 ASN N N 23 116.300 116.300 112.191 4.109 19947
2535 1 8 . 1 1 23 23 ASN HA H 23 4.670 4.670 4.971 -0.301 19947
2536 1 8 . 1 1 23 23 ASN CA C 23 53.200 53.200 53.151 0.049 19947
2537 1 8 . 1 1 23 23 ASN CB C 23 39.300 39.300 41.070 -1.770 19947
2538 1 8 . 1 1 23 23 ASN H H 23 7.960 7.960 8.025 -0.065 19947
2539 1 8 . 1 1 24 24 CYS HA H 24 4.720 4.720 4.383 0.337 19947
2540 1 8 . 1 1 24 24 CYS H H 24 8.510 8.510 7.730 0.780 19947
2541 1 8 . 1 1 25 25 GLN HA H 25 4.460 4.460 3.944 0.516 19947
2542 1 8 . 1 1 25 25 GLN H H 25 8.320 8.320 8.777 -0.457 19947
2543 1 8 . 1 1 26 26 ASP HA H 26 4.740 4.740 4.603 0.138 19947
2544 1 8 . 1 1 26 26 ASP H H 26 8.580 8.580 8.515 0.065 19947
2545 1 8 . 1 1 27 27 ARG HA H 27 4.680 4.680 4.414 0.266 19947
2546 1 8 . 1 1 27 27 ARG CA C 27 54.700 54.700 57.359 -2.659 19947
2547 1 8 . 1 1 27 27 ARG H H 27 8.550 8.550 8.045 0.505 19947
2548 1 8 . 1 1 28 28 CYS HA H 28 4.120 4.120 4.699 -0.580 19947
2549 1 8 . 1 1 28 28 CYS CA C 28 54.400 54.400 58.398 -3.998 19947
2550 1 8 . 1 1 28 28 CYS CB C 28 19.000 19.000 26.650 -7.650 19947
2551 1 8 . 1 1 28 28 CYS H H 28 8.910 8.910 8.411 0.499 19947
2552 1 8 . 1 1 29 29 CYS N N 29 113.300 113.300 120.482 -7.182 19947
2553 1 8 . 1 1 29 29 CYS HA H 29 5.010 5.010 4.744 0.266 19947
2554 1 8 . 1 1 29 29 CYS CA C 29 54.300 54.300 58.030 -3.730 19947
2555 1 8 . 1 1 29 29 CYS H H 29 7.730 7.730 7.956 -0.226 19947
2556 1 8 . 1 1 30 30 ASN HA H 30 4.730 4.730 5.010 -0.280 19947
2557 1 8 . 1 1 30 30 ASN CB C 30 38.700 38.700 39.646 -0.946 19947
2558 1 8 . 1 1 30 30 ASN H H 30 8.870 8.870 8.756 0.114 19947
2559 1 8 . 1 1 31 31 ALA N N 31 129.400 129.400 127.212 2.188 19947
2560 1 8 . 1 1 31 31 ALA HA H 31 4.120 4.120 4.373 -0.253 19947
2561 1 8 . 1 1 31 31 ALA CA C 31 54.400 54.400 54.422 -0.022 19947
2562 1 8 . 1 1 31 31 ALA CB C 31 19.000 19.000 19.093 -0.094 19947
2563 1 8 . 1 1 31 31 ALA H H 31 8.890 8.890 8.416 0.474 19947
2564 1 8 . 1 1 32 32 ALA N N 32 116.400 116.400 119.255 -2.855 19947
2565 1 8 . 1 1 32 32 ALA HA H 32 4.340 4.340 4.318 0.022 19947
2566 1 8 . 1 1 32 32 ALA CA C 32 53.800 53.800 53.554 0.246 19947
2567 1 8 . 1 1 32 32 ALA CB C 32 19.100 19.100 19.106 -0.006 19947
2568 1 8 . 1 1 32 32 ALA H H 32 8.250 8.250 8.412 -0.162 19947
2569 1 8 . 1 1 33 33 THR N N 33 104.300 104.300 109.702 -5.402 19947
2570 1 8 . 1 1 33 33 THR HA H 33 4.430 4.430 4.411 0.019 19947
2571 1 8 . 1 1 33 33 THR CA C 33 60.500 60.500 60.655 -0.155 19947
2572 1 8 . 1 1 33 33 THR CB C 33 70.600 70.600 69.290 1.310 19947
2573 1 8 . 1 1 33 33 THR H H 33 7.320 7.320 7.362 -0.042 19947
2574 1 8 . 1 1 34 34 CYS N N 34 123.400 123.400 120.719 2.681 19947
2575 1 8 . 1 1 34 34 CYS HA H 34 4.170 4.170 4.294 -0.124 19947
2576 1 8 . 1 1 34 34 CYS CA C 34 56.500 56.500 60.002 -3.502 19947
2577 1 8 . 1 1 34 34 CYS H H 34 8.710 8.710 8.077 0.633 19947
2578 1 8 . 1 1 35 35 LYS N N 35 116.900 116.900 118.125 -1.225 19947
2579 1 8 . 1 1 35 35 LYS HA H 35 4.960 4.960 4.893 0.067 19947
2580 1 8 . 1 1 35 35 LYS CA C 35 53.900 53.900 55.235 -1.335 19947
2581 1 8 . 1 1 35 35 LYS CB C 35 35.900 35.900 36.128 -0.228 19947
2582 1 8 . 1 1 35 35 LYS H H 35 7.450 7.450 7.713 -0.263 19947
2583 1 8 . 1 1 36 36 LEU N N 36 119.300 119.300 118.261 1.039 19947
2584 1 8 . 1 1 36 36 LEU HA H 36 4.800 4.800 4.383 0.417 19947
2585 1 8 . 1 1 36 36 LEU CB C 36 42.400 42.400 42.178 0.222 19947
2586 1 8 . 1 1 36 36 LEU H H 36 8.290 8.290 8.077 0.213 19947
2587 1 8 . 1 1 37 37 THR HA H 37 4.340 4.340 4.689 -0.349 19947
2588 1 8 . 1 1 37 37 THR CA C 37 60.200 60.200 58.917 1.283 19947
2589 1 8 . 1 1 37 37 THR CB C 37 67.700 67.700 68.802 -1.102 19947
2590 1 8 . 1 1 37 37 THR H H 37 8.380 8.380 8.115 0.265 19947
2591 1 8 . 1 1 38 38 PRO HA H 38 4.380 4.380 4.123 0.257 19947
2592 1 8 . 1 1 38 38 PRO CA C 38 64.800 64.800 64.409 0.391 19947
2593 1 8 . 1 1 38 38 PRO CB C 38 31.500 31.500 31.745 -0.245 19947
2594 1 8 . 1 1 39 39 GLY N N 39 113.300 113.300 112.058 1.242 19947
2595 1 8 . 1 1 39 39 GLY CA C 39 45.100 45.100 44.797 0.303 19947
2596 1 8 . 1 1 39 39 GLY H H 39 8.830 8.830 8.438 0.392 19947
2597 1 8 . 1 1 40 40 SER N N 40 116.700 116.700 117.800 -1.100 19947
2598 1 8 . 1 1 40 40 SER HA H 40 4.610 4.610 4.350 0.260 19947
2599 1 8 . 1 1 40 40 SER CA C 40 58.800 58.800 58.401 0.399 19947
2600 1 8 . 1 1 40 40 SER CB C 40 63.800 63.800 63.589 0.211 19947
2601 1 8 . 1 1 40 40 SER H H 40 8.280 8.280 7.857 0.423 19947
2602 1 8 . 1 1 41 41 GLN N N 41 120.600 120.600 125.831 -5.231 19947
2603 1 8 . 1 1 41 41 GLN HA H 41 4.110 4.110 4.054 0.056 19947
2604 1 8 . 1 1 41 41 GLN CA C 41 55.200 55.200 56.010 -0.809 19947
2605 1 8 . 1 1 41 41 GLN CB C 41 31.100 31.100 28.617 2.483 19947
2606 1 8 . 1 1 41 41 GLN H H 41 9.190 9.190 7.835 1.355 19947
2607 1 8 . 1 1 42 42 CYS N N 42 113.200 113.200 115.592 -2.392 19947
2608 1 8 . 1 1 42 42 CYS HA H 42 4.630 4.630 4.495 0.135 19947
2609 1 8 . 1 1 42 42 CYS CA C 42 53.700 53.700 57.814 -4.114 19947
2610 1 8 . 1 1 42 42 CYS CB C 42 45.500 45.500 29.918 15.582 19947
2611 1 8 . 1 1 42 42 CYS H H 42 7.710 7.710 7.275 0.435 19947
2612 1 8 . 1 1 43 43 ASN N N 43 114.200 114.200 121.286 -7.086 19947
2613 1 8 . 1 1 43 43 ASN HA H 43 4.940 4.940 4.677 0.263 19947
2614 1 8 . 1 1 43 43 ASN CA C 43 53.000 53.000 54.384 -1.384 19947
2615 1 8 . 1 1 43 43 ASN CB C 43 39.300 39.300 39.214 0.086 19947
2616 1 8 . 1 1 43 43 ASN H H 43 8.870 8.870 8.505 0.365 19947
2617 1 8 . 1 1 44 44 TYR N N 44 118.400 118.400 113.032 5.368 19947
2618 1 8 . 1 1 44 44 TYR HA H 44 4.850 4.850 4.597 0.253 19947
2619 1 8 . 1 1 44 44 TYR CA C 44 55.300 55.300 57.803 -2.503 19947
2620 1 8 . 1 1 44 44 TYR CB C 44 40.700 40.700 39.580 1.120 19947
2621 1 8 . 1 1 44 44 TYR H H 44 7.840 7.840 7.271 0.569 19947
2622 1 8 . 1 1 45 45 GLY N N 45 110.600 110.600 108.021 2.579 19947
2623 1 8 . 1 1 45 45 GLY CA C 45 44.000 44.000 45.218 -1.218 19947
2624 1 8 . 1 1 45 45 GLY H H 45 7.960 7.960 8.134 -0.174 19947
2625 1 8 . 1 1 46 46 GLU N N 46 120.700 120.700 119.433 1.267 19947
2626 1 8 . 1 1 46 46 GLU HA H 46 4.280 4.280 4.173 0.107 19947
2627 1 8 . 1 1 46 46 GLU CA C 46 58.500 58.500 58.899 -0.399 19947
2628 1 8 . 1 1 46 46 GLU CB C 46 29.300 29.300 30.066 -0.766 19947
2629 1 8 . 1 1 46 46 GLU H H 46 9.160 9.160 8.587 0.573 19947
2630 1 8 . 1 1 47 47 CYS N N 47 112.400 112.400 118.035 -5.635 19947
2631 1 8 . 1 1 47 47 CYS HA H 47 4.850 4.850 4.833 0.017 19947
2632 1 8 . 1 1 47 47 CYS CA C 47 57.100 57.100 57.478 -0.378 19947
2633 1 8 . 1 1 47 47 CYS CB C 47 41.200 41.200 26.242 14.958 19947
2634 1 8 . 1 1 47 47 CYS H H 47 8.510 8.510 7.601 0.909 19947
2635 1 8 . 1 1 48 48 CYS N N 48 123.200 123.200 120.660 2.540 19947
2636 1 8 . 1 1 48 48 CYS HA H 48 5.160 5.160 5.081 0.079 19947
2637 1 8 . 1 1 48 48 CYS CA C 48 54.700 54.700 58.116 -3.416 19947
2638 1 8 . 1 1 48 48 CYS CB C 48 45.700 45.700 29.657 16.043 19947
2639 1 8 . 1 1 48 48 CYS H H 48 7.810 7.810 7.887 -0.077 19947
2640 1 8 . 1 1 49 49 ASP N N 49 127.400 127.400 123.335 4.065 19947
2641 1 8 . 1 1 49 49 ASP HA H 49 4.890 4.890 4.984 -0.094 19947
2642 1 8 . 1 1 49 49 ASP CA C 49 53.500 53.500 53.659 -0.159 19947
2643 1 8 . 1 1 49 49 ASP CB C 49 42.400 42.400 44.578 -2.178 19947
2644 1 8 . 1 1 49 49 ASP H H 49 9.670 9.670 8.341 1.329 19947
2645 1 8 . 1 1 50 50 GLN N N 50 127.000 127.000 120.628 6.372 19947
2646 1 8 . 1 1 50 50 GLN HA H 50 3.940 3.940 3.920 0.020 19947
2647 1 8 . 1 1 50 50 GLN CA C 50 56.800 56.800 58.698 -1.898 19947
2648 1 8 . 1 1 50 50 GLN CB C 50 26.500 26.500 27.793 -1.293 19947
2649 1 8 . 1 1 50 50 GLN H H 50 9.450 9.450 8.932 0.518 19947
2650 1 8 . 1 1 51 51 CYS N N 51 106.100 106.100 118.873 -12.773 19947
2651 1 8 . 1 1 51 51 CYS HA H 51 4.760 4.760 4.771 -0.011 19947
2652 1 8 . 1 1 51 51 CYS CB C 51 43.200 43.200 28.126 15.074 19947
2653 1 8 . 1 1 51 51 CYS H H 51 8.700 8.700 8.283 0.417 19947
2654 1 8 . 1 1 52 52 ARG N N 52 121.000 121.000 118.887 2.113 19947
2655 1 8 . 1 1 52 52 ARG HA H 52 4.690 4.690 4.469 0.221 19947
2656 1 8 . 1 1 52 52 ARG CA C 52 55.400 55.400 55.024 0.376 19947
2657 1 8 . 1 1 52 52 ARG CB C 52 33.100 33.100 34.501 -1.401 19947
2658 1 8 . 1 1 52 52 ARG H H 52 7.960 7.960 7.768 0.192 19947
2659 1 8 . 1 1 53 53 PHE N N 53 120.300 120.300 121.727 -1.427 19947
2660 1 8 . 1 1 53 53 PHE HA H 53 5.050 5.050 5.106 -0.056 19947
2661 1 8 . 1 1 53 53 PHE CA C 53 56.100 56.100 57.626 -1.526 19947
2662 1 8 . 1 1 53 53 PHE CB C 53 38.200 38.200 39.204 -1.004 19947
2663 1 8 . 1 1 53 53 PHE H H 53 8.400 8.400 8.484 -0.084 19947
2664 1 8 . 1 1 54 54 LYS N N 54 123.300 123.300 125.258 -1.958 19947
2665 1 8 . 1 1 54 54 LYS HA H 54 4.250 4.250 4.149 0.101 19947
2666 1 8 . 1 1 54 54 LYS CA C 54 57.500 57.500 55.688 1.812 19947
2667 1 8 . 1 1 54 54 LYS CB C 54 34.300 34.300 31.373 2.926 19947
2668 1 8 . 1 1 54 54 LYS H H 54 8.540 8.540 8.506 0.034 19947
2669 1 8 . 1 1 55 55 LYS N N 55 119.400 119.400 124.568 -5.168 19947
2670 1 8 . 1 1 55 55 LYS HA H 55 4.110 4.110 3.939 0.171 19947
2671 1 8 . 1 1 55 55 LYS CA C 55 56.500 56.500 56.998 -0.499 19947
2672 1 8 . 1 1 55 55 LYS CB C 55 33.400 33.400 33.187 0.213 19947
2673 1 8 . 1 1 55 55 LYS H H 55 8.440 8.440 8.071 0.369 19947
2674 1 8 . 1 1 56 56 ALA N N 56 126.700 126.700 127.773 -1.073 19947
2675 1 8 . 1 1 56 56 ALA HA H 56 3.920 3.920 4.056 -0.136 19947
2676 1 8 . 1 1 56 56 ALA CA C 56 52.900 52.900 53.594 -0.694 19947
2677 1 8 . 1 1 56 56 ALA CB C 56 18.100 18.100 18.562 -0.462 19947
2678 1 8 . 1 1 56 56 ALA H H 56 8.930 8.930 8.741 0.189 19947
2679 1 8 . 1 1 57 57 GLY N N 57 109.300 109.300 111.629 -2.329 19947
2680 1 8 . 1 1 57 57 GLY CA C 57 45.100 45.100 44.851 0.249 19947
2681 1 8 . 1 1 57 57 GLY H H 57 8.460 8.460 8.446 0.014 19947
2682 1 8 . 1 1 58 58 THR N N 58 117.200 117.200 120.190 -2.990 19947
2683 1 8 . 1 1 58 58 THR HA H 58 4.260 4.260 4.450 -0.190 19947
2684 1 8 . 1 1 58 58 THR CA C 58 63.300 63.300 62.832 0.468 19947
2685 1 8 . 1 1 58 58 THR CB C 58 69.600 69.600 68.691 0.909 19947
2686 1 8 . 1 1 58 58 THR H H 58 7.660 7.660 7.814 -0.154 19947
2687 1 8 . 1 1 59 59 VAL N N 59 130.400 130.400 128.346 2.054 19947
2688 1 8 . 1 1 59 59 VAL HA H 59 3.900 3.900 3.650 0.250 19947
2689 1 8 . 1 1 59 59 VAL CA C 59 64.400 64.400 63.682 0.718 19947
2690 1 8 . 1 1 59 59 VAL CB C 59 31.900 31.900 32.200 -0.300 19947
2691 1 8 . 1 1 59 59 VAL H H 59 9.190 9.190 8.651 0.539 19947
2692 1 8 . 1 1 60 60 CYS N N 60 121.800 121.800 127.957 -6.157 19947
2693 1 8 . 1 1 60 60 CYS HA H 60 5.050 5.050 4.603 0.447 19947
2694 1 8 . 1 1 60 60 CYS CA C 60 54.400 54.400 57.846 -3.446 19947
2695 1 8 . 1 1 60 60 CYS CB C 60 43.000 43.000 28.265 14.735 19947
2696 1 8 . 1 1 60 60 CYS H H 60 9.130 9.130 8.153 0.977 19947
2697 1 8 . 1 1 61 61 ARG N N 61 124.100 124.100 118.139 5.961 19947
2698 1 8 . 1 1 61 61 ARG HA H 61 4.360 4.360 4.645 -0.285 19947
2699 1 8 . 1 1 61 61 ARG CA C 61 56.800 56.800 54.825 1.976 19947
2700 1 8 . 1 1 61 61 ARG CB C 61 32.800 32.800 32.822 -0.022 19947
2701 1 8 . 1 1 61 61 ARG H H 61 7.580 7.580 7.480 0.100 19947
2702 1 8 . 1 1 62 62 ILE N N 62 126.200 126.200 118.379 7.821 19947
2703 1 8 . 1 1 62 62 ILE HA H 62 4.090 4.090 4.384 -0.294 19947
2704 1 8 . 1 1 62 62 ILE CA C 62 60.300 60.300 60.710 -0.410 19947
2705 1 8 . 1 1 62 62 ILE CB C 62 38.700 38.700 41.029 -2.329 19947
2706 1 8 . 1 1 62 62 ILE H H 62 8.490 8.490 8.260 0.230 19947
2707 1 8 . 1 1 63 63 ALA N N 63 129.400 129.400 132.223 -2.823 19947
2708 1 8 . 1 1 63 63 ALA HA H 63 4.310 4.310 4.354 -0.044 19947
2709 1 8 . 1 1 63 63 ALA CA C 63 51.900 51.900 54.569 -2.670 19947
2710 1 8 . 1 1 63 63 ALA CB C 63 20.600 20.600 19.446 1.154 19947
2711 1 8 . 1 1 63 63 ALA H H 63 8.100 8.100 8.642 -0.542 19947
2712 1 8 . 1 1 64 64 ARG N N 64 120.500 120.500 121.119 -0.619 19947
2713 1 8 . 1 1 64 64 ARG HA H 64 4.290 4.290 4.487 -0.197 19947
2714 1 8 . 1 1 64 64 ARG CA C 64 56.200 56.200 56.056 0.144 19947
2715 1 8 . 1 1 64 64 ARG CB C 64 30.500 30.500 30.560 -0.060 19947
2716 1 8 . 1 1 64 64 ARG H H 64 8.140 8.140 8.816 -0.676 19947
2717 1 8 . 1 1 65 65 GLY N N 65 110.500 110.500 111.345 -0.845 19947
2718 1 8 . 1 1 65 65 GLY CA C 65 45.100 45.100 44.477 0.623 19947
2719 1 8 . 1 1 65 65 GLY H H 65 8.040 8.040 8.296 -0.256 19947
2720 1 8 . 1 1 66 66 ASP N N 66 120.700 120.700 120.611 0.089 19947
2721 1 8 . 1 1 66 66 ASP HA H 66 4.610 4.610 4.611 -0.001 19947
2722 1 8 . 1 1 66 66 ASP CA C 66 53.300 53.300 54.067 -0.767 19947
2723 1 8 . 1 1 66 66 ASP CB C 66 37.600 37.600 40.997 -3.397 19947
2724 1 8 . 1 1 66 66 ASP H H 66 8.380 8.380 7.140 1.240 19947
2725 1 8 . 1 1 67 67 TRP N N 67 120.100 120.100 124.246 -4.146 19947
2726 1 8 . 1 1 67 67 TRP HA H 67 4.760 4.760 5.044 -0.284 19947
2727 1 8 . 1 1 67 67 TRP CA C 67 57.200 57.200 58.127 -0.927 19947
2728 1 8 . 1 1 67 67 TRP CB C 67 29.100 29.100 29.413 -0.313 19947
2729 1 8 . 1 1 67 67 TRP H H 67 7.950 7.950 8.045 -0.095 19947
2730 1 8 . 1 1 68 68 ASN N N 68 118.400 118.400 118.400 0.000 19947
2731 1 8 . 1 1 68 68 ASN HA H 68 4.790 4.790 4.961 -0.171 19947
2732 1 8 . 1 1 68 68 ASN CA C 68 52.800 52.800 53.656 -0.856 19947
2733 1 8 . 1 1 68 68 ASN CB C 68 39.300 39.300 40.103 -0.803 19947
2734 1 8 . 1 1 68 68 ASN H H 68 8.180 8.180 8.729 -0.549 19947
2735 1 8 . 1 1 69 69 ASP N N 69 118.500 118.500 118.555 -0.055 19947
2736 1 8 . 1 1 69 69 ASP HA H 69 4.620 4.620 4.437 0.183 19947
2737 1 8 . 1 1 69 69 ASP CA C 69 53.200 53.200 56.233 -3.033 19947
2738 1 8 . 1 1 69 69 ASP CB C 69 38.000 38.000 41.196 -3.196 19947
2739 1 8 . 1 1 69 69 ASP H H 69 8.130 8.130 8.543 -0.413 19947
2740 1 8 . 1 1 70 70 ASP N N 70 120.500 120.500 121.158 -0.658 19947
2741 1 8 . 1 1 70 70 ASP HA H 70 5.100 5.100 4.866 0.234 19947
2742 1 8 . 1 1 70 70 ASP CA C 70 52.500 52.500 54.095 -1.595 19947
2743 1 8 . 1 1 70 70 ASP CB C 70 42.600 42.600 42.056 0.544 19947
2744 1 8 . 1 1 70 70 ASP H H 70 8.140 8.140 8.199 -0.059 19947
2745 1 8 . 1 1 71 71 TYR N N 71 118.900 118.900 124.013 -5.113 19947
2746 1 8 . 1 1 71 71 TYR HA H 71 5.210 5.210 4.873 0.337 19947
2747 1 8 . 1 1 71 71 TYR CA C 71 56.300 56.300 57.362 -1.062 19947
2748 1 8 . 1 1 71 71 TYR CB C 71 42.200 42.200 43.081 -0.881 19947
2749 1 8 . 1 1 71 71 TYR H H 71 8.450 8.450 8.588 -0.138 19947
2750 1 8 . 1 1 72 72 CYS N N 72 119.800 119.800 120.491 -0.691 19947
2751 1 8 . 1 1 72 72 CYS HA H 72 4.900 4.900 4.574 0.326 19947
2752 1 8 . 1 1 72 72 CYS CA C 72 53.400 53.400 59.706 -6.306 19947
2753 1 8 . 1 1 72 72 CYS CB C 72 37.200 37.200 29.161 8.039 19947
2754 1 8 . 1 1 72 72 CYS H H 72 9.330 9.330 8.525 0.805 19947
2755 1 8 . 1 1 73 73 THR N N 73 112.700 112.700 112.460 0.240 19947
2756 1 8 . 1 1 73 73 THR HA H 73 4.430 4.430 4.387 0.043 19947
2757 1 8 . 1 1 73 73 THR CA C 73 62.300 62.300 61.309 0.991 19947
2758 1 8 . 1 1 73 73 THR CB C 73 71.300 71.300 69.500 1.800 19947
2759 1 8 . 1 1 73 73 THR H H 73 9.980 9.980 8.905 1.075 19947
2760 1 8 . 1 1 74 74 GLY N N 74 111.500 111.500 111.934 -0.434 19947
2761 1 8 . 1 1 74 74 GLY CA C 74 45.300 45.300 46.704 -1.404 19947
2762 1 8 . 1 1 74 74 GLY H H 74 8.580 8.580 8.001 0.579 19947
2763 1 8 . 1 1 75 75 LYS N N 75 115.900 115.900 117.088 -1.188 19947
2764 1 8 . 1 1 75 75 LYS HA H 75 4.140 4.140 4.340 -0.200 19947
2765 1 8 . 1 1 75 75 LYS CA C 75 54.800 54.800 55.779 -0.979 19947
2766 1 8 . 1 1 75 75 LYS CB C 75 34.200 34.200 34.848 -0.648 19947
2767 1 8 . 1 1 75 75 LYS H H 75 7.900 7.900 7.377 0.523 19947
2768 1 8 . 1 1 76 76 SER N N 76 111.000 111.000 113.844 -2.844 19947
2769 1 8 . 1 1 76 76 SER HA H 76 4.160 4.160 3.883 0.277 19947
2770 1 8 . 1 1 76 76 SER CA C 76 61.400 61.400 55.301 6.099 19947
2771 1 8 . 1 1 76 76 SER CB C 76 64.300 64.300 64.171 0.129 19947
2772 1 8 . 1 1 76 76 SER H H 76 6.520 6.520 7.052 -0.532 19947
2773 1 8 . 1 1 77 77 SER N N 77 117.100 117.100 114.385 2.715 19947
2774 1 8 . 1 1 77 77 SER HA H 77 4.220 4.220 4.740 -0.520 19947
2775 1 8 . 1 1 77 77 SER CA C 77 59.800 59.800 58.868 0.931 19947
2776 1 8 . 1 1 77 77 SER CB C 77 64.400 64.400 63.778 0.623 19947
2777 1 8 . 1 1 77 77 SER H H 77 9.030 9.030 8.553 0.477 19947
2778 1 8 . 1 1 78 78 ASP N N 78 122.100 122.100 122.678 -0.578 19947
2779 1 8 . 1 1 78 78 ASP HA H 78 4.930 4.930 4.903 0.027 19947
2780 1 8 . 1 1 78 78 ASP CA C 78 52.400 52.400 53.447 -1.047 19947
2781 1 8 . 1 1 78 78 ASP CB C 78 40.800 40.800 44.694 -3.894 19947
2782 1 8 . 1 1 78 78 ASP H H 78 8.340 8.340 7.385 0.955 19947
2783 1 8 . 1 1 79 79 CYS N N 79 122.200 122.200 120.550 1.650 19947
2784 1 8 . 1 1 79 79 CYS HA H 79 5.320 5.320 5.141 0.179 19947
2785 1 8 . 1 1 79 79 CYS CA C 79 52.000 52.000 54.242 -2.241 19947
2786 1 8 . 1 1 79 79 CYS CB C 79 39.300 39.300 26.515 12.785 19947
2787 1 8 . 1 1 79 79 CYS H H 79 8.960 8.960 8.165 0.795 19947
2788 1 8 . 1 1 80 80 PRO HA H 80 4.410 4.410 4.079 0.331 19947
2789 1 8 . 1 1 80 80 PRO CA C 80 63.500 63.500 62.872 0.628 19947
2790 1 8 . 1 1 80 80 PRO CB C 80 32.400 32.400 32.875 -0.475 19947
2791 1 8 . 1 1 81 81 TRP N N 81 120.500 120.500 121.081 -0.581 19947
2792 1 8 . 1 1 81 81 TRP HA H 81 4.550 4.550 4.307 0.243 19947
2793 1 8 . 1 1 81 81 TRP CA C 81 56.400 56.400 57.990 -1.590 19947
2794 1 8 . 1 1 81 81 TRP CB C 81 29.500 29.500 28.771 0.729 19947
2795 1 8 . 1 1 81 81 TRP H H 81 8.400 8.400 7.670 0.730 19947
2796 1 8 . 1 1 82 82 ASN N N 82 120.400 120.400 113.412 6.988 19947
2797 1 8 . 1 1 82 82 ASN HA H 82 4.750 4.750 4.436 0.314 19947
2798 1 8 . 1 1 82 82 ASN CA C 82 53.100 53.100 54.035 -0.935 19947
2799 1 8 . 1 1 82 82 ASN CB C 82 39.000 39.000 36.853 2.147 19947
2800 1 8 . 1 1 82 82 ASN H H 82 8.040 8.040 8.343 -0.303 19947
2801 1 9 . 1 1 2 2 PRO HA H 2 4.820 4.820 4.728 0.092 19947
2802 1 9 . 1 1 2 2 PRO CA C 2 61.900 61.900 62.196 -0.295 19947
2803 1 9 . 1 1 2 2 PRO CB C 2 30.700 30.700 31.869 -1.169 19947
2804 1 9 . 1 1 3 3 PRO HA H 3 4.540 4.540 4.450 0.090 19947
2805 1 9 . 1 1 3 3 PRO CA C 3 62.900 62.900 62.844 0.056 19947
2806 1 9 . 1 1 3 3 PRO CB C 3 32.100 32.100 32.282 -0.183 19947
2807 1 9 . 1 1 4 4 VAL N N 4 121.900 121.900 120.107 1.793 19947
2808 1 9 . 1 1 4 4 VAL HA H 4 4.200 4.200 4.499 -0.299 19947
2809 1 9 . 1 1 4 4 VAL CA C 4 62.300 62.300 60.734 1.566 19947
2810 1 9 . 1 1 4 4 VAL CB C 4 32.800 32.800 32.360 0.440 19947
2811 1 9 . 1 1 4 4 VAL H H 4 8.330 8.330 8.048 0.282 19947
2812 1 9 . 1 1 5 5 CYS N N 5 120.900 120.900 125.847 -4.947 19947
2813 1 9 . 1 1 5 5 CYS HA H 5 4.700 4.700 4.530 0.170 19947
2814 1 9 . 1 1 5 5 CYS CA C 5 53.600 53.600 58.326 -4.726 19947
2815 1 9 . 1 1 5 5 CYS H H 5 8.500 8.500 8.999 -0.499 19947
2816 1 9 . 1 1 6 6 GLY N N 6 110.200 110.200 113.772 -3.572 19947
2817 1 9 . 1 1 6 6 GLY CA C 6 46.300 46.300 44.725 1.575 19947
2818 1 9 . 1 1 6 6 GLY H H 6 8.490 8.490 8.395 0.095 19947
2819 1 9 . 1 1 7 7 ASN N N 7 120.100 120.100 117.805 2.295 19947
2820 1 9 . 1 1 7 7 ASN HA H 7 4.730 4.730 4.329 0.401 19947
2821 1 9 . 1 1 7 7 ASN CA C 7 53.200 53.200 53.989 -0.789 19947
2822 1 9 . 1 1 7 7 ASN CB C 7 38.700 38.700 39.165 -0.465 19947
2823 1 9 . 1 1 7 7 ASN H H 7 8.320 8.320 8.239 0.081 19947
2824 1 9 . 1 1 8 8 LYS N N 8 121.300 121.300 124.817 -3.517 19947
2825 1 9 . 1 1 8 8 LYS HA H 8 4.340 4.340 4.186 0.154 19947
2826 1 9 . 1 1 8 8 LYS CA C 8 56.600 56.600 56.882 -0.282 19947
2827 1 9 . 1 1 8 8 LYS CB C 8 32.900 32.900 31.890 1.010 19947
2828 1 9 . 1 1 8 8 LYS H H 8 8.260 8.260 8.435 -0.175 19947
2829 1 9 . 1 1 9 9 ILE N N 9 136.600 136.600 123.437 13.163 19947
2830 1 9 . 1 1 9 9 ILE HA H 9 4.140 4.140 3.907 0.233 19947
2831 1 9 . 1 1 9 9 ILE CA C 9 61.300 61.300 62.194 -0.894 19947
2832 1 9 . 1 1 9 9 ILE CB C 9 38.200 38.200 37.789 0.411 19947
2833 1 9 . 1 1 9 9 ILE H H 9 8.150 8.150 8.024 0.126 19947
2834 1 9 . 1 1 10 10 LEU N N 10 125.700 125.700 121.751 3.949 19947
2835 1 9 . 1 1 10 10 LEU HA H 10 4.420 4.420 4.450 -0.030 19947
2836 1 9 . 1 1 10 10 LEU CA C 10 55.200 55.200 55.664 -0.464 19947
2837 1 9 . 1 1 10 10 LEU CB C 10 42.300 42.300 40.523 1.777 19947
2838 1 9 . 1 1 10 10 LEU H H 10 8.230 8.230 8.353 -0.123 19947
2839 1 9 . 1 1 11 11 GLU N N 11 120.600 120.600 114.280 6.320 19947
2840 1 9 . 1 1 11 11 GLU HA H 11 4.470 4.470 4.125 0.345 19947
2841 1 9 . 1 1 11 11 GLU CA C 11 55.500 55.500 56.438 -0.938 19947
2842 1 9 . 1 1 11 11 GLU CB C 11 28.900 28.900 28.416 0.484 19947
2843 1 9 . 1 1 11 11 GLU H H 11 8.250 8.250 7.930 0.320 19947
2844 1 9 . 1 1 12 12 GLN N N 12 121.600 121.600 119.840 1.760 19947
2845 1 9 . 1 1 12 12 GLN HA H 12 4.350 4.350 4.463 -0.113 19947
2846 1 9 . 1 1 12 12 GLN CA C 12 56.600 56.600 56.136 0.464 19947
2847 1 9 . 1 1 12 12 GLN CB C 12 29.200 29.200 29.371 -0.171 19947
2848 1 9 . 1 1 12 12 GLN H H 12 8.460 8.460 7.776 0.684 19947
2849 1 9 . 1 1 13 13 GLY N N 13 110.700 110.700 106.974 3.726 19947
2850 1 9 . 1 1 13 13 GLY CA C 13 45.700 45.700 45.485 0.215 19947
2851 1 9 . 1 1 13 13 GLY H H 13 8.660 8.660 8.383 0.277 19947
2852 1 9 . 1 1 14 14 GLU N N 14 118.900 118.900 113.646 5.254 19947
2853 1 9 . 1 1 14 14 GLU HA H 14 4.530 4.530 4.146 0.384 19947
2854 1 9 . 1 1 14 14 GLU CA C 14 55.600 55.600 56.723 -1.123 19947
2855 1 9 . 1 1 14 14 GLU CB C 14 29.700 29.700 29.726 -0.026 19947
2856 1 9 . 1 1 14 14 GLU H H 14 8.230 8.230 8.225 0.005 19947
2857 1 9 . 1 1 15 15 ASP N N 15 118.400 118.400 119.503 -1.103 19947
2858 1 9 . 1 1 15 15 ASP HA H 15 4.990 4.990 4.456 0.534 19947
2859 1 9 . 1 1 15 15 ASP CA C 15 53.500 53.500 57.595 -4.095 19947
2860 1 9 . 1 1 15 15 ASP CB C 15 39.700 39.700 41.354 -1.654 19947
2861 1 9 . 1 1 15 15 ASP H H 15 8.330 8.330 8.597 -0.267 19947
2862 1 9 . 1 1 16 16 CYS HA H 16 4.340 4.340 4.561 -0.221 19947
2863 1 9 . 1 1 16 16 CYS H H 16 8.510 8.510 7.953 0.557 19947
2864 1 9 . 1 1 17 17 ASP N N 17 116.700 116.700 124.217 -7.517 19947
2865 1 9 . 1 1 17 17 ASP HA H 17 4.740 4.740 4.444 0.296 19947
2866 1 9 . 1 1 17 17 ASP CA C 17 53.100 53.100 55.412 -2.312 19947
2867 1 9 . 1 1 17 17 ASP CB C 17 38.600 38.600 39.064 -0.464 19947
2868 1 9 . 1 1 17 17 ASP H H 17 8.180 8.180 8.810 -0.630 19947
2869 1 9 . 1 1 18 18 CYS HA H 18 4.730 4.730 4.022 0.708 19947
2870 1 9 . 1 1 18 18 CYS CB C 18 41.900 41.900 26.647 15.253 19947
2871 1 9 . 1 1 19 19 GLY H H 19 8.220 8.220 8.482 -0.262 19947
2872 1 9 . 1 1 20 20 SER HA H 20 4.920 4.920 4.422 0.498 19947
2873 1 9 . 1 1 20 20 SER CA C 20 55.700 55.700 57.514 -1.814 19947
2874 1 9 . 1 1 20 20 SER CB C 20 63.500 63.500 63.215 0.285 19947
2875 1 9 . 1 1 20 20 SER H H 20 7.830 7.830 8.156 -0.326 19947
2876 1 9 . 1 1 21 21 PRO HA H 21 4.240 4.240 4.124 0.116 19947
2877 1 9 . 1 1 21 21 PRO CA C 21 63.400 63.400 65.333 -1.933 19947
2878 1 9 . 1 1 21 21 PRO CB C 21 31.800 31.800 31.325 0.475 19947
2879 1 9 . 1 1 22 22 ALA N N 22 119.900 119.900 118.107 1.793 19947
2880 1 9 . 1 1 22 22 ALA HA H 22 4.220 4.220 4.004 0.216 19947
2881 1 9 . 1 1 22 22 ALA CA C 22 54.200 54.200 54.196 0.004 19947
2882 1 9 . 1 1 22 22 ALA CB C 22 18.500 18.500 18.551 -0.051 19947
2883 1 9 . 1 1 22 22 ALA H H 22 8.180 8.180 8.594 -0.414 19947
2884 1 9 . 1 1 23 23 ASN N N 23 116.300 116.300 111.046 5.254 19947
2885 1 9 . 1 1 23 23 ASN HA H 23 4.670 4.670 4.946 -0.276 19947
2886 1 9 . 1 1 23 23 ASN CA C 23 53.200 53.200 51.718 1.482 19947
2887 1 9 . 1 1 23 23 ASN CB C 23 39.300 39.300 39.583 -0.283 19947
2888 1 9 . 1 1 23 23 ASN H H 23 7.960 7.960 8.259 -0.299 19947
2889 1 9 . 1 1 24 24 CYS HA H 24 4.720 4.720 4.546 0.174 19947
2890 1 9 . 1 1 24 24 CYS H H 24 8.510 8.510 7.979 0.531 19947
2891 1 9 . 1 1 25 25 GLN HA H 25 4.460 4.460 4.074 0.386 19947
2892 1 9 . 1 1 25 25 GLN H H 25 8.320 8.320 8.813 -0.493 19947
2893 1 9 . 1 1 26 26 ASP HA H 26 4.740 4.740 4.688 0.052 19947
2894 1 9 . 1 1 26 26 ASP H H 26 8.580 8.580 7.588 0.992 19947
2895 1 9 . 1 1 27 27 ARG HA H 27 4.680 4.680 3.942 0.738 19947
2896 1 9 . 1 1 27 27 ARG CA C 27 54.700 54.700 57.396 -2.696 19947
2897 1 9 . 1 1 27 27 ARG H H 27 8.550 8.550 8.860 -0.310 19947
2898 1 9 . 1 1 28 28 CYS HA H 28 4.120 4.120 4.146 -0.026 19947
2899 1 9 . 1 1 28 28 CYS CA C 28 54.400 54.400 59.661 -5.261 19947
2900 1 9 . 1 1 28 28 CYS CB C 28 19.000 19.000 24.226 -5.226 19947
2901 1 9 . 1 1 28 28 CYS H H 28 8.910 8.910 8.591 0.319 19947
2902 1 9 . 1 1 29 29 CYS N N 29 113.300 113.300 116.663 -3.363 19947
2903 1 9 . 1 1 29 29 CYS HA H 29 5.010 5.010 4.510 0.500 19947
2904 1 9 . 1 1 29 29 CYS CA C 29 54.300 54.300 58.184 -3.884 19947
2905 1 9 . 1 1 29 29 CYS H H 29 7.730 7.730 7.676 0.054 19947
2906 1 9 . 1 1 30 30 ASN HA H 30 4.730 4.730 5.163 -0.433 19947
2907 1 9 . 1 1 30 30 ASN CB C 30 38.700 38.700 41.212 -2.512 19947
2908 1 9 . 1 1 30 30 ASN H H 30 8.870 8.870 8.445 0.425 19947
2909 1 9 . 1 1 31 31 ALA N N 31 129.400 129.400 127.319 2.081 19947
2910 1 9 . 1 1 31 31 ALA HA H 31 4.120 4.120 4.243 -0.123 19947
2911 1 9 . 1 1 31 31 ALA CA C 31 54.400 54.400 53.865 0.535 19947
2912 1 9 . 1 1 31 31 ALA CB C 31 19.000 19.000 18.758 0.242 19947
2913 1 9 . 1 1 31 31 ALA H H 31 8.890 8.890 9.107 -0.217 19947
2914 1 9 . 1 1 32 32 ALA N N 32 116.400 116.400 120.808 -4.408 19947
2915 1 9 . 1 1 32 32 ALA HA H 32 4.340 4.340 4.363 -0.023 19947
2916 1 9 . 1 1 32 32 ALA CA C 32 53.800 53.800 54.007 -0.207 19947
2917 1 9 . 1 1 32 32 ALA CB C 32 19.100 19.100 19.465 -0.365 19947
2918 1 9 . 1 1 32 32 ALA H H 32 8.250 8.250 7.678 0.572 19947
2919 1 9 . 1 1 33 33 THR N N 33 104.300 104.300 110.294 -5.994 19947
2920 1 9 . 1 1 33 33 THR HA H 33 4.430 4.430 4.280 0.150 19947
2921 1 9 . 1 1 33 33 THR CA C 33 60.500 60.500 61.614 -1.114 19947
2922 1 9 . 1 1 33 33 THR CB C 33 70.600 70.600 69.499 1.101 19947
2923 1 9 . 1 1 33 33 THR H H 33 7.320 7.320 7.848 -0.528 19947
2924 1 9 . 1 1 34 34 CYS N N 34 123.400 123.400 120.272 3.128 19947
2925 1 9 . 1 1 34 34 CYS HA H 34 4.170 4.170 4.296 -0.126 19947
2926 1 9 . 1 1 34 34 CYS CA C 34 56.500 56.500 60.116 -3.616 19947
2927 1 9 . 1 1 34 34 CYS H H 34 8.710 8.710 8.179 0.531 19947
2928 1 9 . 1 1 35 35 LYS N N 35 116.900 116.900 117.015 -0.115 19947
2929 1 9 . 1 1 35 35 LYS HA H 35 4.960 4.960 4.769 0.191 19947
2930 1 9 . 1 1 35 35 LYS CA C 35 53.900 53.900 55.313 -1.413 19947
2931 1 9 . 1 1 35 35 LYS CB C 35 35.900 35.900 36.374 -0.474 19947
2932 1 9 . 1 1 35 35 LYS H H 35 7.450 7.450 7.673 -0.223 19947
2933 1 9 . 1 1 36 36 LEU N N 36 119.300 119.300 119.390 -0.090 19947
2934 1 9 . 1 1 36 36 LEU HA H 36 4.800 4.800 4.267 0.533 19947
2935 1 9 . 1 1 36 36 LEU CB C 36 42.400 42.400 41.782 0.618 19947
2936 1 9 . 1 1 36 36 LEU H H 36 8.290 8.290 8.212 0.078 19947
2937 1 9 . 1 1 37 37 THR HA H 37 4.340 4.340 4.672 -0.332 19947
2938 1 9 . 1 1 37 37 THR CA C 37 60.200 60.200 58.813 1.387 19947
2939 1 9 . 1 1 37 37 THR CB C 37 67.700 67.700 68.756 -1.056 19947
2940 1 9 . 1 1 37 37 THR H H 37 8.380 8.380 7.985 0.395 19947
2941 1 9 . 1 1 38 38 PRO HA H 38 4.380 4.380 4.090 0.290 19947
2942 1 9 . 1 1 38 38 PRO CA C 38 64.800 64.800 64.243 0.557 19947
2943 1 9 . 1 1 38 38 PRO CB C 38 31.500 31.500 31.738 -0.238 19947
2944 1 9 . 1 1 39 39 GLY N N 39 113.300 113.300 110.926 2.374 19947
2945 1 9 . 1 1 39 39 GLY CA C 39 45.100 45.100 45.145 -0.045 19947
2946 1 9 . 1 1 39 39 GLY H H 39 8.830 8.830 8.447 0.383 19947
2947 1 9 . 1 1 40 40 SER N N 40 116.700 116.700 117.046 -0.346 19947
2948 1 9 . 1 1 40 40 SER HA H 40 4.610 4.610 4.803 -0.193 19947
2949 1 9 . 1 1 40 40 SER CA C 40 58.800 58.800 57.568 1.232 19947
2950 1 9 . 1 1 40 40 SER CB C 40 63.800 63.800 63.419 0.381 19947
2951 1 9 . 1 1 40 40 SER H H 40 8.280 8.280 7.698 0.582 19947
2952 1 9 . 1 1 41 41 GLN N N 41 120.600 120.600 125.635 -5.035 19947
2953 1 9 . 1 1 41 41 GLN HA H 41 4.110 4.110 4.076 0.034 19947
2954 1 9 . 1 1 41 41 GLN CA C 41 55.200 55.200 57.408 -2.208 19947
2955 1 9 . 1 1 41 41 GLN CB C 41 31.100 31.100 28.926 2.174 19947
2956 1 9 . 1 1 41 41 GLN H H 41 9.190 9.190 7.962 1.228 19947
2957 1 9 . 1 1 42 42 CYS N N 42 113.200 113.200 116.714 -3.514 19947
2958 1 9 . 1 1 42 42 CYS HA H 42 4.630 4.630 4.493 0.137 19947
2959 1 9 . 1 1 42 42 CYS CA C 42 53.700 53.700 57.296 -3.596 19947
2960 1 9 . 1 1 42 42 CYS CB C 42 45.500 45.500 30.074 15.426 19947
2961 1 9 . 1 1 42 42 CYS H H 42 7.710 7.710 7.879 -0.169 19947
2962 1 9 . 1 1 43 43 ASN N N 43 114.200 114.200 123.285 -9.085 19947
2963 1 9 . 1 1 43 43 ASN HA H 43 4.940 4.940 4.659 0.281 19947
2964 1 9 . 1 1 43 43 ASN CA C 43 53.000 53.000 54.518 -1.518 19947
2965 1 9 . 1 1 43 43 ASN CB C 43 39.300 39.300 39.209 0.091 19947
2966 1 9 . 1 1 43 43 ASN H H 43 8.870 8.870 8.711 0.159 19947
2967 1 9 . 1 1 44 44 TYR N N 44 118.400 118.400 114.561 3.839 19947
2968 1 9 . 1 1 44 44 TYR HA H 44 4.850 4.850 4.613 0.237 19947
2969 1 9 . 1 1 44 44 TYR CA C 44 55.300 55.300 57.812 -2.512 19947
2970 1 9 . 1 1 44 44 TYR CB C 44 40.700 40.700 39.733 0.966 19947
2971 1 9 . 1 1 44 44 TYR H H 44 7.840 7.840 7.292 0.548 19947
2972 1 9 . 1 1 45 45 GLY N N 45 110.600 110.600 108.279 2.321 19947
2973 1 9 . 1 1 45 45 GLY CA C 45 44.000 44.000 44.945 -0.945 19947
2974 1 9 . 1 1 45 45 GLY H H 45 7.960 7.960 8.202 -0.242 19947
2975 1 9 . 1 1 46 46 GLU N N 46 120.700 120.700 120.280 0.420 19947
2976 1 9 . 1 1 46 46 GLU HA H 46 4.280 4.280 4.073 0.207 19947
2977 1 9 . 1 1 46 46 GLU CA C 46 58.500 58.500 60.257 -1.756 19947
2978 1 9 . 1 1 46 46 GLU CB C 46 29.300 29.300 30.180 -0.880 19947
2979 1 9 . 1 1 46 46 GLU H H 46 9.160 9.160 8.681 0.479 19947
2980 1 9 . 1 1 47 47 CYS N N 47 112.400 112.400 117.266 -4.866 19947
2981 1 9 . 1 1 47 47 CYS HA H 47 4.850 4.850 4.777 0.073 19947
2982 1 9 . 1 1 47 47 CYS CA C 47 57.100 57.100 58.263 -1.163 19947
2983 1 9 . 1 1 47 47 CYS CB C 47 41.200 41.200 25.673 15.527 19947
2984 1 9 . 1 1 47 47 CYS H H 47 8.510 8.510 7.536 0.974 19947
2985 1 9 . 1 1 48 48 CYS N N 48 123.200 123.200 119.436 3.764 19947
2986 1 9 . 1 1 48 48 CYS HA H 48 5.160 5.160 5.145 0.015 19947
2987 1 9 . 1 1 48 48 CYS CA C 48 54.700 54.700 57.891 -3.191 19947
2988 1 9 . 1 1 48 48 CYS CB C 48 45.700 45.700 30.143 15.557 19947
2989 1 9 . 1 1 48 48 CYS H H 48 7.810 7.810 7.751 0.059 19947
2990 1 9 . 1 1 49 49 ASP N N 49 127.400 127.400 123.370 4.030 19947
2991 1 9 . 1 1 49 49 ASP HA H 49 4.890 4.890 4.965 -0.075 19947
2992 1 9 . 1 1 49 49 ASP CA C 49 53.500 53.500 54.126 -0.625 19947
2993 1 9 . 1 1 49 49 ASP CB C 49 42.400 42.400 44.686 -2.286 19947
2994 1 9 . 1 1 49 49 ASP H H 49 9.670 9.670 8.262 1.408 19947
2995 1 9 . 1 1 50 50 GLN N N 50 127.000 127.000 123.957 3.043 19947
2996 1 9 . 1 1 50 50 GLN HA H 50 3.940 3.940 3.879 0.061 19947
2997 1 9 . 1 1 50 50 GLN CA C 50 56.800 56.800 58.542 -1.742 19947
2998 1 9 . 1 1 50 50 GLN CB C 50 26.500 26.500 28.077 -1.577 19947
2999 1 9 . 1 1 50 50 GLN H H 50 9.450 9.450 9.023 0.427 19947
3000 1 9 . 1 1 51 51 CYS N N 51 106.100 106.100 113.194 -7.094 19947
3001 1 9 . 1 1 51 51 CYS HA H 51 4.760 4.760 5.127 -0.367 19947
3002 1 9 . 1 1 51 51 CYS CB C 51 43.200 43.200 27.495 15.705 19947
3003 1 9 . 1 1 51 51 CYS H H 51 8.700 8.700 8.324 0.376 19947
3004 1 9 . 1 1 52 52 ARG N N 52 121.000 121.000 119.451 1.549 19947
3005 1 9 . 1 1 52 52 ARG HA H 52 4.690 4.690 4.506 0.184 19947
3006 1 9 . 1 1 52 52 ARG CA C 52 55.400 55.400 55.333 0.067 19947
3007 1 9 . 1 1 52 52 ARG CB C 52 33.100 33.100 34.568 -1.468 19947
3008 1 9 . 1 1 52 52 ARG H H 52 7.960 7.960 7.629 0.331 19947
3009 1 9 . 1 1 53 53 PHE N N 53 120.300 120.300 122.086 -1.786 19947
3010 1 9 . 1 1 53 53 PHE HA H 53 5.050 5.050 5.039 0.011 19947
3011 1 9 . 1 1 53 53 PHE CA C 53 56.100 56.100 57.063 -0.963 19947
3012 1 9 . 1 1 53 53 PHE CB C 53 38.200 38.200 38.999 -0.799 19947
3013 1 9 . 1 1 53 53 PHE H H 53 8.400 8.400 8.342 0.058 19947
3014 1 9 . 1 1 54 54 LYS N N 54 123.300 123.300 126.076 -2.776 19947
3015 1 9 . 1 1 54 54 LYS HA H 54 4.250 4.250 4.117 0.133 19947
3016 1 9 . 1 1 54 54 LYS CA C 54 57.500 57.500 56.640 0.860 19947
3017 1 9 . 1 1 54 54 LYS CB C 54 34.300 34.300 32.247 2.053 19947
3018 1 9 . 1 1 54 54 LYS H H 54 8.540 8.540 8.178 0.362 19947
3019 1 9 . 1 1 55 55 LYS N N 55 119.400 119.400 124.911 -5.511 19947
3020 1 9 . 1 1 55 55 LYS HA H 55 4.110 4.110 4.002 0.108 19947
3021 1 9 . 1 1 55 55 LYS CA C 55 56.500 56.500 56.946 -0.446 19947
3022 1 9 . 1 1 55 55 LYS CB C 55 33.400 33.400 33.227 0.173 19947
3023 1 9 . 1 1 55 55 LYS H H 55 8.440 8.440 8.177 0.263 19947
3024 1 9 . 1 1 56 56 ALA N N 56 126.700 126.700 127.100 -0.400 19947
3025 1 9 . 1 1 56 56 ALA HA H 56 3.920 3.920 4.079 -0.159 19947
3026 1 9 . 1 1 56 56 ALA CA C 56 52.900 52.900 53.723 -0.823 19947
3027 1 9 . 1 1 56 56 ALA CB C 56 18.100 18.100 18.074 0.026 19947
3028 1 9 . 1 1 56 56 ALA H H 56 8.930 8.930 8.599 0.331 19947
3029 1 9 . 1 1 57 57 GLY N N 57 109.300 109.300 111.367 -2.067 19947
3030 1 9 . 1 1 57 57 GLY CA C 57 45.100 45.100 44.849 0.251 19947
3031 1 9 . 1 1 57 57 GLY H H 57 8.460 8.460 8.440 0.020 19947
3032 1 9 . 1 1 58 58 THR N N 58 117.200 117.200 119.910 -2.710 19947
3033 1 9 . 1 1 58 58 THR HA H 58 4.260 4.260 4.400 -0.140 19947
3034 1 9 . 1 1 58 58 THR CA C 58 63.300 63.300 63.429 -0.129 19947
3035 1 9 . 1 1 58 58 THR CB C 58 69.600 69.600 68.941 0.659 19947
3036 1 9 . 1 1 58 58 THR H H 58 7.660 7.660 7.805 -0.145 19947
3037 1 9 . 1 1 59 59 VAL N N 59 130.400 130.400 128.072 2.328 19947
3038 1 9 . 1 1 59 59 VAL HA H 59 3.900 3.900 3.678 0.222 19947
3039 1 9 . 1 1 59 59 VAL CA C 59 64.400 64.400 63.014 1.386 19947
3040 1 9 . 1 1 59 59 VAL CB C 59 31.900 31.900 31.865 0.035 19947
3041 1 9 . 1 1 59 59 VAL H H 59 9.190 9.190 8.786 0.404 19947
3042 1 9 . 1 1 60 60 CYS N N 60 121.800 121.800 126.643 -4.843 19947
3043 1 9 . 1 1 60 60 CYS HA H 60 5.050 5.050 4.603 0.447 19947
3044 1 9 . 1 1 60 60 CYS CA C 60 54.400 54.400 58.063 -3.663 19947
3045 1 9 . 1 1 60 60 CYS CB C 60 43.000 43.000 27.374 15.626 19947
3046 1 9 . 1 1 60 60 CYS H H 60 9.130 9.130 8.282 0.848 19947
3047 1 9 . 1 1 61 61 ARG N N 61 124.100 124.100 117.179 6.921 19947
3048 1 9 . 1 1 61 61 ARG HA H 61 4.360 4.360 4.685 -0.325 19947
3049 1 9 . 1 1 61 61 ARG CA C 61 56.800 56.800 55.038 1.762 19947
3050 1 9 . 1 1 61 61 ARG CB C 61 32.800 32.800 33.823 -1.023 19947
3051 1 9 . 1 1 61 61 ARG H H 61 7.580 7.580 7.426 0.154 19947
3052 1 9 . 1 1 62 62 ILE N N 62 126.200 126.200 116.968 9.232 19947
3053 1 9 . 1 1 62 62 ILE HA H 62 4.090 4.090 4.531 -0.441 19947
3054 1 9 . 1 1 62 62 ILE CA C 62 60.300 60.300 60.786 -0.486 19947
3055 1 9 . 1 1 62 62 ILE CB C 62 38.700 38.700 41.091 -2.391 19947
3056 1 9 . 1 1 62 62 ILE H H 62 8.490 8.490 8.438 0.052 19947
3057 1 9 . 1 1 63 63 ALA N N 63 129.400 129.400 132.351 -2.951 19947
3058 1 9 . 1 1 63 63 ALA HA H 63 4.310 4.310 4.339 -0.029 19947
3059 1 9 . 1 1 63 63 ALA CA C 63 51.900 51.900 54.174 -2.274 19947
3060 1 9 . 1 1 63 63 ALA CB C 63 20.600 20.600 19.631 0.969 19947
3061 1 9 . 1 1 63 63 ALA H H 63 8.100 8.100 8.678 -0.578 19947
3062 1 9 . 1 1 64 64 ARG N N 64 120.500 120.500 121.231 -0.731 19947
3063 1 9 . 1 1 64 64 ARG HA H 64 4.290 4.290 4.527 -0.237 19947
3064 1 9 . 1 1 64 64 ARG CA C 64 56.200 56.200 55.972 0.228 19947
3065 1 9 . 1 1 64 64 ARG CB C 64 30.500 30.500 30.280 0.220 19947
3066 1 9 . 1 1 64 64 ARG H H 64 8.140 8.140 8.923 -0.783 19947
3067 1 9 . 1 1 65 65 GLY N N 65 110.500 110.500 112.591 -2.091 19947
3068 1 9 . 1 1 65 65 GLY CA C 65 45.100 45.100 44.627 0.473 19947
3069 1 9 . 1 1 65 65 GLY H H 65 8.040 8.040 8.420 -0.380 19947
3070 1 9 . 1 1 66 66 ASP N N 66 120.700 120.700 119.875 0.825 19947
3071 1 9 . 1 1 66 66 ASP HA H 66 4.610 4.610 4.565 0.045 19947
3072 1 9 . 1 1 66 66 ASP CA C 66 53.300 53.300 53.388 -0.088 19947
3073 1 9 . 1 1 66 66 ASP CB C 66 37.600 37.600 40.378 -2.778 19947
3074 1 9 . 1 1 66 66 ASP H H 66 8.380 8.380 7.137 1.243 19947
3075 1 9 . 1 1 67 67 TRP N N 67 120.100 120.100 123.603 -3.503 19947
3076 1 9 . 1 1 67 67 TRP HA H 67 4.760 4.760 4.965 -0.205 19947
3077 1 9 . 1 1 67 67 TRP CA C 67 57.200 57.200 57.969 -0.769 19947
3078 1 9 . 1 1 67 67 TRP CB C 67 29.100 29.100 29.527 -0.427 19947
3079 1 9 . 1 1 67 67 TRP H H 67 7.950 7.950 7.935 0.015 19947
3080 1 9 . 1 1 68 68 ASN N N 68 118.400 118.400 118.085 0.315 19947
3081 1 9 . 1 1 68 68 ASN HA H 68 4.790 4.790 4.938 -0.148 19947
3082 1 9 . 1 1 68 68 ASN CA C 68 52.800 52.800 53.844 -1.044 19947
3083 1 9 . 1 1 68 68 ASN CB C 68 39.300 39.300 40.105 -0.805 19947
3084 1 9 . 1 1 68 68 ASN H H 68 8.180 8.180 8.634 -0.454 19947
3085 1 9 . 1 1 69 69 ASP N N 69 118.500 118.500 118.625 -0.125 19947
3086 1 9 . 1 1 69 69 ASP HA H 69 4.620 4.620 4.422 0.198 19947
3087 1 9 . 1 1 69 69 ASP CA C 69 53.200 53.200 56.177 -2.977 19947
3088 1 9 . 1 1 69 69 ASP CB C 69 38.000 38.000 41.163 -3.163 19947
3089 1 9 . 1 1 69 69 ASP H H 69 8.130 8.130 8.525 -0.395 19947
3090 1 9 . 1 1 70 70 ASP N N 70 120.500 120.500 121.347 -0.847 19947
3091 1 9 . 1 1 70 70 ASP HA H 70 5.100 5.100 5.065 0.035 19947
3092 1 9 . 1 1 70 70 ASP CA C 70 52.500 52.500 53.561 -1.061 19947
3093 1 9 . 1 1 70 70 ASP CB C 70 42.600 42.600 42.041 0.559 19947
3094 1 9 . 1 1 70 70 ASP H H 70 8.140 8.140 8.162 -0.022 19947
3095 1 9 . 1 1 71 71 TYR N N 71 118.900 118.900 124.305 -5.405 19947
3096 1 9 . 1 1 71 71 TYR HA H 71 5.210 5.210 4.866 0.344 19947
3097 1 9 . 1 1 71 71 TYR CA C 71 56.300 56.300 57.151 -0.851 19947
3098 1 9 . 1 1 71 71 TYR CB C 71 42.200 42.200 42.758 -0.558 19947
3099 1 9 . 1 1 71 71 TYR H H 71 8.450 8.450 8.578 -0.128 19947
3100 1 9 . 1 1 72 72 CYS N N 72 119.800 119.800 121.103 -1.303 19947
3101 1 9 . 1 1 72 72 CYS HA H 72 4.900 4.900 4.516 0.384 19947
3102 1 9 . 1 1 72 72 CYS CA C 72 53.400 53.400 59.150 -5.750 19947
3103 1 9 . 1 1 72 72 CYS CB C 72 37.200 37.200 28.840 8.360 19947
3104 1 9 . 1 1 72 72 CYS H H 72 9.330 9.330 8.468 0.862 19947
3105 1 9 . 1 1 73 73 THR N N 73 112.700 112.700 114.058 -1.358 19947
3106 1 9 . 1 1 73 73 THR HA H 73 4.430 4.430 4.426 0.004 19947
3107 1 9 . 1 1 73 73 THR CA C 73 62.300 62.300 60.897 1.403 19947
3108 1 9 . 1 1 73 73 THR CB C 73 71.300 71.300 69.599 1.701 19947
3109 1 9 . 1 1 73 73 THR H H 73 9.980 9.980 8.728 1.252 19947
3110 1 9 . 1 1 74 74 GLY N N 74 111.500 111.500 110.171 1.329 19947
3111 1 9 . 1 1 74 74 GLY CA C 74 45.300 45.300 46.509 -1.209 19947
3112 1 9 . 1 1 74 74 GLY H H 74 8.580 8.580 7.735 0.845 19947
3113 1 9 . 1 1 75 75 LYS N N 75 115.900 115.900 116.629 -0.729 19947
3114 1 9 . 1 1 75 75 LYS HA H 75 4.140 4.140 4.468 -0.328 19947
3115 1 9 . 1 1 75 75 LYS CA C 75 54.800 54.800 55.470 -0.670 19947
3116 1 9 . 1 1 75 75 LYS CB C 75 34.200 34.200 34.277 -0.077 19947
3117 1 9 . 1 1 75 75 LYS H H 75 7.900 7.900 7.515 0.385 19947
3118 1 9 . 1 1 76 76 SER N N 76 111.000 111.000 112.851 -1.851 19947
3119 1 9 . 1 1 76 76 SER HA H 76 4.160 4.160 3.910 0.250 19947
3120 1 9 . 1 1 76 76 SER CA C 76 61.400 61.400 56.754 4.646 19947
3121 1 9 . 1 1 76 76 SER CB C 76 64.300 64.300 65.700 -1.399 19947
3122 1 9 . 1 1 76 76 SER H H 76 6.520 6.520 6.923 -0.403 19947
3123 1 9 . 1 1 77 77 SER N N 77 117.100 117.100 114.280 2.820 19947
3124 1 9 . 1 1 77 77 SER HA H 77 4.220 4.220 4.520 -0.300 19947
3125 1 9 . 1 1 77 77 SER CA C 77 59.800 59.800 59.409 0.391 19947
3126 1 9 . 1 1 77 77 SER CB C 77 64.400 64.400 63.877 0.523 19947
3127 1 9 . 1 1 77 77 SER H H 77 9.030 9.030 8.240 0.790 19947
3128 1 9 . 1 1 78 78 ASP N N 78 122.100 122.100 121.274 0.826 19947
3129 1 9 . 1 1 78 78 ASP HA H 78 4.930 4.930 4.804 0.126 19947
3130 1 9 . 1 1 78 78 ASP CA C 78 52.400 52.400 53.883 -1.483 19947
3131 1 9 . 1 1 78 78 ASP CB C 78 40.800 40.800 44.367 -3.567 19947
3132 1 9 . 1 1 78 78 ASP H H 78 8.340 8.340 7.586 0.754 19947
3133 1 9 . 1 1 79 79 CYS N N 79 122.200 122.200 122.405 -0.205 19947
3134 1 9 . 1 1 79 79 CYS HA H 79 5.320 5.320 4.800 0.520 19947
3135 1 9 . 1 1 79 79 CYS CA C 79 52.000 52.000 55.268 -3.268 19947
3136 1 9 . 1 1 79 79 CYS CB C 79 39.300 39.300 27.470 11.830 19947
3137 1 9 . 1 1 79 79 CYS H H 79 8.960 8.960 8.395 0.565 19947
3138 1 9 . 1 1 80 80 PRO HA H 80 4.410 4.410 4.100 0.310 19947
3139 1 9 . 1 1 80 80 PRO CA C 80 63.500 63.500 62.873 0.627 19947
3140 1 9 . 1 1 80 80 PRO CB C 80 32.400 32.400 32.877 -0.477 19947
3141 1 9 . 1 1 81 81 TRP N N 81 120.500 120.500 121.356 -0.856 19947
3142 1 9 . 1 1 81 81 TRP HA H 81 4.550 4.550 4.195 0.355 19947
3143 1 9 . 1 1 81 81 TRP CA C 81 56.400 56.400 57.894 -1.494 19947
3144 1 9 . 1 1 81 81 TRP CB C 81 29.500 29.500 28.188 1.312 19947
3145 1 9 . 1 1 81 81 TRP H H 81 8.400 8.400 7.546 0.854 19947
3146 1 9 . 1 1 82 82 ASN N N 82 120.400 120.400 112.926 7.474 19947
3147 1 9 . 1 1 82 82 ASN HA H 82 4.750 4.750 4.494 0.256 19947
3148 1 9 . 1 1 82 82 ASN CA C 82 53.100 53.100 54.102 -1.002 19947
3149 1 9 . 1 1 82 82 ASN CB C 82 39.000 39.000 37.018 1.982 19947
3150 1 9 . 1 1 82 82 ASN H H 82 8.040 8.040 8.242 -0.202 19947
3151 1 10 . 1 1 2 2 PRO HA H 2 4.820 4.820 4.851 -0.031 19947
3152 1 10 . 1 1 2 2 PRO CA C 2 61.900 61.900 61.781 0.119 19947
3153 1 10 . 1 1 2 2 PRO CB C 2 30.700 30.700 31.548 -0.848 19947
3154 1 10 . 1 1 3 3 PRO HA H 3 4.540 4.540 4.486 0.054 19947
3155 1 10 . 1 1 3 3 PRO CA C 3 62.900 62.900 62.385 0.515 19947
3156 1 10 . 1 1 3 3 PRO CB C 3 32.100 32.100 32.786 -0.686 19947
3157 1 10 . 1 1 4 4 VAL N N 4 121.900 121.900 122.625 -0.725 19947
3158 1 10 . 1 1 4 4 VAL HA H 4 4.200 4.200 3.876 0.324 19947
3159 1 10 . 1 1 4 4 VAL CA C 4 62.300 62.300 62.374 -0.074 19947
3160 1 10 . 1 1 4 4 VAL CB C 4 32.800 32.800 32.408 0.392 19947
3161 1 10 . 1 1 4 4 VAL H H 4 8.330 8.330 8.290 0.040 19947
3162 1 10 . 1 1 5 5 CYS N N 5 120.900 120.900 127.985 -7.085 19947
3163 1 10 . 1 1 5 5 CYS HA H 5 4.700 4.700 4.418 0.282 19947
3164 1 10 . 1 1 5 5 CYS CA C 5 53.600 53.600 59.453 -5.853 19947
3165 1 10 . 1 1 5 5 CYS H H 5 8.500 8.500 8.667 -0.167 19947
3166 1 10 . 1 1 6 6 GLY N N 6 110.200 110.200 112.558 -2.358 19947
3167 1 10 . 1 1 6 6 GLY CA C 6 46.300 46.300 44.681 1.619 19947
3168 1 10 . 1 1 6 6 GLY H H 6 8.490 8.490 8.292 0.198 19947
3169 1 10 . 1 1 7 7 ASN N N 7 120.100 120.100 117.180 2.920 19947
3170 1 10 . 1 1 7 7 ASN HA H 7 4.730 4.730 4.293 0.437 19947
3171 1 10 . 1 1 7 7 ASN CA C 7 53.200 53.200 54.159 -0.959 19947
3172 1 10 . 1 1 7 7 ASN CB C 7 38.700 38.700 39.096 -0.396 19947
3173 1 10 . 1 1 7 7 ASN H H 7 8.320 8.320 8.437 -0.117 19947
3174 1 10 . 1 1 8 8 LYS N N 8 121.300 121.300 121.751 -0.451 19947
3175 1 10 . 1 1 8 8 LYS HA H 8 4.340 4.340 4.109 0.231 19947
3176 1 10 . 1 1 8 8 LYS CA C 8 56.600 56.600 56.571 0.029 19947
3177 1 10 . 1 1 8 8 LYS CB C 8 32.900 32.900 31.605 1.295 19947
3178 1 10 . 1 1 8 8 LYS H H 8 8.260 8.260 8.338 -0.078 19947
3179 1 10 . 1 1 9 9 ILE N N 9 136.600 136.600 120.294 16.306 19947
3180 1 10 . 1 1 9 9 ILE HA H 9 4.140 4.140 3.906 0.234 19947
3181 1 10 . 1 1 9 9 ILE CA C 9 61.300 61.300 61.977 -0.677 19947
3182 1 10 . 1 1 9 9 ILE CB C 9 38.200 38.200 37.838 0.362 19947
3183 1 10 . 1 1 9 9 ILE H H 9 8.150 8.150 8.418 -0.268 19947
3184 1 10 . 1 1 10 10 LEU N N 10 125.700 125.700 123.797 1.903 19947
3185 1 10 . 1 1 10 10 LEU HA H 10 4.420 4.420 4.539 -0.119 19947
3186 1 10 . 1 1 10 10 LEU CA C 10 55.200 55.200 54.915 0.285 19947
3187 1 10 . 1 1 10 10 LEU CB C 10 42.300 42.300 41.399 0.901 19947
3188 1 10 . 1 1 10 10 LEU H H 10 8.230 8.230 8.715 -0.485 19947
3189 1 10 . 1 1 11 11 GLU N N 11 120.600 120.600 114.582 6.018 19947
3190 1 10 . 1 1 11 11 GLU HA H 11 4.470 4.470 4.217 0.253 19947
3191 1 10 . 1 1 11 11 GLU CA C 11 55.500 55.500 56.864 -1.363 19947
3192 1 10 . 1 1 11 11 GLU CB C 11 28.900 28.900 28.765 0.135 19947
3193 1 10 . 1 1 11 11 GLU H H 11 8.250 8.250 7.994 0.256 19947
3194 1 10 . 1 1 12 12 GLN N N 12 121.600 121.600 117.106 4.494 19947
3195 1 10 . 1 1 12 12 GLN HA H 12 4.350 4.350 4.687 -0.337 19947
3196 1 10 . 1 1 12 12 GLN CA C 12 56.600 56.600 54.725 1.875 19947
3197 1 10 . 1 1 12 12 GLN CB C 12 29.200 29.200 28.313 0.887 19947
3198 1 10 . 1 1 12 12 GLN H H 12 8.460 8.460 7.889 0.571 19947
3199 1 10 . 1 1 13 13 GLY N N 13 110.700 110.700 110.581 0.119 19947
3200 1 10 . 1 1 13 13 GLY CA C 13 45.700 45.700 47.101 -1.401 19947
3201 1 10 . 1 1 13 13 GLY H H 13 8.660 8.660 8.893 -0.233 19947
3202 1 10 . 1 1 14 14 GLU N N 14 118.900 118.900 117.329 1.571 19947
3203 1 10 . 1 1 14 14 GLU HA H 14 4.530 4.530 4.430 0.100 19947
3204 1 10 . 1 1 14 14 GLU CA C 14 55.600 55.600 57.050 -1.450 19947
3205 1 10 . 1 1 14 14 GLU CB C 14 29.700 29.700 30.712 -1.012 19947
3206 1 10 . 1 1 14 14 GLU H H 14 8.230 8.230 8.403 -0.173 19947
3207 1 10 . 1 1 15 15 ASP N N 15 118.400 118.400 119.423 -1.023 19947
3208 1 10 . 1 1 15 15 ASP HA H 15 4.990 4.990 4.488 0.502 19947
3209 1 10 . 1 1 15 15 ASP CA C 15 53.500 53.500 56.145 -2.646 19947
3210 1 10 . 1 1 15 15 ASP CB C 15 39.700 39.700 41.131 -1.431 19947
3211 1 10 . 1 1 15 15 ASP H H 15 8.330 8.330 8.273 0.057 19947
3212 1 10 . 1 1 16 16 CYS HA H 16 4.340 4.340 4.496 -0.156 19947
3213 1 10 . 1 1 16 16 CYS H H 16 8.510 8.510 7.697 0.813 19947
3214 1 10 . 1 1 17 17 ASP N N 17 116.700 116.700 123.964 -7.264 19947
3215 1 10 . 1 1 17 17 ASP HA H 17 4.740 4.740 4.470 0.270 19947
3216 1 10 . 1 1 17 17 ASP CA C 17 53.100 53.100 55.045 -1.945 19947
3217 1 10 . 1 1 17 17 ASP CB C 17 38.600 38.600 39.192 -0.592 19947
3218 1 10 . 1 1 17 17 ASP H H 17 8.180 8.180 8.509 -0.329 19947
3219 1 10 . 1 1 18 18 CYS HA H 18 4.730 4.730 4.287 0.443 19947
3220 1 10 . 1 1 18 18 CYS CB C 18 41.900 41.900 27.471 14.429 19947
3221 1 10 . 1 1 19 19 GLY H H 19 8.220 8.220 8.515 -0.295 19947
3222 1 10 . 1 1 20 20 SER HA H 20 4.920 4.920 4.802 0.118 19947
3223 1 10 . 1 1 20 20 SER CA C 20 55.700 55.700 55.582 0.118 19947
3224 1 10 . 1 1 20 20 SER CB C 20 63.500 63.500 62.713 0.787 19947
3225 1 10 . 1 1 20 20 SER H H 20 7.830 7.830 7.925 -0.095 19947
3226 1 10 . 1 1 21 21 PRO HA H 21 4.240 4.240 4.147 0.093 19947
3227 1 10 . 1 1 21 21 PRO CA C 21 63.400 63.400 65.403 -2.003 19947
3228 1 10 . 1 1 21 21 PRO CB C 21 31.800 31.800 31.524 0.276 19947
3229 1 10 . 1 1 22 22 ALA N N 22 119.900 119.900 120.132 -0.232 19947
3230 1 10 . 1 1 22 22 ALA HA H 22 4.220 4.220 4.117 0.103 19947
3231 1 10 . 1 1 22 22 ALA CA C 22 54.200 54.200 54.204 -0.004 19947
3232 1 10 . 1 1 22 22 ALA CB C 22 18.500 18.500 18.439 0.061 19947
3233 1 10 . 1 1 22 22 ALA H H 22 8.180 8.180 8.408 -0.228 19947
3234 1 10 . 1 1 23 23 ASN N N 23 116.300 116.300 113.336 2.964 19947
3235 1 10 . 1 1 23 23 ASN HA H 23 4.670 4.670 4.971 -0.301 19947
3236 1 10 . 1 1 23 23 ASN CA C 23 53.200 53.200 52.360 0.840 19947
3237 1 10 . 1 1 23 23 ASN CB C 23 39.300 39.300 38.529 0.771 19947
3238 1 10 . 1 1 23 23 ASN H H 23 7.960 7.960 8.146 -0.186 19947
3239 1 10 . 1 1 24 24 CYS HA H 24 4.720 4.720 4.094 0.626 19947
3240 1 10 . 1 1 24 24 CYS H H 24 8.510 8.510 7.980 0.530 19947
3241 1 10 . 1 1 25 25 GLN HA H 25 4.460 4.460 4.450 0.010 19947
3242 1 10 . 1 1 25 25 GLN H H 25 8.320 8.320 7.865 0.455 19947
3243 1 10 . 1 1 26 26 ASP HA H 26 4.740 4.740 4.438 0.302 19947
3244 1 10 . 1 1 26 26 ASP H H 26 8.580 8.580 7.992 0.588 19947
3245 1 10 . 1 1 27 27 ARG HA H 27 4.680 4.680 4.469 0.211 19947
3246 1 10 . 1 1 27 27 ARG CA C 27 54.700 54.700 55.755 -1.055 19947
3247 1 10 . 1 1 27 27 ARG H H 27 8.550 8.550 7.780 0.770 19947
3248 1 10 . 1 1 28 28 CYS HA H 28 4.120 4.120 4.026 0.094 19947
3249 1 10 . 1 1 28 28 CYS CA C 28 54.400 54.400 61.825 -7.425 19947
3250 1 10 . 1 1 28 28 CYS CB C 28 19.000 19.000 26.037 -7.037 19947
3251 1 10 . 1 1 28 28 CYS H H 28 8.910 8.910 8.720 0.190 19947
3252 1 10 . 1 1 29 29 CYS N N 29 113.300 113.300 120.535 -7.235 19947
3253 1 10 . 1 1 29 29 CYS HA H 29 5.010 5.010 4.722 0.288 19947
3254 1 10 . 1 1 29 29 CYS CA C 29 54.300 54.300 56.612 -2.312 19947
3255 1 10 . 1 1 29 29 CYS H H 29 7.730 7.730 8.378 -0.648 19947
3256 1 10 . 1 1 30 30 ASN HA H 30 4.730 4.730 4.923 -0.193 19947
3257 1 10 . 1 1 30 30 ASN CB C 30 38.700 38.700 40.028 -1.328 19947
3258 1 10 . 1 1 30 30 ASN H H 30 8.870 8.870 8.984 -0.114 19947
3259 1 10 . 1 1 31 31 ALA N N 31 129.400 129.400 126.682 2.718 19947
3260 1 10 . 1 1 31 31 ALA HA H 31 4.120 4.120 4.462 -0.342 19947
3261 1 10 . 1 1 31 31 ALA CA C 31 54.400 54.400 54.038 0.362 19947
3262 1 10 . 1 1 31 31 ALA CB C 31 19.000 19.000 19.336 -0.336 19947
3263 1 10 . 1 1 31 31 ALA H H 31 8.890 8.890 8.690 0.200 19947
3264 1 10 . 1 1 32 32 ALA N N 32 116.400 116.400 117.903 -1.503 19947
3265 1 10 . 1 1 32 32 ALA HA H 32 4.340 4.340 4.397 -0.057 19947
3266 1 10 . 1 1 32 32 ALA CA C 32 53.800 53.800 53.433 0.367 19947
3267 1 10 . 1 1 32 32 ALA CB C 32 19.100 19.100 19.385 -0.285 19947
3268 1 10 . 1 1 32 32 ALA H H 32 8.250 8.250 7.637 0.613 19947
3269 1 10 . 1 1 33 33 THR N N 33 104.300 104.300 109.725 -5.425 19947
3270 1 10 . 1 1 33 33 THR HA H 33 4.430 4.430 4.392 0.038 19947
3271 1 10 . 1 1 33 33 THR CA C 33 60.500 60.500 60.787 -0.287 19947
3272 1 10 . 1 1 33 33 THR CB C 33 70.600 70.600 69.326 1.274 19947
3273 1 10 . 1 1 33 33 THR H H 33 7.320 7.320 7.311 0.009 19947
3274 1 10 . 1 1 34 34 CYS N N 34 123.400 123.400 121.305 2.095 19947
3275 1 10 . 1 1 34 34 CYS HA H 34 4.170 4.170 4.294 -0.124 19947
3276 1 10 . 1 1 34 34 CYS CA C 34 56.500 56.500 59.965 -3.465 19947
3277 1 10 . 1 1 34 34 CYS H H 34 8.710 8.710 8.218 0.492 19947
3278 1 10 . 1 1 35 35 LYS N N 35 116.900 116.900 117.989 -1.089 19947
3279 1 10 . 1 1 35 35 LYS HA H 35 4.960 4.960 4.733 0.227 19947
3280 1 10 . 1 1 35 35 LYS CA C 35 53.900 53.900 55.440 -1.540 19947
3281 1 10 . 1 1 35 35 LYS CB C 35 35.900 35.900 36.510 -0.610 19947
3282 1 10 . 1 1 35 35 LYS H H 35 7.450 7.450 7.683 -0.233 19947
3283 1 10 . 1 1 36 36 LEU N N 36 119.300 119.300 120.094 -0.794 19947
3284 1 10 . 1 1 36 36 LEU HA H 36 4.800 4.800 5.202 -0.402 19947
3285 1 10 . 1 1 36 36 LEU CB C 36 42.400 42.400 42.380 0.021 19947
3286 1 10 . 1 1 36 36 LEU H H 36 8.290 8.290 8.546 -0.256 19947
3287 1 10 . 1 1 37 37 THR HA H 37 4.340 4.340 4.401 -0.061 19947
3288 1 10 . 1 1 37 37 THR CA C 37 60.200 60.200 61.257 -1.057 19947
3289 1 10 . 1 1 37 37 THR CB C 37 67.700 67.700 68.153 -0.454 19947
3290 1 10 . 1 1 37 37 THR H H 37 8.380 8.380 8.496 -0.116 19947
3291 1 10 . 1 1 38 38 PRO HA H 38 4.380 4.380 4.242 0.138 19947
3292 1 10 . 1 1 38 38 PRO CA C 38 64.800 64.800 64.627 0.173 19947
3293 1 10 . 1 1 38 38 PRO CB C 38 31.500 31.500 31.617 -0.117 19947
3294 1 10 . 1 1 39 39 GLY N N 39 113.300 113.300 110.315 2.985 19947
3295 1 10 . 1 1 39 39 GLY CA C 39 45.100 45.100 45.021 0.079 19947
3296 1 10 . 1 1 39 39 GLY H H 39 8.830 8.830 8.627 0.203 19947
3297 1 10 . 1 1 40 40 SER N N 40 116.700 116.700 117.391 -0.691 19947
3298 1 10 . 1 1 40 40 SER HA H 40 4.610 4.610 4.519 0.091 19947
3299 1 10 . 1 1 40 40 SER CA C 40 58.800 58.800 58.096 0.704 19947
3300 1 10 . 1 1 40 40 SER CB C 40 63.800 63.800 62.800 1.000 19947
3301 1 10 . 1 1 40 40 SER H H 40 8.280 8.280 7.627 0.653 19947
3302 1 10 . 1 1 41 41 GLN N N 41 120.600 120.600 125.417 -4.817 19947
3303 1 10 . 1 1 41 41 GLN HA H 41 4.110 4.110 4.053 0.057 19947
3304 1 10 . 1 1 41 41 GLN CA C 41 55.200 55.200 57.251 -2.051 19947
3305 1 10 . 1 1 41 41 GLN CB C 41 31.100 31.100 28.942 2.158 19947
3306 1 10 . 1 1 41 41 GLN H H 41 9.190 9.190 7.672 1.518 19947
3307 1 10 . 1 1 42 42 CYS N N 42 113.200 113.200 116.091 -2.891 19947
3308 1 10 . 1 1 42 42 CYS HA H 42 4.630 4.630 4.553 0.077 19947
3309 1 10 . 1 1 42 42 CYS CA C 42 53.700 53.700 57.240 -3.540 19947
3310 1 10 . 1 1 42 42 CYS CB C 42 45.500 45.500 30.847 14.653 19947
3311 1 10 . 1 1 42 42 CYS H H 42 7.710 7.710 7.731 -0.021 19947
3312 1 10 . 1 1 43 43 ASN N N 43 114.200 114.200 121.308 -7.108 19947
3313 1 10 . 1 1 43 43 ASN HA H 43 4.940 4.940 4.801 0.139 19947
3314 1 10 . 1 1 43 43 ASN CA C 43 53.000 53.000 54.447 -1.447 19947
3315 1 10 . 1 1 43 43 ASN CB C 43 39.300 39.300 39.190 0.110 19947
3316 1 10 . 1 1 43 43 ASN H H 43 8.870 8.870 8.551 0.319 19947
3317 1 10 . 1 1 44 44 TYR N N 44 118.400 118.400 115.282 3.118 19947
3318 1 10 . 1 1 44 44 TYR HA H 44 4.850 4.850 4.621 0.229 19947
3319 1 10 . 1 1 44 44 TYR CA C 44 55.300 55.300 57.864 -2.564 19947
3320 1 10 . 1 1 44 44 TYR CB C 44 40.700 40.700 39.936 0.764 19947
3321 1 10 . 1 1 44 44 TYR H H 44 7.840 7.840 7.317 0.523 19947
3322 1 10 . 1 1 45 45 GLY N N 45 110.600 110.600 108.685 1.915 19947
3323 1 10 . 1 1 45 45 GLY CA C 45 44.000 44.000 44.945 -0.945 19947
3324 1 10 . 1 1 45 45 GLY H H 45 7.960 7.960 8.162 -0.202 19947
3325 1 10 . 1 1 46 46 GLU N N 46 120.700 120.700 120.243 0.457 19947
3326 1 10 . 1 1 46 46 GLU HA H 46 4.280 4.280 4.144 0.136 19947
3327 1 10 . 1 1 46 46 GLU CA C 46 58.500 58.500 58.911 -0.411 19947
3328 1 10 . 1 1 46 46 GLU CB C 46 29.300 29.300 29.978 -0.678 19947
3329 1 10 . 1 1 46 46 GLU H H 46 9.160 9.160 8.666 0.494 19947
3330 1 10 . 1 1 47 47 CYS N N 47 112.400 112.400 117.903 -5.503 19947
3331 1 10 . 1 1 47 47 CYS HA H 47 4.850 4.850 4.654 0.196 19947
3332 1 10 . 1 1 47 47 CYS CA C 47 57.100 57.100 58.185 -1.085 19947
3333 1 10 . 1 1 47 47 CYS CB C 47 41.200 41.200 25.722 15.478 19947
3334 1 10 . 1 1 47 47 CYS H H 47 8.510 8.510 7.482 1.028 19947
3335 1 10 . 1 1 48 48 CYS N N 48 123.200 123.200 119.725 3.475 19947
3336 1 10 . 1 1 48 48 CYS HA H 48 5.160 5.160 4.989 0.171 19947
3337 1 10 . 1 1 48 48 CYS CA C 48 54.700 54.700 58.186 -3.486 19947
3338 1 10 . 1 1 48 48 CYS CB C 48 45.700 45.700 29.034 16.666 19947
3339 1 10 . 1 1 48 48 CYS H H 48 7.810 7.810 7.658 0.152 19947
3340 1 10 . 1 1 49 49 ASP N N 49 127.400 127.400 124.128 3.272 19947
3341 1 10 . 1 1 49 49 ASP HA H 49 4.890 4.890 5.006 -0.116 19947
3342 1 10 . 1 1 49 49 ASP CA C 49 53.500 53.500 53.887 -0.387 19947
3343 1 10 . 1 1 49 49 ASP CB C 49 42.400 42.400 44.680 -2.280 19947
3344 1 10 . 1 1 49 49 ASP H H 49 9.670 9.670 8.278 1.392 19947
3345 1 10 . 1 1 50 50 GLN N N 50 127.000 127.000 122.851 4.149 19947
3346 1 10 . 1 1 50 50 GLN HA H 50 3.940 3.940 3.946 -0.006 19947
3347 1 10 . 1 1 50 50 GLN CA C 50 56.800 56.800 58.516 -1.716 19947
3348 1 10 . 1 1 50 50 GLN CB C 50 26.500 26.500 28.284 -1.784 19947
3349 1 10 . 1 1 50 50 GLN H H 50 9.450 9.450 8.897 0.553 19947
3350 1 10 . 1 1 51 51 CYS N N 51 106.100 106.100 118.595 -12.495 19947
3351 1 10 . 1 1 51 51 CYS HA H 51 4.760 4.760 4.683 0.077 19947
3352 1 10 . 1 1 51 51 CYS CB C 51 43.200 43.200 27.823 15.377 19947
3353 1 10 . 1 1 51 51 CYS H H 51 8.700 8.700 8.217 0.483 19947
3354 1 10 . 1 1 52 52 ARG N N 52 121.000 121.000 119.337 1.663 19947
3355 1 10 . 1 1 52 52 ARG HA H 52 4.690 4.690 4.383 0.307 19947
3356 1 10 . 1 1 52 52 ARG CA C 52 55.400 55.400 55.344 0.056 19947
3357 1 10 . 1 1 52 52 ARG CB C 52 33.100 33.100 34.625 -1.525 19947
3358 1 10 . 1 1 52 52 ARG H H 52 7.960 7.960 7.823 0.137 19947
3359 1 10 . 1 1 53 53 PHE N N 53 120.300 120.300 121.852 -1.552 19947
3360 1 10 . 1 1 53 53 PHE HA H 53 5.050 5.050 5.123 -0.073 19947
3361 1 10 . 1 1 53 53 PHE CA C 53 56.100 56.100 56.352 -0.252 19947
3362 1 10 . 1 1 53 53 PHE CB C 53 38.200 38.200 39.091 -0.891 19947
3363 1 10 . 1 1 53 53 PHE H H 53 8.400 8.400 8.454 -0.054 19947
3364 1 10 . 1 1 54 54 LYS N N 54 123.300 123.300 125.398 -2.098 19947
3365 1 10 . 1 1 54 54 LYS HA H 54 4.250 4.250 4.093 0.157 19947
3366 1 10 . 1 1 54 54 LYS CA C 54 57.500 57.500 55.980 1.520 19947
3367 1 10 . 1 1 54 54 LYS CB C 54 34.300 34.300 30.952 3.348 19947
3368 1 10 . 1 1 54 54 LYS H H 54 8.540 8.540 8.151 0.389 19947
3369 1 10 . 1 1 55 55 LYS N N 55 119.400 119.400 123.664 -4.264 19947
3370 1 10 . 1 1 55 55 LYS HA H 55 4.110 4.110 3.925 0.185 19947
3371 1 10 . 1 1 55 55 LYS CA C 55 56.500 56.500 57.135 -0.634 19947
3372 1 10 . 1 1 55 55 LYS CB C 55 33.400 33.400 33.095 0.305 19947
3373 1 10 . 1 1 55 55 LYS H H 55 8.440 8.440 8.063 0.377 19947
3374 1 10 . 1 1 56 56 ALA N N 56 126.700 126.700 128.299 -1.599 19947
3375 1 10 . 1 1 56 56 ALA HA H 56 3.920 3.920 4.027 -0.107 19947
3376 1 10 . 1 1 56 56 ALA CA C 56 52.900 52.900 53.654 -0.754 19947
3377 1 10 . 1 1 56 56 ALA CB C 56 18.100 18.100 18.561 -0.461 19947
3378 1 10 . 1 1 56 56 ALA H H 56 8.930 8.930 8.760 0.170 19947
3379 1 10 . 1 1 57 57 GLY N N 57 109.300 109.300 111.961 -2.661 19947
3380 1 10 . 1 1 57 57 GLY CA C 57 45.100 45.100 44.879 0.221 19947
3381 1 10 . 1 1 57 57 GLY H H 57 8.460 8.460 8.451 0.009 19947
3382 1 10 . 1 1 58 58 THR N N 58 117.200 117.200 119.763 -2.563 19947
3383 1 10 . 1 1 58 58 THR HA H 58 4.260 4.260 4.420 -0.160 19947
3384 1 10 . 1 1 58 58 THR CA C 58 63.300 63.300 63.152 0.148 19947
3385 1 10 . 1 1 58 58 THR CB C 58 69.600 69.600 69.072 0.528 19947
3386 1 10 . 1 1 58 58 THR H H 58 7.660 7.660 7.774 -0.114 19947
3387 1 10 . 1 1 59 59 VAL N N 59 130.400 130.400 127.083 3.317 19947
3388 1 10 . 1 1 59 59 VAL HA H 59 3.900 3.900 3.583 0.317 19947
3389 1 10 . 1 1 59 59 VAL CA C 59 64.400 64.400 63.027 1.373 19947
3390 1 10 . 1 1 59 59 VAL CB C 59 31.900 31.900 31.676 0.224 19947
3391 1 10 . 1 1 59 59 VAL H H 59 9.190 9.190 8.637 0.553 19947
3392 1 10 . 1 1 60 60 CYS N N 60 121.800 121.800 126.126 -4.326 19947
3393 1 10 . 1 1 60 60 CYS HA H 60 5.050 5.050 4.595 0.455 19947
3394 1 10 . 1 1 60 60 CYS CA C 60 54.400 54.400 58.087 -3.687 19947
3395 1 10 . 1 1 60 60 CYS CB C 60 43.000 43.000 27.508 15.492 19947
3396 1 10 . 1 1 60 60 CYS H H 60 9.130 9.130 8.179 0.951 19947
3397 1 10 . 1 1 61 61 ARG N N 61 124.100 124.100 117.275 6.825 19947
3398 1 10 . 1 1 61 61 ARG HA H 61 4.360 4.360 4.653 -0.293 19947
3399 1 10 . 1 1 61 61 ARG CA C 61 56.800 56.800 55.056 1.744 19947
3400 1 10 . 1 1 61 61 ARG CB C 61 32.800 32.800 33.787 -0.987 19947
3401 1 10 . 1 1 61 61 ARG H H 61 7.580 7.580 7.378 0.202 19947
3402 1 10 . 1 1 62 62 ILE N N 62 126.200 126.200 116.766 9.434 19947
3403 1 10 . 1 1 62 62 ILE HA H 62 4.090 4.090 4.550 -0.460 19947
3404 1 10 . 1 1 62 62 ILE CA C 62 60.300 60.300 60.854 -0.554 19947
3405 1 10 . 1 1 62 62 ILE CB C 62 38.700 38.700 40.946 -2.246 19947
3406 1 10 . 1 1 62 62 ILE H H 62 8.490 8.490 8.408 0.082 19947
3407 1 10 . 1 1 63 63 ALA N N 63 129.400 129.400 131.730 -2.330 19947
3408 1 10 . 1 1 63 63 ALA HA H 63 4.310 4.310 4.351 -0.041 19947
3409 1 10 . 1 1 63 63 ALA CA C 63 51.900 51.900 54.362 -2.462 19947
3410 1 10 . 1 1 63 63 ALA CB C 63 20.600 20.600 19.540 1.060 19947
3411 1 10 . 1 1 63 63 ALA H H 63 8.100 8.100 8.808 -0.708 19947
3412 1 10 . 1 1 64 64 ARG N N 64 120.500 120.500 121.157 -0.657 19947
3413 1 10 . 1 1 64 64 ARG HA H 64 4.290 4.290 4.514 -0.224 19947
3414 1 10 . 1 1 64 64 ARG CA C 64 56.200 56.200 55.952 0.248 19947
3415 1 10 . 1 1 64 64 ARG CB C 64 30.500 30.500 30.194 0.306 19947
3416 1 10 . 1 1 64 64 ARG H H 64 8.140 8.140 8.867 -0.727 19947
3417 1 10 . 1 1 65 65 GLY N N 65 110.500 110.500 112.656 -2.156 19947
3418 1 10 . 1 1 65 65 GLY CA C 65 45.100 45.100 44.606 0.494 19947
3419 1 10 . 1 1 65 65 GLY H H 65 8.040 8.040 8.427 -0.387 19947
3420 1 10 . 1 1 66 66 ASP N N 66 120.700 120.700 119.231 1.469 19947
3421 1 10 . 1 1 66 66 ASP HA H 66 4.610 4.610 4.508 0.102 19947
3422 1 10 . 1 1 66 66 ASP CA C 66 53.300 53.300 53.523 -0.223 19947
3423 1 10 . 1 1 66 66 ASP CB C 66 37.600 37.600 40.279 -2.679 19947
3424 1 10 . 1 1 66 66 ASP H H 66 8.380 8.380 7.234 1.146 19947
3425 1 10 . 1 1 67 67 TRP N N 67 120.100 120.100 123.255 -3.155 19947
3426 1 10 . 1 1 67 67 TRP HA H 67 4.760 4.760 5.017 -0.257 19947
3427 1 10 . 1 1 67 67 TRP CA C 67 57.200 57.200 57.940 -0.740 19947
3428 1 10 . 1 1 67 67 TRP CB C 67 29.100 29.100 29.399 -0.299 19947
3429 1 10 . 1 1 67 67 TRP H H 67 7.950 7.950 7.821 0.129 19947
3430 1 10 . 1 1 68 68 ASN N N 68 118.400 118.400 118.130 0.270 19947
3431 1 10 . 1 1 68 68 ASN HA H 68 4.790 4.790 4.946 -0.156 19947
3432 1 10 . 1 1 68 68 ASN CA C 68 52.800 52.800 53.856 -1.056 19947
3433 1 10 . 1 1 68 68 ASN CB C 68 39.300 39.300 40.087 -0.787 19947
3434 1 10 . 1 1 68 68 ASN H H 68 8.180 8.180 8.641 -0.461 19947
3435 1 10 . 1 1 69 69 ASP N N 69 118.500 118.500 118.681 -0.181 19947
3436 1 10 . 1 1 69 69 ASP HA H 69 4.620 4.620 4.402 0.218 19947
3437 1 10 . 1 1 69 69 ASP CA C 69 53.200 53.200 56.277 -3.077 19947
3438 1 10 . 1 1 69 69 ASP CB C 69 38.000 38.000 41.266 -3.266 19947
3439 1 10 . 1 1 69 69 ASP H H 69 8.130 8.130 8.563 -0.433 19947
3440 1 10 . 1 1 70 70 ASP N N 70 120.500 120.500 121.126 -0.626 19947
3441 1 10 . 1 1 70 70 ASP HA H 70 5.100 5.100 4.860 0.240 19947
3442 1 10 . 1 1 70 70 ASP CA C 70 52.500 52.500 53.710 -1.210 19947
3443 1 10 . 1 1 70 70 ASP CB C 70 42.600 42.600 42.111 0.489 19947
3444 1 10 . 1 1 70 70 ASP H H 70 8.140 8.140 8.218 -0.078 19947
3445 1 10 . 1 1 71 71 TYR N N 71 118.900 118.900 124.184 -5.284 19947
3446 1 10 . 1 1 71 71 TYR HA H 71 5.210 5.210 4.868 0.342 19947
3447 1 10 . 1 1 71 71 TYR CA C 71 56.300 56.300 57.157 -0.857 19947
3448 1 10 . 1 1 71 71 TYR CB C 71 42.200 42.200 42.848 -0.648 19947
3449 1 10 . 1 1 71 71 TYR H H 71 8.450 8.450 8.284 0.166 19947
3450 1 10 . 1 1 72 72 CYS N N 72 119.800 119.800 121.426 -1.626 19947
3451 1 10 . 1 1 72 72 CYS HA H 72 4.900 4.900 4.516 0.384 19947
3452 1 10 . 1 1 72 72 CYS CA C 72 53.400 53.400 58.903 -5.503 19947
3453 1 10 . 1 1 72 72 CYS CB C 72 37.200 37.200 29.099 8.101 19947
3454 1 10 . 1 1 72 72 CYS H H 72 9.330 9.330 8.443 0.887 19947
3455 1 10 . 1 1 73 73 THR N N 73 112.700 112.700 114.401 -1.701 19947
3456 1 10 . 1 1 73 73 THR HA H 73 4.430 4.430 4.402 0.028 19947
3457 1 10 . 1 1 73 73 THR CA C 73 62.300 62.300 62.231 0.069 19947
3458 1 10 . 1 1 73 73 THR CB C 73 71.300 71.300 70.737 0.563 19947
3459 1 10 . 1 1 73 73 THR H H 73 9.980 9.980 8.807 1.173 19947
3460 1 10 . 1 1 74 74 GLY N N 74 111.500 111.500 111.711 -0.211 19947
3461 1 10 . 1 1 74 74 GLY CA C 74 45.300 45.300 46.187 -0.887 19947
3462 1 10 . 1 1 74 74 GLY H H 74 8.580 8.580 7.746 0.834 19947
3463 1 10 . 1 1 75 75 LYS N N 75 115.900 115.900 118.018 -2.118 19947
3464 1 10 . 1 1 75 75 LYS HA H 75 4.140 4.140 4.496 -0.356 19947
3465 1 10 . 1 1 75 75 LYS CA C 75 54.800 54.800 55.824 -1.024 19947
3466 1 10 . 1 1 75 75 LYS CB C 75 34.200 34.200 33.841 0.359 19947
3467 1 10 . 1 1 75 75 LYS H H 75 7.900 7.900 7.596 0.304 19947
3468 1 10 . 1 1 76 76 SER N N 76 111.000 111.000 112.760 -1.760 19947
3469 1 10 . 1 1 76 76 SER HA H 76 4.160 4.160 3.963 0.197 19947
3470 1 10 . 1 1 76 76 SER CA C 76 61.400 61.400 56.011 5.389 19947
3471 1 10 . 1 1 76 76 SER CB C 76 64.300 64.300 66.072 -1.772 19947
3472 1 10 . 1 1 76 76 SER H H 76 6.520 6.520 6.734 -0.214 19947
3473 1 10 . 1 1 77 77 SER N N 77 117.100 117.100 114.275 2.825 19947
3474 1 10 . 1 1 77 77 SER HA H 77 4.220 4.220 4.561 -0.342 19947
3475 1 10 . 1 1 77 77 SER CA C 77 59.800 59.800 58.956 0.844 19947
3476 1 10 . 1 1 77 77 SER CB C 77 64.400 64.400 63.568 0.832 19947
3477 1 10 . 1 1 77 77 SER H H 77 9.030 9.030 8.275 0.755 19947
3478 1 10 . 1 1 78 78 ASP N N 78 122.100 122.100 118.989 3.111 19947
3479 1 10 . 1 1 78 78 ASP HA H 78 4.930 4.930 4.717 0.213 19947
3480 1 10 . 1 1 78 78 ASP CA C 78 52.400 52.400 52.816 -0.415 19947
3481 1 10 . 1 1 78 78 ASP CB C 78 40.800 40.800 42.967 -2.167 19947
3482 1 10 . 1 1 78 78 ASP H H 78 8.340 8.340 7.610 0.730 19947
3483 1 10 . 1 1 79 79 CYS N N 79 122.200 122.200 120.942 1.258 19947
3484 1 10 . 1 1 79 79 CYS HA H 79 5.320 5.320 4.695 0.625 19947
3485 1 10 . 1 1 79 79 CYS CA C 79 52.000 52.000 55.422 -3.422 19947
3486 1 10 . 1 1 79 79 CYS CB C 79 39.300 39.300 27.353 11.947 19947
3487 1 10 . 1 1 79 79 CYS H H 79 8.960 8.960 8.521 0.439 19947
3488 1 10 . 1 1 80 80 PRO HA H 80 4.410 4.410 4.097 0.313 19947
3489 1 10 . 1 1 80 80 PRO CA C 80 63.500 63.500 62.795 0.705 19947
3490 1 10 . 1 1 80 80 PRO CB C 80 32.400 32.400 33.053 -0.653 19947
3491 1 10 . 1 1 81 81 TRP N N 81 120.500 120.500 121.179 -0.679 19947
3492 1 10 . 1 1 81 81 TRP HA H 81 4.550 4.550 4.297 0.253 19947
3493 1 10 . 1 1 81 81 TRP CA C 81 56.400 56.400 57.444 -1.044 19947
3494 1 10 . 1 1 81 81 TRP CB C 81 29.500 29.500 28.474 1.026 19947
3495 1 10 . 1 1 81 81 TRP H H 81 8.400 8.400 7.644 0.756 19947
3496 1 10 . 1 1 82 82 ASN N N 82 120.400 120.400 111.820 8.580 19947
3497 1 10 . 1 1 82 82 ASN HA H 82 4.750 4.750 4.388 0.362 19947
3498 1 10 . 1 1 82 82 ASN CA C 82 53.100 53.100 54.439 -1.339 19947
3499 1 10 . 1 1 82 82 ASN CB C 82 39.000 39.000 37.033 1.967 19947
3500 1 10 . 1 1 82 82 ASN H H 82 8.040 8.040 8.407 -0.367 19947
3501 1 11 . 1 1 2 2 PRO HA H 2 4.820 4.820 4.737 0.083 19947
3502 1 11 . 1 1 2 2 PRO CA C 2 61.900 61.900 62.117 -0.217 19947
3503 1 11 . 1 1 2 2 PRO CB C 2 30.700 30.700 31.879 -1.179 19947
3504 1 11 . 1 1 3 3 PRO HA H 3 4.540 4.540 4.532 0.008 19947
3505 1 11 . 1 1 3 3 PRO CA C 3 62.900 62.900 62.296 0.604 19947
3506 1 11 . 1 1 3 3 PRO CB C 3 32.100 32.100 32.817 -0.717 19947
3507 1 11 . 1 1 4 4 VAL N N 4 121.900 121.900 122.632 -0.732 19947
3508 1 11 . 1 1 4 4 VAL HA H 4 4.200 4.200 4.143 0.057 19947
3509 1 11 . 1 1 4 4 VAL CA C 4 62.300 62.300 62.163 0.137 19947
3510 1 11 . 1 1 4 4 VAL CB C 4 32.800 32.800 30.315 2.485 19947
3511 1 11 . 1 1 4 4 VAL H H 4 8.330 8.330 8.357 -0.027 19947
3512 1 11 . 1 1 5 5 CYS N N 5 120.900 120.900 126.722 -5.822 19947
3513 1 11 . 1 1 5 5 CYS HA H 5 4.700 4.700 4.431 0.269 19947
3514 1 11 . 1 1 5 5 CYS CA C 5 53.600 53.600 58.688 -5.088 19947
3515 1 11 . 1 1 5 5 CYS H H 5 8.500 8.500 8.728 -0.228 19947
3516 1 11 . 1 1 6 6 GLY N N 6 110.200 110.200 113.113 -2.913 19947
3517 1 11 . 1 1 6 6 GLY CA C 6 46.300 46.300 44.687 1.613 19947
3518 1 11 . 1 1 6 6 GLY H H 6 8.490 8.490 8.396 0.094 19947
3519 1 11 . 1 1 7 7 ASN N N 7 120.100 120.100 117.141 2.959 19947
3520 1 11 . 1 1 7 7 ASN HA H 7 4.730 4.730 4.333 0.397 19947
3521 1 11 . 1 1 7 7 ASN CA C 7 53.200 53.200 54.241 -1.041 19947
3522 1 11 . 1 1 7 7 ASN CB C 7 38.700 38.700 38.980 -0.280 19947
3523 1 11 . 1 1 7 7 ASN H H 7 8.320 8.320 8.394 -0.074 19947
3524 1 11 . 1 1 8 8 LYS N N 8 121.300 121.300 122.191 -0.891 19947
3525 1 11 . 1 1 8 8 LYS HA H 8 4.340 4.340 4.260 0.080 19947
3526 1 11 . 1 1 8 8 LYS CA C 8 56.600 56.600 56.832 -0.232 19947
3527 1 11 . 1 1 8 8 LYS CB C 8 32.900 32.900 31.434 1.466 19947
3528 1 11 . 1 1 8 8 LYS H H 8 8.260 8.260 8.451 -0.191 19947
3529 1 11 . 1 1 9 9 ILE N N 9 136.600 136.600 120.405 16.195 19947
3530 1 11 . 1 1 9 9 ILE HA H 9 4.140 4.140 3.915 0.225 19947
3531 1 11 . 1 1 9 9 ILE CA C 9 61.300 61.300 62.650 -1.350 19947
3532 1 11 . 1 1 9 9 ILE CB C 9 38.200 38.200 38.274 -0.074 19947
3533 1 11 . 1 1 9 9 ILE H H 9 8.150 8.150 7.811 0.339 19947
3534 1 11 . 1 1 10 10 LEU N N 10 125.700 125.700 121.230 4.470 19947
3535 1 11 . 1 1 10 10 LEU HA H 10 4.420 4.420 4.541 -0.121 19947
3536 1 11 . 1 1 10 10 LEU CA C 10 55.200 55.200 55.212 -0.012 19947
3537 1 11 . 1 1 10 10 LEU CB C 10 42.300 42.300 41.597 0.702 19947
3538 1 11 . 1 1 10 10 LEU H H 10 8.230 8.230 8.481 -0.251 19947
3539 1 11 . 1 1 11 11 GLU N N 11 120.600 120.600 114.121 6.479 19947
3540 1 11 . 1 1 11 11 GLU HA H 11 4.470 4.470 3.949 0.521 19947
3541 1 11 . 1 1 11 11 GLU CA C 11 55.500 55.500 56.292 -0.792 19947
3542 1 11 . 1 1 11 11 GLU CB C 11 28.900 28.900 28.216 0.683 19947
3543 1 11 . 1 1 11 11 GLU H H 11 8.250 8.250 7.985 0.265 19947
3544 1 11 . 1 1 12 12 GLN N N 12 121.600 121.600 120.505 1.095 19947
3545 1 11 . 1 1 12 12 GLN HA H 12 4.350 4.350 4.302 0.048 19947
3546 1 11 . 1 1 12 12 GLN CA C 12 56.600 56.600 57.393 -0.793 19947
3547 1 11 . 1 1 12 12 GLN CB C 12 29.200 29.200 28.674 0.526 19947
3548 1 11 . 1 1 12 12 GLN H H 12 8.460 8.460 8.013 0.447 19947
3549 1 11 . 1 1 13 13 GLY N N 13 110.700 110.700 105.070 5.630 19947
3550 1 11 . 1 1 13 13 GLY CA C 13 45.700 45.700 45.352 0.347 19947
3551 1 11 . 1 1 13 13 GLY H H 13 8.660 8.660 8.486 0.174 19947
3552 1 11 . 1 1 14 14 GLU N N 14 118.900 118.900 115.321 3.579 19947
3553 1 11 . 1 1 14 14 GLU HA H 14 4.530 4.530 4.282 0.248 19947
3554 1 11 . 1 1 14 14 GLU CA C 14 55.600 55.600 56.488 -0.888 19947
3555 1 11 . 1 1 14 14 GLU CB C 14 29.700 29.700 29.995 -0.295 19947
3556 1 11 . 1 1 14 14 GLU H H 14 8.230 8.230 8.226 0.004 19947
3557 1 11 . 1 1 15 15 ASP N N 15 118.400 118.400 119.896 -1.496 19947
3558 1 11 . 1 1 15 15 ASP HA H 15 4.990 4.990 4.545 0.445 19947
3559 1 11 . 1 1 15 15 ASP CA C 15 53.500 53.500 57.233 -3.732 19947
3560 1 11 . 1 1 15 15 ASP CB C 15 39.700 39.700 42.403 -2.703 19947
3561 1 11 . 1 1 15 15 ASP H H 15 8.330 8.330 8.448 -0.118 19947
3562 1 11 . 1 1 16 16 CYS HA H 16 4.340 4.340 4.385 -0.045 19947
3563 1 11 . 1 1 16 16 CYS H H 16 8.510 8.510 7.823 0.687 19947
3564 1 11 . 1 1 17 17 ASP N N 17 116.700 116.700 123.751 -7.051 19947
3565 1 11 . 1 1 17 17 ASP HA H 17 4.740 4.740 4.295 0.445 19947
3566 1 11 . 1 1 17 17 ASP CA C 17 53.100 53.100 55.354 -2.254 19947
3567 1 11 . 1 1 17 17 ASP CB C 17 38.600 38.600 39.319 -0.719 19947
3568 1 11 . 1 1 17 17 ASP H H 17 8.180 8.180 8.693 -0.513 19947
3569 1 11 . 1 1 18 18 CYS HA H 18 4.730 4.730 3.994 0.736 19947
3570 1 11 . 1 1 18 18 CYS CB C 18 41.900 41.900 26.930 14.970 19947
3571 1 11 . 1 1 19 19 GLY H H 19 8.220 8.220 8.732 -0.512 19947
3572 1 11 . 1 1 20 20 SER HA H 20 4.920 4.920 4.435 0.485 19947
3573 1 11 . 1 1 20 20 SER CA C 20 55.700 55.700 57.906 -2.206 19947
3574 1 11 . 1 1 20 20 SER CB C 20 63.500 63.500 62.886 0.614 19947
3575 1 11 . 1 1 20 20 SER H H 20 7.830 7.830 8.451 -0.621 19947
3576 1 11 . 1 1 21 21 PRO HA H 21 4.240 4.240 4.158 0.082 19947
3577 1 11 . 1 1 21 21 PRO CA C 21 63.400 63.400 65.329 -1.929 19947
3578 1 11 . 1 1 21 21 PRO CB C 21 31.800 31.800 31.341 0.459 19947
3579 1 11 . 1 1 22 22 ALA N N 22 119.900 119.900 118.466 1.434 19947
3580 1 11 . 1 1 22 22 ALA HA H 22 4.220 4.220 4.072 0.148 19947
3581 1 11 . 1 1 22 22 ALA CA C 22 54.200 54.200 53.831 0.369 19947
3582 1 11 . 1 1 22 22 ALA CB C 22 18.500 18.500 18.637 -0.137 19947
3583 1 11 . 1 1 22 22 ALA H H 22 8.180 8.180 8.373 -0.193 19947
3584 1 11 . 1 1 23 23 ASN N N 23 116.300 116.300 111.147 5.153 19947
3585 1 11 . 1 1 23 23 ASN HA H 23 4.670 4.670 4.936 -0.266 19947
3586 1 11 . 1 1 23 23 ASN CA C 23 53.200 53.200 52.206 0.994 19947
3587 1 11 . 1 1 23 23 ASN CB C 23 39.300 39.300 40.543 -1.243 19947
3588 1 11 . 1 1 23 23 ASN H H 23 7.960 7.960 8.027 -0.067 19947
3589 1 11 . 1 1 24 24 CYS HA H 24 4.720 4.720 4.296 0.424 19947
3590 1 11 . 1 1 24 24 CYS H H 24 8.510 8.510 7.409 1.101 19947
3591 1 11 . 1 1 25 25 GLN HA H 25 4.460 4.460 3.979 0.481 19947
3592 1 11 . 1 1 25 25 GLN H H 25 8.320 8.320 8.432 -0.112 19947
3593 1 11 . 1 1 26 26 ASP HA H 26 4.740 4.740 4.623 0.117 19947
3594 1 11 . 1 1 26 26 ASP H H 26 8.580 8.580 8.583 -0.003 19947
3595 1 11 . 1 1 27 27 ARG HA H 27 4.680 4.680 4.399 0.281 19947
3596 1 11 . 1 1 27 27 ARG CA C 27 54.700 54.700 57.604 -2.904 19947
3597 1 11 . 1 1 27 27 ARG H H 27 8.550 8.550 8.047 0.503 19947
3598 1 11 . 1 1 28 28 CYS HA H 28 4.120 4.120 4.757 -0.637 19947
3599 1 11 . 1 1 28 28 CYS CA C 28 54.400 54.400 57.947 -3.547 19947
3600 1 11 . 1 1 28 28 CYS CB C 28 19.000 19.000 26.290 -7.290 19947
3601 1 11 . 1 1 28 28 CYS H H 28 8.910 8.910 8.448 0.462 19947
3602 1 11 . 1 1 29 29 CYS N N 29 113.300 113.300 119.762 -6.462 19947
3603 1 11 . 1 1 29 29 CYS HA H 29 5.010 5.010 4.823 0.187 19947
3604 1 11 . 1 1 29 29 CYS CA C 29 54.300 54.300 56.455 -2.155 19947
3605 1 11 . 1 1 29 29 CYS H H 29 7.730 7.730 7.688 0.042 19947
3606 1 11 . 1 1 30 30 ASN HA H 30 4.730 4.730 5.026 -0.296 19947
3607 1 11 . 1 1 30 30 ASN CB C 30 38.700 38.700 40.092 -1.392 19947
3608 1 11 . 1 1 30 30 ASN H H 30 8.870 8.870 8.886 -0.016 19947
3609 1 11 . 1 1 31 31 ALA N N 31 129.400 129.400 126.071 3.329 19947
3610 1 11 . 1 1 31 31 ALA HA H 31 4.120 4.120 4.247 -0.127 19947
3611 1 11 . 1 1 31 31 ALA CA C 31 54.400 54.400 54.757 -0.357 19947
3612 1 11 . 1 1 31 31 ALA CB C 31 19.000 19.000 19.255 -0.255 19947
3613 1 11 . 1 1 31 31 ALA H H 31 8.890 8.890 8.387 0.503 19947
3614 1 11 . 1 1 32 32 ALA N N 32 116.400 116.400 118.255 -1.855 19947
3615 1 11 . 1 1 32 32 ALA HA H 32 4.340 4.340 4.303 0.037 19947
3616 1 11 . 1 1 32 32 ALA CA C 32 53.800 53.800 53.328 0.472 19947
3617 1 11 . 1 1 32 32 ALA CB C 32 19.100 19.100 18.828 0.272 19947
3618 1 11 . 1 1 32 32 ALA H H 32 8.250 8.250 8.398 -0.148 19947
3619 1 11 . 1 1 33 33 THR N N 33 104.300 104.300 109.576 -5.276 19947
3620 1 11 . 1 1 33 33 THR HA H 33 4.430 4.430 4.410 0.020 19947
3621 1 11 . 1 1 33 33 THR CA C 33 60.500 60.500 60.590 -0.090 19947
3622 1 11 . 1 1 33 33 THR CB C 33 70.600 70.600 69.801 0.799 19947
3623 1 11 . 1 1 33 33 THR H H 33 7.320 7.320 7.375 -0.055 19947
3624 1 11 . 1 1 34 34 CYS N N 34 123.400 123.400 121.256 2.144 19947
3625 1 11 . 1 1 34 34 CYS HA H 34 4.170 4.170 4.195 -0.025 19947
3626 1 11 . 1 1 34 34 CYS CA C 34 56.500 56.500 60.008 -3.507 19947
3627 1 11 . 1 1 34 34 CYS H H 34 8.710 8.710 8.230 0.480 19947
3628 1 11 . 1 1 35 35 LYS N N 35 116.900 116.900 118.371 -1.471 19947
3629 1 11 . 1 1 35 35 LYS HA H 35 4.960 4.960 4.932 0.028 19947
3630 1 11 . 1 1 35 35 LYS CA C 35 53.900 53.900 54.901 -1.000 19947
3631 1 11 . 1 1 35 35 LYS CB C 35 35.900 35.900 36.209 -0.309 19947
3632 1 11 . 1 1 35 35 LYS H H 35 7.450 7.450 7.721 -0.271 19947
3633 1 11 . 1 1 36 36 LEU N N 36 119.300 119.300 117.765 1.535 19947
3634 1 11 . 1 1 36 36 LEU HA H 36 4.800 4.800 4.760 0.040 19947
3635 1 11 . 1 1 36 36 LEU CB C 36 42.400 42.400 42.759 -0.359 19947
3636 1 11 . 1 1 36 36 LEU H H 36 8.290 8.290 8.399 -0.109 19947
3637 1 11 . 1 1 37 37 THR HA H 37 4.340 4.340 4.509 -0.169 19947
3638 1 11 . 1 1 37 37 THR CA C 37 60.200 60.200 60.570 -0.370 19947
3639 1 11 . 1 1 37 37 THR CB C 37 67.700 67.700 68.621 -0.921 19947
3640 1 11 . 1 1 37 37 THR H H 37 8.380 8.380 7.976 0.404 19947
3641 1 11 . 1 1 38 38 PRO HA H 38 4.380 4.380 4.250 0.130 19947
3642 1 11 . 1 1 38 38 PRO CA C 38 64.800 64.800 64.615 0.185 19947
3643 1 11 . 1 1 38 38 PRO CB C 38 31.500 31.500 31.462 0.038 19947
3644 1 11 . 1 1 39 39 GLY N N 39 113.300 113.300 111.568 1.732 19947
3645 1 11 . 1 1 39 39 GLY CA C 39 45.100 45.100 45.049 0.051 19947
3646 1 11 . 1 1 39 39 GLY H H 39 8.830 8.830 8.495 0.335 19947
3647 1 11 . 1 1 40 40 SER N N 40 116.700 116.700 117.552 -0.852 19947
3648 1 11 . 1 1 40 40 SER HA H 40 4.610 4.610 4.419 0.191 19947
3649 1 11 . 1 1 40 40 SER CA C 40 58.800 58.800 59.185 -0.385 19947
3650 1 11 . 1 1 40 40 SER CB C 40 63.800 63.800 63.547 0.253 19947
3651 1 11 . 1 1 40 40 SER H H 40 8.280 8.280 7.691 0.589 19947
3652 1 11 . 1 1 41 41 GLN N N 41 120.600 120.600 125.540 -4.940 19947
3653 1 11 . 1 1 41 41 GLN HA H 41 4.110 4.110 4.113 -0.003 19947
3654 1 11 . 1 1 41 41 GLN CA C 41 55.200 55.200 57.725 -2.525 19947
3655 1 11 . 1 1 41 41 GLN CB C 41 31.100 31.100 29.290 1.810 19947
3656 1 11 . 1 1 41 41 GLN H H 41 9.190 9.190 7.973 1.217 19947
3657 1 11 . 1 1 42 42 CYS N N 42 113.200 113.200 113.896 -0.696 19947
3658 1 11 . 1 1 42 42 CYS HA H 42 4.630 4.630 4.543 0.087 19947
3659 1 11 . 1 1 42 42 CYS CA C 42 53.700 53.700 56.474 -2.774 19947
3660 1 11 . 1 1 42 42 CYS CB C 42 45.500 45.500 30.472 15.028 19947
3661 1 11 . 1 1 42 42 CYS H H 42 7.710 7.710 7.517 0.193 19947
3662 1 11 . 1 1 43 43 ASN N N 43 114.200 114.200 118.913 -4.713 19947
3663 1 11 . 1 1 43 43 ASN HA H 43 4.940 4.940 4.590 0.350 19947
3664 1 11 . 1 1 43 43 ASN CA C 43 53.000 53.000 54.681 -1.681 19947
3665 1 11 . 1 1 43 43 ASN CB C 43 39.300 39.300 39.140 0.160 19947
3666 1 11 . 1 1 43 43 ASN H H 43 8.870 8.870 8.718 0.152 19947
3667 1 11 . 1 1 44 44 TYR N N 44 118.400 118.400 112.904 5.496 19947
3668 1 11 . 1 1 44 44 TYR HA H 44 4.850 4.850 4.590 0.260 19947
3669 1 11 . 1 1 44 44 TYR CA C 44 55.300 55.300 57.452 -2.152 19947
3670 1 11 . 1 1 44 44 TYR CB C 44 40.700 40.700 39.660 1.040 19947
3671 1 11 . 1 1 44 44 TYR H H 44 7.840 7.840 7.124 0.716 19947
3672 1 11 . 1 1 45 45 GLY N N 45 110.600 110.600 107.572 3.028 19947
3673 1 11 . 1 1 45 45 GLY CA C 45 44.000 44.000 44.894 -0.894 19947
3674 1 11 . 1 1 45 45 GLY H H 45 7.960 7.960 7.943 0.017 19947
3675 1 11 . 1 1 46 46 GLU N N 46 120.700 120.700 119.483 1.217 19947
3676 1 11 . 1 1 46 46 GLU HA H 46 4.280 4.280 4.060 0.220 19947
3677 1 11 . 1 1 46 46 GLU CA C 46 58.500 58.500 60.239 -1.739 19947
3678 1 11 . 1 1 46 46 GLU CB C 46 29.300 29.300 29.920 -0.620 19947
3679 1 11 . 1 1 46 46 GLU H H 46 9.160 9.160 8.648 0.512 19947
3680 1 11 . 1 1 47 47 CYS N N 47 112.400 112.400 115.665 -3.265 19947
3681 1 11 . 1 1 47 47 CYS HA H 47 4.850 4.850 4.546 0.304 19947
3682 1 11 . 1 1 47 47 CYS CA C 47 57.100 57.100 59.901 -2.801 19947
3683 1 11 . 1 1 47 47 CYS CB C 47 41.200 41.200 27.039 14.161 19947
3684 1 11 . 1 1 47 47 CYS H H 47 8.510 8.510 7.552 0.958 19947
3685 1 11 . 1 1 48 48 CYS N N 48 123.200 123.200 121.002 2.198 19947
3686 1 11 . 1 1 48 48 CYS HA H 48 5.160 5.160 4.677 0.483 19947
3687 1 11 . 1 1 48 48 CYS CA C 48 54.700 54.700 61.031 -6.331 19947
3688 1 11 . 1 1 48 48 CYS CB C 48 45.700 45.700 27.259 18.441 19947
3689 1 11 . 1 1 48 48 CYS H H 48 7.810 7.810 8.182 -0.372 19947
3690 1 11 . 1 1 49 49 ASP N N 49 127.400 127.400 126.899 0.501 19947
3691 1 11 . 1 1 49 49 ASP HA H 49 4.890 4.890 5.010 -0.120 19947
3692 1 11 . 1 1 49 49 ASP CA C 49 53.500 53.500 53.857 -0.357 19947
3693 1 11 . 1 1 49 49 ASP CB C 49 42.400 42.400 43.433 -1.033 19947
3694 1 11 . 1 1 49 49 ASP H H 49 9.670 9.670 8.713 0.957 19947
3695 1 11 . 1 1 50 50 GLN N N 50 127.000 127.000 120.792 6.208 19947
3696 1 11 . 1 1 50 50 GLN HA H 50 3.940 3.940 3.871 0.069 19947
3697 1 11 . 1 1 50 50 GLN CA C 50 56.800 56.800 58.996 -2.196 19947
3698 1 11 . 1 1 50 50 GLN CB C 50 26.500 26.500 27.572 -1.072 19947
3699 1 11 . 1 1 50 50 GLN H H 50 9.450 9.450 8.906 0.544 19947
3700 1 11 . 1 1 51 51 CYS N N 51 106.100 106.100 117.142 -11.042 19947
3701 1 11 . 1 1 51 51 CYS HA H 51 4.760 4.760 4.788 -0.028 19947
3702 1 11 . 1 1 51 51 CYS CB C 51 43.200 43.200 28.157 15.043 19947
3703 1 11 . 1 1 51 51 CYS H H 51 8.700 8.700 8.262 0.438 19947
3704 1 11 . 1 1 52 52 ARG N N 52 121.000 121.000 119.013 1.987 19947
3705 1 11 . 1 1 52 52 ARG HA H 52 4.690 4.690 4.422 0.268 19947
3706 1 11 . 1 1 52 52 ARG CA C 52 55.400 55.400 54.921 0.479 19947
3707 1 11 . 1 1 52 52 ARG CB C 52 33.100 33.100 33.813 -0.713 19947
3708 1 11 . 1 1 52 52 ARG H H 52 7.960 7.960 7.675 0.285 19947
3709 1 11 . 1 1 53 53 PHE N N 53 120.300 120.300 120.542 -0.242 19947
3710 1 11 . 1 1 53 53 PHE HA H 53 5.050 5.050 4.853 0.197 19947
3711 1 11 . 1 1 53 53 PHE CA C 53 56.100 56.100 57.250 -1.150 19947
3712 1 11 . 1 1 53 53 PHE CB C 53 38.200 38.200 39.431 -1.230 19947
3713 1 11 . 1 1 53 53 PHE H H 53 8.400 8.400 8.417 -0.017 19947
3714 1 11 . 1 1 54 54 LYS N N 54 123.300 123.300 124.281 -0.981 19947
3715 1 11 . 1 1 54 54 LYS HA H 54 4.250 4.250 4.227 0.023 19947
3716 1 11 . 1 1 54 54 LYS CA C 54 57.500 57.500 56.359 1.141 19947
3717 1 11 . 1 1 54 54 LYS CB C 54 34.300 34.300 32.342 1.958 19947
3718 1 11 . 1 1 54 54 LYS H H 54 8.540 8.540 8.761 -0.221 19947
3719 1 11 . 1 1 55 55 LYS N N 55 119.400 119.400 125.691 -6.291 19947
3720 1 11 . 1 1 55 55 LYS HA H 55 4.110 4.110 4.027 0.083 19947
3721 1 11 . 1 1 55 55 LYS CA C 55 56.500 56.500 56.975 -0.475 19947
3722 1 11 . 1 1 55 55 LYS CB C 55 33.400 33.400 33.222 0.178 19947
3723 1 11 . 1 1 55 55 LYS H H 55 8.440 8.440 8.218 0.222 19947
3724 1 11 . 1 1 56 56 ALA N N 56 126.700 126.700 127.225 -0.525 19947
3725 1 11 . 1 1 56 56 ALA HA H 56 3.920 3.920 4.061 -0.141 19947
3726 1 11 . 1 1 56 56 ALA CA C 56 52.900 52.900 53.676 -0.776 19947
3727 1 11 . 1 1 56 56 ALA CB C 56 18.100 18.100 18.300 -0.200 19947
3728 1 11 . 1 1 56 56 ALA H H 56 8.930 8.930 8.528 0.402 19947
3729 1 11 . 1 1 57 57 GLY N N 57 109.300 109.300 111.917 -2.617 19947
3730 1 11 . 1 1 57 57 GLY CA C 57 45.100 45.100 44.798 0.302 19947
3731 1 11 . 1 1 57 57 GLY H H 57 8.460 8.460 8.452 0.008 19947
3732 1 11 . 1 1 58 58 THR N N 58 117.200 117.200 119.604 -2.404 19947
3733 1 11 . 1 1 58 58 THR HA H 58 4.260 4.260 4.430 -0.170 19947
3734 1 11 . 1 1 58 58 THR CA C 58 63.300 63.300 63.404 -0.104 19947
3735 1 11 . 1 1 58 58 THR CB C 58 69.600 69.600 69.483 0.117 19947
3736 1 11 . 1 1 58 58 THR H H 58 7.660 7.660 7.755 -0.095 19947
3737 1 11 . 1 1 59 59 VAL N N 59 130.400 130.400 127.907 2.493 19947
3738 1 11 . 1 1 59 59 VAL HA H 59 3.900 3.900 4.145 -0.245 19947
3739 1 11 . 1 1 59 59 VAL CA C 59 64.400 64.400 62.290 2.110 19947
3740 1 11 . 1 1 59 59 VAL CB C 59 31.900 31.900 31.808 0.092 19947
3741 1 11 . 1 1 59 59 VAL H H 59 9.190 9.190 8.858 0.332 19947
3742 1 11 . 1 1 60 60 CYS N N 60 121.800 121.800 126.600 -4.800 19947
3743 1 11 . 1 1 60 60 CYS HA H 60 5.050 5.050 4.621 0.429 19947
3744 1 11 . 1 1 60 60 CYS CA C 60 54.400 54.400 58.515 -4.115 19947
3745 1 11 . 1 1 60 60 CYS CB C 60 43.000 43.000 27.743 15.257 19947
3746 1 11 . 1 1 60 60 CYS H H 60 9.130 9.130 8.562 0.568 19947
3747 1 11 . 1 1 61 61 ARG N N 61 124.100 124.100 118.596 5.504 19947
3748 1 11 . 1 1 61 61 ARG HA H 61 4.360 4.360 4.634 -0.274 19947
3749 1 11 . 1 1 61 61 ARG CA C 61 56.800 56.800 55.269 1.531 19947
3750 1 11 . 1 1 61 61 ARG CB C 61 32.800 32.800 34.317 -1.517 19947
3751 1 11 . 1 1 61 61 ARG H H 61 7.580 7.580 7.560 0.020 19947
3752 1 11 . 1 1 62 62 ILE N N 62 126.200 126.200 116.568 9.632 19947
3753 1 11 . 1 1 62 62 ILE HA H 62 4.090 4.090 4.541 -0.451 19947
3754 1 11 . 1 1 62 62 ILE CA C 62 60.300 60.300 61.459 -1.159 19947
3755 1 11 . 1 1 62 62 ILE CB C 62 38.700 38.700 40.740 -2.041 19947
3756 1 11 . 1 1 62 62 ILE H H 62 8.490 8.490 8.530 -0.040 19947
3757 1 11 . 1 1 63 63 ALA N N 63 129.400 129.400 132.313 -2.913 19947
3758 1 11 . 1 1 63 63 ALA HA H 63 4.310 4.310 4.439 -0.129 19947
3759 1 11 . 1 1 63 63 ALA CA C 63 51.900 51.900 54.202 -2.301 19947
3760 1 11 . 1 1 63 63 ALA CB C 63 20.600 20.600 19.057 1.543 19947
3761 1 11 . 1 1 63 63 ALA H H 63 8.100 8.100 8.607 -0.507 19947
3762 1 11 . 1 1 64 64 ARG N N 64 120.500 120.500 120.454 0.046 19947
3763 1 11 . 1 1 64 64 ARG HA H 64 4.290 4.290 4.479 -0.189 19947
3764 1 11 . 1 1 64 64 ARG CA C 64 56.200 56.200 56.031 0.170 19947
3765 1 11 . 1 1 64 64 ARG CB C 64 30.500 30.500 30.801 -0.301 19947
3766 1 11 . 1 1 64 64 ARG H H 64 8.140 8.140 8.730 -0.590 19947
3767 1 11 . 1 1 65 65 GLY N N 65 110.500 110.500 112.196 -1.696 19947
3768 1 11 . 1 1 65 65 GLY CA C 65 45.100 45.100 44.575 0.524 19947
3769 1 11 . 1 1 65 65 GLY H H 65 8.040 8.040 8.332 -0.292 19947
3770 1 11 . 1 1 66 66 ASP N N 66 120.700 120.700 118.888 1.812 19947
3771 1 11 . 1 1 66 66 ASP HA H 66 4.610 4.610 4.450 0.160 19947
3772 1 11 . 1 1 66 66 ASP CA C 66 53.300 53.300 53.722 -0.422 19947
3773 1 11 . 1 1 66 66 ASP CB C 66 37.600 37.600 40.183 -2.583 19947
3774 1 11 . 1 1 66 66 ASP H H 66 8.380 8.380 7.139 1.241 19947
3775 1 11 . 1 1 67 67 TRP N N 67 120.100 120.100 123.074 -2.974 19947
3776 1 11 . 1 1 67 67 TRP HA H 67 4.760 4.760 5.064 -0.304 19947
3777 1 11 . 1 1 67 67 TRP CA C 67 57.200 57.200 57.875 -0.675 19947
3778 1 11 . 1 1 67 67 TRP CB C 67 29.100 29.100 29.530 -0.430 19947
3779 1 11 . 1 1 67 67 TRP H H 67 7.950 7.950 7.580 0.370 19947
3780 1 11 . 1 1 68 68 ASN N N 68 118.400 118.400 116.683 1.717 19947
3781 1 11 . 1 1 68 68 ASN HA H 68 4.790 4.790 4.984 -0.194 19947
3782 1 11 . 1 1 68 68 ASN CA C 68 52.800 52.800 53.650 -0.850 19947
3783 1 11 . 1 1 68 68 ASN CB C 68 39.300 39.300 40.529 -1.230 19947
3784 1 11 . 1 1 68 68 ASN H H 68 8.180 8.180 8.853 -0.673 19947
3785 1 11 . 1 1 69 69 ASP N N 69 118.500 118.500 118.407 0.093 19947
3786 1 11 . 1 1 69 69 ASP HA H 69 4.620 4.620 4.497 0.123 19947
3787 1 11 . 1 1 69 69 ASP CA C 69 53.200 53.200 56.166 -2.966 19947
3788 1 11 . 1 1 69 69 ASP CB C 69 38.000 38.000 41.187 -3.187 19947
3789 1 11 . 1 1 69 69 ASP H H 69 8.130 8.130 8.412 -0.282 19947
3790 1 11 . 1 1 70 70 ASP N N 70 120.500 120.500 120.918 -0.418 19947
3791 1 11 . 1 1 70 70 ASP HA H 70 5.100 5.100 5.319 -0.219 19947
3792 1 11 . 1 1 70 70 ASP CA C 70 52.500 52.500 52.897 -0.397 19947
3793 1 11 . 1 1 70 70 ASP CB C 70 42.600 42.600 42.920 -0.320 19947
3794 1 11 . 1 1 70 70 ASP H H 70 8.140 8.140 8.096 0.044 19947
3795 1 11 . 1 1 71 71 TYR N N 71 118.900 118.900 123.784 -4.884 19947
3796 1 11 . 1 1 71 71 TYR HA H 71 5.210 5.210 5.223 -0.013 19947
3797 1 11 . 1 1 71 71 TYR CA C 71 56.300 56.300 56.780 -0.480 19947
3798 1 11 . 1 1 71 71 TYR CB C 71 42.200 42.200 42.642 -0.442 19947
3799 1 11 . 1 1 71 71 TYR H H 71 8.450 8.450 8.349 0.101 19947
3800 1 11 . 1 1 72 72 CYS N N 72 119.800 119.800 122.033 -2.233 19947
3801 1 11 . 1 1 72 72 CYS HA H 72 4.900 4.900 4.533 0.367 19947
3802 1 11 . 1 1 72 72 CYS CA C 72 53.400 53.400 59.105 -5.705 19947
3803 1 11 . 1 1 72 72 CYS CB C 72 37.200 37.200 29.196 8.004 19947
3804 1 11 . 1 1 72 72 CYS H H 72 9.330 9.330 8.774 0.556 19947
3805 1 11 . 1 1 73 73 THR N N 73 112.700 112.700 114.641 -1.941 19947
3806 1 11 . 1 1 73 73 THR HA H 73 4.430 4.430 4.454 -0.024 19947
3807 1 11 . 1 1 73 73 THR CA C 73 62.300 62.300 61.136 1.164 19947
3808 1 11 . 1 1 73 73 THR CB C 73 71.300 71.300 69.672 1.628 19947
3809 1 11 . 1 1 73 73 THR H H 73 9.980 9.980 8.745 1.235 19947
3810 1 11 . 1 1 74 74 GLY N N 74 111.500 111.500 110.754 0.746 19947
3811 1 11 . 1 1 74 74 GLY CA C 74 45.300 45.300 46.582 -1.282 19947
3812 1 11 . 1 1 74 74 GLY H H 74 8.580 8.580 7.757 0.823 19947
3813 1 11 . 1 1 75 75 LYS N N 75 115.900 115.900 116.927 -1.027 19947
3814 1 11 . 1 1 75 75 LYS HA H 75 4.140 4.140 4.579 -0.439 19947
3815 1 11 . 1 1 75 75 LYS CA C 75 54.800 54.800 55.531 -0.731 19947
3816 1 11 . 1 1 75 75 LYS CB C 75 34.200 34.200 34.364 -0.164 19947
3817 1 11 . 1 1 75 75 LYS H H 75 7.900 7.900 7.559 0.341 19947
3818 1 11 . 1 1 76 76 SER N N 76 111.000 111.000 112.932 -1.932 19947
3819 1 11 . 1 1 76 76 SER HA H 76 4.160 4.160 3.937 0.223 19947
3820 1 11 . 1 1 76 76 SER CA C 76 61.400 61.400 56.378 5.022 19947
3821 1 11 . 1 1 76 76 SER CB C 76 64.300 64.300 63.673 0.627 19947
3822 1 11 . 1 1 76 76 SER H H 76 6.520 6.520 7.056 -0.536 19947
3823 1 11 . 1 1 77 77 SER N N 77 117.100 117.100 114.852 2.248 19947
3824 1 11 . 1 1 77 77 SER HA H 77 4.220 4.220 4.473 -0.253 19947
3825 1 11 . 1 1 77 77 SER CA C 77 59.800 59.800 59.280 0.520 19947
3826 1 11 . 1 1 77 77 SER CB C 77 64.400 64.400 63.612 0.788 19947
3827 1 11 . 1 1 77 77 SER H H 77 9.030 9.030 8.330 0.700 19947
3828 1 11 . 1 1 78 78 ASP N N 78 122.100 122.100 121.630 0.470 19947
3829 1 11 . 1 1 78 78 ASP HA H 78 4.930 4.930 4.801 0.129 19947
3830 1 11 . 1 1 78 78 ASP CA C 78 52.400 52.400 54.082 -1.682 19947
3831 1 11 . 1 1 78 78 ASP CB C 78 40.800 40.800 44.114 -3.314 19947
3832 1 11 . 1 1 78 78 ASP H H 78 8.340 8.340 7.615 0.725 19947
3833 1 11 . 1 1 79 79 CYS N N 79 122.200 122.200 121.623 0.577 19947
3834 1 11 . 1 1 79 79 CYS HA H 79 5.320 5.320 4.824 0.496 19947
3835 1 11 . 1 1 79 79 CYS CA C 79 52.000 52.000 55.732 -3.732 19947
3836 1 11 . 1 1 79 79 CYS CB C 79 39.300 39.300 28.477 10.823 19947
3837 1 11 . 1 1 79 79 CYS H H 79 8.960 8.960 8.670 0.290 19947
3838 1 11 . 1 1 80 80 PRO HA H 80 4.410 4.410 4.569 -0.159 19947
3839 1 11 . 1 1 80 80 PRO CA C 80 63.500 63.500 63.136 0.364 19947
3840 1 11 . 1 1 80 80 PRO CB C 80 32.400 32.400 32.262 0.138 19947
3841 1 11 . 1 1 81 81 TRP N N 81 120.500 120.500 121.038 -0.538 19947
3842 1 11 . 1 1 81 81 TRP HA H 81 4.550 4.550 4.663 -0.113 19947
3843 1 11 . 1 1 81 81 TRP CA C 81 56.400 56.400 53.990 2.410 19947
3844 1 11 . 1 1 81 81 TRP CB C 81 29.500 29.500 28.414 1.086 19947
3845 1 11 . 1 1 81 81 TRP H H 81 8.400 8.400 8.400 0.000 19947
3846 1 11 . 1 1 82 82 ASN N N 82 120.400 120.400 115.993 4.407 19947
3847 1 11 . 1 1 82 82 ASN HA H 82 4.750 4.750 4.432 0.318 19947
3848 1 11 . 1 1 82 82 ASN CA C 82 53.100 53.100 53.860 -0.760 19947
3849 1 11 . 1 1 82 82 ASN CB C 82 39.000 39.000 36.605 2.395 19947
3850 1 11 . 1 1 82 82 ASN H H 82 8.040 8.040 8.447 -0.407 19947
3851 1 12 . 1 1 2 2 PRO HA H 2 4.820 4.820 4.893 -0.073 19947
3852 1 12 . 1 1 2 2 PRO CA C 2 61.900 61.900 61.821 0.079 19947
3853 1 12 . 1 1 2 2 PRO CB C 2 30.700 30.700 31.647 -0.947 19947
3854 1 12 . 1 1 3 3 PRO HA H 3 4.540 4.540 4.401 0.139 19947
3855 1 12 . 1 1 3 3 PRO CA C 3 62.900 62.900 62.461 0.439 19947
3856 1 12 . 1 1 3 3 PRO CB C 3 32.100 32.100 32.600 -0.500 19947
3857 1 12 . 1 1 4 4 VAL N N 4 121.900 121.900 125.150 -3.250 19947
3858 1 12 . 1 1 4 4 VAL HA H 4 4.200 4.200 4.102 0.098 19947
3859 1 12 . 1 1 4 4 VAL CA C 4 62.300 62.300 62.317 -0.017 19947
3860 1 12 . 1 1 4 4 VAL CB C 4 32.800 32.800 31.283 1.517 19947
3861 1 12 . 1 1 4 4 VAL H H 4 8.330 8.330 8.427 -0.097 19947
3862 1 12 . 1 1 5 5 CYS N N 5 120.900 120.900 127.465 -6.565 19947
3863 1 12 . 1 1 5 5 CYS HA H 5 4.700 4.700 4.351 0.349 19947
3864 1 12 . 1 1 5 5 CYS CA C 5 53.600 53.600 59.104 -5.504 19947
3865 1 12 . 1 1 5 5 CYS H H 5 8.500 8.500 8.602 -0.102 19947
3866 1 12 . 1 1 6 6 GLY N N 6 110.200 110.200 113.808 -3.608 19947
3867 1 12 . 1 1 6 6 GLY CA C 6 46.300 46.300 44.691 1.609 19947
3868 1 12 . 1 1 6 6 GLY H H 6 8.490 8.490 8.422 0.068 19947
3869 1 12 . 1 1 7 7 ASN N N 7 120.100 120.100 116.847 3.253 19947
3870 1 12 . 1 1 7 7 ASN HA H 7 4.730 4.730 4.326 0.404 19947
3871 1 12 . 1 1 7 7 ASN CA C 7 53.200 53.200 54.255 -1.055 19947
3872 1 12 . 1 1 7 7 ASN CB C 7 38.700 38.700 39.241 -0.541 19947
3873 1 12 . 1 1 7 7 ASN H H 7 8.320 8.320 8.190 0.130 19947
3874 1 12 . 1 1 8 8 LYS N N 8 121.300 121.300 124.410 -3.110 19947
3875 1 12 . 1 1 8 8 LYS HA H 8 4.340 4.340 4.185 0.155 19947
3876 1 12 . 1 1 8 8 LYS CA C 8 56.600 56.600 56.941 -0.341 19947
3877 1 12 . 1 1 8 8 LYS CB C 8 32.900 32.900 31.573 1.327 19947
3878 1 12 . 1 1 8 8 LYS H H 8 8.260 8.260 8.465 -0.205 19947
3879 1 12 . 1 1 9 9 ILE N N 9 136.600 136.600 122.952 13.648 19947
3880 1 12 . 1 1 9 9 ILE HA H 9 4.140 4.140 3.991 0.149 19947
3881 1 12 . 1 1 9 9 ILE CA C 9 61.300 61.300 62.708 -1.408 19947
3882 1 12 . 1 1 9 9 ILE CB C 9 38.200 38.200 37.910 0.290 19947
3883 1 12 . 1 1 9 9 ILE H H 9 8.150 8.150 8.172 -0.022 19947
3884 1 12 . 1 1 10 10 LEU N N 10 125.700 125.700 123.285 2.415 19947
3885 1 12 . 1 1 10 10 LEU HA H 10 4.420 4.420 4.475 -0.055 19947
3886 1 12 . 1 1 10 10 LEU CA C 10 55.200 55.200 55.390 -0.190 19947
3887 1 12 . 1 1 10 10 LEU CB C 10 42.300 42.300 41.168 1.132 19947
3888 1 12 . 1 1 10 10 LEU H H 10 8.230 8.230 8.660 -0.430 19947
3889 1 12 . 1 1 11 11 GLU N N 11 120.600 120.600 115.543 5.057 19947
3890 1 12 . 1 1 11 11 GLU HA H 11 4.470 4.470 4.124 0.346 19947
3891 1 12 . 1 1 11 11 GLU CA C 11 55.500 55.500 56.477 -0.978 19947
3892 1 12 . 1 1 11 11 GLU CB C 11 28.900 28.900 29.177 -0.277 19947
3893 1 12 . 1 1 11 11 GLU H H 11 8.250 8.250 8.132 0.118 19947
3894 1 12 . 1 1 12 12 GLN N N 12 121.600 121.600 119.169 2.431 19947
3895 1 12 . 1 1 12 12 GLN HA H 12 4.350 4.350 4.582 -0.232 19947
3896 1 12 . 1 1 12 12 GLN CA C 12 56.600 56.600 56.039 0.561 19947
3897 1 12 . 1 1 12 12 GLN CB C 12 29.200 29.200 29.964 -0.764 19947
3898 1 12 . 1 1 12 12 GLN H H 12 8.460 8.460 7.802 0.658 19947
3899 1 12 . 1 1 13 13 GLY N N 13 110.700 110.700 107.166 3.534 19947
3900 1 12 . 1 1 13 13 GLY CA C 13 45.700 45.700 45.511 0.188 19947
3901 1 12 . 1 1 13 13 GLY H H 13 8.660 8.660 8.714 -0.054 19947
3902 1 12 . 1 1 14 14 GLU N N 14 118.900 118.900 115.554 3.346 19947
3903 1 12 . 1 1 14 14 GLU HA H 14 4.530 4.530 4.239 0.290 19947
3904 1 12 . 1 1 14 14 GLU CA C 14 55.600 55.600 56.866 -1.266 19947
3905 1 12 . 1 1 14 14 GLU CB C 14 29.700 29.700 29.917 -0.217 19947
3906 1 12 . 1 1 14 14 GLU H H 14 8.230 8.230 8.343 -0.113 19947
3907 1 12 . 1 1 15 15 ASP N N 15 118.400 118.400 119.942 -1.542 19947
3908 1 12 . 1 1 15 15 ASP HA H 15 4.990 4.990 4.541 0.449 19947
3909 1 12 . 1 1 15 15 ASP CA C 15 53.500 53.500 56.841 -3.341 19947
3910 1 12 . 1 1 15 15 ASP CB C 15 39.700 39.700 41.697 -1.997 19947
3911 1 12 . 1 1 15 15 ASP H H 15 8.330 8.330 8.508 -0.178 19947
3912 1 12 . 1 1 16 16 CYS HA H 16 4.340 4.340 4.466 -0.126 19947
3913 1 12 . 1 1 16 16 CYS H H 16 8.510 8.510 7.665 0.845 19947
3914 1 12 . 1 1 17 17 ASP N N 17 116.700 116.700 118.507 -1.807 19947
3915 1 12 . 1 1 17 17 ASP HA H 17 4.740 4.740 4.134 0.606 19947
3916 1 12 . 1 1 17 17 ASP CA C 17 53.100 53.100 55.228 -2.128 19947
3917 1 12 . 1 1 17 17 ASP CB C 17 38.600 38.600 38.346 0.254 19947
3918 1 12 . 1 1 17 17 ASP H H 17 8.180 8.180 8.810 -0.630 19947
3919 1 12 . 1 1 18 18 CYS HA H 18 4.730 4.730 3.956 0.774 19947
3920 1 12 . 1 1 18 18 CYS CB C 18 41.900 41.900 26.460 15.440 19947
3921 1 12 . 1 1 19 19 GLY H H 19 8.220 8.220 8.800 -0.580 19947
3922 1 12 . 1 1 20 20 SER HA H 20 4.920 4.920 4.405 0.515 19947
3923 1 12 . 1 1 20 20 SER CA C 20 55.700 55.700 57.476 -1.776 19947
3924 1 12 . 1 1 20 20 SER CB C 20 63.500 63.500 63.046 0.454 19947
3925 1 12 . 1 1 20 20 SER H H 20 7.830 7.830 8.497 -0.667 19947
3926 1 12 . 1 1 21 21 PRO HA H 21 4.240 4.240 4.203 0.037 19947
3927 1 12 . 1 1 21 21 PRO CA C 21 63.400 63.400 64.945 -1.545 19947
3928 1 12 . 1 1 21 21 PRO CB C 21 31.800 31.800 31.428 0.372 19947
3929 1 12 . 1 1 22 22 ALA N N 22 119.900 119.900 118.219 1.681 19947
3930 1 12 . 1 1 22 22 ALA HA H 22 4.220 4.220 4.099 0.121 19947
3931 1 12 . 1 1 22 22 ALA CA C 22 54.200 54.200 54.032 0.168 19947
3932 1 12 . 1 1 22 22 ALA CB C 22 18.500 18.500 18.675 -0.175 19947
3933 1 12 . 1 1 22 22 ALA H H 22 8.180 8.180 8.263 -0.083 19947
3934 1 12 . 1 1 23 23 ASN N N 23 116.300 116.300 112.590 3.710 19947
3935 1 12 . 1 1 23 23 ASN HA H 23 4.670 4.670 4.877 -0.207 19947
3936 1 12 . 1 1 23 23 ASN CA C 23 53.200 53.200 52.685 0.515 19947
3937 1 12 . 1 1 23 23 ASN CB C 23 39.300 39.300 40.015 -0.715 19947
3938 1 12 . 1 1 23 23 ASN H H 23 7.960 7.960 8.136 -0.176 19947
3939 1 12 . 1 1 24 24 CYS HA H 24 4.720 4.720 4.164 0.556 19947
3940 1 12 . 1 1 24 24 CYS H H 24 8.510 8.510 7.611 0.899 19947
3941 1 12 . 1 1 25 25 GLN HA H 25 4.460 4.460 3.967 0.493 19947
3942 1 12 . 1 1 25 25 GLN H H 25 8.320 8.320 8.382 -0.062 19947
3943 1 12 . 1 1 26 26 ASP HA H 26 4.740 4.740 4.629 0.111 19947
3944 1 12 . 1 1 26 26 ASP H H 26 8.580 8.580 8.276 0.304 19947
3945 1 12 . 1 1 27 27 ARG HA H 27 4.680 4.680 4.383 0.297 19947
3946 1 12 . 1 1 27 27 ARG CA C 27 54.700 54.700 57.425 -2.725 19947
3947 1 12 . 1 1 27 27 ARG H H 27 8.550 8.550 7.805 0.745 19947
3948 1 12 . 1 1 28 28 CYS HA H 28 4.120 4.120 4.719 -0.599 19947
3949 1 12 . 1 1 28 28 CYS CA C 28 54.400 54.400 57.968 -3.568 19947
3950 1 12 . 1 1 28 28 CYS CB C 28 19.000 19.000 26.180 -7.180 19947
3951 1 12 . 1 1 28 28 CYS H H 28 8.910 8.910 8.377 0.533 19947
3952 1 12 . 1 1 29 29 CYS N N 29 113.300 113.300 119.670 -6.370 19947
3953 1 12 . 1 1 29 29 CYS HA H 29 5.010 5.010 4.826 0.184 19947
3954 1 12 . 1 1 29 29 CYS CA C 29 54.300 54.300 56.515 -2.215 19947
3955 1 12 . 1 1 29 29 CYS H H 29 7.730 7.730 7.701 0.029 19947
3956 1 12 . 1 1 30 30 ASN HA H 30 4.730 4.730 5.033 -0.303 19947
3957 1 12 . 1 1 30 30 ASN CB C 30 38.700 38.700 40.074 -1.374 19947
3958 1 12 . 1 1 30 30 ASN H H 30 8.870 8.870 8.951 -0.081 19947
3959 1 12 . 1 1 31 31 ALA N N 31 129.400 129.400 126.150 3.250 19947
3960 1 12 . 1 1 31 31 ALA HA H 31 4.120 4.120 4.327 -0.207 19947
3961 1 12 . 1 1 31 31 ALA CA C 31 54.400 54.400 54.738 -0.338 19947
3962 1 12 . 1 1 31 31 ALA CB C 31 19.000 19.000 19.233 -0.233 19947
3963 1 12 . 1 1 31 31 ALA H H 31 8.890 8.890 8.414 0.476 19947
3964 1 12 . 1 1 32 32 ALA N N 32 116.400 116.400 118.420 -2.020 19947
3965 1 12 . 1 1 32 32 ALA HA H 32 4.340 4.340 4.334 0.006 19947
3966 1 12 . 1 1 32 32 ALA CA C 32 53.800 53.800 53.832 -0.032 19947
3967 1 12 . 1 1 32 32 ALA CB C 32 19.100 19.100 18.468 0.631 19947
3968 1 12 . 1 1 32 32 ALA H H 32 8.250 8.250 8.316 -0.066 19947
3969 1 12 . 1 1 33 33 THR N N 33 104.300 104.300 110.195 -5.895 19947
3970 1 12 . 1 1 33 33 THR HA H 33 4.430 4.430 4.415 0.015 19947
3971 1 12 . 1 1 33 33 THR CA C 33 60.500 60.500 60.580 -0.080 19947
3972 1 12 . 1 1 33 33 THR CB C 33 70.600 70.600 69.605 0.995 19947
3973 1 12 . 1 1 33 33 THR H H 33 7.320 7.320 7.435 -0.115 19947
3974 1 12 . 1 1 34 34 CYS N N 34 123.400 123.400 121.171 2.229 19947
3975 1 12 . 1 1 34 34 CYS HA H 34 4.170 4.170 4.300 -0.130 19947
3976 1 12 . 1 1 34 34 CYS CA C 34 56.500 56.500 60.022 -3.522 19947
3977 1 12 . 1 1 34 34 CYS H H 34 8.710 8.710 8.077 0.633 19947
3978 1 12 . 1 1 35 35 LYS N N 35 116.900 116.900 116.973 -0.073 19947
3979 1 12 . 1 1 35 35 LYS HA H 35 4.960 4.960 4.794 0.166 19947
3980 1 12 . 1 1 35 35 LYS CA C 35 53.900 53.900 55.414 -1.514 19947
3981 1 12 . 1 1 35 35 LYS CB C 35 35.900 35.900 35.961 -0.061 19947
3982 1 12 . 1 1 35 35 LYS H H 35 7.450 7.450 7.955 -0.505 19947
3983 1 12 . 1 1 36 36 LEU N N 36 119.300 119.300 117.205 2.095 19947
3984 1 12 . 1 1 36 36 LEU HA H 36 4.800 4.800 4.576 0.224 19947
3985 1 12 . 1 1 36 36 LEU CB C 36 42.400 42.400 42.665 -0.265 19947
3986 1 12 . 1 1 36 36 LEU H H 36 8.290 8.290 8.454 -0.164 19947
3987 1 12 . 1 1 37 37 THR HA H 37 4.340 4.340 4.779 -0.439 19947
3988 1 12 . 1 1 37 37 THR CA C 37 60.200 60.200 59.093 1.107 19947
3989 1 12 . 1 1 37 37 THR CB C 37 67.700 67.700 68.577 -0.877 19947
3990 1 12 . 1 1 37 37 THR H H 37 8.380 8.380 8.079 0.301 19947
3991 1 12 . 1 1 38 38 PRO HA H 38 4.380 4.380 4.158 0.222 19947
3992 1 12 . 1 1 38 38 PRO CA C 38 64.800 64.800 63.927 0.873 19947
3993 1 12 . 1 1 38 38 PRO CB C 38 31.500 31.500 31.553 -0.053 19947
3994 1 12 . 1 1 39 39 GLY N N 39 113.300 113.300 113.479 -0.179 19947
3995 1 12 . 1 1 39 39 GLY CA C 39 45.100 45.100 44.727 0.373 19947
3996 1 12 . 1 1 39 39 GLY H H 39 8.830 8.830 8.371 0.459 19947
3997 1 12 . 1 1 40 40 SER N N 40 116.700 116.700 117.287 -0.587 19947
3998 1 12 . 1 1 40 40 SER HA H 40 4.610 4.610 4.518 0.092 19947
3999 1 12 . 1 1 40 40 SER CA C 40 58.800 58.800 59.115 -0.315 19947
4000 1 12 . 1 1 40 40 SER CB C 40 63.800 63.800 63.617 0.183 19947
4001 1 12 . 1 1 40 40 SER H H 40 8.280 8.280 7.835 0.445 19947
4002 1 12 . 1 1 41 41 GLN N N 41 120.600 120.600 124.652 -4.052 19947
4003 1 12 . 1 1 41 41 GLN HA H 41 4.110 4.110 4.097 0.013 19947
4004 1 12 . 1 1 41 41 GLN CA C 41 55.200 55.200 57.452 -2.252 19947
4005 1 12 . 1 1 41 41 GLN CB C 41 31.100 31.100 29.541 1.559 19947
4006 1 12 . 1 1 41 41 GLN H H 41 9.190 9.190 8.235 0.955 19947
4007 1 12 . 1 1 42 42 CYS N N 42 113.200 113.200 113.652 -0.452 19947
4008 1 12 . 1 1 42 42 CYS HA H 42 4.630 4.630 4.647 -0.017 19947
4009 1 12 . 1 1 42 42 CYS CA C 42 53.700 53.700 55.930 -2.230 19947
4010 1 12 . 1 1 42 42 CYS CB C 42 45.500 45.500 30.611 14.889 19947
4011 1 12 . 1 1 42 42 CYS H H 42 7.710 7.710 7.692 0.017 19947
4012 1 12 . 1 1 43 43 ASN N N 43 114.200 114.200 118.531 -4.331 19947
4013 1 12 . 1 1 43 43 ASN HA H 43 4.940 4.940 4.660 0.280 19947
4014 1 12 . 1 1 43 43 ASN CA C 43 53.000 53.000 54.535 -1.535 19947
4015 1 12 . 1 1 43 43 ASN CB C 43 39.300 39.300 39.283 0.017 19947
4016 1 12 . 1 1 43 43 ASN H H 43 8.870 8.870 8.876 -0.006 19947
4017 1 12 . 1 1 44 44 TYR N N 44 118.400 118.400 112.166 6.234 19947
4018 1 12 . 1 1 44 44 TYR HA H 44 4.850 4.850 4.569 0.281 19947
4019 1 12 . 1 1 44 44 TYR CA C 44 55.300 55.300 57.291 -1.991 19947
4020 1 12 . 1 1 44 44 TYR CB C 44 40.700 40.700 39.261 1.439 19947
4021 1 12 . 1 1 44 44 TYR H H 44 7.840 7.840 7.085 0.755 19947
4022 1 12 . 1 1 45 45 GLY N N 45 110.600 110.600 107.819 2.781 19947
4023 1 12 . 1 1 45 45 GLY CA C 45 44.000 44.000 44.998 -0.998 19947
4024 1 12 . 1 1 45 45 GLY H H 45 7.960 7.960 7.884 0.076 19947
4025 1 12 . 1 1 46 46 GLU N N 46 120.700 120.700 119.340 1.360 19947
4026 1 12 . 1 1 46 46 GLU HA H 46 4.280 4.280 4.128 0.152 19947
4027 1 12 . 1 1 46 46 GLU CA C 46 58.500 58.500 60.185 -1.685 19947
4028 1 12 . 1 1 46 46 GLU CB C 46 29.300 29.300 30.066 -0.766 19947
4029 1 12 . 1 1 46 46 GLU H H 46 9.160 9.160 8.671 0.489 19947
4030 1 12 . 1 1 47 47 CYS N N 47 112.400 112.400 115.858 -3.458 19947
4031 1 12 . 1 1 47 47 CYS HA H 47 4.850 4.850 4.678 0.172 19947
4032 1 12 . 1 1 47 47 CYS CA C 47 57.100 57.100 59.294 -2.194 19947
4033 1 12 . 1 1 47 47 CYS CB C 47 41.200 41.200 26.651 14.549 19947
4034 1 12 . 1 1 47 47 CYS H H 47 8.510 8.510 7.496 1.014 19947
4035 1 12 . 1 1 48 48 CYS N N 48 123.200 123.200 120.557 2.643 19947
4036 1 12 . 1 1 48 48 CYS HA H 48 5.160 5.160 4.847 0.313 19947
4037 1 12 . 1 1 48 48 CYS CA C 48 54.700 54.700 60.794 -6.094 19947
4038 1 12 . 1 1 48 48 CYS CB C 48 45.700 45.700 27.357 18.343 19947
4039 1 12 . 1 1 48 48 CYS H H 48 7.810 7.810 8.084 -0.274 19947
4040 1 12 . 1 1 49 49 ASP N N 49 127.400 127.400 126.599 0.801 19947
4041 1 12 . 1 1 49 49 ASP HA H 49 4.890 4.890 4.960 -0.070 19947
4042 1 12 . 1 1 49 49 ASP CA C 49 53.500 53.500 53.789 -0.289 19947
4043 1 12 . 1 1 49 49 ASP CB C 49 42.400 42.400 43.508 -1.108 19947
4044 1 12 . 1 1 49 49 ASP H H 49 9.670 9.670 8.821 0.849 19947
4045 1 12 . 1 1 50 50 GLN N N 50 127.000 127.000 121.584 5.416 19947
4046 1 12 . 1 1 50 50 GLN HA H 50 3.940 3.940 3.944 -0.004 19947
4047 1 12 . 1 1 50 50 GLN CA C 50 56.800 56.800 59.092 -2.292 19947
4048 1 12 . 1 1 50 50 GLN CB C 50 26.500 26.500 28.155 -1.655 19947
4049 1 12 . 1 1 50 50 GLN H H 50 9.450 9.450 8.836 0.614 19947
4050 1 12 . 1 1 51 51 CYS N N 51 106.100 106.100 117.699 -11.599 19947
4051 1 12 . 1 1 51 51 CYS HA H 51 4.760 4.760 4.806 -0.046 19947
4052 1 12 . 1 1 51 51 CYS CB C 51 43.200 43.200 28.398 14.802 19947
4053 1 12 . 1 1 51 51 CYS H H 51 8.700 8.700 8.203 0.497 19947
4054 1 12 . 1 1 52 52 ARG N N 52 121.000 121.000 118.780 2.220 19947
4055 1 12 . 1 1 52 52 ARG HA H 52 4.690 4.690 4.421 0.269 19947
4056 1 12 . 1 1 52 52 ARG CA C 52 55.400 55.400 54.997 0.403 19947
4057 1 12 . 1 1 52 52 ARG CB C 52 33.100 33.100 34.140 -1.040 19947
4058 1 12 . 1 1 52 52 ARG H H 52 7.960 7.960 7.735 0.225 19947
4059 1 12 . 1 1 53 53 PHE N N 53 120.300 120.300 119.567 0.733 19947
4060 1 12 . 1 1 53 53 PHE HA H 53 5.050 5.050 5.295 -0.245 19947
4061 1 12 . 1 1 53 53 PHE CA C 53 56.100 56.100 56.119 -0.019 19947
4062 1 12 . 1 1 53 53 PHE CB C 53 38.200 38.200 39.549 -1.349 19947
4063 1 12 . 1 1 53 53 PHE H H 53 8.400 8.400 8.396 0.004 19947
4064 1 12 . 1 1 54 54 LYS N N 54 123.300 123.300 123.592 -0.292 19947
4065 1 12 . 1 1 54 54 LYS HA H 54 4.250 4.250 4.273 -0.023 19947
4066 1 12 . 1 1 54 54 LYS CA C 54 57.500 57.500 55.766 1.734 19947
4067 1 12 . 1 1 54 54 LYS CB C 54 34.300 34.300 31.894 2.406 19947
4068 1 12 . 1 1 54 54 LYS H H 54 8.540 8.540 8.939 -0.399 19947
4069 1 12 . 1 1 55 55 LYS N N 55 119.400 119.400 124.911 -5.511 19947
4070 1 12 . 1 1 55 55 LYS HA H 55 4.110 4.110 3.996 0.114 19947
4071 1 12 . 1 1 55 55 LYS CA C 55 56.500 56.500 56.905 -0.405 19947
4072 1 12 . 1 1 55 55 LYS CB C 55 33.400 33.400 32.971 0.429 19947
4073 1 12 . 1 1 55 55 LYS H H 55 8.440 8.440 8.498 -0.058 19947
4074 1 12 . 1 1 56 56 ALA N N 56 126.700 126.700 127.315 -0.615 19947
4075 1 12 . 1 1 56 56 ALA HA H 56 3.920 3.920 4.070 -0.150 19947
4076 1 12 . 1 1 56 56 ALA CA C 56 52.900 52.900 53.683 -0.783 19947
4077 1 12 . 1 1 56 56 ALA CB C 56 18.100 18.100 18.201 -0.101 19947
4078 1 12 . 1 1 56 56 ALA H H 56 8.930 8.930 8.546 0.384 19947
4079 1 12 . 1 1 57 57 GLY N N 57 109.300 109.300 111.441 -2.141 19947
4080 1 12 . 1 1 57 57 GLY CA C 57 45.100 45.100 44.787 0.313 19947
4081 1 12 . 1 1 57 57 GLY H H 57 8.460 8.460 8.449 0.011 19947
4082 1 12 . 1 1 58 58 THR N N 58 117.200 117.200 120.271 -3.071 19947
4083 1 12 . 1 1 58 58 THR HA H 58 4.260 4.260 4.416 -0.156 19947
4084 1 12 . 1 1 58 58 THR CA C 58 63.300 63.300 63.673 -0.373 19947
4085 1 12 . 1 1 58 58 THR CB C 58 69.600 69.600 69.402 0.198 19947
4086 1 12 . 1 1 58 58 THR H H 58 7.660 7.660 7.779 -0.119 19947
4087 1 12 . 1 1 59 59 VAL N N 59 130.400 130.400 127.857 2.543 19947
4088 1 12 . 1 1 59 59 VAL HA H 59 3.900 3.900 4.116 -0.216 19947
4089 1 12 . 1 1 59 59 VAL CA C 59 64.400 64.400 61.930 2.470 19947
4090 1 12 . 1 1 59 59 VAL CB C 59 31.900 31.900 31.764 0.136 19947
4091 1 12 . 1 1 59 59 VAL H H 59 9.190 9.190 8.786 0.404 19947
4092 1 12 . 1 1 60 60 CYS N N 60 121.800 121.800 126.780 -4.980 19947
4093 1 12 . 1 1 60 60 CYS HA H 60 5.050 5.050 4.557 0.493 19947
4094 1 12 . 1 1 60 60 CYS CA C 60 54.400 54.400 58.452 -4.052 19947
4095 1 12 . 1 1 60 60 CYS CB C 60 43.000 43.000 27.590 15.410 19947
4096 1 12 . 1 1 60 60 CYS H H 60 9.130 9.130 8.233 0.897 19947
4097 1 12 . 1 1 61 61 ARG N N 61 124.100 124.100 118.574 5.526 19947
4098 1 12 . 1 1 61 61 ARG HA H 61 4.360 4.360 4.629 -0.269 19947
4099 1 12 . 1 1 61 61 ARG CA C 61 56.800 56.800 55.297 1.503 19947
4100 1 12 . 1 1 61 61 ARG CB C 61 32.800 32.800 34.324 -1.524 19947
4101 1 12 . 1 1 61 61 ARG H H 61 7.580 7.580 7.558 0.022 19947
4102 1 12 . 1 1 62 62 ILE N N 62 126.200 126.200 116.585 9.615 19947
4103 1 12 . 1 1 62 62 ILE HA H 62 4.090 4.090 4.545 -0.455 19947
4104 1 12 . 1 1 62 62 ILE CA C 62 60.300 60.300 61.440 -1.140 19947
4105 1 12 . 1 1 62 62 ILE CB C 62 38.700 38.700 40.753 -2.053 19947
4106 1 12 . 1 1 62 62 ILE H H 62 8.490 8.490 8.525 -0.035 19947
4107 1 12 . 1 1 63 63 ALA N N 63 129.400 129.400 131.890 -2.490 19947
4108 1 12 . 1 1 63 63 ALA HA H 63 4.310 4.310 4.435 -0.125 19947
4109 1 12 . 1 1 63 63 ALA CA C 63 51.900 51.900 54.156 -2.256 19947
4110 1 12 . 1 1 63 63 ALA CB C 63 20.600 20.600 19.116 1.484 19947
4111 1 12 . 1 1 63 63 ALA H H 63 8.100 8.100 8.571 -0.471 19947
4112 1 12 . 1 1 64 64 ARG N N 64 120.500 120.500 121.020 -0.520 19947
4113 1 12 . 1 1 64 64 ARG HA H 64 4.290 4.290 4.497 -0.207 19947
4114 1 12 . 1 1 64 64 ARG CA C 64 56.200 56.200 55.898 0.302 19947
4115 1 12 . 1 1 64 64 ARG CB C 64 30.500 30.500 30.153 0.347 19947
4116 1 12 . 1 1 64 64 ARG H H 64 8.140 8.140 8.775 -0.635 19947
4117 1 12 . 1 1 65 65 GLY N N 65 110.500 110.500 112.043 -1.543 19947
4118 1 12 . 1 1 65 65 GLY CA C 65 45.100 45.100 44.512 0.588 19947
4119 1 12 . 1 1 65 65 GLY H H 65 8.040 8.040 8.308 -0.268 19947
4120 1 12 . 1 1 66 66 ASP N N 66 120.700 120.700 119.033 1.667 19947
4121 1 12 . 1 1 66 66 ASP HA H 66 4.610 4.610 4.507 0.103 19947
4122 1 12 . 1 1 66 66 ASP CA C 66 53.300 53.300 54.254 -0.954 19947
4123 1 12 . 1 1 66 66 ASP CB C 66 37.600 37.600 41.036 -3.436 19947
4124 1 12 . 1 1 66 66 ASP H H 66 8.380 8.380 7.150 1.230 19947
4125 1 12 . 1 1 67 67 TRP N N 67 120.100 120.100 122.600 -2.500 19947
4126 1 12 . 1 1 67 67 TRP HA H 67 4.760 4.760 5.157 -0.397 19947
4127 1 12 . 1 1 67 67 TRP CA C 67 57.200 57.200 58.142 -0.941 19947
4128 1 12 . 1 1 67 67 TRP CB C 67 29.100 29.100 29.732 -0.632 19947
4129 1 12 . 1 1 67 67 TRP H H 67 7.950 7.950 7.820 0.130 19947
4130 1 12 . 1 1 68 68 ASN N N 68 118.400 118.400 117.420 0.980 19947
4131 1 12 . 1 1 68 68 ASN HA H 68 4.790 4.790 4.981 -0.191 19947
4132 1 12 . 1 1 68 68 ASN CA C 68 52.800 52.800 53.783 -0.983 19947
4133 1 12 . 1 1 68 68 ASN CB C 68 39.300 39.300 40.476 -1.176 19947
4134 1 12 . 1 1 68 68 ASN H H 68 8.180 8.180 8.717 -0.537 19947
4135 1 12 . 1 1 69 69 ASP N N 69 118.500 118.500 118.231 0.269 19947
4136 1 12 . 1 1 69 69 ASP HA H 69 4.620 4.620 4.442 0.178 19947
4137 1 12 . 1 1 69 69 ASP CA C 69 53.200 53.200 55.891 -2.691 19947
4138 1 12 . 1 1 69 69 ASP CB C 69 38.000 38.000 40.542 -2.542 19947
4139 1 12 . 1 1 69 69 ASP H H 69 8.130 8.130 8.375 -0.245 19947
4140 1 12 . 1 1 70 70 ASP N N 70 120.500 120.500 121.000 -0.500 19947
4141 1 12 . 1 1 70 70 ASP HA H 70 5.100 5.100 5.316 -0.216 19947
4142 1 12 . 1 1 70 70 ASP CA C 70 52.500 52.500 52.920 -0.420 19947
4143 1 12 . 1 1 70 70 ASP CB C 70 42.600 42.600 43.053 -0.453 19947
4144 1 12 . 1 1 70 70 ASP H H 70 8.140 8.140 8.096 0.044 19947
4145 1 12 . 1 1 71 71 TYR N N 71 118.900 118.900 123.680 -4.780 19947
4146 1 12 . 1 1 71 71 TYR HA H 71 5.210 5.210 5.166 0.044 19947
4147 1 12 . 1 1 71 71 TYR CA C 71 56.300 56.300 56.817 -0.517 19947
4148 1 12 . 1 1 71 71 TYR CB C 71 42.200 42.200 42.657 -0.457 19947
4149 1 12 . 1 1 71 71 TYR H H 71 8.450 8.450 8.327 0.123 19947
4150 1 12 . 1 1 72 72 CYS N N 72 119.800 119.800 121.946 -2.146 19947
4151 1 12 . 1 1 72 72 CYS HA H 72 4.900 4.900 4.540 0.360 19947
4152 1 12 . 1 1 72 72 CYS CA C 72 53.400 53.400 59.087 -5.687 19947
4153 1 12 . 1 1 72 72 CYS CB C 72 37.200 37.200 29.177 8.023 19947
4154 1 12 . 1 1 72 72 CYS H H 72 9.330 9.330 8.707 0.623 19947
4155 1 12 . 1 1 73 73 THR N N 73 112.700 112.700 114.662 -1.962 19947
4156 1 12 . 1 1 73 73 THR HA H 73 4.430 4.430 4.456 -0.026 19947
4157 1 12 . 1 1 73 73 THR CA C 73 62.300 62.300 61.138 1.162 19947
4158 1 12 . 1 1 73 73 THR CB C 73 71.300 71.300 69.732 1.568 19947
4159 1 12 . 1 1 73 73 THR H H 73 9.980 9.980 8.713 1.267 19947
4160 1 12 . 1 1 74 74 GLY N N 74 111.500 111.500 110.726 0.774 19947
4161 1 12 . 1 1 74 74 GLY CA C 74 45.300 45.300 46.555 -1.255 19947
4162 1 12 . 1 1 74 74 GLY H H 74 8.580 8.580 7.763 0.817 19947
4163 1 12 . 1 1 75 75 LYS N N 75 115.900 115.900 116.744 -0.844 19947
4164 1 12 . 1 1 75 75 LYS HA H 75 4.140 4.140 4.722 -0.582 19947
4165 1 12 . 1 1 75 75 LYS CA C 75 54.800 54.800 55.541 -0.741 19947
4166 1 12 . 1 1 75 75 LYS CB C 75 34.200 34.200 34.668 -0.468 19947
4167 1 12 . 1 1 75 75 LYS H H 75 7.900 7.900 7.524 0.376 19947
4168 1 12 . 1 1 76 76 SER N N 76 111.000 111.000 112.953 -1.953 19947
4169 1 12 . 1 1 76 76 SER HA H 76 4.160 4.160 4.040 0.120 19947
4170 1 12 . 1 1 76 76 SER CA C 76 61.400 61.400 56.909 4.491 19947
4171 1 12 . 1 1 76 76 SER CB C 76 64.300 64.300 65.589 -1.289 19947
4172 1 12 . 1 1 76 76 SER H H 76 6.520 6.520 6.911 -0.391 19947
4173 1 12 . 1 1 77 77 SER N N 77 117.100 117.100 113.926 3.174 19947
4174 1 12 . 1 1 77 77 SER HA H 77 4.220 4.220 4.297 -0.077 19947
4175 1 12 . 1 1 77 77 SER CA C 77 59.800 59.800 58.882 0.918 19947
4176 1 12 . 1 1 77 77 SER CB C 77 64.400 64.400 63.641 0.759 19947
4177 1 12 . 1 1 77 77 SER H H 77 9.030 9.030 8.454 0.576 19947
4178 1 12 . 1 1 78 78 ASP N N 78 122.100 122.100 119.452 2.648 19947
4179 1 12 . 1 1 78 78 ASP HA H 78 4.930 4.930 4.760 0.170 19947
4180 1 12 . 1 1 78 78 ASP CA C 78 52.400 52.400 52.503 -0.103 19947
4181 1 12 . 1 1 78 78 ASP CB C 78 40.800 40.800 42.679 -1.879 19947
4182 1 12 . 1 1 78 78 ASP H H 78 8.340 8.340 7.584 0.756 19947
4183 1 12 . 1 1 79 79 CYS N N 79 122.200 122.200 121.971 0.229 19947
4184 1 12 . 1 1 79 79 CYS HA H 79 5.320 5.320 4.737 0.583 19947
4185 1 12 . 1 1 79 79 CYS CA C 79 52.000 52.000 56.130 -4.130 19947
4186 1 12 . 1 1 79 79 CYS CB C 79 39.300 39.300 27.173 12.127 19947
4187 1 12 . 1 1 79 79 CYS H H 79 8.960 8.960 8.771 0.189 19947
4188 1 12 . 1 1 80 80 PRO HA H 80 4.410 4.410 4.550 -0.140 19947
4189 1 12 . 1 1 80 80 PRO CA C 80 63.500 63.500 63.117 0.383 19947
4190 1 12 . 1 1 80 80 PRO CB C 80 32.400 32.400 32.253 0.147 19947
4191 1 12 . 1 1 81 81 TRP N N 81 120.500 120.500 120.999 -0.499 19947
4192 1 12 . 1 1 81 81 TRP HA H 81 4.550 4.550 4.671 -0.121 19947
4193 1 12 . 1 1 81 81 TRP CA C 81 56.400 56.400 53.951 2.449 19947
4194 1 12 . 1 1 81 81 TRP CB C 81 29.500 29.500 28.480 1.020 19947
4195 1 12 . 1 1 81 81 TRP H H 81 8.400 8.400 8.385 0.015 19947
4196 1 12 . 1 1 82 82 ASN N N 82 120.400 120.400 116.246 4.154 19947
4197 1 12 . 1 1 82 82 ASN HA H 82 4.750 4.750 4.430 0.320 19947
4198 1 12 . 1 1 82 82 ASN CA C 82 53.100 53.100 53.970 -0.870 19947
4199 1 12 . 1 1 82 82 ASN CB C 82 39.000 39.000 36.717 2.283 19947
4200 1 12 . 1 1 82 82 ASN H H 82 8.040 8.040 8.462 -0.422 19947
4201 1 13 . 1 1 2 2 PRO HA H 2 4.820 4.820 4.672 0.148 19947
4202 1 13 . 1 1 2 2 PRO CA C 2 61.900 61.900 62.197 -0.297 19947
4203 1 13 . 1 1 2 2 PRO CB C 2 30.700 30.700 31.563 -0.863 19947
4204 1 13 . 1 1 3 3 PRO HA H 3 4.540 4.540 4.387 0.153 19947
4205 1 13 . 1 1 3 3 PRO CA C 3 62.900 62.900 62.505 0.395 19947
4206 1 13 . 1 1 3 3 PRO CB C 3 32.100 32.100 32.140 -0.040 19947
4207 1 13 . 1 1 4 4 VAL N N 4 121.900 121.900 126.371 -4.471 19947
4208 1 13 . 1 1 4 4 VAL HA H 4 4.200 4.200 4.192 0.008 19947
4209 1 13 . 1 1 4 4 VAL CA C 4 62.300 62.300 61.859 0.441 19947
4210 1 13 . 1 1 4 4 VAL CB C 4 32.800 32.800 31.448 1.352 19947
4211 1 13 . 1 1 4 4 VAL H H 4 8.330 8.330 8.367 -0.037 19947
4212 1 13 . 1 1 5 5 CYS N N 5 120.900 120.900 127.719 -6.819 19947
4213 1 13 . 1 1 5 5 CYS HA H 5 4.700 4.700 4.459 0.241 19947
4214 1 13 . 1 1 5 5 CYS CA C 5 53.600 53.600 58.188 -4.588 19947
4215 1 13 . 1 1 5 5 CYS H H 5 8.500 8.500 8.564 -0.064 19947
4216 1 13 . 1 1 6 6 GLY N N 6 110.200 110.200 113.710 -3.510 19947
4217 1 13 . 1 1 6 6 GLY CA C 6 46.300 46.300 44.677 1.623 19947
4218 1 13 . 1 1 6 6 GLY H H 6 8.490 8.490 8.420 0.070 19947
4219 1 13 . 1 1 7 7 ASN N N 7 120.100 120.100 116.938 3.162 19947
4220 1 13 . 1 1 7 7 ASN HA H 7 4.730 4.730 4.311 0.418 19947
4221 1 13 . 1 1 7 7 ASN CA C 7 53.200 53.200 54.412 -1.212 19947
4222 1 13 . 1 1 7 7 ASN CB C 7 38.700 38.700 39.389 -0.689 19947
4223 1 13 . 1 1 7 7 ASN H H 7 8.320 8.320 8.185 0.135 19947
4224 1 13 . 1 1 8 8 LYS N N 8 121.300 121.300 121.980 -0.680 19947
4225 1 13 . 1 1 8 8 LYS HA H 8 4.340 4.340 4.096 0.244 19947
4226 1 13 . 1 1 8 8 LYS CA C 8 56.600 56.600 56.868 -0.268 19947
4227 1 13 . 1 1 8 8 LYS CB C 8 32.900 32.900 31.101 1.799 19947
4228 1 13 . 1 1 8 8 LYS H H 8 8.260 8.260 8.525 -0.265 19947
4229 1 13 . 1 1 9 9 ILE N N 9 136.600 136.600 122.114 14.486 19947
4230 1 13 . 1 1 9 9 ILE HA H 9 4.140 4.140 3.971 0.169 19947
4231 1 13 . 1 1 9 9 ILE CA C 9 61.300 61.300 61.967 -0.667 19947
4232 1 13 . 1 1 9 9 ILE CB C 9 38.200 38.200 37.539 0.661 19947
4233 1 13 . 1 1 9 9 ILE H H 9 8.150 8.150 7.809 0.341 19947
4234 1 13 . 1 1 10 10 LEU N N 10 125.700 125.700 121.338 4.362 19947
4235 1 13 . 1 1 10 10 LEU HA H 10 4.420 4.420 4.502 -0.082 19947
4236 1 13 . 1 1 10 10 LEU CA C 10 55.200 55.200 55.224 -0.023 19947
4237 1 13 . 1 1 10 10 LEU CB C 10 42.300 42.300 40.276 2.024 19947
4238 1 13 . 1 1 10 10 LEU H H 10 8.230 8.230 8.587 -0.357 19947
4239 1 13 . 1 1 11 11 GLU N N 11 120.600 120.600 112.505 8.095 19947
4240 1 13 . 1 1 11 11 GLU HA H 11 4.470 4.470 4.278 0.192 19947
4241 1 13 . 1 1 11 11 GLU CA C 11 55.500 55.500 56.238 -0.738 19947
4242 1 13 . 1 1 11 11 GLU CB C 11 28.900 28.900 27.732 1.168 19947
4243 1 13 . 1 1 11 11 GLU H H 11 8.250 8.250 7.964 0.286 19947
4244 1 13 . 1 1 12 12 GLN N N 12 121.600 121.600 120.153 1.447 19947
4245 1 13 . 1 1 12 12 GLN HA H 12 4.350 4.350 4.558 -0.208 19947
4246 1 13 . 1 1 12 12 GLN CA C 12 56.600 56.600 56.054 0.546 19947
4247 1 13 . 1 1 12 12 GLN CB C 12 29.200 29.200 29.873 -0.673 19947
4248 1 13 . 1 1 12 12 GLN H H 12 8.460 8.460 8.297 0.163 19947
4249 1 13 . 1 1 13 13 GLY N N 13 110.700 110.700 106.326 4.374 19947
4250 1 13 . 1 1 13 13 GLY CA C 13 45.700 45.700 46.177 -0.477 19947
4251 1 13 . 1 1 13 13 GLY H H 13 8.660 8.660 8.580 0.080 19947
4252 1 13 . 1 1 14 14 GLU N N 14 118.900 118.900 116.333 2.567 19947
4253 1 13 . 1 1 14 14 GLU HA H 14 4.530 4.530 4.248 0.282 19947
4254 1 13 . 1 1 14 14 GLU CA C 14 55.600 55.600 56.417 -0.817 19947
4255 1 13 . 1 1 14 14 GLU CB C 14 29.700 29.700 29.880 -0.180 19947
4256 1 13 . 1 1 14 14 GLU H H 14 8.230 8.230 8.179 0.051 19947
4257 1 13 . 1 1 15 15 ASP N N 15 118.400 118.400 119.267 -0.867 19947
4258 1 13 . 1 1 15 15 ASP HA H 15 4.990 4.990 5.206 -0.216 19947
4259 1 13 . 1 1 15 15 ASP CA C 15 53.500 53.500 54.745 -1.245 19947
4260 1 13 . 1 1 15 15 ASP CB C 15 39.700 39.700 43.818 -4.118 19947
4261 1 13 . 1 1 15 15 ASP H H 15 8.330 8.330 8.474 -0.144 19947
4262 1 13 . 1 1 16 16 CYS HA H 16 4.340 4.340 4.477 -0.137 19947
4263 1 13 . 1 1 16 16 CYS H H 16 8.510 8.510 8.379 0.131 19947
4264 1 13 . 1 1 17 17 ASP N N 17 116.700 116.700 123.662 -6.962 19947
4265 1 13 . 1 1 17 17 ASP HA H 17 4.740 4.740 4.427 0.313 19947
4266 1 13 . 1 1 17 17 ASP CA C 17 53.100 53.100 55.488 -2.388 19947
4267 1 13 . 1 1 17 17 ASP CB C 17 38.600 38.600 39.474 -0.875 19947
4268 1 13 . 1 1 17 17 ASP H H 17 8.180 8.180 8.719 -0.539 19947
4269 1 13 . 1 1 18 18 CYS HA H 18 4.730 4.730 3.956 0.774 19947
4270 1 13 . 1 1 18 18 CYS CB C 18 41.900 41.900 27.115 14.785 19947
4271 1 13 . 1 1 19 19 GLY H H 19 8.220 8.220 8.790 -0.570 19947
4272 1 13 . 1 1 20 20 SER HA H 20 4.920 4.920 4.428 0.492 19947
4273 1 13 . 1 1 20 20 SER CA C 20 55.700 55.700 56.982 -1.282 19947
4274 1 13 . 1 1 20 20 SER CB C 20 63.500 63.500 62.738 0.762 19947
4275 1 13 . 1 1 20 20 SER H H 20 7.830 7.830 8.255 -0.425 19947
4276 1 13 . 1 1 21 21 PRO HA H 21 4.240 4.240 4.147 0.093 19947
4277 1 13 . 1 1 21 21 PRO CA C 21 63.400 63.400 64.976 -1.576 19947
4278 1 13 . 1 1 21 21 PRO CB C 21 31.800 31.800 31.414 0.386 19947
4279 1 13 . 1 1 22 22 ALA N N 22 119.900 119.900 117.043 2.857 19947
4280 1 13 . 1 1 22 22 ALA HA H 22 4.220 4.220 4.058 0.162 19947
4281 1 13 . 1 1 22 22 ALA CA C 22 54.200 54.200 53.830 0.370 19947
4282 1 13 . 1 1 22 22 ALA CB C 22 18.500 18.500 18.526 -0.026 19947
4283 1 13 . 1 1 22 22 ALA H H 22 8.180 8.180 8.176 0.004 19947
4284 1 13 . 1 1 23 23 ASN N N 23 116.300 116.300 113.568 2.732 19947
4285 1 13 . 1 1 23 23 ASN HA H 23 4.670 4.670 4.849 -0.179 19947
4286 1 13 . 1 1 23 23 ASN CA C 23 53.200 53.200 53.405 -0.205 19947
4287 1 13 . 1 1 23 23 ASN CB C 23 39.300 39.300 41.238 -1.938 19947
4288 1 13 . 1 1 23 23 ASN H H 23 7.960 7.960 8.144 -0.184 19947
4289 1 13 . 1 1 24 24 CYS HA H 24 4.720 4.720 4.263 0.457 19947
4290 1 13 . 1 1 24 24 CYS H H 24 8.510 8.510 7.471 1.039 19947
4291 1 13 . 1 1 25 25 GLN HA H 25 4.460 4.460 3.984 0.476 19947
4292 1 13 . 1 1 25 25 GLN H H 25 8.320 8.320 8.327 -0.007 19947
4293 1 13 . 1 1 26 26 ASP HA H 26 4.740 4.740 4.731 0.009 19947
4294 1 13 . 1 1 26 26 ASP H H 26 8.580 8.580 8.188 0.392 19947
4295 1 13 . 1 1 27 27 ARG HA H 27 4.680 4.680 4.299 0.381 19947
4296 1 13 . 1 1 27 27 ARG CA C 27 54.700 54.700 57.966 -3.266 19947
4297 1 13 . 1 1 27 27 ARG H H 27 8.550 8.550 8.423 0.127 19947
4298 1 13 . 1 1 28 28 CYS HA H 28 4.120 4.120 4.938 -0.818 19947
4299 1 13 . 1 1 28 28 CYS CA C 28 54.400 54.400 57.344 -2.945 19947
4300 1 13 . 1 1 28 28 CYS CB C 28 19.000 19.000 26.983 -7.984 19947
4301 1 13 . 1 1 28 28 CYS H H 28 8.910 8.910 8.203 0.707 19947
4302 1 13 . 1 1 29 29 CYS N N 29 113.300 113.300 121.135 -7.835 19947
4303 1 13 . 1 1 29 29 CYS HA H 29 5.010 5.010 4.654 0.356 19947
4304 1 13 . 1 1 29 29 CYS CA C 29 54.300 54.300 57.757 -3.457 19947
4305 1 13 . 1 1 29 29 CYS H H 29 7.730 7.730 7.992 -0.262 19947
4306 1 13 . 1 1 30 30 ASN HA H 30 4.730 4.730 5.048 -0.318 19947
4307 1 13 . 1 1 30 30 ASN CB C 30 38.700 38.700 39.876 -1.176 19947
4308 1 13 . 1 1 30 30 ASN H H 30 8.870 8.870 8.934 -0.064 19947
4309 1 13 . 1 1 31 31 ALA N N 31 129.400 129.400 126.581 2.819 19947
4310 1 13 . 1 1 31 31 ALA HA H 31 4.120 4.120 4.263 -0.143 19947
4311 1 13 . 1 1 31 31 ALA CA C 31 54.400 54.400 54.677 -0.277 19947
4312 1 13 . 1 1 31 31 ALA CB C 31 19.000 19.000 19.206 -0.206 19947
4313 1 13 . 1 1 31 31 ALA H H 31 8.890 8.890 8.544 0.346 19947
4314 1 13 . 1 1 32 32 ALA N N 32 116.400 116.400 118.184 -1.784 19947
4315 1 13 . 1 1 32 32 ALA HA H 32 4.340 4.340 4.309 0.031 19947
4316 1 13 . 1 1 32 32 ALA CA C 32 53.800 53.800 53.665 0.135 19947
4317 1 13 . 1 1 32 32 ALA CB C 32 19.100 19.100 18.850 0.250 19947
4318 1 13 . 1 1 32 32 ALA H H 32 8.250 8.250 8.409 -0.159 19947
4319 1 13 . 1 1 33 33 THR N N 33 104.300 104.300 110.509 -6.209 19947
4320 1 13 . 1 1 33 33 THR HA H 33 4.430 4.430 4.425 0.005 19947
4321 1 13 . 1 1 33 33 THR CA C 33 60.500 60.500 60.993 -0.493 19947
4322 1 13 . 1 1 33 33 THR CB C 33 70.600 70.600 69.248 1.352 19947
4323 1 13 . 1 1 33 33 THR H H 33 7.320 7.320 7.437 -0.117 19947
4324 1 13 . 1 1 34 34 CYS N N 34 123.400 123.400 120.600 2.800 19947
4325 1 13 . 1 1 34 34 CYS HA H 34 4.170 4.170 4.134 0.036 19947
4326 1 13 . 1 1 34 34 CYS CA C 34 56.500 56.500 59.937 -3.437 19947
4327 1 13 . 1 1 34 34 CYS H H 34 8.710 8.710 7.997 0.713 19947
4328 1 13 . 1 1 35 35 LYS N N 35 116.900 116.900 118.933 -2.033 19947
4329 1 13 . 1 1 35 35 LYS HA H 35 4.960 4.960 4.843 0.117 19947
4330 1 13 . 1 1 35 35 LYS CA C 35 53.900 53.900 55.014 -1.113 19947
4331 1 13 . 1 1 35 35 LYS CB C 35 35.900 35.900 35.755 0.145 19947
4332 1 13 . 1 1 35 35 LYS H H 35 7.450 7.450 7.752 -0.302 19947
4333 1 13 . 1 1 36 36 LEU N N 36 119.300 119.300 119.067 0.233 19947
4334 1 13 . 1 1 36 36 LEU HA H 36 4.800 4.800 4.847 -0.047 19947
4335 1 13 . 1 1 36 36 LEU CB C 36 42.400 42.400 43.023 -0.623 19947
4336 1 13 . 1 1 36 36 LEU H H 36 8.290 8.290 8.573 -0.283 19947
4337 1 13 . 1 1 37 37 THR HA H 37 4.340 4.340 4.626 -0.286 19947
4338 1 13 . 1 1 37 37 THR CA C 37 60.200 60.200 59.845 0.355 19947
4339 1 13 . 1 1 37 37 THR CB C 37 67.700 67.700 68.332 -0.632 19947
4340 1 13 . 1 1 37 37 THR H H 37 8.380 8.380 8.202 0.178 19947
4341 1 13 . 1 1 38 38 PRO HA H 38 4.380 4.380 4.138 0.242 19947
4342 1 13 . 1 1 38 38 PRO CA C 38 64.800 64.800 64.789 0.011 19947
4343 1 13 . 1 1 38 38 PRO CB C 38 31.500 31.500 31.559 -0.059 19947
4344 1 13 . 1 1 39 39 GLY N N 39 113.300 113.300 110.850 2.450 19947
4345 1 13 . 1 1 39 39 GLY CA C 39 45.100 45.100 44.758 0.342 19947
4346 1 13 . 1 1 39 39 GLY H H 39 8.830 8.830 8.654 0.176 19947
4347 1 13 . 1 1 40 40 SER N N 40 116.700 116.700 118.144 -1.444 19947
4348 1 13 . 1 1 40 40 SER HA H 40 4.610 4.610 4.344 0.266 19947
4349 1 13 . 1 1 40 40 SER CA C 40 58.800 58.800 58.270 0.530 19947
4350 1 13 . 1 1 40 40 SER CB C 40 63.800 63.800 63.020 0.780 19947
4351 1 13 . 1 1 40 40 SER H H 40 8.280 8.280 7.755 0.525 19947
4352 1 13 . 1 1 41 41 GLN N N 41 120.600 120.600 125.217 -4.617 19947
4353 1 13 . 1 1 41 41 GLN HA H 41 4.110 4.110 4.133 -0.023 19947
4354 1 13 . 1 1 41 41 GLN CA C 41 55.200 55.200 56.415 -1.215 19947
4355 1 13 . 1 1 41 41 GLN CB C 41 31.100 31.100 28.765 2.335 19947
4356 1 13 . 1 1 41 41 GLN H H 41 9.190 9.190 7.856 1.334 19947
4357 1 13 . 1 1 42 42 CYS N N 42 113.200 113.200 114.573 -1.373 19947
4358 1 13 . 1 1 42 42 CYS HA H 42 4.630 4.630 4.628 0.002 19947
4359 1 13 . 1 1 42 42 CYS CA C 42 53.700 53.700 56.779 -3.079 19947
4360 1 13 . 1 1 42 42 CYS CB C 42 45.500 45.500 30.836 14.664 19947
4361 1 13 . 1 1 42 42 CYS H H 42 7.710 7.710 7.450 0.260 19947
4362 1 13 . 1 1 43 43 ASN N N 43 114.200 114.200 119.524 -5.324 19947
4363 1 13 . 1 1 43 43 ASN HA H 43 4.940 4.940 4.783 0.157 19947
4364 1 13 . 1 1 43 43 ASN CA C 43 53.000 53.000 54.865 -1.865 19947
4365 1 13 . 1 1 43 43 ASN CB C 43 39.300 39.300 39.604 -0.304 19947
4366 1 13 . 1 1 43 43 ASN H H 43 8.870 8.870 8.613 0.257 19947
4367 1 13 . 1 1 44 44 TYR N N 44 118.400 118.400 117.285 1.115 19947
4368 1 13 . 1 1 44 44 TYR HA H 44 4.850 4.850 4.587 0.263 19947
4369 1 13 . 1 1 44 44 TYR CA C 44 55.300 55.300 58.171 -2.871 19947
4370 1 13 . 1 1 44 44 TYR CB C 44 40.700 40.700 40.919 -0.219 19947
4371 1 13 . 1 1 44 44 TYR H H 44 7.840 7.840 7.578 0.262 19947
4372 1 13 . 1 1 45 45 GLY N N 45 110.600 110.600 109.680 0.920 19947
4373 1 13 . 1 1 45 45 GLY CA C 45 44.000 44.000 45.103 -1.103 19947
4374 1 13 . 1 1 45 45 GLY H H 45 7.960 7.960 7.843 0.117 19947
4375 1 13 . 1 1 46 46 GLU N N 46 120.700 120.700 120.520 0.180 19947
4376 1 13 . 1 1 46 46 GLU HA H 46 4.280 4.280 3.939 0.341 19947
4377 1 13 . 1 1 46 46 GLU CA C 46 58.500 58.500 59.816 -1.316 19947
4378 1 13 . 1 1 46 46 GLU CB C 46 29.300 29.300 29.936 -0.636 19947
4379 1 13 . 1 1 46 46 GLU H H 46 9.160 9.160 8.729 0.431 19947
4380 1 13 . 1 1 47 47 CYS N N 47 112.400 112.400 117.407 -5.007 19947
4381 1 13 . 1 1 47 47 CYS HA H 47 4.850 4.850 4.566 0.284 19947
4382 1 13 . 1 1 47 47 CYS CA C 47 57.100 57.100 59.400 -2.300 19947
4383 1 13 . 1 1 47 47 CYS CB C 47 41.200 41.200 25.363 15.837 19947
4384 1 13 . 1 1 47 47 CYS H H 47 8.510 8.510 7.496 1.014 19947
4385 1 13 . 1 1 48 48 CYS N N 48 123.200 123.200 120.583 2.617 19947
4386 1 13 . 1 1 48 48 CYS HA H 48 5.160 5.160 4.909 0.251 19947
4387 1 13 . 1 1 48 48 CYS CA C 48 54.700 54.700 58.266 -3.566 19947
4388 1 13 . 1 1 48 48 CYS CB C 48 45.700 45.700 27.147 18.553 19947
4389 1 13 . 1 1 48 48 CYS H H 48 7.810 7.810 8.142 -0.332 19947
4390 1 13 . 1 1 49 49 ASP N N 49 127.400 127.400 126.781 0.619 19947
4391 1 13 . 1 1 49 49 ASP HA H 49 4.890 4.890 4.854 0.036 19947
4392 1 13 . 1 1 49 49 ASP CA C 49 53.500 53.500 54.053 -0.554 19947
4393 1 13 . 1 1 49 49 ASP CB C 49 42.400 42.400 44.361 -1.961 19947
4394 1 13 . 1 1 49 49 ASP H H 49 9.670 9.670 8.708 0.962 19947
4395 1 13 . 1 1 50 50 GLN N N 50 127.000 127.000 122.467 4.533 19947
4396 1 13 . 1 1 50 50 GLN HA H 50 3.940 3.940 3.936 0.004 19947
4397 1 13 . 1 1 50 50 GLN CA C 50 56.800 56.800 57.068 -0.268 19947
4398 1 13 . 1 1 50 50 GLN CB C 50 26.500 26.500 26.932 -0.432 19947
4399 1 13 . 1 1 50 50 GLN H H 50 9.450 9.450 8.856 0.594 19947
4400 1 13 . 1 1 51 51 CYS N N 51 106.100 106.100 111.257 -5.157 19947
4401 1 13 . 1 1 51 51 CYS HA H 51 4.760 4.760 4.193 0.567 19947
4402 1 13 . 1 1 51 51 CYS CB C 51 43.200 43.200 24.950 18.250 19947
4403 1 13 . 1 1 51 51 CYS H H 51 8.700 8.700 8.477 0.223 19947
4404 1 13 . 1 1 52 52 ARG N N 52 121.000 121.000 116.969 4.031 19947
4405 1 13 . 1 1 52 52 ARG HA H 52 4.690 4.690 4.470 0.220 19947
4406 1 13 . 1 1 52 52 ARG CA C 52 55.400 55.400 54.549 0.851 19947
4407 1 13 . 1 1 52 52 ARG CB C 52 33.100 33.100 34.674 -1.574 19947
4408 1 13 . 1 1 52 52 ARG H H 52 7.960 7.960 7.391 0.569 19947
4409 1 13 . 1 1 53 53 PHE N N 53 120.300 120.300 120.872 -0.572 19947
4410 1 13 . 1 1 53 53 PHE HA H 53 5.050 5.050 4.987 0.063 19947
4411 1 13 . 1 1 53 53 PHE CA C 53 56.100 56.100 57.538 -1.438 19947
4412 1 13 . 1 1 53 53 PHE CB C 53 38.200 38.200 38.800 -0.600 19947
4413 1 13 . 1 1 53 53 PHE H H 53 8.400 8.400 8.365 0.035 19947
4414 1 13 . 1 1 54 54 LYS N N 54 123.300 123.300 126.396 -3.096 19947
4415 1 13 . 1 1 54 54 LYS HA H 54 4.250 4.250 4.069 0.181 19947
4416 1 13 . 1 1 54 54 LYS CA C 54 57.500 57.500 56.746 0.754 19947
4417 1 13 . 1 1 54 54 LYS CB C 54 34.300 34.300 32.141 2.159 19947
4418 1 13 . 1 1 54 54 LYS H H 54 8.540 8.540 8.197 0.343 19947
4419 1 13 . 1 1 55 55 LYS N N 55 119.400 119.400 125.203 -5.803 19947
4420 1 13 . 1 1 55 55 LYS HA H 55 4.110 4.110 3.999 0.111 19947
4421 1 13 . 1 1 55 55 LYS CA C 55 56.500 56.500 56.846 -0.346 19947
4422 1 13 . 1 1 55 55 LYS CB C 55 33.400 33.400 33.363 0.037 19947
4423 1 13 . 1 1 55 55 LYS H H 55 8.440 8.440 7.926 0.514 19947
4424 1 13 . 1 1 56 56 ALA N N 56 126.700 126.700 127.338 -0.638 19947
4425 1 13 . 1 1 56 56 ALA HA H 56 3.920 3.920 4.040 -0.120 19947
4426 1 13 . 1 1 56 56 ALA CA C 56 52.900 52.900 53.638 -0.738 19947
4427 1 13 . 1 1 56 56 ALA CB C 56 18.100 18.100 18.502 -0.402 19947
4428 1 13 . 1 1 56 56 ALA H H 56 8.930 8.930 8.576 0.354 19947
4429 1 13 . 1 1 57 57 GLY N N 57 109.300 109.300 111.509 -2.209 19947
4430 1 13 . 1 1 57 57 GLY CA C 57 45.100 45.100 44.866 0.234 19947
4431 1 13 . 1 1 57 57 GLY H H 57 8.460 8.460 8.462 -0.002 19947
4432 1 13 . 1 1 58 58 THR N N 58 117.200 117.200 120.032 -2.832 19947
4433 1 13 . 1 1 58 58 THR HA H 58 4.260 4.260 4.423 -0.163 19947
4434 1 13 . 1 1 58 58 THR CA C 58 63.300 63.300 62.721 0.578 19947
4435 1 13 . 1 1 58 58 THR CB C 58 69.600 69.600 68.645 0.955 19947
4436 1 13 . 1 1 58 58 THR H H 58 7.660 7.660 7.811 -0.151 19947
4437 1 13 . 1 1 59 59 VAL N N 59 130.400 130.400 127.014 3.386 19947
4438 1 13 . 1 1 59 59 VAL HA H 59 3.900 3.900 3.660 0.240 19947
4439 1 13 . 1 1 59 59 VAL CA C 59 64.400 64.400 63.436 0.964 19947
4440 1 13 . 1 1 59 59 VAL CB C 59 31.900 31.900 31.967 -0.067 19947
4441 1 13 . 1 1 59 59 VAL H H 59 9.190 9.190 8.494 0.696 19947
4442 1 13 . 1 1 60 60 CYS N N 60 121.800 121.800 125.806 -4.006 19947
4443 1 13 . 1 1 60 60 CYS HA H 60 5.050 5.050 4.535 0.515 19947
4444 1 13 . 1 1 60 60 CYS CA C 60 54.400 54.400 57.673 -3.273 19947
4445 1 13 . 1 1 60 60 CYS CB C 60 43.000 43.000 27.278 15.722 19947
4446 1 13 . 1 1 60 60 CYS H H 60 9.130 9.130 8.131 0.999 19947
4447 1 13 . 1 1 61 61 ARG N N 61 124.100 124.100 118.971 5.129 19947
4448 1 13 . 1 1 61 61 ARG HA H 61 4.360 4.360 4.426 -0.066 19947
4449 1 13 . 1 1 61 61 ARG CA C 61 56.800 56.800 55.280 1.520 19947
4450 1 13 . 1 1 61 61 ARG CB C 61 32.800 32.800 34.117 -1.317 19947
4451 1 13 . 1 1 61 61 ARG H H 61 7.580 7.580 7.282 0.298 19947
4452 1 13 . 1 1 62 62 ILE N N 62 126.200 126.200 115.815 10.385 19947
4453 1 13 . 1 1 62 62 ILE HA H 62 4.090 4.090 4.388 -0.298 19947
4454 1 13 . 1 1 62 62 ILE CA C 62 60.300 60.300 61.359 -1.059 19947
4455 1 13 . 1 1 62 62 ILE CB C 62 38.700 38.700 41.107 -2.407 19947
4456 1 13 . 1 1 62 62 ILE H H 62 8.490 8.490 8.074 0.416 19947
4457 1 13 . 1 1 63 63 ALA N N 63 129.400 129.400 131.585 -2.185 19947
4458 1 13 . 1 1 63 63 ALA HA H 63 4.310 4.310 4.602 -0.292 19947
4459 1 13 . 1 1 63 63 ALA CA C 63 51.900 51.900 54.591 -2.691 19947
4460 1 13 . 1 1 63 63 ALA CB C 63 20.600 20.600 19.571 1.029 19947
4461 1 13 . 1 1 63 63 ALA H H 63 8.100 8.100 8.667 -0.567 19947
4462 1 13 . 1 1 64 64 ARG N N 64 120.500 120.500 120.200 0.300 19947
4463 1 13 . 1 1 64 64 ARG HA H 64 4.290 4.290 4.530 -0.240 19947
4464 1 13 . 1 1 64 64 ARG CA C 64 56.200 56.200 55.794 0.406 19947
4465 1 13 . 1 1 64 64 ARG CB C 64 30.500 30.500 30.480 0.020 19947
4466 1 13 . 1 1 64 64 ARG H H 64 8.140 8.140 8.935 -0.795 19947
4467 1 13 . 1 1 65 65 GLY N N 65 110.500 110.500 111.987 -1.487 19947
4468 1 13 . 1 1 65 65 GLY CA C 65 45.100 45.100 44.583 0.517 19947
4469 1 13 . 1 1 65 65 GLY H H 65 8.040 8.040 8.356 -0.316 19947
4470 1 13 . 1 1 66 66 ASP N N 66 120.700 120.700 119.462 1.238 19947
4471 1 13 . 1 1 66 66 ASP HA H 66 4.610 4.610 4.534 0.076 19947
4472 1 13 . 1 1 66 66 ASP CA C 66 53.300 53.300 53.549 -0.249 19947
4473 1 13 . 1 1 66 66 ASP CB C 66 37.600 37.600 40.259 -2.659 19947
4474 1 13 . 1 1 66 66 ASP H H 66 8.380 8.380 7.216 1.164 19947
4475 1 13 . 1 1 67 67 TRP N N 67 120.100 120.100 123.387 -3.287 19947
4476 1 13 . 1 1 67 67 TRP HA H 67 4.760 4.760 5.001 -0.241 19947
4477 1 13 . 1 1 67 67 TRP CA C 67 57.200 57.200 57.974 -0.774 19947
4478 1 13 . 1 1 67 67 TRP CB C 67 29.100 29.100 29.347 -0.247 19947
4479 1 13 . 1 1 67 67 TRP H H 67 7.950 7.950 7.866 0.084 19947
4480 1 13 . 1 1 68 68 ASN N N 68 118.400 118.400 118.107 0.293 19947
4481 1 13 . 1 1 68 68 ASN HA H 68 4.790 4.790 4.945 -0.155 19947
4482 1 13 . 1 1 68 68 ASN CA C 68 52.800 52.800 53.907 -1.107 19947
4483 1 13 . 1 1 68 68 ASN CB C 68 39.300 39.300 40.053 -0.753 19947
4484 1 13 . 1 1 68 68 ASN H H 68 8.180 8.180 8.581 -0.401 19947
4485 1 13 . 1 1 69 69 ASP N N 69 118.500 118.500 118.540 -0.040 19947
4486 1 13 . 1 1 69 69 ASP HA H 69 4.620 4.620 4.397 0.223 19947
4487 1 13 . 1 1 69 69 ASP CA C 69 53.200 53.200 56.279 -3.079 19947
4488 1 13 . 1 1 69 69 ASP CB C 69 38.000 38.000 41.196 -3.196 19947
4489 1 13 . 1 1 69 69 ASP H H 69 8.130 8.130 8.627 -0.497 19947
4490 1 13 . 1 1 70 70 ASP N N 70 120.500 120.500 121.245 -0.745 19947
4491 1 13 . 1 1 70 70 ASP HA H 70 5.100 5.100 4.909 0.191 19947
4492 1 13 . 1 1 70 70 ASP CA C 70 52.500 52.500 53.686 -1.186 19947
4493 1 13 . 1 1 70 70 ASP CB C 70 42.600 42.600 41.873 0.727 19947
4494 1 13 . 1 1 70 70 ASP H H 70 8.140 8.140 8.066 0.074 19947
4495 1 13 . 1 1 71 71 TYR N N 71 118.900 118.900 124.206 -5.306 19947
4496 1 13 . 1 1 71 71 TYR HA H 71 5.210 5.210 4.879 0.331 19947
4497 1 13 . 1 1 71 71 TYR CA C 71 56.300 56.300 57.158 -0.858 19947
4498 1 13 . 1 1 71 71 TYR CB C 71 42.200 42.200 42.727 -0.527 19947
4499 1 13 . 1 1 71 71 TYR H H 71 8.450 8.450 8.491 -0.041 19947
4500 1 13 . 1 1 72 72 CYS N N 72 119.800 119.800 121.767 -1.967 19947
4501 1 13 . 1 1 72 72 CYS HA H 72 4.900 4.900 4.559 0.341 19947
4502 1 13 . 1 1 72 72 CYS CA C 72 53.400 53.400 59.121 -5.721 19947
4503 1 13 . 1 1 72 72 CYS CB C 72 37.200 37.200 28.970 8.230 19947
4504 1 13 . 1 1 72 72 CYS H H 72 9.330 9.330 8.497 0.833 19947
4505 1 13 . 1 1 73 73 THR N N 73 112.700 112.700 114.146 -1.446 19947
4506 1 13 . 1 1 73 73 THR HA H 73 4.430 4.430 4.467 -0.037 19947
4507 1 13 . 1 1 73 73 THR CA C 73 62.300 62.300 60.769 1.531 19947
4508 1 13 . 1 1 73 73 THR CB C 73 71.300 71.300 69.403 1.897 19947
4509 1 13 . 1 1 73 73 THR H H 73 9.980 9.980 8.798 1.182 19947
4510 1 13 . 1 1 74 74 GLY N N 74 111.500 111.500 110.226 1.274 19947
4511 1 13 . 1 1 74 74 GLY CA C 74 45.300 45.300 46.635 -1.335 19947
4512 1 13 . 1 1 74 74 GLY H H 74 8.580 8.580 7.777 0.803 19947
4513 1 13 . 1 1 75 75 LYS N N 75 115.900 115.900 117.116 -1.216 19947
4514 1 13 . 1 1 75 75 LYS HA H 75 4.140 4.140 4.427 -0.287 19947
4515 1 13 . 1 1 75 75 LYS CA C 75 54.800 54.800 55.578 -0.778 19947
4516 1 13 . 1 1 75 75 LYS CB C 75 34.200 34.200 33.905 0.295 19947
4517 1 13 . 1 1 75 75 LYS H H 75 7.900 7.900 7.651 0.249 19947
4518 1 13 . 1 1 76 76 SER N N 76 111.000 111.000 111.921 -0.921 19947
4519 1 13 . 1 1 76 76 SER HA H 76 4.160 4.160 3.617 0.543 19947
4520 1 13 . 1 1 76 76 SER CA C 76 61.400 61.400 56.644 4.756 19947
4521 1 13 . 1 1 76 76 SER CB C 76 64.300 64.300 64.951 -0.651 19947
4522 1 13 . 1 1 76 76 SER H H 76 6.520 6.520 6.816 -0.296 19947
4523 1 13 . 1 1 77 77 SER N N 77 117.100 117.100 114.449 2.651 19947
4524 1 13 . 1 1 77 77 SER HA H 77 4.220 4.220 4.521 -0.301 19947
4525 1 13 . 1 1 77 77 SER CA C 77 59.800 59.800 58.880 0.920 19947
4526 1 13 . 1 1 77 77 SER CB C 77 64.400 64.400 63.694 0.706 19947
4527 1 13 . 1 1 77 77 SER H H 77 9.030 9.030 8.328 0.702 19947
4528 1 13 . 1 1 78 78 ASP N N 78 122.100 122.100 121.906 0.194 19947
4529 1 13 . 1 1 78 78 ASP HA H 78 4.930 4.930 4.823 0.107 19947
4530 1 13 . 1 1 78 78 ASP CA C 78 52.400 52.400 54.169 -1.769 19947
4531 1 13 . 1 1 78 78 ASP CB C 78 40.800 40.800 44.094 -3.294 19947
4532 1 13 . 1 1 78 78 ASP H H 78 8.340 8.340 7.623 0.717 19947
4533 1 13 . 1 1 79 79 CYS N N 79 122.200 122.200 121.848 0.352 19947
4534 1 13 . 1 1 79 79 CYS HA H 79 5.320 5.320 4.927 0.393 19947
4535 1 13 . 1 1 79 79 CYS CA C 79 52.000 52.000 55.339 -3.339 19947
4536 1 13 . 1 1 79 79 CYS CB C 79 39.300 39.300 27.982 11.318 19947
4537 1 13 . 1 1 79 79 CYS H H 79 8.960 8.960 8.919 0.041 19947
4538 1 13 . 1 1 80 80 PRO HA H 80 4.410 4.410 4.608 -0.198 19947
4539 1 13 . 1 1 80 80 PRO CA C 80 63.500 63.500 63.456 0.044 19947
4540 1 13 . 1 1 80 80 PRO CB C 80 32.400 32.400 33.071 -0.671 19947
4541 1 13 . 1 1 81 81 TRP N N 81 120.500 120.500 121.365 -0.865 19947
4542 1 13 . 1 1 81 81 TRP HA H 81 4.550 4.550 4.363 0.187 19947
4543 1 13 . 1 1 81 81 TRP CA C 81 56.400 56.400 58.213 -1.813 19947
4544 1 13 . 1 1 81 81 TRP CB C 81 29.500 29.500 28.788 0.712 19947
4545 1 13 . 1 1 81 81 TRP H H 81 8.400 8.400 8.806 -0.406 19947
4546 1 13 . 1 1 82 82 ASN N N 82 120.400 120.400 113.078 7.322 19947
4547 1 13 . 1 1 82 82 ASN HA H 82 4.750 4.750 4.522 0.228 19947
4548 1 13 . 1 1 82 82 ASN CA C 82 53.100 53.100 53.786 -0.686 19947
4549 1 13 . 1 1 82 82 ASN CB C 82 39.000 39.000 36.441 2.559 19947
4550 1 13 . 1 1 82 82 ASN H H 82 8.040 8.040 8.392 -0.352 19947
4551 1 14 . 1 1 2 2 PRO HA H 2 4.820 4.820 4.681 0.139 19947
4552 1 14 . 1 1 2 2 PRO CA C 2 61.900 61.900 61.893 0.007 19947
4553 1 14 . 1 1 2 2 PRO CB C 2 30.700 30.700 31.807 -1.107 19947
4554 1 14 . 1 1 3 3 PRO HA H 3 4.540 4.540 4.447 0.093 19947
4555 1 14 . 1 1 3 3 PRO CA C 3 62.900 62.900 62.486 0.414 19947
4556 1 14 . 1 1 3 3 PRO CB C 3 32.100 32.100 32.689 -0.589 19947
4557 1 14 . 1 1 4 4 VAL N N 4 121.900 121.900 125.260 -3.360 19947
4558 1 14 . 1 1 4 4 VAL HA H 4 4.200 4.200 4.137 0.063 19947
4559 1 14 . 1 1 4 4 VAL CA C 4 62.300 62.300 62.775 -0.475 19947
4560 1 14 . 1 1 4 4 VAL CB C 4 32.800 32.800 31.923 0.877 19947
4561 1 14 . 1 1 4 4 VAL H H 4 8.330 8.330 8.388 -0.058 19947
4562 1 14 . 1 1 5 5 CYS N N 5 120.900 120.900 128.432 -7.532 19947
4563 1 14 . 1 1 5 5 CYS HA H 5 4.700 4.700 4.474 0.226 19947
4564 1 14 . 1 1 5 5 CYS CA C 5 53.600 53.600 58.458 -4.858 19947
4565 1 14 . 1 1 5 5 CYS H H 5 8.500 8.500 8.547 -0.047 19947
4566 1 14 . 1 1 6 6 GLY N N 6 110.200 110.200 113.508 -3.308 19947
4567 1 14 . 1 1 6 6 GLY CA C 6 46.300 46.300 44.679 1.621 19947
4568 1 14 . 1 1 6 6 GLY H H 6 8.490 8.490 8.420 0.070 19947
4569 1 14 . 1 1 7 7 ASN N N 7 120.100 120.100 116.589 3.511 19947
4570 1 14 . 1 1 7 7 ASN HA H 7 4.730 4.730 4.309 0.421 19947
4571 1 14 . 1 1 7 7 ASN CA C 7 53.200 53.200 53.794 -0.594 19947
4572 1 14 . 1 1 7 7 ASN CB C 7 38.700 38.700 39.247 -0.547 19947
4573 1 14 . 1 1 7 7 ASN H H 7 8.320 8.320 8.225 0.095 19947
4574 1 14 . 1 1 8 8 LYS N N 8 121.300 121.300 122.906 -1.606 19947
4575 1 14 . 1 1 8 8 LYS HA H 8 4.340 4.340 4.072 0.268 19947
4576 1 14 . 1 1 8 8 LYS CA C 8 56.600 56.600 56.872 -0.272 19947
4577 1 14 . 1 1 8 8 LYS CB C 8 32.900 32.900 31.050 1.850 19947
4578 1 14 . 1 1 8 8 LYS H H 8 8.260 8.260 8.533 -0.273 19947
4579 1 14 . 1 1 9 9 ILE N N 9 136.600 136.600 120.987 15.613 19947
4580 1 14 . 1 1 9 9 ILE HA H 9 4.140 4.140 3.880 0.260 19947
4581 1 14 . 1 1 9 9 ILE CA C 9 61.300 61.300 62.527 -1.227 19947
4582 1 14 . 1 1 9 9 ILE CB C 9 38.200 38.200 37.877 0.323 19947
4583 1 14 . 1 1 9 9 ILE H H 9 8.150 8.150 8.000 0.150 19947
4584 1 14 . 1 1 10 10 LEU N N 10 125.700 125.700 122.284 3.416 19947
4585 1 14 . 1 1 10 10 LEU HA H 10 4.420 4.420 4.576 -0.156 19947
4586 1 14 . 1 1 10 10 LEU CA C 10 55.200 55.200 54.630 0.570 19947
4587 1 14 . 1 1 10 10 LEU CB C 10 42.300 42.300 41.952 0.348 19947
4588 1 14 . 1 1 10 10 LEU H H 10 8.230 8.230 8.387 -0.157 19947
4589 1 14 . 1 1 11 11 GLU N N 11 120.600 120.600 114.230 6.370 19947
4590 1 14 . 1 1 11 11 GLU HA H 11 4.470 4.470 4.146 0.324 19947
4591 1 14 . 1 1 11 11 GLU CA C 11 55.500 55.500 56.551 -1.051 19947
4592 1 14 . 1 1 11 11 GLU CB C 11 28.900 28.900 29.040 -0.140 19947
4593 1 14 . 1 1 11 11 GLU H H 11 8.250 8.250 7.844 0.406 19947
4594 1 14 . 1 1 12 12 GLN N N 12 121.600 121.600 119.077 2.523 19947
4595 1 14 . 1 1 12 12 GLN HA H 12 4.350 4.350 4.615 -0.265 19947
4596 1 14 . 1 1 12 12 GLN CA C 12 56.600 56.600 56.108 0.492 19947
4597 1 14 . 1 1 12 12 GLN CB C 12 29.200 29.200 29.939 -0.738 19947
4598 1 14 . 1 1 12 12 GLN H H 12 8.460 8.460 7.991 0.469 19947
4599 1 14 . 1 1 13 13 GLY N N 13 110.700 110.700 105.884 4.816 19947
4600 1 14 . 1 1 13 13 GLY CA C 13 45.700 45.700 45.485 0.215 19947
4601 1 14 . 1 1 13 13 GLY H H 13 8.660 8.660 8.697 -0.037 19947
4602 1 14 . 1 1 14 14 GLU N N 14 118.900 118.900 115.490 3.410 19947
4603 1 14 . 1 1 14 14 GLU HA H 14 4.530 4.530 4.231 0.299 19947
4604 1 14 . 1 1 14 14 GLU CA C 14 55.600 55.600 56.938 -1.339 19947
4605 1 14 . 1 1 14 14 GLU CB C 14 29.700 29.700 29.641 0.059 19947
4606 1 14 . 1 1 14 14 GLU H H 14 8.230 8.230 8.339 -0.109 19947
4607 1 14 . 1 1 15 15 ASP N N 15 118.400 118.400 119.878 -1.478 19947
4608 1 14 . 1 1 15 15 ASP HA H 15 4.990 4.990 4.531 0.459 19947
4609 1 14 . 1 1 15 15 ASP CA C 15 53.500 53.500 56.789 -3.289 19947
4610 1 14 . 1 1 15 15 ASP CB C 15 39.700 39.700 41.916 -2.216 19947
4611 1 14 . 1 1 15 15 ASP H H 15 8.330 8.330 8.253 0.077 19947
4612 1 14 . 1 1 16 16 CYS HA H 16 4.340 4.340 4.410 -0.070 19947
4613 1 14 . 1 1 16 16 CYS H H 16 8.510 8.510 7.737 0.773 19947
4614 1 14 . 1 1 17 17 ASP N N 17 116.700 116.700 122.679 -5.979 19947
4615 1 14 . 1 1 17 17 ASP HA H 17 4.740 4.740 4.408 0.332 19947
4616 1 14 . 1 1 17 17 ASP CA C 17 53.100 53.100 55.511 -2.411 19947
4617 1 14 . 1 1 17 17 ASP CB C 17 38.600 38.600 39.228 -0.628 19947
4618 1 14 . 1 1 17 17 ASP H H 17 8.180 8.180 8.812 -0.632 19947
4619 1 14 . 1 1 18 18 CYS HA H 18 4.730 4.730 3.987 0.743 19947
4620 1 14 . 1 1 18 18 CYS CB C 18 41.900 41.900 26.914 14.986 19947
4621 1 14 . 1 1 19 19 GLY H H 19 8.220 8.220 8.733 -0.513 19947
4622 1 14 . 1 1 20 20 SER HA H 20 4.920 4.920 4.415 0.505 19947
4623 1 14 . 1 1 20 20 SER CA C 20 55.700 55.700 56.509 -0.809 19947
4624 1 14 . 1 1 20 20 SER CB C 20 63.500 63.500 63.033 0.467 19947
4625 1 14 . 1 1 20 20 SER H H 20 7.830 7.830 8.526 -0.696 19947
4626 1 14 . 1 1 21 21 PRO HA H 21 4.240 4.240 4.155 0.085 19947
4627 1 14 . 1 1 21 21 PRO CA C 21 63.400 63.400 65.148 -1.748 19947
4628 1 14 . 1 1 21 21 PRO CB C 21 31.800 31.800 31.337 0.463 19947
4629 1 14 . 1 1 22 22 ALA N N 22 119.900 119.900 120.444 -0.544 19947
4630 1 14 . 1 1 22 22 ALA HA H 22 4.220 4.220 4.120 0.100 19947
4631 1 14 . 1 1 22 22 ALA CA C 22 54.200 54.200 54.085 0.115 19947
4632 1 14 . 1 1 22 22 ALA CB C 22 18.500 18.500 18.336 0.164 19947
4633 1 14 . 1 1 22 22 ALA H H 22 8.180 8.180 8.362 -0.182 19947
4634 1 14 . 1 1 23 23 ASN N N 23 116.300 116.300 110.781 5.519 19947
4635 1 14 . 1 1 23 23 ASN HA H 23 4.670 4.670 4.939 -0.269 19947
4636 1 14 . 1 1 23 23 ASN CA C 23 53.200 53.200 52.061 1.139 19947
4637 1 14 . 1 1 23 23 ASN CB C 23 39.300 39.300 40.123 -0.823 19947
4638 1 14 . 1 1 23 23 ASN H H 23 7.960 7.960 8.084 -0.124 19947
4639 1 14 . 1 1 24 24 CYS HA H 24 4.720 4.720 4.380 0.340 19947
4640 1 14 . 1 1 24 24 CYS H H 24 8.510 8.510 7.721 0.789 19947
4641 1 14 . 1 1 25 25 GLN HA H 25 4.460 4.460 3.915 0.545 19947
4642 1 14 . 1 1 25 25 GLN H H 25 8.320 8.320 8.668 -0.348 19947
4643 1 14 . 1 1 26 26 ASP HA H 26 4.740 4.740 4.589 0.151 19947
4644 1 14 . 1 1 26 26 ASP H H 26 8.580 8.580 8.532 0.048 19947
4645 1 14 . 1 1 27 27 ARG HA H 27 4.680 4.680 4.447 0.233 19947
4646 1 14 . 1 1 27 27 ARG CA C 27 54.700 54.700 57.463 -2.763 19947
4647 1 14 . 1 1 27 27 ARG H H 27 8.550 8.550 8.098 0.452 19947
4648 1 14 . 1 1 28 28 CYS HA H 28 4.120 4.120 4.730 -0.610 19947
4649 1 14 . 1 1 28 28 CYS CA C 28 54.400 54.400 58.079 -3.679 19947
4650 1 14 . 1 1 28 28 CYS CB C 28 19.000 19.000 26.466 -7.466 19947
4651 1 14 . 1 1 28 28 CYS H H 28 8.910 8.910 8.429 0.481 19947
4652 1 14 . 1 1 29 29 CYS N N 29 113.300 113.300 119.320 -6.020 19947
4653 1 14 . 1 1 29 29 CYS HA H 29 5.010 5.010 4.816 0.194 19947
4654 1 14 . 1 1 29 29 CYS CA C 29 54.300 54.300 56.389 -2.089 19947
4655 1 14 . 1 1 29 29 CYS H H 29 7.730 7.730 7.690 0.040 19947
4656 1 14 . 1 1 30 30 ASN HA H 30 4.730 4.730 5.037 -0.307 19947
4657 1 14 . 1 1 30 30 ASN CB C 30 38.700 38.700 40.071 -1.371 19947
4658 1 14 . 1 1 30 30 ASN H H 30 8.870 8.870 8.943 -0.073 19947
4659 1 14 . 1 1 31 31 ALA N N 31 129.400 129.400 126.162 3.238 19947
4660 1 14 . 1 1 31 31 ALA HA H 31 4.120 4.120 4.337 -0.217 19947
4661 1 14 . 1 1 31 31 ALA CA C 31 54.400 54.400 54.767 -0.367 19947
4662 1 14 . 1 1 31 31 ALA CB C 31 19.000 19.000 19.237 -0.237 19947
4663 1 14 . 1 1 31 31 ALA H H 31 8.890 8.890 8.411 0.479 19947
4664 1 14 . 1 1 32 32 ALA N N 32 116.400 116.400 118.104 -1.704 19947
4665 1 14 . 1 1 32 32 ALA HA H 32 4.340 4.340 4.320 0.020 19947
4666 1 14 . 1 1 32 32 ALA CA C 32 53.800 53.800 53.550 0.250 19947
4667 1 14 . 1 1 32 32 ALA CB C 32 19.100 19.100 18.887 0.213 19947
4668 1 14 . 1 1 32 32 ALA H H 32 8.250 8.250 8.399 -0.149 19947
4669 1 14 . 1 1 33 33 THR N N 33 104.300 104.300 109.973 -5.673 19947
4670 1 14 . 1 1 33 33 THR HA H 33 4.430 4.430 4.394 0.036 19947
4671 1 14 . 1 1 33 33 THR CA C 33 60.500 60.500 60.607 -0.107 19947
4672 1 14 . 1 1 33 33 THR CB C 33 70.600 70.600 69.451 1.149 19947
4673 1 14 . 1 1 33 33 THR H H 33 7.320 7.320 7.354 -0.034 19947
4674 1 14 . 1 1 34 34 CYS N N 34 123.400 123.400 121.200 2.200 19947
4675 1 14 . 1 1 34 34 CYS HA H 34 4.170 4.170 4.291 -0.121 19947
4676 1 14 . 1 1 34 34 CYS CA C 34 56.500 56.500 60.014 -3.514 19947
4677 1 14 . 1 1 34 34 CYS H H 34 8.710 8.710 8.022 0.688 19947
4678 1 14 . 1 1 35 35 LYS N N 35 116.900 116.900 117.623 -0.723 19947
4679 1 14 . 1 1 35 35 LYS HA H 35 4.960 4.960 4.814 0.146 19947
4680 1 14 . 1 1 35 35 LYS CA C 35 53.900 53.900 55.459 -1.559 19947
4681 1 14 . 1 1 35 35 LYS CB C 35 35.900 35.900 35.876 0.024 19947
4682 1 14 . 1 1 35 35 LYS H H 35 7.450 7.450 7.915 -0.465 19947
4683 1 14 . 1 1 36 36 LEU N N 36 119.300 119.300 116.685 2.615 19947
4684 1 14 . 1 1 36 36 LEU HA H 36 4.800 4.800 4.615 0.185 19947
4685 1 14 . 1 1 36 36 LEU CB C 36 42.400 42.400 42.859 -0.459 19947
4686 1 14 . 1 1 36 36 LEU H H 36 8.290 8.290 8.464 -0.174 19947
4687 1 14 . 1 1 37 37 THR HA H 37 4.340 4.340 4.747 -0.407 19947
4688 1 14 . 1 1 37 37 THR CA C 37 60.200 60.200 59.494 0.706 19947
4689 1 14 . 1 1 37 37 THR CB C 37 67.700 67.700 68.939 -1.239 19947
4690 1 14 . 1 1 37 37 THR H H 37 8.380 8.380 8.050 0.330 19947
4691 1 14 . 1 1 38 38 PRO HA H 38 4.380 4.380 4.147 0.233 19947
4692 1 14 . 1 1 38 38 PRO CA C 38 64.800 64.800 64.134 0.666 19947
4693 1 14 . 1 1 38 38 PRO CB C 38 31.500 31.500 31.703 -0.203 19947
4694 1 14 . 1 1 39 39 GLY N N 39 113.300 113.300 110.931 2.369 19947
4695 1 14 . 1 1 39 39 GLY CA C 39 45.100 45.100 45.198 -0.098 19947
4696 1 14 . 1 1 39 39 GLY H H 39 8.830 8.830 8.500 0.330 19947
4697 1 14 . 1 1 40 40 SER N N 40 116.700 116.700 115.946 0.754 19947
4698 1 14 . 1 1 40 40 SER HA H 40 4.610 4.610 4.857 -0.247 19947
4699 1 14 . 1 1 40 40 SER CA C 40 58.800 58.800 56.865 1.935 19947
4700 1 14 . 1 1 40 40 SER CB C 40 63.800 63.800 63.889 -0.089 19947
4701 1 14 . 1 1 40 40 SER H H 40 8.280 8.280 7.631 0.649 19947
4702 1 14 . 1 1 41 41 GLN N N 41 120.600 120.600 126.736 -6.136 19947
4703 1 14 . 1 1 41 41 GLN HA H 41 4.110 4.110 4.088 0.022 19947
4704 1 14 . 1 1 41 41 GLN CA C 41 55.200 55.200 57.401 -2.201 19947
4705 1 14 . 1 1 41 41 GLN CB C 41 31.100 31.100 29.345 1.756 19947
4706 1 14 . 1 1 41 41 GLN H H 41 9.190 9.190 7.964 1.226 19947
4707 1 14 . 1 1 42 42 CYS N N 42 113.200 113.200 113.382 -0.182 19947
4708 1 14 . 1 1 42 42 CYS HA H 42 4.630 4.630 4.622 0.008 19947
4709 1 14 . 1 1 42 42 CYS CA C 42 53.700 53.700 56.725 -3.025 19947
4710 1 14 . 1 1 42 42 CYS CB C 42 45.500 45.500 30.499 15.001 19947
4711 1 14 . 1 1 42 42 CYS H H 42 7.710 7.710 7.308 0.402 19947
4712 1 14 . 1 1 43 43 ASN N N 43 114.200 114.200 118.002 -3.802 19947
4713 1 14 . 1 1 43 43 ASN HA H 43 4.940 4.940 4.654 0.286 19947
4714 1 14 . 1 1 43 43 ASN CA C 43 53.000 53.000 54.275 -1.275 19947
4715 1 14 . 1 1 43 43 ASN CB C 43 39.300 39.300 39.403 -0.103 19947
4716 1 14 . 1 1 43 43 ASN H H 43 8.870 8.870 8.790 0.080 19947
4717 1 14 . 1 1 44 44 TYR N N 44 118.400 118.400 113.076 5.324 19947
4718 1 14 . 1 1 44 44 TYR HA H 44 4.850 4.850 4.613 0.237 19947
4719 1 14 . 1 1 44 44 TYR CA C 44 55.300 55.300 57.206 -1.906 19947
4720 1 14 . 1 1 44 44 TYR CB C 44 40.700 40.700 39.812 0.888 19947
4721 1 14 . 1 1 44 44 TYR H H 44 7.840 7.840 7.106 0.734 19947
4722 1 14 . 1 1 45 45 GLY N N 45 110.600 110.600 107.579 3.021 19947
4723 1 14 . 1 1 45 45 GLY CA C 45 44.000 44.000 44.830 -0.830 19947
4724 1 14 . 1 1 45 45 GLY H H 45 7.960 7.960 8.033 -0.073 19947
4725 1 14 . 1 1 46 46 GLU N N 46 120.700 120.700 119.080 1.620 19947
4726 1 14 . 1 1 46 46 GLU HA H 46 4.280 4.280 4.056 0.224 19947
4727 1 14 . 1 1 46 46 GLU CA C 46 58.500 58.500 59.910 -1.410 19947
4728 1 14 . 1 1 46 46 GLU CB C 46 29.300 29.300 30.006 -0.706 19947
4729 1 14 . 1 1 46 46 GLU H H 46 9.160 9.160 8.448 0.712 19947
4730 1 14 . 1 1 47 47 CYS N N 47 112.400 112.400 115.838 -3.438 19947
4731 1 14 . 1 1 47 47 CYS HA H 47 4.850 4.850 4.729 0.121 19947
4732 1 14 . 1 1 47 47 CYS CA C 47 57.100 57.100 59.266 -2.166 19947
4733 1 14 . 1 1 47 47 CYS CB C 47 41.200 41.200 26.600 14.600 19947
4734 1 14 . 1 1 47 47 CYS H H 47 8.510 8.510 7.475 1.035 19947
4735 1 14 . 1 1 48 48 CYS N N 48 123.200 123.200 120.857 2.343 19947
4736 1 14 . 1 1 48 48 CYS HA H 48 5.160 5.160 4.933 0.227 19947
4737 1 14 . 1 1 48 48 CYS CA C 48 54.700 54.700 60.501 -5.801 19947
4738 1 14 . 1 1 48 48 CYS CB C 48 45.700 45.700 27.893 17.807 19947
4739 1 14 . 1 1 48 48 CYS H H 48 7.810 7.810 8.137 -0.327 19947
4740 1 14 . 1 1 49 49 ASP N N 49 127.400 127.400 126.492 0.908 19947
4741 1 14 . 1 1 49 49 ASP HA H 49 4.890 4.890 5.030 -0.140 19947
4742 1 14 . 1 1 49 49 ASP CA C 49 53.500 53.500 54.255 -0.755 19947
4743 1 14 . 1 1 49 49 ASP CB C 49 42.400 42.400 43.924 -1.524 19947
4744 1 14 . 1 1 49 49 ASP H H 49 9.670 9.670 8.925 0.745 19947
4745 1 14 . 1 1 50 50 GLN N N 50 127.000 127.000 123.147 3.853 19947
4746 1 14 . 1 1 50 50 GLN HA H 50 3.940 3.940 4.006 -0.066 19947
4747 1 14 . 1 1 50 50 GLN CA C 50 56.800 56.800 58.627 -1.827 19947
4748 1 14 . 1 1 50 50 GLN CB C 50 26.500 26.500 28.101 -1.601 19947
4749 1 14 . 1 1 50 50 GLN H H 50 9.450 9.450 8.960 0.490 19947
4750 1 14 . 1 1 51 51 CYS N N 51 106.100 106.100 118.751 -12.651 19947
4751 1 14 . 1 1 51 51 CYS HA H 51 4.760 4.760 4.670 0.090 19947
4752 1 14 . 1 1 51 51 CYS CB C 51 43.200 43.200 27.979 15.221 19947
4753 1 14 . 1 1 51 51 CYS H H 51 8.700 8.700 8.300 0.400 19947
4754 1 14 . 1 1 52 52 ARG N N 52 121.000 121.000 118.444 2.556 19947
4755 1 14 . 1 1 52 52 ARG HA H 52 4.690 4.690 4.485 0.205 19947
4756 1 14 . 1 1 52 52 ARG CA C 52 55.400 55.400 54.676 0.724 19947
4757 1 14 . 1 1 52 52 ARG CB C 52 33.100 33.100 34.926 -1.826 19947
4758 1 14 . 1 1 52 52 ARG H H 52 7.960 7.960 7.777 0.183 19947
4759 1 14 . 1 1 53 53 PHE N N 53 120.300 120.300 119.415 0.885 19947
4760 1 14 . 1 1 53 53 PHE HA H 53 5.050 5.050 5.305 -0.255 19947
4761 1 14 . 1 1 53 53 PHE CA C 53 56.100 56.100 55.922 0.178 19947
4762 1 14 . 1 1 53 53 PHE CB C 53 38.200 38.200 39.734 -1.534 19947
4763 1 14 . 1 1 53 53 PHE H H 53 8.400 8.400 8.389 0.011 19947
4764 1 14 . 1 1 54 54 LYS N N 54 123.300 123.300 125.007 -1.707 19947
4765 1 14 . 1 1 54 54 LYS HA H 54 4.250 4.250 4.219 0.031 19947
4766 1 14 . 1 1 54 54 LYS CA C 54 57.500 57.500 56.495 1.005 19947
4767 1 14 . 1 1 54 54 LYS CB C 54 34.300 34.300 32.903 1.397 19947
4768 1 14 . 1 1 54 54 LYS H H 54 8.540 8.540 9.008 -0.468 19947
4769 1 14 . 1 1 55 55 LYS N N 55 119.400 119.400 125.298 -5.898 19947
4770 1 14 . 1 1 55 55 LYS HA H 55 4.110 4.110 4.032 0.078 19947
4771 1 14 . 1 1 55 55 LYS CA C 55 56.500 56.500 56.853 -0.353 19947
4772 1 14 . 1 1 55 55 LYS CB C 55 33.400 33.400 33.292 0.108 19947
4773 1 14 . 1 1 55 55 LYS H H 55 8.440 8.440 8.597 -0.157 19947
4774 1 14 . 1 1 56 56 ALA N N 56 126.700 126.700 128.317 -1.617 19947
4775 1 14 . 1 1 56 56 ALA HA H 56 3.920 3.920 3.961 -0.041 19947
4776 1 14 . 1 1 56 56 ALA CA C 56 52.900 52.900 53.679 -0.779 19947
4777 1 14 . 1 1 56 56 ALA CB C 56 18.100 18.100 18.617 -0.517 19947
4778 1 14 . 1 1 56 56 ALA H H 56 8.930 8.930 8.651 0.279 19947
4779 1 14 . 1 1 57 57 GLY N N 57 109.300 109.300 111.117 -1.817 19947
4780 1 14 . 1 1 57 57 GLY CA C 57 45.100 45.100 44.795 0.305 19947
4781 1 14 . 1 1 57 57 GLY H H 57 8.460 8.460 8.435 0.025 19947
4782 1 14 . 1 1 58 58 THR N N 58 117.200 117.200 120.235 -3.035 19947
4783 1 14 . 1 1 58 58 THR HA H 58 4.260 4.260 4.416 -0.156 19947
4784 1 14 . 1 1 58 58 THR CA C 58 63.300 63.300 63.740 -0.440 19947
4785 1 14 . 1 1 58 58 THR CB C 58 69.600 69.600 69.409 0.191 19947
4786 1 14 . 1 1 58 58 THR H H 58 7.660 7.660 7.768 -0.108 19947
4787 1 14 . 1 1 59 59 VAL N N 59 130.400 130.400 128.565 1.835 19947
4788 1 14 . 1 1 59 59 VAL HA H 59 3.900 3.900 4.081 -0.181 19947
4789 1 14 . 1 1 59 59 VAL CA C 59 64.400 64.400 61.951 2.449 19947
4790 1 14 . 1 1 59 59 VAL CB C 59 31.900 31.900 31.813 0.087 19947
4791 1 14 . 1 1 59 59 VAL H H 59 9.190 9.190 8.863 0.327 19947
4792 1 14 . 1 1 60 60 CYS N N 60 121.800 121.800 126.680 -4.880 19947
4793 1 14 . 1 1 60 60 CYS HA H 60 5.050 5.050 4.621 0.429 19947
4794 1 14 . 1 1 60 60 CYS CA C 60 54.400 54.400 58.413 -4.013 19947
4795 1 14 . 1 1 60 60 CYS CB C 60 43.000 43.000 28.025 14.975 19947
4796 1 14 . 1 1 60 60 CYS H H 60 9.130 9.130 8.493 0.637 19947
4797 1 14 . 1 1 61 61 ARG N N 61 124.100 124.100 118.705 5.395 19947
4798 1 14 . 1 1 61 61 ARG HA H 61 4.360 4.360 4.640 -0.280 19947
4799 1 14 . 1 1 61 61 ARG CA C 61 56.800 56.800 55.409 1.391 19947
4800 1 14 . 1 1 61 61 ARG CB C 61 32.800 32.800 34.705 -1.905 19947
4801 1 14 . 1 1 61 61 ARG H H 61 7.580 7.580 7.421 0.159 19947
4802 1 14 . 1 1 62 62 ILE N N 62 126.200 126.200 115.920 10.280 19947
4803 1 14 . 1 1 62 62 ILE HA H 62 4.090 4.090 4.612 -0.522 19947
4804 1 14 . 1 1 62 62 ILE CA C 62 60.300 60.300 61.273 -0.973 19947
4805 1 14 . 1 1 62 62 ILE CB C 62 38.700 38.700 40.676 -1.976 19947
4806 1 14 . 1 1 62 62 ILE H H 62 8.490 8.490 8.456 0.034 19947
4807 1 14 . 1 1 63 63 ALA N N 63 129.400 129.400 131.810 -2.410 19947
4808 1 14 . 1 1 63 63 ALA HA H 63 4.310 4.310 4.449 -0.139 19947
4809 1 14 . 1 1 63 63 ALA CA C 63 51.900 51.900 54.110 -2.210 19947
4810 1 14 . 1 1 63 63 ALA CB C 63 20.600 20.600 19.165 1.435 19947
4811 1 14 . 1 1 63 63 ALA H H 63 8.100 8.100 8.572 -0.472 19947
4812 1 14 . 1 1 64 64 ARG N N 64 120.500 120.500 120.890 -0.390 19947
4813 1 14 . 1 1 64 64 ARG HA H 64 4.290 4.290 4.496 -0.206 19947
4814 1 14 . 1 1 64 64 ARG CA C 64 56.200 56.200 55.896 0.304 19947
4815 1 14 . 1 1 64 64 ARG CB C 64 30.500 30.500 30.183 0.317 19947
4816 1 14 . 1 1 64 64 ARG H H 64 8.140 8.140 8.764 -0.624 19947
4817 1 14 . 1 1 65 65 GLY N N 65 110.500 110.500 112.240 -1.740 19947
4818 1 14 . 1 1 65 65 GLY CA C 65 45.100 45.100 44.542 0.558 19947
4819 1 14 . 1 1 65 65 GLY H H 65 8.040 8.040 8.311 -0.271 19947
4820 1 14 . 1 1 66 66 ASP N N 66 120.700 120.700 119.460 1.240 19947
4821 1 14 . 1 1 66 66 ASP HA H 66 4.610 4.610 4.575 0.035 19947
4822 1 14 . 1 1 66 66 ASP CA C 66 53.300 53.300 54.142 -0.842 19947
4823 1 14 . 1 1 66 66 ASP CB C 66 37.600 37.600 41.199 -3.599 19947
4824 1 14 . 1 1 66 66 ASP H H 66 8.380 8.380 7.068 1.312 19947
4825 1 14 . 1 1 67 67 TRP N N 67 120.100 120.100 123.530 -3.430 19947
4826 1 14 . 1 1 67 67 TRP HA H 67 4.760 4.760 5.143 -0.383 19947
4827 1 14 . 1 1 67 67 TRP CA C 67 57.200 57.200 58.134 -0.934 19947
4828 1 14 . 1 1 67 67 TRP CB C 67 29.100 29.100 29.827 -0.727 19947
4829 1 14 . 1 1 67 67 TRP H H 67 7.950 7.950 7.955 -0.005 19947
4830 1 14 . 1 1 68 68 ASN N N 68 118.400 118.400 117.339 1.061 19947
4831 1 14 . 1 1 68 68 ASN HA H 68 4.790 4.790 4.958 -0.168 19947
4832 1 14 . 1 1 68 68 ASN CA C 68 52.800 52.800 53.687 -0.887 19947
4833 1 14 . 1 1 68 68 ASN CB C 68 39.300 39.300 40.406 -1.106 19947
4834 1 14 . 1 1 68 68 ASN H H 68 8.180 8.180 8.872 -0.692 19947
4835 1 14 . 1 1 69 69 ASP N N 69 118.500 118.500 118.121 0.379 19947
4836 1 14 . 1 1 69 69 ASP HA H 69 4.620 4.620 4.545 0.075 19947
4837 1 14 . 1 1 69 69 ASP CA C 69 53.200 53.200 56.357 -3.157 19947
4838 1 14 . 1 1 69 69 ASP CB C 69 38.000 38.000 41.224 -3.224 19947
4839 1 14 . 1 1 69 69 ASP H H 69 8.130 8.130 8.381 -0.251 19947
4840 1 14 . 1 1 70 70 ASP N N 70 120.500 120.500 120.763 -0.263 19947
4841 1 14 . 1 1 70 70 ASP HA H 70 5.100 5.100 5.274 -0.174 19947
4842 1 14 . 1 1 70 70 ASP CA C 70 52.500 52.500 52.865 -0.365 19947
4843 1 14 . 1 1 70 70 ASP CB C 70 42.600 42.600 42.954 -0.354 19947
4844 1 14 . 1 1 70 70 ASP H H 70 8.140 8.140 8.072 0.068 19947
4845 1 14 . 1 1 71 71 TYR N N 71 118.900 118.900 123.489 -4.589 19947
4846 1 14 . 1 1 71 71 TYR HA H 71 5.210 5.210 5.123 0.087 19947
4847 1 14 . 1 1 71 71 TYR CA C 71 56.300 56.300 57.007 -0.707 19947
4848 1 14 . 1 1 71 71 TYR CB C 71 42.200 42.200 42.780 -0.580 19947
4849 1 14 . 1 1 71 71 TYR H H 71 8.450 8.450 8.275 0.175 19947
4850 1 14 . 1 1 72 72 CYS N N 72 119.800 119.800 121.059 -1.259 19947
4851 1 14 . 1 1 72 72 CYS HA H 72 4.900 4.900 4.492 0.408 19947
4852 1 14 . 1 1 72 72 CYS CA C 72 53.400 53.400 60.501 -7.101 19947
4853 1 14 . 1 1 72 72 CYS CB C 72 37.200 37.200 28.387 8.813 19947
4854 1 14 . 1 1 72 72 CYS H H 72 9.330 9.330 8.885 0.445 19947
4855 1 14 . 1 1 73 73 THR N N 73 112.700 112.700 112.762 -0.062 19947
4856 1 14 . 1 1 73 73 THR HA H 73 4.430 4.430 4.418 0.012 19947
4857 1 14 . 1 1 73 73 THR CA C 73 62.300 62.300 61.462 0.838 19947
4858 1 14 . 1 1 73 73 THR CB C 73 71.300 71.300 69.990 1.310 19947
4859 1 14 . 1 1 73 73 THR H H 73 9.980 9.980 8.652 1.328 19947
4860 1 14 . 1 1 74 74 GLY N N 74 111.500 111.500 111.670 -0.170 19947
4861 1 14 . 1 1 74 74 GLY CA C 74 45.300 45.300 46.538 -1.238 19947
4862 1 14 . 1 1 74 74 GLY H H 74 8.580 8.580 8.387 0.193 19947
4863 1 14 . 1 1 75 75 LYS N N 75 115.900 115.900 114.814 1.086 19947
4864 1 14 . 1 1 75 75 LYS HA H 75 4.140 4.140 4.645 -0.505 19947
4865 1 14 . 1 1 75 75 LYS CA C 75 54.800 54.800 55.883 -1.083 19947
4866 1 14 . 1 1 75 75 LYS CB C 75 34.200 34.200 34.312 -0.112 19947
4867 1 14 . 1 1 75 75 LYS H H 75 7.900 7.900 7.420 0.480 19947
4868 1 14 . 1 1 76 76 SER N N 76 111.000 111.000 112.868 -1.868 19947
4869 1 14 . 1 1 76 76 SER HA H 76 4.160 4.160 4.015 0.145 19947
4870 1 14 . 1 1 76 76 SER CA C 76 61.400 61.400 56.574 4.826 19947
4871 1 14 . 1 1 76 76 SER CB C 76 64.300 64.300 64.596 -0.296 19947
4872 1 14 . 1 1 76 76 SER H H 76 6.520 6.520 6.919 -0.399 19947
4873 1 14 . 1 1 77 77 SER N N 77 117.100 117.100 115.785 1.315 19947
4874 1 14 . 1 1 77 77 SER HA H 77 4.220 4.220 4.264 -0.044 19947
4875 1 14 . 1 1 77 77 SER CA C 77 59.800 59.800 58.705 1.095 19947
4876 1 14 . 1 1 77 77 SER CB C 77 64.400 64.400 63.773 0.627 19947
4877 1 14 . 1 1 77 77 SER H H 77 9.030 9.030 8.278 0.752 19947
4878 1 14 . 1 1 78 78 ASP N N 78 122.100 122.100 121.712 0.388 19947
4879 1 14 . 1 1 78 78 ASP HA H 78 4.930 4.930 4.691 0.239 19947
4880 1 14 . 1 1 78 78 ASP CA C 78 52.400 52.400 53.469 -1.069 19947
4881 1 14 . 1 1 78 78 ASP CB C 78 40.800 40.800 44.063 -3.263 19947
4882 1 14 . 1 1 78 78 ASP H H 78 8.340 8.340 7.514 0.826 19947
4883 1 14 . 1 1 79 79 CYS N N 79 122.200 122.200 121.425 0.775 19947
4884 1 14 . 1 1 79 79 CYS HA H 79 5.320 5.320 4.924 0.396 19947
4885 1 14 . 1 1 79 79 CYS CA C 79 52.000 52.000 55.509 -3.509 19947
4886 1 14 . 1 1 79 79 CYS CB C 79 39.300 39.300 28.358 10.942 19947
4887 1 14 . 1 1 79 79 CYS H H 79 8.960 8.960 8.560 0.400 19947
4888 1 14 . 1 1 80 80 PRO HA H 80 4.410 4.410 4.594 -0.184 19947
4889 1 14 . 1 1 80 80 PRO CA C 80 63.500 63.500 63.074 0.426 19947
4890 1 14 . 1 1 80 80 PRO CB C 80 32.400 32.400 32.248 0.152 19947
4891 1 14 . 1 1 81 81 TRP N N 81 120.500 120.500 121.375 -0.875 19947
4892 1 14 . 1 1 81 81 TRP HA H 81 4.550 4.550 4.656 -0.106 19947
4893 1 14 . 1 1 81 81 TRP CA C 81 56.400 56.400 53.979 2.421 19947
4894 1 14 . 1 1 81 81 TRP CB C 81 29.500 29.500 28.272 1.228 19947
4895 1 14 . 1 1 81 81 TRP H H 81 8.400 8.400 8.402 -0.002 19947
4896 1 14 . 1 1 82 82 ASN N N 82 120.400 120.400 115.437 4.963 19947
4897 1 14 . 1 1 82 82 ASN HA H 82 4.750 4.750 4.432 0.318 19947
4898 1 14 . 1 1 82 82 ASN CA C 82 53.100 53.100 53.763 -0.663 19947
4899 1 14 . 1 1 82 82 ASN CB C 82 39.000 39.000 36.447 2.553 19947
4900 1 14 . 1 1 82 82 ASN H H 82 8.040 8.040 8.420 -0.380 19947
4901 1 15 . 1 1 2 2 PRO HA H 2 4.820 4.820 4.855 -0.035 19947
4902 1 15 . 1 1 2 2 PRO CA C 2 61.900 61.900 61.897 0.003 19947
4903 1 15 . 1 1 2 2 PRO CB C 2 30.700 30.700 32.050 -1.350 19947
4904 1 15 . 1 1 3 3 PRO HA H 3 4.540 4.540 4.478 0.062 19947
4905 1 15 . 1 1 3 3 PRO CA C 3 62.900 62.900 62.473 0.427 19947
4906 1 15 . 1 1 3 3 PRO CB C 3 32.100 32.100 32.797 -0.697 19947
4907 1 15 . 1 1 4 4 VAL N N 4 121.900 121.900 125.003 -3.103 19947
4908 1 15 . 1 1 4 4 VAL HA H 4 4.200 4.200 4.189 0.011 19947
4909 1 15 . 1 1 4 4 VAL CA C 4 62.300 62.300 61.821 0.479 19947
4910 1 15 . 1 1 4 4 VAL CB C 4 32.800 32.800 31.900 0.900 19947
4911 1 15 . 1 1 4 4 VAL H H 4 8.330 8.330 8.430 -0.100 19947
4912 1 15 . 1 1 5 5 CYS N N 5 120.900 120.900 127.347 -6.447 19947
4913 1 15 . 1 1 5 5 CYS HA H 5 4.700 4.700 4.399 0.301 19947
4914 1 15 . 1 1 5 5 CYS CA C 5 53.600 53.600 59.002 -5.402 19947
4915 1 15 . 1 1 5 5 CYS H H 5 8.500 8.500 8.609 -0.109 19947
4916 1 15 . 1 1 6 6 GLY N N 6 110.200 110.200 113.844 -3.644 19947
4917 1 15 . 1 1 6 6 GLY CA C 6 46.300 46.300 44.697 1.603 19947
4918 1 15 . 1 1 6 6 GLY H H 6 8.490 8.490 8.403 0.087 19947
4919 1 15 . 1 1 7 7 ASN N N 7 120.100 120.100 117.248 2.852 19947
4920 1 15 . 1 1 7 7 ASN HA H 7 4.730 4.730 4.365 0.365 19947
4921 1 15 . 1 1 7 7 ASN CA C 7 53.200 53.200 54.692 -1.492 19947
4922 1 15 . 1 1 7 7 ASN CB C 7 38.700 38.700 39.431 -0.731 19947
4923 1 15 . 1 1 7 7 ASN H H 7 8.320 8.320 8.190 0.130 19947
4924 1 15 . 1 1 8 8 LYS N N 8 121.300 121.300 121.630 -0.330 19947
4925 1 15 . 1 1 8 8 LYS HA H 8 4.340 4.340 4.333 0.007 19947
4926 1 15 . 1 1 8 8 LYS CA C 8 56.600 56.600 57.080 -0.480 19947
4927 1 15 . 1 1 8 8 LYS CB C 8 32.900 32.900 31.391 1.509 19947
4928 1 15 . 1 1 8 8 LYS H H 8 8.260 8.260 8.434 -0.174 19947
4929 1 15 . 1 1 9 9 ILE N N 9 136.600 136.600 122.597 14.003 19947
4930 1 15 . 1 1 9 9 ILE HA H 9 4.140 4.140 3.959 0.181 19947
4931 1 15 . 1 1 9 9 ILE CA C 9 61.300 61.300 62.196 -0.896 19947
4932 1 15 . 1 1 9 9 ILE CB C 9 38.200 38.200 37.744 0.456 19947
4933 1 15 . 1 1 9 9 ILE H H 9 8.150 8.150 8.105 0.045 19947
4934 1 15 . 1 1 10 10 LEU N N 10 125.700 125.700 121.882 3.818 19947
4935 1 15 . 1 1 10 10 LEU HA H 10 4.420 4.420 4.469 -0.049 19947
4936 1 15 . 1 1 10 10 LEU CA C 10 55.200 55.200 55.555 -0.355 19947
4937 1 15 . 1 1 10 10 LEU CB C 10 42.300 42.300 40.568 1.732 19947
4938 1 15 . 1 1 10 10 LEU H H 10 8.230 8.230 8.490 -0.260 19947
4939 1 15 . 1 1 11 11 GLU N N 11 120.600 120.600 114.196 6.404 19947
4940 1 15 . 1 1 11 11 GLU HA H 11 4.470 4.470 4.178 0.292 19947
4941 1 15 . 1 1 11 11 GLU CA C 11 55.500 55.500 56.670 -1.171 19947
4942 1 15 . 1 1 11 11 GLU CB C 11 28.900 28.900 27.807 1.093 19947
4943 1 15 . 1 1 11 11 GLU H H 11 8.250 8.250 7.931 0.319 19947
4944 1 15 . 1 1 12 12 GLN N N 12 121.600 121.600 118.266 3.334 19947
4945 1 15 . 1 1 12 12 GLN HA H 12 4.350 4.350 4.585 -0.235 19947
4946 1 15 . 1 1 12 12 GLN CA C 12 56.600 56.600 56.364 0.236 19947
4947 1 15 . 1 1 12 12 GLN CB C 12 29.200 29.200 30.294 -1.094 19947
4948 1 15 . 1 1 12 12 GLN H H 12 8.460 8.460 8.007 0.453 19947
4949 1 15 . 1 1 13 13 GLY N N 13 110.700 110.700 108.813 1.887 19947
4950 1 15 . 1 1 13 13 GLY CA C 13 45.700 45.700 46.500 -0.800 19947
4951 1 15 . 1 1 13 13 GLY H H 13 8.660 8.660 8.641 0.019 19947
4952 1 15 . 1 1 14 14 GLU N N 14 118.900 118.900 112.962 5.938 19947
4953 1 15 . 1 1 14 14 GLU HA H 14 4.530 4.530 4.187 0.343 19947
4954 1 15 . 1 1 14 14 GLU CA C 14 55.600 55.600 56.708 -1.108 19947
4955 1 15 . 1 1 14 14 GLU CB C 14 29.700 29.700 29.947 -0.247 19947
4956 1 15 . 1 1 14 14 GLU H H 14 8.230 8.230 8.167 0.063 19947
4957 1 15 . 1 1 15 15 ASP N N 15 118.400 118.400 120.627 -2.227 19947
4958 1 15 . 1 1 15 15 ASP HA H 15 4.990 4.990 4.485 0.505 19947
4959 1 15 . 1 1 15 15 ASP CA C 15 53.500 53.500 57.034 -3.534 19947
4960 1 15 . 1 1 15 15 ASP CB C 15 39.700 39.700 41.923 -2.223 19947
4961 1 15 . 1 1 15 15 ASP H H 15 8.330 8.330 7.999 0.331 19947
4962 1 15 . 1 1 16 16 CYS HA H 16 4.340 4.340 4.450 -0.110 19947
4963 1 15 . 1 1 16 16 CYS H H 16 8.510 8.510 8.143 0.367 19947
4964 1 15 . 1 1 17 17 ASP N N 17 116.700 116.700 122.720 -6.020 19947
4965 1 15 . 1 1 17 17 ASP HA H 17 4.740 4.740 4.265 0.475 19947
4966 1 15 . 1 1 17 17 ASP CA C 17 53.100 53.100 55.558 -2.458 19947
4967 1 15 . 1 1 17 17 ASP CB C 17 38.600 38.600 39.392 -0.792 19947
4968 1 15 . 1 1 17 17 ASP H H 17 8.180 8.180 8.787 -0.607 19947
4969 1 15 . 1 1 18 18 CYS HA H 18 4.730 4.730 4.020 0.710 19947
4970 1 15 . 1 1 18 18 CYS CB C 18 41.900 41.900 26.683 15.217 19947
4971 1 15 . 1 1 19 19 GLY H H 19 8.220 8.220 8.770 -0.550 19947
4972 1 15 . 1 1 20 20 SER HA H 20 4.920 4.920 4.415 0.505 19947
4973 1 15 . 1 1 20 20 SER CA C 20 55.700 55.700 57.437 -1.736 19947
4974 1 15 . 1 1 20 20 SER CB C 20 63.500 63.500 63.090 0.410 19947
4975 1 15 . 1 1 20 20 SER H H 20 7.830 7.830 8.418 -0.588 19947
4976 1 15 . 1 1 21 21 PRO HA H 21 4.240 4.240 4.250 -0.010 19947
4977 1 15 . 1 1 21 21 PRO CA C 21 63.400 63.400 64.773 -1.373 19947
4978 1 15 . 1 1 21 21 PRO CB C 21 31.800 31.800 31.392 0.408 19947
4979 1 15 . 1 1 22 22 ALA N N 22 119.900 119.900 115.732 4.168 19947
4980 1 15 . 1 1 22 22 ALA HA H 22 4.220 4.220 4.105 0.115 19947
4981 1 15 . 1 1 22 22 ALA CA C 22 54.200 54.200 54.182 0.018 19947
4982 1 15 . 1 1 22 22 ALA CB C 22 18.500 18.500 19.039 -0.539 19947
4983 1 15 . 1 1 22 22 ALA H H 22 8.180 8.180 7.957 0.223 19947
4984 1 15 . 1 1 23 23 ASN N N 23 116.300 116.300 112.861 3.439 19947
4985 1 15 . 1 1 23 23 ASN HA H 23 4.670 4.670 4.893 -0.223 19947
4986 1 15 . 1 1 23 23 ASN CA C 23 53.200 53.200 53.043 0.157 19947
4987 1 15 . 1 1 23 23 ASN CB C 23 39.300 39.300 40.043 -0.743 19947
4988 1 15 . 1 1 23 23 ASN H H 23 7.960 7.960 8.230 -0.270 19947
4989 1 15 . 1 1 24 24 CYS HA H 24 4.720 4.720 4.259 0.461 19947
4990 1 15 . 1 1 24 24 CYS H H 24 8.510 8.510 7.444 1.066 19947
4991 1 15 . 1 1 25 25 GLN HA H 25 4.460 4.460 3.934 0.526 19947
4992 1 15 . 1 1 25 25 GLN H H 25 8.320 8.320 8.466 -0.146 19947
4993 1 15 . 1 1 26 26 ASP HA H 26 4.740 4.740 4.693 0.047 19947
4994 1 15 . 1 1 26 26 ASP H H 26 8.580 8.580 8.528 0.052 19947
4995 1 15 . 1 1 27 27 ARG HA H 27 4.680 4.680 4.296 0.384 19947
4996 1 15 . 1 1 27 27 ARG CA C 27 54.700 54.700 57.511 -2.811 19947
4997 1 15 . 1 1 27 27 ARG H H 27 8.550 8.550 8.561 -0.011 19947
4998 1 15 . 1 1 28 28 CYS HA H 28 4.120 4.120 4.852 -0.732 19947
4999 1 15 . 1 1 28 28 CYS CA C 28 54.400 54.400 57.584 -3.184 19947
5000 1 15 . 1 1 28 28 CYS CB C 28 19.000 19.000 26.352 -7.353 19947
5001 1 15 . 1 1 28 28 CYS H H 28 8.910 8.910 8.170 0.740 19947
5002 1 15 . 1 1 29 29 CYS N N 29 113.300 113.300 120.966 -7.666 19947
5003 1 15 . 1 1 29 29 CYS HA H 29 5.010 5.010 4.661 0.349 19947
5004 1 15 . 1 1 29 29 CYS CA C 29 54.300 54.300 58.475 -4.175 19947
5005 1 15 . 1 1 29 29 CYS H H 29 7.730 7.730 8.247 -0.517 19947
5006 1 15 . 1 1 30 30 ASN HA H 30 4.730 4.730 5.057 -0.327 19947
5007 1 15 . 1 1 30 30 ASN CB C 30 38.700 38.700 39.959 -1.259 19947
5008 1 15 . 1 1 30 30 ASN H H 30 8.870 8.870 8.953 -0.083 19947
5009 1 15 . 1 1 31 31 ALA N N 31 129.400 129.400 126.453 2.947 19947
5010 1 15 . 1 1 31 31 ALA HA H 31 4.120 4.120 4.325 -0.205 19947
5011 1 15 . 1 1 31 31 ALA CA C 31 54.400 54.400 54.548 -0.148 19947
5012 1 15 . 1 1 31 31 ALA CB C 31 19.000 19.000 19.113 -0.113 19947
5013 1 15 . 1 1 31 31 ALA H H 31 8.890 8.890 8.565 0.325 19947
5014 1 15 . 1 1 32 32 ALA N N 32 116.400 116.400 117.836 -1.436 19947
5015 1 15 . 1 1 32 32 ALA HA H 32 4.340 4.340 4.313 0.027 19947
5016 1 15 . 1 1 32 32 ALA CA C 32 53.800 53.800 53.614 0.186 19947
5017 1 15 . 1 1 32 32 ALA CB C 32 19.100 19.100 18.951 0.149 19947
5018 1 15 . 1 1 32 32 ALA H H 32 8.250 8.250 8.346 -0.096 19947
5019 1 15 . 1 1 33 33 THR N N 33 104.300 104.300 110.317 -6.017 19947
5020 1 15 . 1 1 33 33 THR HA H 33 4.430 4.430 4.393 0.037 19947
5021 1 15 . 1 1 33 33 THR CA C 33 60.500 60.500 60.907 -0.407 19947
5022 1 15 . 1 1 33 33 THR CB C 33 70.600 70.600 69.472 1.128 19947
5023 1 15 . 1 1 33 33 THR H H 33 7.320 7.320 7.393 -0.073 19947
5024 1 15 . 1 1 34 34 CYS N N 34 123.400 123.400 121.243 2.157 19947
5025 1 15 . 1 1 34 34 CYS HA H 34 4.170 4.170 4.264 -0.094 19947
5026 1 15 . 1 1 34 34 CYS CA C 34 56.500 56.500 59.943 -3.443 19947
5027 1 15 . 1 1 34 34 CYS H H 34 8.710 8.710 8.185 0.525 19947
5028 1 15 . 1 1 35 35 LYS N N 35 116.900 116.900 117.814 -0.914 19947
5029 1 15 . 1 1 35 35 LYS HA H 35 4.960 4.960 4.850 0.110 19947
5030 1 15 . 1 1 35 35 LYS CA C 35 53.900 53.900 55.409 -1.509 19947
5031 1 15 . 1 1 35 35 LYS CB C 35 35.900 35.900 35.991 -0.091 19947
5032 1 15 . 1 1 35 35 LYS H H 35 7.450 7.450 7.779 -0.329 19947
5033 1 15 . 1 1 36 36 LEU N N 36 119.300 119.300 118.270 1.030 19947
5034 1 15 . 1 1 36 36 LEU HA H 36 4.800 4.800 4.885 -0.085 19947
5035 1 15 . 1 1 36 36 LEU CB C 36 42.400 42.400 43.168 -0.768 19947
5036 1 15 . 1 1 36 36 LEU H H 36 8.290 8.290 8.424 -0.134 19947
5037 1 15 . 1 1 37 37 THR HA H 37 4.340 4.340 4.703 -0.363 19947
5038 1 15 . 1 1 37 37 THR CA C 37 60.200 60.200 59.370 0.830 19947
5039 1 15 . 1 1 37 37 THR CB C 37 67.700 67.700 68.577 -0.877 19947
5040 1 15 . 1 1 37 37 THR H H 37 8.380 8.380 8.084 0.296 19947
5041 1 15 . 1 1 38 38 PRO HA H 38 4.380 4.380 4.236 0.144 19947
5042 1 15 . 1 1 38 38 PRO CA C 38 64.800 64.800 64.715 0.085 19947
5043 1 15 . 1 1 38 38 PRO CB C 38 31.500 31.500 31.417 0.083 19947
5044 1 15 . 1 1 39 39 GLY N N 39 113.300 113.300 111.619 1.681 19947
5045 1 15 . 1 1 39 39 GLY CA C 39 45.100 45.100 45.281 -0.181 19947
5046 1 15 . 1 1 39 39 GLY H H 39 8.830 8.830 8.516 0.314 19947
5047 1 15 . 1 1 40 40 SER N N 40 116.700 116.700 118.399 -1.699 19947
5048 1 15 . 1 1 40 40 SER HA H 40 4.610 4.610 4.377 0.233 19947
5049 1 15 . 1 1 40 40 SER CA C 40 58.800 58.800 59.078 -0.278 19947
5050 1 15 . 1 1 40 40 SER CB C 40 63.800 63.800 63.079 0.721 19947
5051 1 15 . 1 1 40 40 SER H H 40 8.280 8.280 7.746 0.534 19947
5052 1 15 . 1 1 41 41 GLN N N 41 120.600 120.600 125.047 -4.447 19947
5053 1 15 . 1 1 41 41 GLN HA H 41 4.110 4.110 4.096 0.014 19947
5054 1 15 . 1 1 41 41 GLN CA C 41 55.200 55.200 57.220 -2.020 19947
5055 1 15 . 1 1 41 41 GLN CB C 41 31.100 31.100 29.189 1.911 19947
5056 1 15 . 1 1 41 41 GLN H H 41 9.190 9.190 7.832 1.358 19947
5057 1 15 . 1 1 42 42 CYS N N 42 113.200 113.200 111.961 1.239 19947
5058 1 15 . 1 1 42 42 CYS HA H 42 4.630 4.630 4.752 -0.122 19947
5059 1 15 . 1 1 42 42 CYS CA C 42 53.700 53.700 56.308 -2.608 19947
5060 1 15 . 1 1 42 42 CYS CB C 42 45.500 45.500 31.112 14.388 19947
5061 1 15 . 1 1 42 42 CYS H H 42 7.710 7.710 7.524 0.186 19947
5062 1 15 . 1 1 43 43 ASN N N 43 114.200 114.200 119.072 -4.872 19947
5063 1 15 . 1 1 43 43 ASN HA H 43 4.940 4.940 4.760 0.180 19947
5064 1 15 . 1 1 43 43 ASN CA C 43 53.000 53.000 54.674 -1.674 19947
5065 1 15 . 1 1 43 43 ASN CB C 43 39.300 39.300 38.803 0.497 19947
5066 1 15 . 1 1 43 43 ASN H H 43 8.870 8.870 8.717 0.153 19947
5067 1 15 . 1 1 44 44 TYR N N 44 118.400 118.400 113.468 4.932 19947
5068 1 15 . 1 1 44 44 TYR HA H 44 4.850 4.850 4.604 0.246 19947
5069 1 15 . 1 1 44 44 TYR CA C 44 55.300 55.300 57.458 -2.158 19947
5070 1 15 . 1 1 44 44 TYR CB C 44 40.700 40.700 39.415 1.285 19947
5071 1 15 . 1 1 44 44 TYR H H 44 7.840 7.840 7.099 0.741 19947
5072 1 15 . 1 1 45 45 GLY N N 45 110.600 110.600 107.348 3.252 19947
5073 1 15 . 1 1 45 45 GLY CA C 45 44.000 44.000 44.928 -0.928 19947
5074 1 15 . 1 1 45 45 GLY H H 45 7.960 7.960 7.868 0.092 19947
5075 1 15 . 1 1 46 46 GLU N N 46 120.700 120.700 119.764 0.936 19947
5076 1 15 . 1 1 46 46 GLU HA H 46 4.280 4.280 4.229 0.051 19947
5077 1 15 . 1 1 46 46 GLU CA C 46 58.500 58.500 58.771 -0.271 19947
5078 1 15 . 1 1 46 46 GLU CB C 46 29.300 29.300 29.998 -0.698 19947
5079 1 15 . 1 1 46 46 GLU H H 46 9.160 9.160 8.640 0.520 19947
5080 1 15 . 1 1 47 47 CYS N N 47 112.400 112.400 117.449 -5.049 19947
5081 1 15 . 1 1 47 47 CYS HA H 47 4.850 4.850 4.695 0.155 19947
5082 1 15 . 1 1 47 47 CYS CA C 47 57.100 57.100 58.462 -1.362 19947
5083 1 15 . 1 1 47 47 CYS CB C 47 41.200 41.200 25.869 15.331 19947
5084 1 15 . 1 1 47 47 CYS H H 47 8.510 8.510 7.635 0.875 19947
5085 1 15 . 1 1 48 48 CYS N N 48 123.200 123.200 121.272 1.928 19947
5086 1 15 . 1 1 48 48 CYS HA H 48 5.160 5.160 5.092 0.068 19947
5087 1 15 . 1 1 48 48 CYS CA C 48 54.700 54.700 59.820 -5.120 19947
5088 1 15 . 1 1 48 48 CYS CB C 48 45.700 45.700 29.929 15.771 19947
5089 1 15 . 1 1 48 48 CYS H H 48 7.810 7.810 7.725 0.085 19947
5090 1 15 . 1 1 49 49 ASP N N 49 127.400 127.400 124.388 3.012 19947
5091 1 15 . 1 1 49 49 ASP HA H 49 4.890 4.890 4.992 -0.102 19947
5092 1 15 . 1 1 49 49 ASP CA C 49 53.500 53.500 54.020 -0.520 19947
5093 1 15 . 1 1 49 49 ASP CB C 49 42.400 42.400 43.474 -1.074 19947
5094 1 15 . 1 1 49 49 ASP H H 49 9.670 9.670 8.487 1.183 19947
5095 1 15 . 1 1 50 50 GLN N N 50 127.000 127.000 120.750 6.250 19947
5096 1 15 . 1 1 50 50 GLN HA H 50 3.940 3.940 3.948 -0.008 19947
5097 1 15 . 1 1 50 50 GLN CA C 50 56.800 56.800 59.093 -2.293 19947
5098 1 15 . 1 1 50 50 GLN CB C 50 26.500 26.500 27.544 -1.044 19947
5099 1 15 . 1 1 50 50 GLN H H 50 9.450 9.450 8.787 0.663 19947
5100 1 15 . 1 1 51 51 CYS N N 51 106.100 106.100 118.039 -11.939 19947
5101 1 15 . 1 1 51 51 CYS HA H 51 4.760 4.760 4.851 -0.091 19947
5102 1 15 . 1 1 51 51 CYS CB C 51 43.200 43.200 28.330 14.870 19947
5103 1 15 . 1 1 51 51 CYS H H 51 8.700 8.700 8.238 0.462 19947
5104 1 15 . 1 1 52 52 ARG N N 52 121.000 121.000 119.031 1.969 19947
5105 1 15 . 1 1 52 52 ARG HA H 52 4.690 4.690 4.444 0.246 19947
5106 1 15 . 1 1 52 52 ARG CA C 52 55.400 55.400 55.314 0.086 19947
5107 1 15 . 1 1 52 52 ARG CB C 52 33.100 33.100 34.404 -1.304 19947
5108 1 15 . 1 1 52 52 ARG H H 52 7.960 7.960 7.836 0.124 19947
5109 1 15 . 1 1 53 53 PHE N N 53 120.300 120.300 119.858 0.442 19947
5110 1 15 . 1 1 53 53 PHE HA H 53 5.050 5.050 5.359 -0.309 19947
5111 1 15 . 1 1 53 53 PHE CA C 53 56.100 56.100 56.446 -0.346 19947
5112 1 15 . 1 1 53 53 PHE CB C 53 38.200 38.200 39.452 -1.252 19947
5113 1 15 . 1 1 53 53 PHE H H 53 8.400 8.400 8.439 -0.039 19947
5114 1 15 . 1 1 54 54 LYS N N 54 123.300 123.300 125.005 -1.705 19947
5115 1 15 . 1 1 54 54 LYS HA H 54 4.250 4.250 4.164 0.086 19947
5116 1 15 . 1 1 54 54 LYS CA C 54 57.500 57.500 56.666 0.834 19947
5117 1 15 . 1 1 54 54 LYS CB C 54 34.300 34.300 32.416 1.884 19947
5118 1 15 . 1 1 54 54 LYS H H 54 8.540 8.540 8.804 -0.264 19947
5119 1 15 . 1 1 55 55 LYS N N 55 119.400 119.400 125.074 -5.674 19947
5120 1 15 . 1 1 55 55 LYS HA H 55 4.110 4.110 4.013 0.097 19947
5121 1 15 . 1 1 55 55 LYS CA C 55 56.500 56.500 56.848 -0.348 19947
5122 1 15 . 1 1 55 55 LYS CB C 55 33.400 33.400 33.260 0.140 19947
5123 1 15 . 1 1 55 55 LYS H H 55 8.440 8.440 8.324 0.116 19947
5124 1 15 . 1 1 56 56 ALA N N 56 126.700 126.700 128.243 -1.543 19947
5125 1 15 . 1 1 56 56 ALA HA H 56 3.920 3.920 3.977 -0.057 19947
5126 1 15 . 1 1 56 56 ALA CA C 56 52.900 52.900 53.696 -0.796 19947
5127 1 15 . 1 1 56 56 ALA CB C 56 18.100 18.100 18.465 -0.365 19947
5128 1 15 . 1 1 56 56 ALA H H 56 8.930 8.930 8.712 0.218 19947
5129 1 15 . 1 1 57 57 GLY N N 57 109.300 109.300 111.502 -2.202 19947
5130 1 15 . 1 1 57 57 GLY CA C 57 45.100 45.100 44.871 0.229 19947
5131 1 15 . 1 1 57 57 GLY H H 57 8.460 8.460 8.447 0.013 19947
5132 1 15 . 1 1 58 58 THR N N 58 117.200 117.200 120.289 -3.089 19947
5133 1 15 . 1 1 58 58 THR HA H 58 4.260 4.260 4.457 -0.197 19947
5134 1 15 . 1 1 58 58 THR CA C 58 63.300 63.300 62.662 0.638 19947
5135 1 15 . 1 1 58 58 THR CB C 58 69.600 69.600 68.693 0.907 19947
5136 1 15 . 1 1 58 58 THR H H 58 7.660 7.660 7.792 -0.132 19947
5137 1 15 . 1 1 59 59 VAL N N 59 130.400 130.400 128.415 1.985 19947
5138 1 15 . 1 1 59 59 VAL HA H 59 3.900 3.900 3.687 0.213 19947
5139 1 15 . 1 1 59 59 VAL CA C 59 64.400 64.400 62.302 2.098 19947
5140 1 15 . 1 1 59 59 VAL CB C 59 31.900 31.900 31.566 0.334 19947
5141 1 15 . 1 1 59 59 VAL H H 59 9.190 9.190 8.704 0.486 19947
5142 1 15 . 1 1 60 60 CYS N N 60 121.800 121.800 126.686 -4.886 19947
5143 1 15 . 1 1 60 60 CYS HA H 60 5.050 5.050 4.541 0.509 19947
5144 1 15 . 1 1 60 60 CYS CA C 60 54.400 54.400 58.297 -3.897 19947
5145 1 15 . 1 1 60 60 CYS CB C 60 43.000 43.000 27.834 15.166 19947
5146 1 15 . 1 1 60 60 CYS H H 60 9.130 9.130 8.352 0.778 19947
5147 1 15 . 1 1 61 61 ARG N N 61 124.100 124.100 118.562 5.538 19947
5148 1 15 . 1 1 61 61 ARG HA H 61 4.360 4.360 4.430 -0.070 19947
5149 1 15 . 1 1 61 61 ARG CA C 61 56.800 56.800 55.308 1.492 19947
5150 1 15 . 1 1 61 61 ARG CB C 61 32.800 32.800 34.184 -1.384 19947
5151 1 15 . 1 1 61 61 ARG H H 61 7.580 7.580 7.277 0.303 19947
5152 1 15 . 1 1 62 62 ILE N N 62 126.200 126.200 116.667 9.533 19947
5153 1 15 . 1 1 62 62 ILE HA H 62 4.090 4.090 4.352 -0.262 19947
5154 1 15 . 1 1 62 62 ILE CA C 62 60.300 60.300 61.257 -0.957 19947
5155 1 15 . 1 1 62 62 ILE CB C 62 38.700 38.700 40.815 -2.115 19947
5156 1 15 . 1 1 62 62 ILE H H 62 8.490 8.490 8.146 0.344 19947
5157 1 15 . 1 1 63 63 ALA N N 63 129.400 129.400 131.115 -1.715 19947
5158 1 15 . 1 1 63 63 ALA HA H 63 4.310 4.310 4.419 -0.109 19947
5159 1 15 . 1 1 63 63 ALA CA C 63 51.900 51.900 54.202 -2.302 19947
5160 1 15 . 1 1 63 63 ALA CB C 63 20.600 20.600 19.660 0.941 19947
5161 1 15 . 1 1 63 63 ALA H H 63 8.100 8.100 8.827 -0.727 19947
5162 1 15 . 1 1 64 64 ARG N N 64 120.500 120.500 121.037 -0.537 19947
5163 1 15 . 1 1 64 64 ARG HA H 64 4.290 4.290 4.550 -0.260 19947
5164 1 15 . 1 1 64 64 ARG CA C 64 56.200 56.200 55.914 0.286 19947
5165 1 15 . 1 1 64 64 ARG CB C 64 30.500 30.500 30.133 0.367 19947
5166 1 15 . 1 1 64 64 ARG H H 64 8.140 8.140 8.988 -0.848 19947
5167 1 15 . 1 1 65 65 GLY N N 65 110.500 110.500 112.016 -1.516 19947
5168 1 15 . 1 1 65 65 GLY CA C 65 45.100 45.100 44.568 0.532 19947
5169 1 15 . 1 1 65 65 GLY H H 65 8.040 8.040 8.338 -0.298 19947
5170 1 15 . 1 1 66 66 ASP N N 66 120.700 120.700 119.239 1.461 19947
5171 1 15 . 1 1 66 66 ASP HA H 66 4.610 4.610 4.616 -0.006 19947
5172 1 15 . 1 1 66 66 ASP CA C 66 53.300 53.300 54.092 -0.792 19947
5173 1 15 . 1 1 66 66 ASP CB C 66 37.600 37.600 40.957 -3.357 19947
5174 1 15 . 1 1 66 66 ASP H H 66 8.380 8.380 7.233 1.147 19947
5175 1 15 . 1 1 67 67 TRP N N 67 120.100 120.100 123.112 -3.012 19947
5176 1 15 . 1 1 67 67 TRP HA H 67 4.760 4.760 5.084 -0.324 19947
5177 1 15 . 1 1 67 67 TRP CA C 67 57.200 57.200 57.861 -0.661 19947
5178 1 15 . 1 1 67 67 TRP CB C 67 29.100 29.100 29.190 -0.090 19947
5179 1 15 . 1 1 67 67 TRP H H 67 7.950 7.950 7.740 0.210 19947
5180 1 15 . 1 1 68 68 ASN N N 68 118.400 118.400 119.452 -1.052 19947
5181 1 15 . 1 1 68 68 ASN HA H 68 4.790 4.790 4.839 -0.049 19947
5182 1 15 . 1 1 68 68 ASN CA C 68 52.800 52.800 53.700 -0.900 19947
5183 1 15 . 1 1 68 68 ASN CB C 68 39.300 39.300 39.104 0.196 19947
5184 1 15 . 1 1 68 68 ASN H H 68 8.180 8.180 8.172 0.008 19947
5185 1 15 . 1 1 69 69 ASP N N 69 118.500 118.500 118.154 0.346 19947
5186 1 15 . 1 1 69 69 ASP HA H 69 4.620 4.620 4.407 0.213 19947
5187 1 15 . 1 1 69 69 ASP CA C 69 53.200 53.200 56.294 -3.094 19947
5188 1 15 . 1 1 69 69 ASP CB C 69 38.000 38.000 41.253 -3.253 19947
5189 1 15 . 1 1 69 69 ASP H H 69 8.130 8.130 8.270 -0.140 19947
5190 1 15 . 1 1 70 70 ASP N N 70 120.500 120.500 121.294 -0.794 19947
5191 1 15 . 1 1 70 70 ASP HA H 70 5.100 5.100 5.091 0.009 19947
5192 1 15 . 1 1 70 70 ASP CA C 70 52.500 52.500 53.720 -1.220 19947
5193 1 15 . 1 1 70 70 ASP CB C 70 42.600 42.600 42.016 0.584 19947
5194 1 15 . 1 1 70 70 ASP H H 70 8.140 8.140 8.122 0.018 19947
5195 1 15 . 1 1 71 71 TYR N N 71 118.900 118.900 124.068 -5.168 19947
5196 1 15 . 1 1 71 71 TYR HA H 71 5.210 5.210 4.910 0.300 19947
5197 1 15 . 1 1 71 71 TYR CA C 71 56.300 56.300 57.171 -0.871 19947
5198 1 15 . 1 1 71 71 TYR CB C 71 42.200 42.200 42.967 -0.767 19947
5199 1 15 . 1 1 71 71 TYR H H 71 8.450 8.450 8.544 -0.094 19947
5200 1 15 . 1 1 72 72 CYS N N 72 119.800 119.800 121.083 -1.283 19947
5201 1 15 . 1 1 72 72 CYS HA H 72 4.900 4.900 4.597 0.303 19947
5202 1 15 . 1 1 72 72 CYS CA C 72 53.400 53.400 58.802 -5.402 19947
5203 1 15 . 1 1 72 72 CYS CB C 72 37.200 37.200 29.165 8.035 19947
5204 1 15 . 1 1 72 72 CYS H H 72 9.330 9.330 8.587 0.743 19947
5205 1 15 . 1 1 73 73 THR N N 73 112.700 112.700 114.759 -2.059 19947
5206 1 15 . 1 1 73 73 THR HA H 73 4.430 4.430 4.442 -0.012 19947
5207 1 15 . 1 1 73 73 THR CA C 73 62.300 62.300 61.556 0.744 19947
5208 1 15 . 1 1 73 73 THR CB C 73 71.300 71.300 70.187 1.113 19947
5209 1 15 . 1 1 73 73 THR H H 73 9.980 9.980 8.812 1.168 19947
5210 1 15 . 1 1 74 74 GLY N N 74 111.500 111.500 111.767 -0.267 19947
5211 1 15 . 1 1 74 74 GLY CA C 74 45.300 45.300 46.635 -1.335 19947
5212 1 15 . 1 1 74 74 GLY H H 74 8.580 8.580 7.811 0.769 19947
5213 1 15 . 1 1 75 75 LYS N N 75 115.900 115.900 117.311 -1.411 19947
5214 1 15 . 1 1 75 75 LYS HA H 75 4.140 4.140 4.620 -0.480 19947
5215 1 15 . 1 1 75 75 LYS CA C 75 54.800 54.800 55.664 -0.864 19947
5216 1 15 . 1 1 75 75 LYS CB C 75 34.200 34.200 34.285 -0.084 19947
5217 1 15 . 1 1 75 75 LYS H H 75 7.900 7.900 7.563 0.337 19947
5218 1 15 . 1 1 76 76 SER N N 76 111.000 111.000 111.917 -0.917 19947
5219 1 15 . 1 1 76 76 SER HA H 76 4.160 4.160 3.791 0.369 19947
5220 1 15 . 1 1 76 76 SER CA C 76 61.400 61.400 57.077 4.323 19947
5221 1 15 . 1 1 76 76 SER CB C 76 64.300 64.300 64.207 0.093 19947
5222 1 15 . 1 1 76 76 SER H H 76 6.520 6.520 7.052 -0.532 19947
5223 1 15 . 1 1 77 77 SER N N 77 117.100 117.100 116.132 0.968 19947
5224 1 15 . 1 1 77 77 SER HA H 77 4.220 4.220 4.417 -0.197 19947
5225 1 15 . 1 1 77 77 SER CA C 77 59.800 59.800 58.836 0.964 19947
5226 1 15 . 1 1 77 77 SER CB C 77 64.400 64.400 63.459 0.942 19947
5227 1 15 . 1 1 77 77 SER H H 77 9.030 9.030 8.340 0.690 19947
5228 1 15 . 1 1 78 78 ASP N N 78 122.100 122.100 118.254 3.846 19947
5229 1 15 . 1 1 78 78 ASP HA H 78 4.930 4.930 4.695 0.235 19947
5230 1 15 . 1 1 78 78 ASP CA C 78 52.400 52.400 52.415 -0.015 19947
5231 1 15 . 1 1 78 78 ASP CB C 78 40.800 40.800 43.391 -2.591 19947
5232 1 15 . 1 1 78 78 ASP H H 78 8.340 8.340 7.543 0.796 19947
5233 1 15 . 1 1 79 79 CYS N N 79 122.200 122.200 121.244 0.956 19947
5234 1 15 . 1 1 79 79 CYS HA H 79 5.320 5.320 4.836 0.484 19947
5235 1 15 . 1 1 79 79 CYS CA C 79 52.000 52.000 55.608 -3.608 19947
5236 1 15 . 1 1 79 79 CYS CB C 79 39.300 39.300 27.707 11.593 19947
5237 1 15 . 1 1 79 79 CYS H H 79 8.960 8.960 8.747 0.213 19947
5238 1 15 . 1 1 80 80 PRO HA H 80 4.410 4.410 4.620 -0.210 19947
5239 1 15 . 1 1 80 80 PRO CA C 80 63.500 63.500 63.532 -0.032 19947
5240 1 15 . 1 1 80 80 PRO CB C 80 32.400 32.400 32.827 -0.427 19947
5241 1 15 . 1 1 81 81 TRP N N 81 120.500 120.500 121.407 -0.907 19947
5242 1 15 . 1 1 81 81 TRP HA H 81 4.550 4.550 4.747 -0.197 19947
5243 1 15 . 1 1 81 81 TRP CA C 81 56.400 56.400 58.286 -1.887 19947
5244 1 15 . 1 1 81 81 TRP CB C 81 29.500 29.500 29.570 -0.070 19947
5245 1 15 . 1 1 81 81 TRP H H 81 8.400 8.400 8.922 -0.522 19947
5246 1 15 . 1 1 82 82 ASN N N 82 120.400 120.400 115.107 5.293 19947
5247 1 15 . 1 1 82 82 ASN HA H 82 4.750 4.750 4.584 0.166 19947
5248 1 15 . 1 1 82 82 ASN CA C 82 53.100 53.100 53.658 -0.558 19947
5249 1 15 . 1 1 82 82 ASN CB C 82 39.000 39.000 37.389 1.611 19947
5250 1 15 . 1 1 82 82 ASN H H 82 8.040 8.040 8.482 -0.442 19947
5251 1 16 . 1 1 2 2 PRO HA H 2 4.820 4.820 4.503 0.317 19947
5252 1 16 . 1 1 2 2 PRO CA C 2 61.900 61.900 62.193 -0.293 19947
5253 1 16 . 1 1 2 2 PRO CB C 2 30.700 30.700 31.831 -1.131 19947
5254 1 16 . 1 1 3 3 PRO HA H 3 4.540 4.540 4.413 0.127 19947
5255 1 16 . 1 1 3 3 PRO CA C 3 62.900 62.900 62.433 0.467 19947
5256 1 16 . 1 1 3 3 PRO CB C 3 32.100 32.100 32.745 -0.645 19947
5257 1 16 . 1 1 4 4 VAL N N 4 121.900 121.900 124.626 -2.726 19947
5258 1 16 . 1 1 4 4 VAL HA H 4 4.200 4.200 4.254 -0.054 19947
5259 1 16 . 1 1 4 4 VAL CA C 4 62.300 62.300 62.491 -0.191 19947
5260 1 16 . 1 1 4 4 VAL CB C 4 32.800 32.800 32.469 0.331 19947
5261 1 16 . 1 1 4 4 VAL H H 4 8.330 8.330 8.518 -0.188 19947
5262 1 16 . 1 1 5 5 CYS N N 5 120.900 120.900 125.048 -4.148 19947
5263 1 16 . 1 1 5 5 CYS HA H 5 4.700 4.700 4.457 0.243 19947
5264 1 16 . 1 1 5 5 CYS CA C 5 53.600 53.600 58.607 -5.007 19947
5265 1 16 . 1 1 5 5 CYS H H 5 8.500 8.500 8.251 0.249 19947
5266 1 16 . 1 1 6 6 GLY N N 6 110.200 110.200 114.475 -4.275 19947
5267 1 16 . 1 1 6 6 GLY CA C 6 46.300 46.300 46.240 0.060 19947
5268 1 16 . 1 1 6 6 GLY H H 6 8.490 8.490 8.632 -0.142 19947
5269 1 16 . 1 1 7 7 ASN N N 7 120.100 120.100 113.687 6.413 19947
5270 1 16 . 1 1 7 7 ASN HA H 7 4.730 4.730 4.282 0.448 19947
5271 1 16 . 1 1 7 7 ASN CA C 7 53.200 53.200 53.247 -0.047 19947
5272 1 16 . 1 1 7 7 ASN CB C 7 38.700 38.700 38.224 0.476 19947
5273 1 16 . 1 1 7 7 ASN H H 7 8.320 8.320 8.069 0.251 19947
5274 1 16 . 1 1 8 8 LYS N N 8 121.300 121.300 123.630 -2.330 19947
5275 1 16 . 1 1 8 8 LYS HA H 8 4.340 4.340 4.093 0.247 19947
5276 1 16 . 1 1 8 8 LYS CA C 8 56.600 56.600 56.764 -0.165 19947
5277 1 16 . 1 1 8 8 LYS CB C 8 32.900 32.900 32.038 0.862 19947
5278 1 16 . 1 1 8 8 LYS H H 8 8.260 8.260 8.307 -0.047 19947
5279 1 16 . 1 1 9 9 ILE N N 9 136.600 136.600 122.364 14.236 19947
5280 1 16 . 1 1 9 9 ILE HA H 9 4.140 4.140 3.950 0.190 19947
5281 1 16 . 1 1 9 9 ILE CA C 9 61.300 61.300 62.512 -1.212 19947
5282 1 16 . 1 1 9 9 ILE CB C 9 38.200 38.200 38.106 0.094 19947
5283 1 16 . 1 1 9 9 ILE H H 9 8.150 8.150 8.011 0.139 19947
5284 1 16 . 1 1 10 10 LEU N N 10 125.700 125.700 119.682 6.018 19947
5285 1 16 . 1 1 10 10 LEU HA H 10 4.420 4.420 4.592 -0.172 19947
5286 1 16 . 1 1 10 10 LEU CA C 10 55.200 55.200 55.288 -0.087 19947
5287 1 16 . 1 1 10 10 LEU CB C 10 42.300 42.300 40.844 1.456 19947
5288 1 16 . 1 1 10 10 LEU H H 10 8.230 8.230 8.482 -0.252 19947
5289 1 16 . 1 1 11 11 GLU N N 11 120.600 120.600 116.394 4.206 19947
5290 1 16 . 1 1 11 11 GLU HA H 11 4.470 4.470 4.068 0.402 19947
5291 1 16 . 1 1 11 11 GLU CA C 11 55.500 55.500 56.515 -1.015 19947
5292 1 16 . 1 1 11 11 GLU CB C 11 28.900 28.900 29.373 -0.473 19947
5293 1 16 . 1 1 11 11 GLU H H 11 8.250 8.250 8.069 0.181 19947
5294 1 16 . 1 1 12 12 GLN N N 12 121.600 121.600 120.331 1.269 19947
5295 1 16 . 1 1 12 12 GLN HA H 12 4.350 4.350 4.828 -0.478 19947
5296 1 16 . 1 1 12 12 GLN CA C 12 56.600 56.600 54.011 2.589 19947
5297 1 16 . 1 1 12 12 GLN CB C 12 29.200 29.200 27.282 1.918 19947
5298 1 16 . 1 1 12 12 GLN H H 12 8.460 8.460 8.166 0.294 19947
5299 1 16 . 1 1 13 13 GLY N N 13 110.700 110.700 109.794 0.906 19947
5300 1 16 . 1 1 13 13 GLY CA C 13 45.700 45.700 45.797 -0.097 19947
5301 1 16 . 1 1 13 13 GLY H H 13 8.660 8.660 8.269 0.391 19947
5302 1 16 . 1 1 14 14 GLU N N 14 118.900 118.900 116.672 2.228 19947
5303 1 16 . 1 1 14 14 GLU HA H 14 4.530 4.530 4.134 0.396 19947
5304 1 16 . 1 1 14 14 GLU CA C 14 55.600 55.600 57.530 -1.930 19947
5305 1 16 . 1 1 14 14 GLU CB C 14 29.700 29.700 29.636 0.064 19947
5306 1 16 . 1 1 14 14 GLU H H 14 8.230 8.230 8.257 -0.027 19947
5307 1 16 . 1 1 15 15 ASP N N 15 118.400 118.400 119.611 -1.211 19947
5308 1 16 . 1 1 15 15 ASP HA H 15 4.990 4.990 4.452 0.538 19947
5309 1 16 . 1 1 15 15 ASP CA C 15 53.500 53.500 56.596 -3.096 19947
5310 1 16 . 1 1 15 15 ASP CB C 15 39.700 39.700 41.408 -1.708 19947
5311 1 16 . 1 1 15 15 ASP H H 15 8.330 8.330 8.582 -0.252 19947
5312 1 16 . 1 1 16 16 CYS HA H 16 4.340 4.340 4.515 -0.175 19947
5313 1 16 . 1 1 16 16 CYS H H 16 8.510 8.510 7.589 0.921 19947
5314 1 16 . 1 1 17 17 ASP N N 17 116.700 116.700 126.029 -9.329 19947
5315 1 16 . 1 1 17 17 ASP HA H 17 4.740 4.740 4.446 0.294 19947
5316 1 16 . 1 1 17 17 ASP CA C 17 53.100 53.100 55.170 -2.071 19947
5317 1 16 . 1 1 17 17 ASP CB C 17 38.600 38.600 40.032 -1.432 19947
5318 1 16 . 1 1 17 17 ASP H H 17 8.180 8.180 8.573 -0.393 19947
5319 1 16 . 1 1 18 18 CYS HA H 18 4.730 4.730 3.985 0.745 19947
5320 1 16 . 1 1 18 18 CYS CB C 18 41.900 41.900 27.331 14.569 19947
5321 1 16 . 1 1 19 19 GLY H H 19 8.220 8.220 8.400 -0.180 19947
5322 1 16 . 1 1 20 20 SER HA H 20 4.920 4.920 4.843 0.077 19947
5323 1 16 . 1 1 20 20 SER CA C 20 55.700 55.700 55.758 -0.058 19947
5324 1 16 . 1 1 20 20 SER CB C 20 63.500 63.500 63.250 0.250 19947
5325 1 16 . 1 1 20 20 SER H H 20 7.830 7.830 7.988 -0.158 19947
5326 1 16 . 1 1 21 21 PRO HA H 21 4.240 4.240 4.264 -0.024 19947
5327 1 16 . 1 1 21 21 PRO CA C 21 63.400 63.400 65.203 -1.803 19947
5328 1 16 . 1 1 21 21 PRO CB C 21 31.800 31.800 31.801 -0.001 19947
5329 1 16 . 1 1 22 22 ALA N N 22 119.900 119.900 119.905 -0.005 19947
5330 1 16 . 1 1 22 22 ALA HA H 22 4.220 4.220 4.121 0.099 19947
5331 1 16 . 1 1 22 22 ALA CA C 22 54.200 54.200 54.031 0.169 19947
5332 1 16 . 1 1 22 22 ALA CB C 22 18.500 18.500 18.576 -0.076 19947
5333 1 16 . 1 1 22 22 ALA H H 22 8.180 8.180 8.465 -0.285 19947
5334 1 16 . 1 1 23 23 ASN N N 23 116.300 116.300 113.391 2.909 19947
5335 1 16 . 1 1 23 23 ASN HA H 23 4.670 4.670 4.951 -0.281 19947
5336 1 16 . 1 1 23 23 ASN CA C 23 53.200 53.200 52.649 0.551 19947
5337 1 16 . 1 1 23 23 ASN CB C 23 39.300 39.300 38.467 0.833 19947
5338 1 16 . 1 1 23 23 ASN H H 23 7.960 7.960 7.731 0.229 19947
5339 1 16 . 1 1 24 24 CYS HA H 24 4.720 4.720 4.125 0.595 19947
5340 1 16 . 1 1 24 24 CYS H H 24 8.510 8.510 7.911 0.599 19947
5341 1 16 . 1 1 25 25 GLN HA H 25 4.460 4.460 4.521 -0.061 19947
5342 1 16 . 1 1 25 25 GLN H H 25 8.320 8.320 8.005 0.315 19947
5343 1 16 . 1 1 26 26 ASP HA H 26 4.740 4.740 4.760 -0.020 19947
5344 1 16 . 1 1 26 26 ASP H H 26 8.580 8.580 7.867 0.713 19947
5345 1 16 . 1 1 27 27 ARG HA H 27 4.680 4.680 3.960 0.720 19947
5346 1 16 . 1 1 27 27 ARG CA C 27 54.700 54.700 58.735 -4.035 19947
5347 1 16 . 1 1 27 27 ARG H H 27 8.550 8.550 8.666 -0.116 19947
5348 1 16 . 1 1 28 28 CYS HA H 28 4.120 4.120 4.794 -0.674 19947
5349 1 16 . 1 1 28 28 CYS CA C 28 54.400 54.400 58.330 -3.930 19947
5350 1 16 . 1 1 28 28 CYS CB C 28 19.000 19.000 27.849 -8.849 19947
5351 1 16 . 1 1 28 28 CYS H H 28 8.910 8.910 8.103 0.807 19947
5352 1 16 . 1 1 29 29 CYS N N 29 113.300 113.300 118.679 -5.379 19947
5353 1 16 . 1 1 29 29 CYS HA H 29 5.010 5.010 4.764 0.246 19947
5354 1 16 . 1 1 29 29 CYS CA C 29 54.300 54.300 56.820 -2.520 19947
5355 1 16 . 1 1 29 29 CYS H H 29 7.730 7.730 7.934 -0.204 19947
5356 1 16 . 1 1 30 30 ASN HA H 30 4.730 4.730 4.917 -0.187 19947
5357 1 16 . 1 1 30 30 ASN CB C 30 38.700 38.700 39.821 -1.121 19947
5358 1 16 . 1 1 30 30 ASN H H 30 8.870 8.870 8.997 -0.127 19947
5359 1 16 . 1 1 31 31 ALA N N 31 129.400 129.400 127.181 2.219 19947
5360 1 16 . 1 1 31 31 ALA HA H 31 4.120 4.120 4.320 -0.200 19947
5361 1 16 . 1 1 31 31 ALA CA C 31 54.400 54.400 54.151 0.249 19947
5362 1 16 . 1 1 31 31 ALA CB C 31 19.000 19.000 19.069 -0.069 19947
5363 1 16 . 1 1 31 31 ALA H H 31 8.890 8.890 8.684 0.206 19947
5364 1 16 . 1 1 32 32 ALA N N 32 116.400 116.400 116.410 -0.010 19947
5365 1 16 . 1 1 32 32 ALA HA H 32 4.340 4.340 4.456 -0.116 19947
5366 1 16 . 1 1 32 32 ALA CA C 32 53.800 53.800 52.862 0.938 19947
5367 1 16 . 1 1 32 32 ALA CB C 32 19.100 19.100 19.438 -0.338 19947
5368 1 16 . 1 1 32 32 ALA H H 32 8.250 8.250 7.834 0.416 19947
5369 1 16 . 1 1 33 33 THR N N 33 104.300 104.300 110.953 -6.653 19947
5370 1 16 . 1 1 33 33 THR HA H 33 4.430 4.430 4.409 0.021 19947
5371 1 16 . 1 1 33 33 THR CA C 33 60.500 60.500 61.231 -0.731 19947
5372 1 16 . 1 1 33 33 THR CB C 33 70.600 70.600 69.926 0.674 19947
5373 1 16 . 1 1 33 33 THR H H 33 7.320 7.320 7.184 0.136 19947
5374 1 16 . 1 1 34 34 CYS N N 34 123.400 123.400 121.252 2.148 19947
5375 1 16 . 1 1 34 34 CYS HA H 34 4.170 4.170 4.211 -0.041 19947
5376 1 16 . 1 1 34 34 CYS CA C 34 56.500 56.500 60.277 -3.777 19947
5377 1 16 . 1 1 34 34 CYS H H 34 8.710 8.710 8.274 0.436 19947
5378 1 16 . 1 1 35 35 LYS N N 35 116.900 116.900 117.207 -0.307 19947
5379 1 16 . 1 1 35 35 LYS HA H 35 4.960 4.960 4.790 0.170 19947
5380 1 16 . 1 1 35 35 LYS CA C 35 53.900 53.900 55.393 -1.493 19947
5381 1 16 . 1 1 35 35 LYS CB C 35 35.900 35.900 35.985 -0.085 19947
5382 1 16 . 1 1 35 35 LYS H H 35 7.450 7.450 7.795 -0.345 19947
5383 1 16 . 1 1 36 36 LEU N N 36 119.300 119.300 117.456 1.844 19947
5384 1 16 . 1 1 36 36 LEU HA H 36 4.800 4.800 4.537 0.263 19947
5385 1 16 . 1 1 36 36 LEU CB C 36 42.400 42.400 42.726 -0.326 19947
5386 1 16 . 1 1 36 36 LEU H H 36 8.290 8.290 8.484 -0.194 19947
5387 1 16 . 1 1 37 37 THR HA H 37 4.340 4.340 4.576 -0.236 19947
5388 1 16 . 1 1 37 37 THR CA C 37 60.200 60.200 59.839 0.361 19947
5389 1 16 . 1 1 37 37 THR CB C 37 67.700 67.700 68.426 -0.726 19947
5390 1 16 . 1 1 37 37 THR H H 37 8.380 8.380 8.051 0.329 19947
5391 1 16 . 1 1 38 38 PRO HA H 38 4.380 4.380 4.195 0.185 19947
5392 1 16 . 1 1 38 38 PRO CA C 38 64.800 64.800 64.227 0.573 19947
5393 1 16 . 1 1 38 38 PRO CB C 38 31.500 31.500 31.493 0.007 19947
5394 1 16 . 1 1 39 39 GLY N N 39 113.300 113.300 112.593 0.707 19947
5395 1 16 . 1 1 39 39 GLY CA C 39 45.100 45.100 44.966 0.134 19947
5396 1 16 . 1 1 39 39 GLY H H 39 8.830 8.830 8.444 0.386 19947
5397 1 16 . 1 1 40 40 SER N N 40 116.700 116.700 116.438 0.262 19947
5398 1 16 . 1 1 40 40 SER HA H 40 4.610 4.610 4.446 0.164 19947
5399 1 16 . 1 1 40 40 SER CA C 40 58.800 58.800 59.548 -0.748 19947
5400 1 16 . 1 1 40 40 SER CB C 40 63.800 63.800 63.514 0.286 19947
5401 1 16 . 1 1 40 40 SER H H 40 8.280 8.280 7.781 0.499 19947
5402 1 16 . 1 1 41 41 GLN N N 41 120.600 120.600 124.137 -3.537 19947
5403 1 16 . 1 1 41 41 GLN HA H 41 4.110 4.110 4.170 -0.060 19947
5404 1 16 . 1 1 41 41 GLN CA C 41 55.200 55.200 56.599 -1.399 19947
5405 1 16 . 1 1 41 41 GLN CB C 41 31.100 31.100 29.566 1.534 19947
5406 1 16 . 1 1 41 41 GLN H H 41 9.190 9.190 7.955 1.235 19947
5407 1 16 . 1 1 42 42 CYS N N 42 113.200 113.200 115.415 -2.215 19947
5408 1 16 . 1 1 42 42 CYS HA H 42 4.630 4.630 4.479 0.151 19947
5409 1 16 . 1 1 42 42 CYS CA C 42 53.700 53.700 57.458 -3.758 19947
5410 1 16 . 1 1 42 42 CYS CB C 42 45.500 45.500 30.130 15.370 19947
5411 1 16 . 1 1 42 42 CYS H H 42 7.710 7.710 7.637 0.073 19947
5412 1 16 . 1 1 43 43 ASN N N 43 114.200 114.200 121.360 -7.160 19947
5413 1 16 . 1 1 43 43 ASN HA H 43 4.940 4.940 4.724 0.216 19947
5414 1 16 . 1 1 43 43 ASN CA C 43 53.000 53.000 54.306 -1.306 19947
5415 1 16 . 1 1 43 43 ASN CB C 43 39.300 39.300 39.248 0.052 19947
5416 1 16 . 1 1 43 43 ASN H H 43 8.870 8.870 8.567 0.303 19947
5417 1 16 . 1 1 44 44 TYR N N 44 118.400 118.400 114.021 4.379 19947
5418 1 16 . 1 1 44 44 TYR HA H 44 4.850 4.850 4.622 0.228 19947
5419 1 16 . 1 1 44 44 TYR CA C 44 55.300 55.300 57.743 -2.443 19947
5420 1 16 . 1 1 44 44 TYR CB C 44 40.700 40.700 40.020 0.680 19947
5421 1 16 . 1 1 44 44 TYR H H 44 7.840 7.840 7.276 0.564 19947
5422 1 16 . 1 1 45 45 GLY N N 45 110.600 110.600 108.045 2.555 19947
5423 1 16 . 1 1 45 45 GLY CA C 45 44.000 44.000 45.033 -1.033 19947
5424 1 16 . 1 1 45 45 GLY H H 45 7.960 7.960 8.227 -0.268 19947
5425 1 16 . 1 1 46 46 GLU N N 46 120.700 120.700 119.602 1.098 19947
5426 1 16 . 1 1 46 46 GLU HA H 46 4.280 4.280 4.096 0.184 19947
5427 1 16 . 1 1 46 46 GLU CA C 46 58.500 58.500 59.677 -1.177 19947
5428 1 16 . 1 1 46 46 GLU CB C 46 29.300 29.300 30.250 -0.950 19947
5429 1 16 . 1 1 46 46 GLU H H 46 9.160 9.160 8.611 0.549 19947
5430 1 16 . 1 1 47 47 CYS N N 47 112.400 112.400 116.885 -4.485 19947
5431 1 16 . 1 1 47 47 CYS HA H 47 4.850 4.850 4.920 -0.070 19947
5432 1 16 . 1 1 47 47 CYS CA C 47 57.100 57.100 57.701 -0.601 19947
5433 1 16 . 1 1 47 47 CYS CB C 47 41.200 41.200 25.865 15.335 19947
5434 1 16 . 1 1 47 47 CYS H H 47 8.510 8.510 7.565 0.945 19947
5435 1 16 . 1 1 48 48 CYS N N 48 123.200 123.200 120.819 2.381 19947
5436 1 16 . 1 1 48 48 CYS HA H 48 5.160 5.160 5.029 0.131 19947
5437 1 16 . 1 1 48 48 CYS CA C 48 54.700 54.700 58.250 -3.550 19947
5438 1 16 . 1 1 48 48 CYS CB C 48 45.700 45.700 29.203 16.497 19947
5439 1 16 . 1 1 48 48 CYS H H 48 7.810 7.810 7.836 -0.026 19947
5440 1 16 . 1 1 49 49 ASP N N 49 127.400 127.400 123.613 3.787 19947
5441 1 16 . 1 1 49 49 ASP HA H 49 4.890 4.890 5.000 -0.110 19947
5442 1 16 . 1 1 49 49 ASP CA C 49 53.500 53.500 53.474 0.026 19947
5443 1 16 . 1 1 49 49 ASP CB C 49 42.400 42.400 44.634 -2.234 19947
5444 1 16 . 1 1 49 49 ASP H H 49 9.670 9.670 8.265 1.405 19947
5445 1 16 . 1 1 50 50 GLN N N 50 127.000 127.000 121.346 5.654 19947
5446 1 16 . 1 1 50 50 GLN HA H 50 3.940 3.940 3.926 0.014 19947
5447 1 16 . 1 1 50 50 GLN CA C 50 56.800 56.800 58.933 -2.133 19947
5448 1 16 . 1 1 50 50 GLN CB C 50 26.500 26.500 28.032 -1.532 19947
5449 1 16 . 1 1 50 50 GLN H H 50 9.450 9.450 8.887 0.563 19947
5450 1 16 . 1 1 51 51 CYS N N 51 106.100 106.100 118.911 -12.811 19947
5451 1 16 . 1 1 51 51 CYS HA H 51 4.760 4.760 4.680 0.080 19947
5452 1 16 . 1 1 51 51 CYS CB C 51 43.200 43.200 28.439 14.761 19947
5453 1 16 . 1 1 51 51 CYS H H 51 8.700 8.700 8.246 0.454 19947
5454 1 16 . 1 1 52 52 ARG N N 52 121.000 121.000 118.726 2.274 19947
5455 1 16 . 1 1 52 52 ARG HA H 52 4.690 4.690 4.690 -0.000 19947
5456 1 16 . 1 1 52 52 ARG CA C 52 55.400 55.400 55.031 0.369 19947
5457 1 16 . 1 1 52 52 ARG CB C 52 33.100 33.100 34.915 -1.815 19947
5458 1 16 . 1 1 52 52 ARG H H 52 7.960 7.960 7.825 0.135 19947
5459 1 16 . 1 1 53 53 PHE N N 53 120.300 120.300 120.817 -0.517 19947
5460 1 16 . 1 1 53 53 PHE HA H 53 5.050 5.050 5.104 -0.054 19947
5461 1 16 . 1 1 53 53 PHE CA C 53 56.100 56.100 57.383 -1.283 19947
5462 1 16 . 1 1 53 53 PHE CB C 53 38.200 38.200 39.210 -1.010 19947
5463 1 16 . 1 1 53 53 PHE H H 53 8.400 8.400 8.510 -0.110 19947
5464 1 16 . 1 1 54 54 LYS N N 54 123.300 123.300 125.478 -2.178 19947
5465 1 16 . 1 1 54 54 LYS HA H 54 4.250 4.250 4.100 0.150 19947
5466 1 16 . 1 1 54 54 LYS CA C 54 57.500 57.500 56.756 0.744 19947
5467 1 16 . 1 1 54 54 LYS CB C 54 34.300 34.300 32.076 2.224 19947
5468 1 16 . 1 1 54 54 LYS H H 54 8.540 8.540 8.396 0.144 19947
5469 1 16 . 1 1 55 55 LYS N N 55 119.400 119.400 124.799 -5.399 19947
5470 1 16 . 1 1 55 55 LYS HA H 55 4.110 4.110 3.988 0.122 19947
5471 1 16 . 1 1 55 55 LYS CA C 55 56.500 56.500 56.828 -0.328 19947
5472 1 16 . 1 1 55 55 LYS CB C 55 33.400 33.400 33.251 0.149 19947
5473 1 16 . 1 1 55 55 LYS H H 55 8.440 8.440 8.113 0.327 19947
5474 1 16 . 1 1 56 56 ALA N N 56 126.700 126.700 128.483 -1.783 19947
5475 1 16 . 1 1 56 56 ALA HA H 56 3.920 3.920 4.061 -0.141 19947
5476 1 16 . 1 1 56 56 ALA CA C 56 52.900 52.900 53.614 -0.714 19947
5477 1 16 . 1 1 56 56 ALA CB C 56 18.100 18.100 18.497 -0.397 19947
5478 1 16 . 1 1 56 56 ALA H H 56 8.930 8.930 8.792 0.138 19947
5479 1 16 . 1 1 57 57 GLY N N 57 109.300 109.300 111.602 -2.302 19947
5480 1 16 . 1 1 57 57 GLY CA C 57 45.100 45.100 44.844 0.256 19947
5481 1 16 . 1 1 57 57 GLY H H 57 8.460 8.460 8.452 0.008 19947
5482 1 16 . 1 1 58 58 THR N N 58 117.200 117.200 119.981 -2.781 19947
5483 1 16 . 1 1 58 58 THR HA H 58 4.260 4.260 4.508 -0.248 19947
5484 1 16 . 1 1 58 58 THR CA C 58 63.300 63.300 62.648 0.652 19947
5485 1 16 . 1 1 58 58 THR CB C 58 69.600 69.600 68.544 1.056 19947
5486 1 16 . 1 1 58 58 THR H H 58 7.660 7.660 7.806 -0.146 19947
5487 1 16 . 1 1 59 59 VAL N N 59 130.400 130.400 128.253 2.147 19947
5488 1 16 . 1 1 59 59 VAL HA H 59 3.900 3.900 3.752 0.148 19947
5489 1 16 . 1 1 59 59 VAL CA C 59 64.400 64.400 63.130 1.270 19947
5490 1 16 . 1 1 59 59 VAL CB C 59 31.900 31.900 31.966 -0.066 19947
5491 1 16 . 1 1 59 59 VAL H H 59 9.190 9.190 8.800 0.390 19947
5492 1 16 . 1 1 60 60 CYS N N 60 121.800 121.800 127.099 -5.299 19947
5493 1 16 . 1 1 60 60 CYS HA H 60 5.050 5.050 4.626 0.424 19947
5494 1 16 . 1 1 60 60 CYS CA C 60 54.400 54.400 57.422 -3.022 19947
5495 1 16 . 1 1 60 60 CYS CB C 60 43.000 43.000 28.035 14.965 19947
5496 1 16 . 1 1 60 60 CYS H H 60 9.130 9.130 8.339 0.791 19947
5497 1 16 . 1 1 61 61 ARG N N 61 124.100 124.100 119.045 5.055 19947
5498 1 16 . 1 1 61 61 ARG HA H 61 4.360 4.360 4.625 -0.265 19947
5499 1 16 . 1 1 61 61 ARG CA C 61 56.800 56.800 55.533 1.267 19947
5500 1 16 . 1 1 61 61 ARG CB C 61 32.800 32.800 34.042 -1.242 19947
5501 1 16 . 1 1 61 61 ARG H H 61 7.580 7.580 7.488 0.092 19947
5502 1 16 . 1 1 62 62 ILE N N 62 126.200 126.200 115.582 10.618 19947
5503 1 16 . 1 1 62 62 ILE HA H 62 4.090 4.090 4.457 -0.367 19947
5504 1 16 . 1 1 62 62 ILE CA C 62 60.300 60.300 59.571 0.729 19947
5505 1 16 . 1 1 62 62 ILE CB C 62 38.700 38.700 39.934 -1.234 19947
5506 1 16 . 1 1 62 62 ILE H H 62 8.490 8.490 8.296 0.194 19947
5507 1 16 . 1 1 63 63 ALA N N 63 129.400 129.400 129.680 -0.280 19947
5508 1 16 . 1 1 63 63 ALA HA H 63 4.310 4.310 4.413 -0.103 19947
5509 1 16 . 1 1 63 63 ALA CA C 63 51.900 51.900 54.544 -2.644 19947
5510 1 16 . 1 1 63 63 ALA CB C 63 20.600 20.600 19.656 0.944 19947
5511 1 16 . 1 1 63 63 ALA H H 63 8.100 8.100 8.975 -0.875 19947
5512 1 16 . 1 1 64 64 ARG N N 64 120.500 120.500 120.455 0.045 19947
5513 1 16 . 1 1 64 64 ARG HA H 64 4.290 4.290 4.462 -0.172 19947
5514 1 16 . 1 1 64 64 ARG CA C 64 56.200 56.200 55.720 0.480 19947
5515 1 16 . 1 1 64 64 ARG CB C 64 30.500 30.500 30.028 0.472 19947
5516 1 16 . 1 1 64 64 ARG H H 64 8.140 8.140 8.846 -0.706 19947
5517 1 16 . 1 1 65 65 GLY N N 65 110.500 110.500 111.976 -1.476 19947
5518 1 16 . 1 1 65 65 GLY CA C 65 45.100 45.100 44.507 0.593 19947
5519 1 16 . 1 1 65 65 GLY H H 65 8.040 8.040 8.323 -0.283 19947
5520 1 16 . 1 1 66 66 ASP N N 66 120.700 120.700 120.708 -0.008 19947
5521 1 16 . 1 1 66 66 ASP HA H 66 4.610 4.610 4.787 -0.177 19947
5522 1 16 . 1 1 66 66 ASP CA C 66 53.300 53.300 53.975 -0.675 19947
5523 1 16 . 1 1 66 66 ASP CB C 66 37.600 37.600 41.438 -3.838 19947
5524 1 16 . 1 1 66 66 ASP H H 66 8.380 8.380 7.132 1.248 19947
5525 1 16 . 1 1 67 67 TRP N N 67 120.100 120.100 124.616 -4.516 19947
5526 1 16 . 1 1 67 67 TRP HA H 67 4.760 4.760 5.031 -0.271 19947
5527 1 16 . 1 1 67 67 TRP CA C 67 57.200 57.200 58.320 -1.120 19947
5528 1 16 . 1 1 67 67 TRP CB C 67 29.100 29.100 29.441 -0.341 19947
5529 1 16 . 1 1 67 67 TRP H H 67 7.950 7.950 8.280 -0.330 19947
5530 1 16 . 1 1 68 68 ASN N N 68 118.400 118.400 118.186 0.214 19947
5531 1 16 . 1 1 68 68 ASN HA H 68 4.790 4.790 4.910 -0.120 19947
5532 1 16 . 1 1 68 68 ASN CA C 68 52.800 52.800 53.948 -1.148 19947
5533 1 16 . 1 1 68 68 ASN CB C 68 39.300 39.300 39.784 -0.484 19947
5534 1 16 . 1 1 68 68 ASN H H 68 8.180 8.180 8.635 -0.455 19947
5535 1 16 . 1 1 69 69 ASP N N 69 118.500 118.500 118.266 0.234 19947
5536 1 16 . 1 1 69 69 ASP HA H 69 4.620 4.620 4.424 0.196 19947
5537 1 16 . 1 1 69 69 ASP CA C 69 53.200 53.200 55.825 -2.625 19947
5538 1 16 . 1 1 69 69 ASP CB C 69 38.000 38.000 40.846 -2.846 19947
5539 1 16 . 1 1 69 69 ASP H H 69 8.130 8.130 8.513 -0.383 19947
5540 1 16 . 1 1 70 70 ASP N N 70 120.500 120.500 121.733 -1.233 19947
5541 1 16 . 1 1 70 70 ASP HA H 70 5.100 5.100 4.780 0.320 19947
5542 1 16 . 1 1 70 70 ASP CA C 70 52.500 52.500 54.683 -2.183 19947
5543 1 16 . 1 1 70 70 ASP CB C 70 42.600 42.600 41.750 0.850 19947
5544 1 16 . 1 1 70 70 ASP H H 70 8.140 8.140 8.128 0.012 19947
5545 1 16 . 1 1 71 71 TYR N N 71 118.900 118.900 124.187 -5.287 19947
5546 1 16 . 1 1 71 71 TYR HA H 71 5.210 5.210 4.843 0.367 19947
5547 1 16 . 1 1 71 71 TYR CA C 71 56.300 56.300 57.431 -1.131 19947
5548 1 16 . 1 1 71 71 TYR CB C 71 42.200 42.200 42.836 -0.636 19947
5549 1 16 . 1 1 71 71 TYR H H 71 8.450 8.450 9.065 -0.615 19947
5550 1 16 . 1 1 72 72 CYS N N 72 119.800 119.800 121.533 -1.733 19947
5551 1 16 . 1 1 72 72 CYS HA H 72 4.900 4.900 4.489 0.411 19947
5552 1 16 . 1 1 72 72 CYS CA C 72 53.400 53.400 59.997 -6.597 19947
5553 1 16 . 1 1 72 72 CYS CB C 72 37.200 37.200 28.880 8.320 19947
5554 1 16 . 1 1 72 72 CYS H H 72 9.330 9.330 8.555 0.775 19947
5555 1 16 . 1 1 73 73 THR N N 73 112.700 112.700 112.540 0.160 19947
5556 1 16 . 1 1 73 73 THR HA H 73 4.430 4.430 4.370 0.060 19947
5557 1 16 . 1 1 73 73 THR CA C 73 62.300 62.300 61.351 0.949 19947
5558 1 16 . 1 1 73 73 THR CB C 73 71.300 71.300 69.534 1.766 19947
5559 1 16 . 1 1 73 73 THR H H 73 9.980 9.980 8.748 1.232 19947
5560 1 16 . 1 1 74 74 GLY N N 74 111.500 111.500 112.147 -0.647 19947
5561 1 16 . 1 1 74 74 GLY CA C 74 45.300 45.300 46.803 -1.503 19947
5562 1 16 . 1 1 74 74 GLY H H 74 8.580 8.580 8.113 0.467 19947
5563 1 16 . 1 1 75 75 LYS N N 75 115.900 115.900 117.623 -1.723 19947
5564 1 16 . 1 1 75 75 LYS HA H 75 4.140 4.140 4.398 -0.258 19947
5565 1 16 . 1 1 75 75 LYS CA C 75 54.800 54.800 55.959 -1.159 19947
5566 1 16 . 1 1 75 75 LYS CB C 75 34.200 34.200 34.798 -0.598 19947
5567 1 16 . 1 1 75 75 LYS H H 75 7.900 7.900 7.394 0.506 19947
5568 1 16 . 1 1 76 76 SER N N 76 111.000 111.000 114.171 -3.171 19947
5569 1 16 . 1 1 76 76 SER HA H 76 4.160 4.160 3.964 0.196 19947
5570 1 16 . 1 1 76 76 SER CA C 76 61.400 61.400 55.901 5.499 19947
5571 1 16 . 1 1 76 76 SER CB C 76 64.300 64.300 65.647 -1.347 19947
5572 1 16 . 1 1 76 76 SER H H 76 6.520 6.520 7.053 -0.533 19947
5573 1 16 . 1 1 77 77 SER N N 77 117.100 117.100 113.810 3.290 19947
5574 1 16 . 1 1 77 77 SER HA H 77 4.220 4.220 4.664 -0.444 19947
5575 1 16 . 1 1 77 77 SER CA C 77 59.800 59.800 58.839 0.961 19947
5576 1 16 . 1 1 77 77 SER CB C 77 64.400 64.400 63.721 0.679 19947
5577 1 16 . 1 1 77 77 SER H H 77 9.030 9.030 8.448 0.582 19947
5578 1 16 . 1 1 78 78 ASP N N 78 122.100 122.100 118.847 3.253 19947
5579 1 16 . 1 1 78 78 ASP HA H 78 4.930 4.930 4.814 0.116 19947
5580 1 16 . 1 1 78 78 ASP CA C 78 52.400 52.400 52.115 0.285 19947
5581 1 16 . 1 1 78 78 ASP CB C 78 40.800 40.800 43.694 -2.894 19947
5582 1 16 . 1 1 78 78 ASP H H 78 8.340 8.340 7.540 0.800 19947
5583 1 16 . 1 1 79 79 CYS N N 79 122.200 122.200 118.237 3.963 19947
5584 1 16 . 1 1 79 79 CYS HA H 79 5.320 5.320 5.076 0.244 19947
5585 1 16 . 1 1 79 79 CYS CA C 79 52.000 52.000 54.773 -2.773 19947
5586 1 16 . 1 1 79 79 CYS CB C 79 39.300 39.300 26.515 12.785 19947
5587 1 16 . 1 1 79 79 CYS H H 79 8.960 8.960 8.247 0.713 19947
5588 1 16 . 1 1 80 80 PRO HA H 80 4.410 4.410 4.157 0.253 19947
5589 1 16 . 1 1 80 80 PRO CA C 80 63.500 63.500 62.898 0.602 19947
5590 1 16 . 1 1 80 80 PRO CB C 80 32.400 32.400 32.867 -0.467 19947
5591 1 16 . 1 1 81 81 TRP N N 81 120.500 120.500 122.160 -1.660 19947
5592 1 16 . 1 1 81 81 TRP HA H 81 4.550 4.550 4.184 0.366 19947
5593 1 16 . 1 1 81 81 TRP CA C 81 56.400 56.400 58.594 -2.194 19947
5594 1 16 . 1 1 81 81 TRP CB C 81 29.500 29.500 28.389 1.111 19947
5595 1 16 . 1 1 81 81 TRP H H 81 8.400 8.400 7.613 0.787 19947
5596 1 16 . 1 1 82 82 ASN N N 82 120.400 120.400 110.539 9.861 19947
5597 1 16 . 1 1 82 82 ASN HA H 82 4.750 4.750 4.409 0.341 19947
5598 1 16 . 1 1 82 82 ASN CA C 82 53.100 53.100 53.980 -0.880 19947
5599 1 16 . 1 1 82 82 ASN CB C 82 39.000 39.000 36.917 2.083 19947
5600 1 16 . 1 1 82 82 ASN H H 82 8.040 8.040 8.457 -0.417 19947
5601 1 17 . 1 1 2 2 PRO HA H 2 4.820 4.820 4.716 0.104 19947
5602 1 17 . 1 1 2 2 PRO CA C 2 61.900 61.900 62.237 -0.337 19947
5603 1 17 . 1 1 2 2 PRO CB C 2 30.700 30.700 31.634 -0.933 19947
5604 1 17 . 1 1 3 3 PRO HA H 3 4.540 4.540 4.563 -0.023 19947
5605 1 17 . 1 1 3 3 PRO CA C 3 62.900 62.900 62.502 0.398 19947
5606 1 17 . 1 1 3 3 PRO CB C 3 32.100 32.100 32.748 -0.648 19947
5607 1 17 . 1 1 4 4 VAL N N 4 121.900 121.900 122.527 -0.627 19947
5608 1 17 . 1 1 4 4 VAL HA H 4 4.200 4.200 4.607 -0.407 19947
5609 1 17 . 1 1 4 4 VAL CA C 4 62.300 62.300 61.060 1.240 19947
5610 1 17 . 1 1 4 4 VAL CB C 4 32.800 32.800 30.936 1.864 19947
5611 1 17 . 1 1 4 4 VAL H H 4 8.330 8.330 8.310 0.020 19947
5612 1 17 . 1 1 5 5 CYS N N 5 120.900 120.900 127.714 -6.814 19947
5613 1 17 . 1 1 5 5 CYS HA H 5 4.700 4.700 4.408 0.292 19947
5614 1 17 . 1 1 5 5 CYS CA C 5 53.600 53.600 59.043 -5.443 19947
5615 1 17 . 1 1 5 5 CYS H H 5 8.500 8.500 8.755 -0.255 19947
5616 1 17 . 1 1 6 6 GLY N N 6 110.200 110.200 113.840 -3.640 19947
5617 1 17 . 1 1 6 6 GLY CA C 6 46.300 46.300 44.814 1.486 19947
5618 1 17 . 1 1 6 6 GLY H H 6 8.490 8.490 8.412 0.078 19947
5619 1 17 . 1 1 7 7 ASN N N 7 120.100 120.100 116.818 3.282 19947
5620 1 17 . 1 1 7 7 ASN HA H 7 4.730 4.730 4.365 0.365 19947
5621 1 17 . 1 1 7 7 ASN CA C 7 53.200 53.200 53.884 -0.684 19947
5622 1 17 . 1 1 7 7 ASN CB C 7 38.700 38.700 39.164 -0.464 19947
5623 1 17 . 1 1 7 7 ASN H H 7 8.320 8.320 8.139 0.181 19947
5624 1 17 . 1 1 8 8 LYS N N 8 121.300 121.300 122.884 -1.584 19947
5625 1 17 . 1 1 8 8 LYS HA H 8 4.340 4.340 4.277 0.063 19947
5626 1 17 . 1 1 8 8 LYS CA C 8 56.600 56.600 56.797 -0.198 19947
5627 1 17 . 1 1 8 8 LYS CB C 8 32.900 32.900 31.251 1.649 19947
5628 1 17 . 1 1 8 8 LYS H H 8 8.260 8.260 8.479 -0.219 19947
5629 1 17 . 1 1 9 9 ILE N N 9 136.600 136.600 121.455 15.145 19947
5630 1 17 . 1 1 9 9 ILE HA H 9 4.140 4.140 3.919 0.221 19947
5631 1 17 . 1 1 9 9 ILE CA C 9 61.300 61.300 61.947 -0.647 19947
5632 1 17 . 1 1 9 9 ILE CB C 9 38.200 38.200 38.184 0.016 19947
5633 1 17 . 1 1 9 9 ILE H H 9 8.150 8.150 7.918 0.232 19947
5634 1 17 . 1 1 10 10 LEU N N 10 125.700 125.700 120.873 4.827 19947
5635 1 17 . 1 1 10 10 LEU HA H 10 4.420 4.420 4.552 -0.132 19947
5636 1 17 . 1 1 10 10 LEU CA C 10 55.200 55.200 54.951 0.249 19947
5637 1 17 . 1 1 10 10 LEU CB C 10 42.300 42.300 40.541 1.759 19947
5638 1 17 . 1 1 10 10 LEU H H 10 8.230 8.230 8.449 -0.219 19947
5639 1 17 . 1 1 11 11 GLU N N 11 120.600 120.600 115.704 4.896 19947
5640 1 17 . 1 1 11 11 GLU HA H 11 4.470 4.470 4.147 0.323 19947
5641 1 17 . 1 1 11 11 GLU CA C 11 55.500 55.500 56.437 -0.937 19947
5642 1 17 . 1 1 11 11 GLU CB C 11 28.900 28.900 28.364 0.535 19947
5643 1 17 . 1 1 11 11 GLU H H 11 8.250 8.250 7.853 0.397 19947
5644 1 17 . 1 1 12 12 GLN N N 12 121.600 121.600 119.380 2.220 19947
5645 1 17 . 1 1 12 12 GLN HA H 12 4.350 4.350 4.583 -0.233 19947
5646 1 17 . 1 1 12 12 GLN CA C 12 56.600 56.600 56.297 0.303 19947
5647 1 17 . 1 1 12 12 GLN CB C 12 29.200 29.200 29.997 -0.797 19947
5648 1 17 . 1 1 12 12 GLN H H 12 8.460 8.460 7.876 0.584 19947
5649 1 17 . 1 1 13 13 GLY N N 13 110.700 110.700 109.503 1.197 19947
5650 1 17 . 1 1 13 13 GLY CA C 13 45.700 45.700 46.767 -1.067 19947
5651 1 17 . 1 1 13 13 GLY H H 13 8.660 8.660 8.815 -0.155 19947
5652 1 17 . 1 1 14 14 GLU N N 14 118.900 118.900 114.656 4.244 19947
5653 1 17 . 1 1 14 14 GLU HA H 14 4.530 4.530 4.146 0.384 19947
5654 1 17 . 1 1 14 14 GLU CA C 14 55.600 55.600 57.049 -1.449 19947
5655 1 17 . 1 1 14 14 GLU CB C 14 29.700 29.700 29.793 -0.093 19947
5656 1 17 . 1 1 14 14 GLU H H 14 8.230 8.230 7.893 0.337 19947
5657 1 17 . 1 1 15 15 ASP N N 15 118.400 118.400 121.347 -2.947 19947
5658 1 17 . 1 1 15 15 ASP HA H 15 4.990 4.990 4.438 0.552 19947
5659 1 17 . 1 1 15 15 ASP CA C 15 53.500 53.500 57.629 -4.129 19947
5660 1 17 . 1 1 15 15 ASP CB C 15 39.700 39.700 41.710 -2.010 19947
5661 1 17 . 1 1 15 15 ASP H H 15 8.330 8.330 7.796 0.534 19947
5662 1 17 . 1 1 16 16 CYS HA H 16 4.340 4.340 4.543 -0.203 19947
5663 1 17 . 1 1 16 16 CYS H H 16 8.510 8.510 8.054 0.456 19947
5664 1 17 . 1 1 17 17 ASP N N 17 116.700 116.700 124.623 -7.923 19947
5665 1 17 . 1 1 17 17 ASP HA H 17 4.740 4.740 4.678 0.062 19947
5666 1 17 . 1 1 17 17 ASP CA C 17 53.100 53.100 54.663 -1.563 19947
5667 1 17 . 1 1 17 17 ASP CB C 17 38.600 38.600 41.229 -2.629 19947
5668 1 17 . 1 1 17 17 ASP H H 17 8.180 8.180 7.977 0.203 19947
5669 1 17 . 1 1 18 18 CYS HA H 18 4.730 4.730 4.944 -0.214 19947
5670 1 17 . 1 1 18 18 CYS CB C 18 41.900 41.900 29.836 12.064 19947
5671 1 17 . 1 1 19 19 GLY H H 19 8.220 8.220 8.479 -0.259 19947
5672 1 17 . 1 1 20 20 SER HA H 20 4.920 4.920 4.507 0.413 19947
5673 1 17 . 1 1 20 20 SER CA C 20 55.700 55.700 57.220 -1.520 19947
5674 1 17 . 1 1 20 20 SER CB C 20 63.500 63.500 63.114 0.386 19947
5675 1 17 . 1 1 20 20 SER H H 20 7.830 7.830 8.448 -0.618 19947
5676 1 17 . 1 1 21 21 PRO HA H 21 4.240 4.240 4.202 0.038 19947
5677 1 17 . 1 1 21 21 PRO CA C 21 63.400 63.400 64.846 -1.446 19947
5678 1 17 . 1 1 21 21 PRO CB C 21 31.800 31.800 31.608 0.192 19947
5679 1 17 . 1 1 22 22 ALA N N 22 119.900 119.900 118.757 1.143 19947
5680 1 17 . 1 1 22 22 ALA HA H 22 4.220 4.220 4.054 0.166 19947
5681 1 17 . 1 1 22 22 ALA CA C 22 54.200 54.200 54.126 0.074 19947
5682 1 17 . 1 1 22 22 ALA CB C 22 18.500 18.500 18.892 -0.392 19947
5683 1 17 . 1 1 22 22 ALA H H 22 8.180 8.180 8.219 -0.039 19947
5684 1 17 . 1 1 23 23 ASN N N 23 116.300 116.300 111.902 4.398 19947
5685 1 17 . 1 1 23 23 ASN HA H 23 4.670 4.670 4.791 -0.121 19947
5686 1 17 . 1 1 23 23 ASN CA C 23 53.200 53.200 53.871 -0.671 19947
5687 1 17 . 1 1 23 23 ASN CB C 23 39.300 39.300 41.340 -2.040 19947
5688 1 17 . 1 1 23 23 ASN H H 23 7.960 7.960 8.365 -0.405 19947
5689 1 17 . 1 1 24 24 CYS HA H 24 4.720 4.720 4.118 0.602 19947
5690 1 17 . 1 1 24 24 CYS H H 24 8.510 8.510 7.580 0.930 19947
5691 1 17 . 1 1 25 25 GLN HA H 25 4.460 4.460 4.051 0.409 19947
5692 1 17 . 1 1 25 25 GLN H H 25 8.320 8.320 8.596 -0.276 19947
5693 1 17 . 1 1 26 26 ASP HA H 26 4.740 4.740 4.303 0.437 19947
5694 1 17 . 1 1 26 26 ASP H H 26 8.580 8.580 8.835 -0.255 19947
5695 1 17 . 1 1 27 27 ARG HA H 27 4.680 4.680 4.556 0.124 19947
5696 1 17 . 1 1 27 27 ARG CA C 27 54.700 54.700 55.265 -0.565 19947
5697 1 17 . 1 1 27 27 ARG H H 27 8.550 8.550 7.849 0.701 19947
5698 1 17 . 1 1 28 28 CYS HA H 28 4.120 4.120 4.832 -0.712 19947
5699 1 17 . 1 1 28 28 CYS CA C 28 54.400 54.400 58.359 -3.959 19947
5700 1 17 . 1 1 28 28 CYS CB C 28 19.000 19.000 26.185 -7.185 19947
5701 1 17 . 1 1 28 28 CYS H H 28 8.910 8.910 8.612 0.298 19947
5702 1 17 . 1 1 29 29 CYS N N 29 113.300 113.300 118.385 -5.085 19947
5703 1 17 . 1 1 29 29 CYS HA H 29 5.010 5.010 4.710 0.300 19947
5704 1 17 . 1 1 29 29 CYS CA C 29 54.300 54.300 56.472 -2.172 19947
5705 1 17 . 1 1 29 29 CYS H H 29 7.730 7.730 7.882 -0.152 19947
5706 1 17 . 1 1 30 30 ASN HA H 30 4.730 4.730 4.886 -0.156 19947
5707 1 17 . 1 1 30 30 ASN CB C 30 38.700 38.700 39.773 -1.073 19947
5708 1 17 . 1 1 30 30 ASN H H 30 8.870 8.870 8.409 0.461 19947
5709 1 17 . 1 1 31 31 ALA N N 31 129.400 129.400 126.494 2.906 19947
5710 1 17 . 1 1 31 31 ALA HA H 31 4.120 4.120 4.257 -0.137 19947
5711 1 17 . 1 1 31 31 ALA CA C 31 54.400 54.400 54.332 0.068 19947
5712 1 17 . 1 1 31 31 ALA CB C 31 19.000 19.000 19.196 -0.196 19947
5713 1 17 . 1 1 31 31 ALA H H 31 8.890 8.890 8.302 0.588 19947
5714 1 17 . 1 1 32 32 ALA N N 32 116.400 116.400 118.012 -1.612 19947
5715 1 17 . 1 1 32 32 ALA HA H 32 4.340 4.340 4.310 0.030 19947
5716 1 17 . 1 1 32 32 ALA CA C 32 53.800 53.800 53.391 0.409 19947
5717 1 17 . 1 1 32 32 ALA CB C 32 19.100 19.100 19.163 -0.063 19947
5718 1 17 . 1 1 32 32 ALA H H 32 8.250 8.250 8.194 0.056 19947
5719 1 17 . 1 1 33 33 THR N N 33 104.300 104.300 110.920 -6.620 19947
5720 1 17 . 1 1 33 33 THR HA H 33 4.430 4.430 4.387 0.043 19947
5721 1 17 . 1 1 33 33 THR CA C 33 60.500 60.500 60.756 -0.256 19947
5722 1 17 . 1 1 33 33 THR CB C 33 70.600 70.600 69.107 1.493 19947
5723 1 17 . 1 1 33 33 THR H H 33 7.320 7.320 7.395 -0.075 19947
5724 1 17 . 1 1 34 34 CYS N N 34 123.400 123.400 121.196 2.204 19947
5725 1 17 . 1 1 34 34 CYS HA H 34 4.170 4.170 4.260 -0.090 19947
5726 1 17 . 1 1 34 34 CYS CA C 34 56.500 56.500 60.114 -3.614 19947
5727 1 17 . 1 1 34 34 CYS H H 34 8.710 8.710 8.052 0.658 19947
5728 1 17 . 1 1 35 35 LYS N N 35 116.900 116.900 119.680 -2.780 19947
5729 1 17 . 1 1 35 35 LYS HA H 35 4.960 4.960 4.660 0.300 19947
5730 1 17 . 1 1 35 35 LYS CA C 35 53.900 53.900 55.442 -1.542 19947
5731 1 17 . 1 1 35 35 LYS CB C 35 35.900 35.900 35.804 0.096 19947
5732 1 17 . 1 1 35 35 LYS H H 35 7.450 7.450 7.631 -0.181 19947
5733 1 17 . 1 1 36 36 LEU N N 36 119.300 119.300 122.944 -3.644 19947
5734 1 17 . 1 1 36 36 LEU HA H 36 4.800 4.800 4.393 0.407 19947
5735 1 17 . 1 1 36 36 LEU CB C 36 42.400 42.400 41.270 1.131 19947
5736 1 17 . 1 1 36 36 LEU H H 36 8.290 8.290 8.390 -0.100 19947
5737 1 17 . 1 1 37 37 THR HA H 37 4.340 4.340 4.569 -0.229 19947
5738 1 17 . 1 1 37 37 THR CA C 37 60.200 60.200 60.841 -0.641 19947
5739 1 17 . 1 1 37 37 THR CB C 37 67.700 67.700 68.671 -0.971 19947
5740 1 17 . 1 1 37 37 THR H H 37 8.380 8.380 7.980 0.400 19947
5741 1 17 . 1 1 38 38 PRO HA H 38 4.380 4.380 4.267 0.113 19947
5742 1 17 . 1 1 38 38 PRO CA C 38 64.800 64.800 64.546 0.254 19947
5743 1 17 . 1 1 38 38 PRO CB C 38 31.500 31.500 31.718 -0.218 19947
5744 1 17 . 1 1 39 39 GLY N N 39 113.300 113.300 110.808 2.492 19947
5745 1 17 . 1 1 39 39 GLY CA C 39 45.100 45.100 44.888 0.212 19947
5746 1 17 . 1 1 39 39 GLY H H 39 8.830 8.830 8.632 0.198 19947
5747 1 17 . 1 1 40 40 SER N N 40 116.700 116.700 118.037 -1.337 19947
5748 1 17 . 1 1 40 40 SER HA H 40 4.610 4.610 4.530 0.080 19947
5749 1 17 . 1 1 40 40 SER CA C 40 58.800 58.800 58.424 0.376 19947
5750 1 17 . 1 1 40 40 SER CB C 40 63.800 63.800 62.967 0.833 19947
5751 1 17 . 1 1 40 40 SER H H 40 8.280 8.280 7.679 0.601 19947
5752 1 17 . 1 1 41 41 GLN N N 41 120.600 120.600 124.739 -4.139 19947
5753 1 17 . 1 1 41 41 GLN HA H 41 4.110 4.110 4.001 0.109 19947
5754 1 17 . 1 1 41 41 GLN CA C 41 55.200 55.200 57.575 -2.375 19947
5755 1 17 . 1 1 41 41 GLN CB C 41 31.100 31.100 28.811 2.289 19947
5756 1 17 . 1 1 41 41 GLN H H 41 9.190 9.190 7.934 1.256 19947
5757 1 17 . 1 1 42 42 CYS N N 42 113.200 113.200 114.891 -1.691 19947
5758 1 17 . 1 1 42 42 CYS HA H 42 4.630 4.630 4.573 0.057 19947
5759 1 17 . 1 1 42 42 CYS CA C 42 53.700 53.700 57.536 -3.837 19947
5760 1 17 . 1 1 42 42 CYS CB C 42 45.500 45.500 29.901 15.599 19947
5761 1 17 . 1 1 42 42 CYS H H 42 7.710 7.710 7.793 -0.083 19947
5762 1 17 . 1 1 43 43 ASN N N 43 114.200 114.200 122.186 -7.986 19947
5763 1 17 . 1 1 43 43 ASN HA H 43 4.940 4.940 4.759 0.181 19947
5764 1 17 . 1 1 43 43 ASN CA C 43 53.000 53.000 54.807 -1.807 19947
5765 1 17 . 1 1 43 43 ASN CB C 43 39.300 39.300 39.013 0.287 19947
5766 1 17 . 1 1 43 43 ASN H H 43 8.870 8.870 8.613 0.257 19947
5767 1 17 . 1 1 44 44 TYR N N 44 118.400 118.400 115.262 3.138 19947
5768 1 17 . 1 1 44 44 TYR HA H 44 4.850 4.850 4.549 0.301 19947
5769 1 17 . 1 1 44 44 TYR CA C 44 55.300 55.300 57.802 -2.502 19947
5770 1 17 . 1 1 44 44 TYR CB C 44 40.700 40.700 39.762 0.938 19947
5771 1 17 . 1 1 44 44 TYR H H 44 7.840 7.840 7.275 0.565 19947
5772 1 17 . 1 1 45 45 GLY N N 45 110.600 110.600 107.916 2.684 19947
5773 1 17 . 1 1 45 45 GLY CA C 45 44.000 44.000 44.921 -0.921 19947
5774 1 17 . 1 1 45 45 GLY H H 45 7.960 7.960 8.183 -0.223 19947
5775 1 17 . 1 1 46 46 GLU N N 46 120.700 120.700 120.129 0.571 19947
5776 1 17 . 1 1 46 46 GLU HA H 46 4.280 4.280 4.070 0.210 19947
5777 1 17 . 1 1 46 46 GLU CA C 46 58.500 58.500 59.892 -1.392 19947
5778 1 17 . 1 1 46 46 GLU CB C 46 29.300 29.300 30.231 -0.931 19947
5779 1 17 . 1 1 46 46 GLU H H 46 9.160 9.160 8.683 0.477 19947
5780 1 17 . 1 1 47 47 CYS N N 47 112.400 112.400 117.193 -4.793 19947
5781 1 17 . 1 1 47 47 CYS HA H 47 4.850 4.850 4.796 0.054 19947
5782 1 17 . 1 1 47 47 CYS CA C 47 57.100 57.100 58.162 -1.062 19947
5783 1 17 . 1 1 47 47 CYS CB C 47 41.200 41.200 25.769 15.431 19947
5784 1 17 . 1 1 47 47 CYS H H 47 8.510 8.510 7.556 0.954 19947
5785 1 17 . 1 1 48 48 CYS N N 48 123.200 123.200 119.221 3.979 19947
5786 1 17 . 1 1 48 48 CYS HA H 48 5.160 5.160 5.277 -0.117 19947
5787 1 17 . 1 1 48 48 CYS CA C 48 54.700 54.700 57.921 -3.221 19947
5788 1 17 . 1 1 48 48 CYS CB C 48 45.700 45.700 30.941 14.759 19947
5789 1 17 . 1 1 48 48 CYS H H 48 7.810 7.810 7.664 0.146 19947
5790 1 17 . 1 1 49 49 ASP N N 49 127.400 127.400 122.472 4.928 19947
5791 1 17 . 1 1 49 49 ASP HA H 49 4.890 4.890 4.986 -0.096 19947
5792 1 17 . 1 1 49 49 ASP CA C 49 53.500 53.500 54.217 -0.717 19947
5793 1 17 . 1 1 49 49 ASP CB C 49 42.400 42.400 44.569 -2.168 19947
5794 1 17 . 1 1 49 49 ASP H H 49 9.670 9.670 8.362 1.308 19947
5795 1 17 . 1 1 50 50 GLN N N 50 127.000 127.000 120.825 6.175 19947
5796 1 17 . 1 1 50 50 GLN HA H 50 3.940 3.940 3.953 -0.013 19947
5797 1 17 . 1 1 50 50 GLN CA C 50 56.800 56.800 59.481 -2.681 19947
5798 1 17 . 1 1 50 50 GLN CB C 50 26.500 26.500 28.349 -1.849 19947
5799 1 17 . 1 1 50 50 GLN H H 50 9.450 9.450 8.925 0.525 19947
5800 1 17 . 1 1 51 51 CYS N N 51 106.100 106.100 112.473 -6.373 19947
5801 1 17 . 1 1 51 51 CYS HA H 51 4.760 4.760 5.128 -0.368 19947
5802 1 17 . 1 1 51 51 CYS CB C 51 43.200 43.200 28.129 15.071 19947
5803 1 17 . 1 1 51 51 CYS H H 51 8.700 8.700 8.456 0.244 19947
5804 1 17 . 1 1 52 52 ARG N N 52 121.000 121.000 119.094 1.906 19947
5805 1 17 . 1 1 52 52 ARG HA H 52 4.690 4.690 4.555 0.135 19947
5806 1 17 . 1 1 52 52 ARG CA C 52 55.400 55.400 54.960 0.440 19947
5807 1 17 . 1 1 52 52 ARG CB C 52 33.100 33.100 35.121 -2.021 19947
5808 1 17 . 1 1 52 52 ARG H H 52 7.960 7.960 7.688 0.272 19947
5809 1 17 . 1 1 53 53 PHE N N 53 120.300 120.300 120.723 -0.423 19947
5810 1 17 . 1 1 53 53 PHE HA H 53 5.050 5.050 5.034 0.016 19947
5811 1 17 . 1 1 53 53 PHE CA C 53 56.100 56.100 56.673 -0.573 19947
5812 1 17 . 1 1 53 53 PHE CB C 53 38.200 38.200 39.060 -0.860 19947
5813 1 17 . 1 1 53 53 PHE H H 53 8.400 8.400 8.346 0.054 19947
5814 1 17 . 1 1 54 54 LYS N N 54 123.300 123.300 126.063 -2.763 19947
5815 1 17 . 1 1 54 54 LYS HA H 54 4.250 4.250 4.128 0.122 19947
5816 1 17 . 1 1 54 54 LYS CA C 54 57.500 57.500 56.578 0.923 19947
5817 1 17 . 1 1 54 54 LYS CB C 54 34.300 34.300 32.003 2.297 19947
5818 1 17 . 1 1 54 54 LYS H H 54 8.540 8.540 8.248 0.292 19947
5819 1 17 . 1 1 55 55 LYS N N 55 119.400 119.400 124.798 -5.398 19947
5820 1 17 . 1 1 55 55 LYS HA H 55 4.110 4.110 3.986 0.124 19947
5821 1 17 . 1 1 55 55 LYS CA C 55 56.500 56.500 56.693 -0.193 19947
5822 1 17 . 1 1 55 55 LYS CB C 55 33.400 33.400 33.326 0.074 19947
5823 1 17 . 1 1 55 55 LYS H H 55 8.440 8.440 8.008 0.432 19947
5824 1 17 . 1 1 56 56 ALA N N 56 126.700 126.700 127.308 -0.608 19947
5825 1 17 . 1 1 56 56 ALA HA H 56 3.920 3.920 3.983 -0.063 19947
5826 1 17 . 1 1 56 56 ALA CA C 56 52.900 52.900 53.561 -0.661 19947
5827 1 17 . 1 1 56 56 ALA CB C 56 18.100 18.100 18.636 -0.536 19947
5828 1 17 . 1 1 56 56 ALA H H 56 8.930 8.930 8.604 0.326 19947
5829 1 17 . 1 1 57 57 GLY N N 57 109.300 109.300 111.309 -2.009 19947
5830 1 17 . 1 1 57 57 GLY CA C 57 45.100 45.100 44.876 0.224 19947
5831 1 17 . 1 1 57 57 GLY H H 57 8.460 8.460 8.457 0.003 19947
5832 1 17 . 1 1 58 58 THR N N 58 117.200 117.200 120.146 -2.946 19947
5833 1 17 . 1 1 58 58 THR HA H 58 4.260 4.260 4.508 -0.248 19947
5834 1 17 . 1 1 58 58 THR CA C 58 63.300 63.300 62.587 0.713 19947
5835 1 17 . 1 1 58 58 THR CB C 58 69.600 69.600 68.911 0.689 19947
5836 1 17 . 1 1 58 58 THR H H 58 7.660 7.660 7.785 -0.125 19947
5837 1 17 . 1 1 59 59 VAL N N 59 130.400 130.400 128.364 2.036 19947
5838 1 17 . 1 1 59 59 VAL HA H 59 3.900 3.900 4.029 -0.129 19947
5839 1 17 . 1 1 59 59 VAL CA C 59 64.400 64.400 62.155 2.245 19947
5840 1 17 . 1 1 59 59 VAL CB C 59 31.900 31.900 31.767 0.133 19947
5841 1 17 . 1 1 59 59 VAL H H 59 9.190 9.190 8.734 0.456 19947
5842 1 17 . 1 1 60 60 CYS N N 60 121.800 121.800 127.342 -5.542 19947
5843 1 17 . 1 1 60 60 CYS HA H 60 5.050 5.050 4.605 0.445 19947
5844 1 17 . 1 1 60 60 CYS CA C 60 54.400 54.400 58.304 -3.904 19947
5845 1 17 . 1 1 60 60 CYS CB C 60 43.000 43.000 27.111 15.889 19947
5846 1 17 . 1 1 60 60 CYS H H 60 9.130 9.130 8.533 0.597 19947
5847 1 17 . 1 1 61 61 ARG N N 61 124.100 124.100 118.384 5.716 19947
5848 1 17 . 1 1 61 61 ARG HA H 61 4.360 4.360 4.642 -0.282 19947
5849 1 17 . 1 1 61 61 ARG CA C 61 56.800 56.800 55.587 1.213 19947
5850 1 17 . 1 1 61 61 ARG CB C 61 32.800 32.800 34.857 -2.057 19947
5851 1 17 . 1 1 61 61 ARG H H 61 7.580 7.580 7.419 0.161 19947
5852 1 17 . 1 1 62 62 ILE N N 62 126.200 126.200 115.915 10.285 19947
5853 1 17 . 1 1 62 62 ILE HA H 62 4.090 4.090 4.631 -0.541 19947
5854 1 17 . 1 1 62 62 ILE CA C 62 60.300 60.300 61.261 -0.961 19947
5855 1 17 . 1 1 62 62 ILE CB C 62 38.700 38.700 40.707 -2.007 19947
5856 1 17 . 1 1 62 62 ILE H H 62 8.490 8.490 8.452 0.038 19947
5857 1 17 . 1 1 63 63 ALA N N 63 129.400 129.400 132.580 -3.180 19947
5858 1 17 . 1 1 63 63 ALA HA H 63 4.310 4.310 4.443 -0.133 19947
5859 1 17 . 1 1 63 63 ALA CA C 63 51.900 51.900 54.338 -2.438 19947
5860 1 17 . 1 1 63 63 ALA CB C 63 20.600 20.600 18.960 1.640 19947
5861 1 17 . 1 1 63 63 ALA H H 63 8.100 8.100 8.553 -0.453 19947
5862 1 17 . 1 1 64 64 ARG N N 64 120.500 120.500 121.098 -0.598 19947
5863 1 17 . 1 1 64 64 ARG HA H 64 4.290 4.290 4.470 -0.180 19947
5864 1 17 . 1 1 64 64 ARG CA C 64 56.200 56.200 55.894 0.306 19947
5865 1 17 . 1 1 64 64 ARG CB C 64 30.500 30.500 30.340 0.160 19947
5866 1 17 . 1 1 64 64 ARG H H 64 8.140 8.140 8.695 -0.555 19947
5867 1 17 . 1 1 65 65 GLY N N 65 110.500 110.500 112.088 -1.588 19947
5868 1 17 . 1 1 65 65 GLY CA C 65 45.100 45.100 44.495 0.605 19947
5869 1 17 . 1 1 65 65 GLY H H 65 8.040 8.040 8.233 -0.193 19947
5870 1 17 . 1 1 66 66 ASP N N 66 120.700 120.700 119.345 1.355 19947
5871 1 17 . 1 1 66 66 ASP HA H 66 4.610 4.610 4.558 0.052 19947
5872 1 17 . 1 1 66 66 ASP CA C 66 53.300 53.300 54.147 -0.847 19947
5873 1 17 . 1 1 66 66 ASP CB C 66 37.600 37.600 41.189 -3.589 19947
5874 1 17 . 1 1 66 66 ASP H H 66 8.380 8.380 7.062 1.318 19947
5875 1 17 . 1 1 67 67 TRP N N 67 120.100 120.100 123.383 -3.283 19947
5876 1 17 . 1 1 67 67 TRP HA H 67 4.760 4.760 5.149 -0.389 19947
5877 1 17 . 1 1 67 67 TRP CA C 67 57.200 57.200 58.118 -0.918 19947
5878 1 17 . 1 1 67 67 TRP CB C 67 29.100 29.100 29.819 -0.719 19947
5879 1 17 . 1 1 67 67 TRP H H 67 7.950 7.950 7.956 -0.006 19947
5880 1 17 . 1 1 68 68 ASN N N 68 118.400 118.400 117.336 1.064 19947
5881 1 17 . 1 1 68 68 ASN HA H 68 4.790 4.790 4.962 -0.172 19947
5882 1 17 . 1 1 68 68 ASN CA C 68 52.800 52.800 53.690 -0.890 19947
5883 1 17 . 1 1 68 68 ASN CB C 68 39.300 39.300 40.373 -1.073 19947
5884 1 17 . 1 1 68 68 ASN H H 68 8.180 8.180 8.878 -0.698 19947
5885 1 17 . 1 1 69 69 ASP N N 69 118.500 118.500 118.049 0.451 19947
5886 1 17 . 1 1 69 69 ASP HA H 69 4.620 4.620 4.535 0.085 19947
5887 1 17 . 1 1 69 69 ASP CA C 69 53.200 53.200 56.372 -3.172 19947
5888 1 17 . 1 1 69 69 ASP CB C 69 38.000 38.000 41.253 -3.253 19947
5889 1 17 . 1 1 69 69 ASP H H 69 8.130 8.130 8.379 -0.249 19947
5890 1 17 . 1 1 70 70 ASP N N 70 120.500 120.500 120.897 -0.397 19947
5891 1 17 . 1 1 70 70 ASP HA H 70 5.100 5.100 5.240 -0.140 19947
5892 1 17 . 1 1 70 70 ASP CA C 70 52.500 52.500 52.900 -0.400 19947
5893 1 17 . 1 1 70 70 ASP CB C 70 42.600 42.600 42.691 -0.090 19947
5894 1 17 . 1 1 70 70 ASP H H 70 8.140 8.140 8.059 0.081 19947
5895 1 17 . 1 1 71 71 TYR N N 71 118.900 118.900 123.617 -4.717 19947
5896 1 17 . 1 1 71 71 TYR HA H 71 5.210 5.210 5.054 0.156 19947
5897 1 17 . 1 1 71 71 TYR CA C 71 56.300 56.300 56.898 -0.598 19947
5898 1 17 . 1 1 71 71 TYR CB C 71 42.200 42.200 42.360 -0.160 19947
5899 1 17 . 1 1 71 71 TYR H H 71 8.450 8.450 8.161 0.289 19947
5900 1 17 . 1 1 72 72 CYS N N 72 119.800 119.800 122.140 -2.340 19947
5901 1 17 . 1 1 72 72 CYS HA H 72 4.900 4.900 4.453 0.447 19947
5902 1 17 . 1 1 72 72 CYS CA C 72 53.400 53.400 59.735 -6.335 19947
5903 1 17 . 1 1 72 72 CYS CB C 72 37.200 37.200 29.049 8.150 19947
5904 1 17 . 1 1 72 72 CYS H H 72 9.330 9.330 8.607 0.723 19947
5905 1 17 . 1 1 73 73 THR N N 73 112.700 112.700 114.457 -1.757 19947
5906 1 17 . 1 1 73 73 THR HA H 73 4.430 4.430 4.447 -0.017 19947
5907 1 17 . 1 1 73 73 THR CA C 73 62.300 62.300 61.313 0.987 19947
5908 1 17 . 1 1 73 73 THR CB C 73 71.300 71.300 70.004 1.296 19947
5909 1 17 . 1 1 73 73 THR H H 73 9.980 9.980 8.774 1.206 19947
5910 1 17 . 1 1 74 74 GLY N N 74 111.500 111.500 110.794 0.706 19947
5911 1 17 . 1 1 74 74 GLY CA C 74 45.300 45.300 46.478 -1.178 19947
5912 1 17 . 1 1 74 74 GLY H H 74 8.580 8.580 7.800 0.780 19947
5913 1 17 . 1 1 75 75 LYS N N 75 115.900 115.900 116.923 -1.023 19947
5914 1 17 . 1 1 75 75 LYS HA H 75 4.140 4.140 4.506 -0.366 19947
5915 1 17 . 1 1 75 75 LYS CA C 75 54.800 54.800 55.519 -0.719 19947
5916 1 17 . 1 1 75 75 LYS CB C 75 34.200 34.200 34.020 0.180 19947
5917 1 17 . 1 1 75 75 LYS H H 75 7.900 7.900 7.597 0.303 19947
5918 1 17 . 1 1 76 76 SER N N 76 111.000 111.000 113.013 -2.013 19947
5919 1 17 . 1 1 76 76 SER HA H 76 4.160 4.160 3.848 0.312 19947
5920 1 17 . 1 1 76 76 SER CA C 76 61.400 61.400 56.771 4.629 19947
5921 1 17 . 1 1 76 76 SER CB C 76 64.300 64.300 64.772 -0.472 19947
5922 1 17 . 1 1 76 76 SER H H 76 6.520 6.520 6.818 -0.298 19947
5923 1 17 . 1 1 77 77 SER N N 77 117.100 117.100 112.694 4.406 19947
5924 1 17 . 1 1 77 77 SER HA H 77 4.220 4.220 4.657 -0.437 19947
5925 1 17 . 1 1 77 77 SER CA C 77 59.800 59.800 58.996 0.804 19947
5926 1 17 . 1 1 77 77 SER CB C 77 64.400 64.400 63.913 0.487 19947
5927 1 17 . 1 1 77 77 SER H H 77 9.030 9.030 8.442 0.588 19947
5928 1 17 . 1 1 78 78 ASP N N 78 122.100 122.100 121.612 0.488 19947
5929 1 17 . 1 1 78 78 ASP HA H 78 4.930 4.930 4.799 0.131 19947
5930 1 17 . 1 1 78 78 ASP CA C 78 52.400 52.400 53.802 -1.402 19947
5931 1 17 . 1 1 78 78 ASP CB C 78 40.800 40.800 44.682 -3.882 19947
5932 1 17 . 1 1 78 78 ASP H H 78 8.340 8.340 7.337 1.003 19947
5933 1 17 . 1 1 79 79 CYS N N 79 122.200 122.200 121.555 0.645 19947
5934 1 17 . 1 1 79 79 CYS HA H 79 5.320 5.320 4.975 0.345 19947
5935 1 17 . 1 1 79 79 CYS CA C 79 52.000 52.000 55.607 -3.607 19947
5936 1 17 . 1 1 79 79 CYS CB C 79 39.300 39.300 28.125 11.175 19947
5937 1 17 . 1 1 79 79 CYS H H 79 8.960 8.960 8.318 0.642 19947
5938 1 17 . 1 1 80 80 PRO HA H 80 4.410 4.410 4.573 -0.163 19947
5939 1 17 . 1 1 80 80 PRO CA C 80 63.500 63.500 63.053 0.447 19947
5940 1 17 . 1 1 80 80 PRO CB C 80 32.400 32.400 32.178 0.222 19947
5941 1 17 . 1 1 81 81 TRP N N 81 120.500 120.500 121.769 -1.269 19947
5942 1 17 . 1 1 81 81 TRP HA H 81 4.550 4.550 4.657 -0.107 19947
5943 1 17 . 1 1 81 81 TRP CA C 81 56.400 56.400 53.822 2.578 19947
5944 1 17 . 1 1 81 81 TRP CB C 81 29.500 29.500 28.395 1.105 19947
5945 1 17 . 1 1 81 81 TRP H H 81 8.400 8.400 8.386 0.014 19947
5946 1 17 . 1 1 82 82 ASN N N 82 120.400 120.400 116.533 3.867 19947
5947 1 17 . 1 1 82 82 ASN HA H 82 4.750 4.750 4.440 0.310 19947
5948 1 17 . 1 1 82 82 ASN CA C 82 53.100 53.100 53.998 -0.899 19947
5949 1 17 . 1 1 82 82 ASN CB C 82 39.000 39.000 37.075 1.925 19947
5950 1 17 . 1 1 82 82 ASN H H 82 8.040 8.040 8.404 -0.364 19947
5951 1 18 . 1 1 2 2 PRO HA H 2 4.820 4.820 4.531 0.289 19947
5952 1 18 . 1 1 2 2 PRO CA C 2 61.900 61.900 62.363 -0.463 19947
5953 1 18 . 1 1 2 2 PRO CB C 2 30.700 30.700 31.576 -0.876 19947
5954 1 18 . 1 1 3 3 PRO HA H 3 4.540 4.540 4.438 0.102 19947
5955 1 18 . 1 1 3 3 PRO CA C 3 62.900 62.900 62.513 0.387 19947
5956 1 18 . 1 1 3 3 PRO CB C 3 32.100 32.100 32.325 -0.226 19947
5957 1 18 . 1 1 4 4 VAL N N 4 121.900 121.900 123.240 -1.340 19947
5958 1 18 . 1 1 4 4 VAL HA H 4 4.200 4.200 4.359 -0.159 19947
5959 1 18 . 1 1 4 4 VAL CA C 4 62.300 62.300 61.328 0.972 19947
5960 1 18 . 1 1 4 4 VAL CB C 4 32.800 32.800 29.975 2.825 19947
5961 1 18 . 1 1 4 4 VAL H H 4 8.330 8.330 8.333 -0.003 19947
5962 1 18 . 1 1 5 5 CYS N N 5 120.900 120.900 127.411 -6.511 19947
5963 1 18 . 1 1 5 5 CYS HA H 5 4.700 4.700 4.361 0.339 19947
5964 1 18 . 1 1 5 5 CYS CA C 5 53.600 53.600 59.517 -5.917 19947
5965 1 18 . 1 1 5 5 CYS H H 5 8.500 8.500 8.521 -0.021 19947
5966 1 18 . 1 1 6 6 GLY N N 6 110.200 110.200 113.826 -3.626 19947
5967 1 18 . 1 1 6 6 GLY CA C 6 46.300 46.300 44.740 1.560 19947
5968 1 18 . 1 1 6 6 GLY H H 6 8.490 8.490 8.397 0.093 19947
5969 1 18 . 1 1 7 7 ASN N N 7 120.100 120.100 117.084 3.016 19947
5970 1 18 . 1 1 7 7 ASN HA H 7 4.730 4.730 4.366 0.364 19947
5971 1 18 . 1 1 7 7 ASN CA C 7 53.200 53.200 53.886 -0.686 19947
5972 1 18 . 1 1 7 7 ASN CB C 7 38.700 38.700 38.965 -0.265 19947
5973 1 18 . 1 1 7 7 ASN H H 7 8.320 8.320 8.243 0.077 19947
5974 1 18 . 1 1 8 8 LYS N N 8 121.300 121.300 121.354 -0.054 19947
5975 1 18 . 1 1 8 8 LYS HA H 8 4.340 4.340 4.289 0.051 19947
5976 1 18 . 1 1 8 8 LYS CA C 8 56.600 56.600 56.468 0.132 19947
5977 1 18 . 1 1 8 8 LYS CB C 8 32.900 32.900 31.355 1.545 19947
5978 1 18 . 1 1 8 8 LYS H H 8 8.260 8.260 8.415 -0.155 19947
5979 1 18 . 1 1 9 9 ILE N N 9 136.600 136.600 120.667 15.933 19947
5980 1 18 . 1 1 9 9 ILE HA H 9 4.140 4.140 3.853 0.287 19947
5981 1 18 . 1 1 9 9 ILE CA C 9 61.300 61.300 62.106 -0.806 19947
5982 1 18 . 1 1 9 9 ILE CB C 9 38.200 38.200 38.015 0.185 19947
5983 1 18 . 1 1 9 9 ILE H H 9 8.150 8.150 7.837 0.313 19947
5984 1 18 . 1 1 10 10 LEU N N 10 125.700 125.700 120.680 5.020 19947
5985 1 18 . 1 1 10 10 LEU HA H 10 4.420 4.420 4.436 -0.016 19947
5986 1 18 . 1 1 10 10 LEU CA C 10 55.200 55.200 55.507 -0.307 19947
5987 1 18 . 1 1 10 10 LEU CB C 10 42.300 42.300 40.846 1.454 19947
5988 1 18 . 1 1 10 10 LEU H H 10 8.230 8.230 8.350 -0.120 19947
5989 1 18 . 1 1 11 11 GLU N N 11 120.600 120.600 113.809 6.791 19947
5990 1 18 . 1 1 11 11 GLU HA H 11 4.470 4.470 4.134 0.336 19947
5991 1 18 . 1 1 11 11 GLU CA C 11 55.500 55.500 56.430 -0.930 19947
5992 1 18 . 1 1 11 11 GLU CB C 11 28.900 28.900 28.736 0.164 19947
5993 1 18 . 1 1 11 11 GLU H H 11 8.250 8.250 7.998 0.252 19947
5994 1 18 . 1 1 12 12 GLN N N 12 121.600 121.600 117.208 4.392 19947
5995 1 18 . 1 1 12 12 GLN HA H 12 4.350 4.350 4.751 -0.401 19947
5996 1 18 . 1 1 12 12 GLN CA C 12 56.600 56.600 54.790 1.810 19947
5997 1 18 . 1 1 12 12 GLN CB C 12 29.200 29.200 30.159 -0.959 19947
5998 1 18 . 1 1 12 12 GLN H H 12 8.460 8.460 7.708 0.752 19947
5999 1 18 . 1 1 13 13 GLY N N 13 110.700 110.700 109.861 0.839 19947
6000 1 18 . 1 1 13 13 GLY CA C 13 45.700 45.700 44.980 0.720 19947
6001 1 18 . 1 1 13 13 GLY H H 13 8.660 8.660 8.979 -0.319 19947
6002 1 18 . 1 1 14 14 GLU N N 14 118.900 118.900 118.271 0.629 19947
6003 1 18 . 1 1 14 14 GLU HA H 14 4.530 4.530 4.348 0.182 19947
6004 1 18 . 1 1 14 14 GLU CA C 14 55.600 55.600 56.823 -1.223 19947
6005 1 18 . 1 1 14 14 GLU CB C 14 29.700 29.700 30.531 -0.831 19947
6006 1 18 . 1 1 14 14 GLU H H 14 8.230 8.230 7.894 0.336 19947
6007 1 18 . 1 1 15 15 ASP N N 15 118.400 118.400 118.986 -0.586 19947
6008 1 18 . 1 1 15 15 ASP HA H 15 4.990 4.990 4.794 0.196 19947
6009 1 18 . 1 1 15 15 ASP CA C 15 53.500 53.500 55.191 -1.691 19947
6010 1 18 . 1 1 15 15 ASP CB C 15 39.700 39.700 44.148 -4.448 19947
6011 1 18 . 1 1 15 15 ASP H H 15 8.330 8.330 8.405 -0.075 19947
6012 1 18 . 1 1 16 16 CYS HA H 16 4.340 4.340 4.470 -0.130 19947
6013 1 18 . 1 1 16 16 CYS H H 16 8.510 8.510 8.092 0.418 19947
6014 1 18 . 1 1 17 17 ASP N N 17 116.700 116.700 124.622 -7.922 19947
6015 1 18 . 1 1 17 17 ASP HA H 17 4.740 4.740 4.312 0.428 19947
6016 1 18 . 1 1 17 17 ASP CA C 17 53.100 53.100 55.313 -2.213 19947
6017 1 18 . 1 1 17 17 ASP CB C 17 38.600 38.600 39.466 -0.866 19947
6018 1 18 . 1 1 17 17 ASP H H 17 8.180 8.180 8.742 -0.562 19947
6019 1 18 . 1 1 18 18 CYS HA H 18 4.730 4.730 3.999 0.731 19947
6020 1 18 . 1 1 18 18 CYS CB C 18 41.900 41.900 26.929 14.971 19947
6021 1 18 . 1 1 19 19 GLY H H 19 8.220 8.220 8.562 -0.342 19947
6022 1 18 . 1 1 20 20 SER HA H 20 4.920 4.920 4.445 0.475 19947
6023 1 18 . 1 1 20 20 SER CA C 20 55.700 55.700 57.768 -2.068 19947
6024 1 18 . 1 1 20 20 SER CB C 20 63.500 63.500 62.958 0.542 19947
6025 1 18 . 1 1 20 20 SER H H 20 7.830 7.830 8.472 -0.642 19947
6026 1 18 . 1 1 21 21 PRO HA H 21 4.240 4.240 4.251 -0.011 19947
6027 1 18 . 1 1 21 21 PRO CA C 21 63.400 63.400 64.741 -1.341 19947
6028 1 18 . 1 1 21 21 PRO CB C 21 31.800 31.800 31.346 0.454 19947
6029 1 18 . 1 1 22 22 ALA N N 22 119.900 119.900 117.438 2.462 19947
6030 1 18 . 1 1 22 22 ALA HA H 22 4.220 4.220 4.101 0.119 19947
6031 1 18 . 1 1 22 22 ALA CA C 22 54.200 54.200 54.114 0.086 19947
6032 1 18 . 1 1 22 22 ALA CB C 22 18.500 18.500 18.805 -0.305 19947
6033 1 18 . 1 1 22 22 ALA H H 22 8.180 8.180 8.209 -0.029 19947
6034 1 18 . 1 1 23 23 ASN N N 23 116.300 116.300 112.686 3.614 19947
6035 1 18 . 1 1 23 23 ASN HA H 23 4.670 4.670 4.965 -0.295 19947
6036 1 18 . 1 1 23 23 ASN CA C 23 53.200 53.200 52.566 0.634 19947
6037 1 18 . 1 1 23 23 ASN CB C 23 39.300 39.300 40.056 -0.756 19947
6038 1 18 . 1 1 23 23 ASN H H 23 7.960 7.960 8.286 -0.326 19947
6039 1 18 . 1 1 24 24 CYS HA H 24 4.720 4.720 4.161 0.559 19947
6040 1 18 . 1 1 24 24 CYS H H 24 8.510 8.510 7.636 0.874 19947
6041 1 18 . 1 1 25 25 GLN HA H 25 4.460 4.460 3.911 0.549 19947
6042 1 18 . 1 1 25 25 GLN H H 25 8.320 8.320 8.396 -0.076 19947
6043 1 18 . 1 1 26 26 ASP HA H 26 4.740 4.740 4.800 -0.060 19947
6044 1 18 . 1 1 26 26 ASP H H 26 8.580 8.580 8.300 0.280 19947
6045 1 18 . 1 1 27 27 ARG HA H 27 4.680 4.680 4.318 0.362 19947
6046 1 18 . 1 1 27 27 ARG CA C 27 54.700 54.700 57.941 -3.241 19947
6047 1 18 . 1 1 27 27 ARG H H 27 8.550 8.550 7.564 0.986 19947
6048 1 18 . 1 1 28 28 CYS HA H 28 4.120 4.120 4.866 -0.746 19947
6049 1 18 . 1 1 28 28 CYS CA C 28 54.400 54.400 56.970 -2.570 19947
6050 1 18 . 1 1 28 28 CYS CB C 28 19.000 19.000 26.353 -7.353 19947
6051 1 18 . 1 1 28 28 CYS H H 28 8.910 8.910 8.397 0.513 19947
6052 1 18 . 1 1 29 29 CYS N N 29 113.300 113.300 119.828 -6.528 19947
6053 1 18 . 1 1 29 29 CYS HA H 29 5.010 5.010 5.136 -0.126 19947
6054 1 18 . 1 1 29 29 CYS CA C 29 54.300 54.300 56.001 -1.701 19947
6055 1 18 . 1 1 29 29 CYS H H 29 7.730 7.730 7.754 -0.024 19947
6056 1 18 . 1 1 30 30 ASN HA H 30 4.730 4.730 5.029 -0.299 19947
6057 1 18 . 1 1 30 30 ASN CB C 30 38.700 38.700 40.266 -1.566 19947
6058 1 18 . 1 1 30 30 ASN H H 30 8.870 8.870 8.929 -0.059 19947
6059 1 18 . 1 1 31 31 ALA N N 31 129.400 129.400 126.799 2.601 19947
6060 1 18 . 1 1 31 31 ALA HA H 31 4.120 4.120 4.299 -0.179 19947
6061 1 18 . 1 1 31 31 ALA CA C 31 54.400 54.400 54.648 -0.248 19947
6062 1 18 . 1 1 31 31 ALA CB C 31 19.000 19.000 19.213 -0.213 19947
6063 1 18 . 1 1 31 31 ALA H H 31 8.890 8.890 8.598 0.292 19947
6064 1 18 . 1 1 32 32 ALA N N 32 116.400 116.400 117.315 -0.915 19947
6065 1 18 . 1 1 32 32 ALA HA H 32 4.340 4.340 4.344 -0.004 19947
6066 1 18 . 1 1 32 32 ALA CA C 32 53.800 53.800 53.275 0.525 19947
6067 1 18 . 1 1 32 32 ALA CB C 32 19.100 19.100 18.922 0.178 19947
6068 1 18 . 1 1 32 32 ALA H H 32 8.250 8.250 8.334 -0.084 19947
6069 1 18 . 1 1 33 33 THR N N 33 104.300 104.300 110.633 -6.333 19947
6070 1 18 . 1 1 33 33 THR HA H 33 4.430 4.430 4.391 0.039 19947
6071 1 18 . 1 1 33 33 THR CA C 33 60.500 60.500 60.987 -0.487 19947
6072 1 18 . 1 1 33 33 THR CB C 33 70.600 70.600 69.437 1.163 19947
6073 1 18 . 1 1 33 33 THR H H 33 7.320 7.320 7.389 -0.069 19947
6074 1 18 . 1 1 34 34 CYS N N 34 123.400 123.400 121.041 2.359 19947
6075 1 18 . 1 1 34 34 CYS HA H 34 4.170 4.170 4.171 -0.001 19947
6076 1 18 . 1 1 34 34 CYS CA C 34 56.500 56.500 60.104 -3.604 19947
6077 1 18 . 1 1 34 34 CYS H H 34 8.710 8.710 8.208 0.502 19947
6078 1 18 . 1 1 35 35 LYS N N 35 116.900 116.900 115.979 0.921 19947
6079 1 18 . 1 1 35 35 LYS HA H 35 4.960 4.960 4.745 0.215 19947
6080 1 18 . 1 1 35 35 LYS CA C 35 53.900 53.900 55.408 -1.508 19947
6081 1 18 . 1 1 35 35 LYS CB C 35 35.900 35.900 35.583 0.317 19947
6082 1 18 . 1 1 35 35 LYS H H 35 7.450 7.450 7.815 -0.365 19947
6083 1 18 . 1 1 36 36 LEU N N 36 119.300 119.300 119.853 -0.553 19947
6084 1 18 . 1 1 36 36 LEU HA H 36 4.800 4.800 4.371 0.429 19947
6085 1 18 . 1 1 36 36 LEU CB C 36 42.400 42.400 42.427 -0.027 19947
6086 1 18 . 1 1 36 36 LEU H H 36 8.290 8.290 8.497 -0.207 19947
6087 1 18 . 1 1 37 37 THR HA H 37 4.340 4.340 4.795 -0.455 19947
6088 1 18 . 1 1 37 37 THR CA C 37 60.200 60.200 58.903 1.297 19947
6089 1 18 . 1 1 37 37 THR CB C 37 67.700 67.700 68.876 -1.176 19947
6090 1 18 . 1 1 37 37 THR H H 37 8.380 8.380 8.101 0.279 19947
6091 1 18 . 1 1 38 38 PRO HA H 38 4.380 4.380 4.213 0.167 19947
6092 1 18 . 1 1 38 38 PRO CA C 38 64.800 64.800 64.436 0.365 19947
6093 1 18 . 1 1 38 38 PRO CB C 38 31.500 31.500 31.208 0.292 19947
6094 1 18 . 1 1 39 39 GLY N N 39 113.300 113.300 113.548 -0.248 19947
6095 1 18 . 1 1 39 39 GLY CA C 39 45.100 45.100 44.836 0.264 19947
6096 1 18 . 1 1 39 39 GLY H H 39 8.830 8.830 8.420 0.410 19947
6097 1 18 . 1 1 40 40 SER N N 40 116.700 116.700 117.602 -0.902 19947
6098 1 18 . 1 1 40 40 SER HA H 40 4.610 4.610 4.471 0.139 19947
6099 1 18 . 1 1 40 40 SER CA C 40 58.800 58.800 58.806 -0.006 19947
6100 1 18 . 1 1 40 40 SER CB C 40 63.800 63.800 63.634 0.166 19947
6101 1 18 . 1 1 40 40 SER H H 40 8.280 8.280 7.829 0.451 19947
6102 1 18 . 1 1 41 41 GLN N N 41 120.600 120.600 125.534 -4.934 19947
6103 1 18 . 1 1 41 41 GLN HA H 41 4.110 4.110 4.141 -0.031 19947
6104 1 18 . 1 1 41 41 GLN CA C 41 55.200 55.200 56.222 -1.022 19947
6105 1 18 . 1 1 41 41 GLN CB C 41 31.100 31.100 29.576 1.524 19947
6106 1 18 . 1 1 41 41 GLN H H 41 9.190 9.190 7.924 1.266 19947
6107 1 18 . 1 1 42 42 CYS N N 42 113.200 113.200 109.819 3.381 19947
6108 1 18 . 1 1 42 42 CYS HA H 42 4.630 4.630 4.675 -0.045 19947
6109 1 18 . 1 1 42 42 CYS CA C 42 53.700 53.700 56.720 -3.020 19947
6110 1 18 . 1 1 42 42 CYS CB C 42 45.500 45.500 30.034 15.466 19947
6111 1 18 . 1 1 42 42 CYS H H 42 7.710 7.710 7.211 0.499 19947
6112 1 18 . 1 1 43 43 ASN N N 43 114.200 114.200 119.236 -5.036 19947
6113 1 18 . 1 1 43 43 ASN HA H 43 4.940 4.940 4.618 0.322 19947
6114 1 18 . 1 1 43 43 ASN CA C 43 53.000 53.000 54.129 -1.129 19947
6115 1 18 . 1 1 43 43 ASN CB C 43 39.300 39.300 40.633 -1.333 19947
6116 1 18 . 1 1 43 43 ASN H H 43 8.870 8.870 8.836 0.034 19947
6117 1 18 . 1 1 44 44 TYR N N 44 118.400 118.400 115.621 2.779 19947
6118 1 18 . 1 1 44 44 TYR HA H 44 4.850 4.850 4.736 0.114 19947
6119 1 18 . 1 1 44 44 TYR CA C 44 55.300 55.300 56.742 -1.442 19947
6120 1 18 . 1 1 44 44 TYR CB C 44 40.700 40.700 40.075 0.625 19947
6121 1 18 . 1 1 44 44 TYR H H 44 7.840 7.840 7.279 0.561 19947
6122 1 18 . 1 1 45 45 GLY N N 45 110.600 110.600 110.009 0.591 19947
6123 1 18 . 1 1 45 45 GLY CA C 45 44.000 44.000 45.047 -1.047 19947
6124 1 18 . 1 1 45 45 GLY H H 45 7.960 7.960 8.136 -0.176 19947
6125 1 18 . 1 1 46 46 GLU N N 46 120.700 120.700 119.824 0.876 19947
6126 1 18 . 1 1 46 46 GLU HA H 46 4.280 4.280 4.173 0.107 19947
6127 1 18 . 1 1 46 46 GLU CA C 46 58.500 58.500 58.720 -0.220 19947
6128 1 18 . 1 1 46 46 GLU CB C 46 29.300 29.300 30.112 -0.812 19947
6129 1 18 . 1 1 46 46 GLU H H 46 9.160 9.160 8.564 0.596 19947
6130 1 18 . 1 1 47 47 CYS N N 47 112.400 112.400 119.091 -6.691 19947
6131 1 18 . 1 1 47 47 CYS HA H 47 4.850 4.850 4.950 -0.100 19947
6132 1 18 . 1 1 47 47 CYS CA C 47 57.100 57.100 57.064 0.036 19947
6133 1 18 . 1 1 47 47 CYS CB C 47 41.200 41.200 25.645 15.555 19947
6134 1 18 . 1 1 47 47 CYS H H 47 8.510 8.510 7.525 0.985 19947
6135 1 18 . 1 1 48 48 CYS N N 48 123.200 123.200 121.720 1.480 19947
6136 1 18 . 1 1 48 48 CYS HA H 48 5.160 5.160 5.262 -0.102 19947
6137 1 18 . 1 1 48 48 CYS CA C 48 54.700 54.700 59.294 -4.594 19947
6138 1 18 . 1 1 48 48 CYS CB C 48 45.700 45.700 29.607 16.093 19947
6139 1 18 . 1 1 48 48 CYS H H 48 7.810 7.810 7.847 -0.037 19947
6140 1 18 . 1 1 49 49 ASP N N 49 127.400 127.400 122.355 5.045 19947
6141 1 18 . 1 1 49 49 ASP HA H 49 4.890 4.890 4.739 0.151 19947
6142 1 18 . 1 1 49 49 ASP CA C 49 53.500 53.500 54.450 -0.951 19947
6143 1 18 . 1 1 49 49 ASP CB C 49 42.400 42.400 42.601 -0.201 19947
6144 1 18 . 1 1 49 49 ASP H H 49 9.670 9.670 8.595 1.075 19947
6145 1 18 . 1 1 50 50 GLN N N 50 127.000 127.000 121.634 5.366 19947
6146 1 18 . 1 1 50 50 GLN HA H 50 3.940 3.940 3.960 -0.020 19947
6147 1 18 . 1 1 50 50 GLN CA C 50 56.800 56.800 57.191 -0.391 19947
6148 1 18 . 1 1 50 50 GLN CB C 50 26.500 26.500 27.483 -0.983 19947
6149 1 18 . 1 1 50 50 GLN H H 50 9.450 9.450 8.622 0.828 19947
6150 1 18 . 1 1 51 51 CYS N N 51 106.100 106.100 113.386 -7.286 19947
6151 1 18 . 1 1 51 51 CYS HA H 51 4.760 4.760 4.499 0.261 19947
6152 1 18 . 1 1 51 51 CYS CB C 51 43.200 43.200 24.889 18.311 19947
6153 1 18 . 1 1 51 51 CYS H H 51 8.700 8.700 8.531 0.169 19947
6154 1 18 . 1 1 52 52 ARG N N 52 121.000 121.000 115.968 5.032 19947
6155 1 18 . 1 1 52 52 ARG HA H 52 4.690 4.690 4.360 0.330 19947
6156 1 18 . 1 1 52 52 ARG CA C 52 55.400 55.400 54.677 0.723 19947
6157 1 18 . 1 1 52 52 ARG CB C 52 33.100 33.100 34.569 -1.469 19947
6158 1 18 . 1 1 52 52 ARG H H 52 7.960 7.960 7.063 0.897 19947
6159 1 18 . 1 1 53 53 PHE N N 53 120.300 120.300 120.406 -0.106 19947
6160 1 18 . 1 1 53 53 PHE HA H 53 5.050 5.050 4.803 0.247 19947
6161 1 18 . 1 1 53 53 PHE CA C 53 56.100 56.100 57.381 -1.281 19947
6162 1 18 . 1 1 53 53 PHE CB C 53 38.200 38.200 39.344 -1.144 19947
6163 1 18 . 1 1 53 53 PHE H H 53 8.400 8.400 8.261 0.139 19947
6164 1 18 . 1 1 54 54 LYS N N 54 123.300 123.300 123.939 -0.639 19947
6165 1 18 . 1 1 54 54 LYS HA H 54 4.250 4.250 4.163 0.087 19947
6166 1 18 . 1 1 54 54 LYS CA C 54 57.500 57.500 56.427 1.073 19947
6167 1 18 . 1 1 54 54 LYS CB C 54 34.300 34.300 32.787 1.513 19947
6168 1 18 . 1 1 54 54 LYS H H 54 8.540 8.540 8.595 -0.055 19947
6169 1 18 . 1 1 55 55 LYS N N 55 119.400 119.400 125.305 -5.905 19947
6170 1 18 . 1 1 55 55 LYS HA H 55 4.110 4.110 4.025 0.085 19947
6171 1 18 . 1 1 55 55 LYS CA C 55 56.500 56.500 56.662 -0.162 19947
6172 1 18 . 1 1 55 55 LYS CB C 55 33.400 33.400 33.366 0.034 19947
6173 1 18 . 1 1 55 55 LYS H H 55 8.440 8.440 8.423 0.017 19947
6174 1 18 . 1 1 56 56 ALA N N 56 126.700 126.700 127.179 -0.479 19947
6175 1 18 . 1 1 56 56 ALA HA H 56 3.920 3.920 4.068 -0.148 19947
6176 1 18 . 1 1 56 56 ALA CA C 56 52.900 52.900 53.814 -0.914 19947
6177 1 18 . 1 1 56 56 ALA CB C 56 18.100 18.100 18.607 -0.507 19947
6178 1 18 . 1 1 56 56 ALA H H 56 8.930 8.930 8.596 0.334 19947
6179 1 18 . 1 1 57 57 GLY N N 57 109.300 109.300 110.868 -1.568 19947
6180 1 18 . 1 1 57 57 GLY CA C 57 45.100 45.100 44.856 0.244 19947
6181 1 18 . 1 1 57 57 GLY H H 57 8.460 8.460 8.435 0.025 19947
6182 1 18 . 1 1 58 58 THR N N 58 117.200 117.200 120.022 -2.822 19947
6183 1 18 . 1 1 58 58 THR HA H 58 4.260 4.260 4.384 -0.124 19947
6184 1 18 . 1 1 58 58 THR CA C 58 63.300 63.300 63.741 -0.441 19947
6185 1 18 . 1 1 58 58 THR CB C 58 69.600 69.600 69.102 0.498 19947
6186 1 18 . 1 1 58 58 THR H H 58 7.660 7.660 7.786 -0.126 19947
6187 1 18 . 1 1 59 59 VAL N N 59 130.400 130.400 127.866 2.534 19947
6188 1 18 . 1 1 59 59 VAL HA H 59 3.900 3.900 3.894 0.006 19947
6189 1 18 . 1 1 59 59 VAL CA C 59 64.400 64.400 62.840 1.560 19947
6190 1 18 . 1 1 59 59 VAL CB C 59 31.900 31.900 32.129 -0.229 19947
6191 1 18 . 1 1 59 59 VAL H H 59 9.190 9.190 8.849 0.341 19947
6192 1 18 . 1 1 60 60 CYS N N 60 121.800 121.800 126.346 -4.546 19947
6193 1 18 . 1 1 60 60 CYS HA H 60 5.050 5.050 4.646 0.404 19947
6194 1 18 . 1 1 60 60 CYS CA C 60 54.400 54.400 57.928 -3.528 19947
6195 1 18 . 1 1 60 60 CYS CB C 60 43.000 43.000 27.337 15.663 19947
6196 1 18 . 1 1 60 60 CYS H H 60 9.130 9.130 8.253 0.877 19947
6197 1 18 . 1 1 61 61 ARG N N 61 124.100 124.100 118.377 5.723 19947
6198 1 18 . 1 1 61 61 ARG HA H 61 4.360 4.360 4.633 -0.273 19947
6199 1 18 . 1 1 61 61 ARG CA C 61 56.800 56.800 55.505 1.295 19947
6200 1 18 . 1 1 61 61 ARG CB C 61 32.800 32.800 34.747 -1.947 19947
6201 1 18 . 1 1 61 61 ARG H H 61 7.580 7.580 7.404 0.176 19947
6202 1 18 . 1 1 62 62 ILE N N 62 126.200 126.200 115.888 10.312 19947
6203 1 18 . 1 1 62 62 ILE HA H 62 4.090 4.090 4.615 -0.525 19947
6204 1 18 . 1 1 62 62 ILE CA C 62 60.300 60.300 61.261 -0.961 19947
6205 1 18 . 1 1 62 62 ILE CB C 62 38.700 38.700 40.674 -1.974 19947
6206 1 18 . 1 1 62 62 ILE H H 62 8.490 8.490 8.464 0.026 19947
6207 1 18 . 1 1 63 63 ALA N N 63 129.400 129.400 131.994 -2.594 19947
6208 1 18 . 1 1 63 63 ALA HA H 63 4.310 4.310 4.431 -0.121 19947
6209 1 18 . 1 1 63 63 ALA CA C 63 51.900 51.900 54.115 -2.215 19947
6210 1 18 . 1 1 63 63 ALA CB C 63 20.600 20.600 19.090 1.510 19947
6211 1 18 . 1 1 63 63 ALA H H 63 8.100 8.100 8.566 -0.466 19947
6212 1 18 . 1 1 64 64 ARG N N 64 120.500 120.500 121.601 -1.101 19947
6213 1 18 . 1 1 64 64 ARG HA H 64 4.290 4.290 4.426 -0.136 19947
6214 1 18 . 1 1 64 64 ARG CA C 64 56.200 56.200 55.890 0.310 19947
6215 1 18 . 1 1 64 64 ARG CB C 64 30.500 30.500 29.996 0.504 19947
6216 1 18 . 1 1 64 64 ARG H H 64 8.140 8.140 8.695 -0.555 19947
6217 1 18 . 1 1 65 65 GLY N N 65 110.500 110.500 114.250 -3.750 19947
6218 1 18 . 1 1 65 65 GLY CA C 65 45.100 45.100 44.600 0.500 19947
6219 1 18 . 1 1 65 65 GLY H H 65 8.040 8.040 8.442 -0.402 19947
6220 1 18 . 1 1 66 66 ASP N N 66 120.700 120.700 118.947 1.753 19947
6221 1 18 . 1 1 66 66 ASP HA H 66 4.610 4.610 4.480 0.130 19947
6222 1 18 . 1 1 66 66 ASP CA C 66 53.300 53.300 53.741 -0.441 19947
6223 1 18 . 1 1 66 66 ASP CB C 66 37.600 37.600 40.297 -2.697 19947
6224 1 18 . 1 1 66 66 ASP H H 66 8.380 8.380 7.196 1.184 19947
6225 1 18 . 1 1 67 67 TRP N N 67 120.100 120.100 123.042 -2.942 19947
6226 1 18 . 1 1 67 67 TRP HA H 67 4.760 4.760 5.061 -0.301 19947
6227 1 18 . 1 1 67 67 TRP CA C 67 57.200 57.200 57.891 -0.691 19947
6228 1 18 . 1 1 67 67 TRP CB C 67 29.100 29.100 29.524 -0.424 19947
6229 1 18 . 1 1 67 67 TRP H H 67 7.950 7.950 7.578 0.372 19947
6230 1 18 . 1 1 68 68 ASN N N 68 118.400 118.400 117.410 0.990 19947
6231 1 18 . 1 1 68 68 ASN HA H 68 4.790 4.790 4.960 -0.170 19947
6232 1 18 . 1 1 68 68 ASN CA C 68 52.800 52.800 53.697 -0.897 19947
6233 1 18 . 1 1 68 68 ASN CB C 68 39.300 39.300 40.424 -1.124 19947
6234 1 18 . 1 1 68 68 ASN H H 68 8.180 8.180 8.875 -0.695 19947
6235 1 18 . 1 1 69 69 ASP N N 69 118.500 118.500 118.171 0.329 19947
6236 1 18 . 1 1 69 69 ASP HA H 69 4.620 4.620 4.546 0.074 19947
6237 1 18 . 1 1 69 69 ASP CA C 69 53.200 53.200 56.340 -3.140 19947
6238 1 18 . 1 1 69 69 ASP CB C 69 38.000 38.000 41.241 -3.241 19947
6239 1 18 . 1 1 69 69 ASP H H 69 8.130 8.130 8.382 -0.252 19947
6240 1 18 . 1 1 70 70 ASP N N 70 120.500 120.500 120.725 -0.225 19947
6241 1 18 . 1 1 70 70 ASP HA H 70 5.100 5.100 5.264 -0.164 19947
6242 1 18 . 1 1 70 70 ASP CA C 70 52.500 52.500 52.907 -0.407 19947
6243 1 18 . 1 1 70 70 ASP CB C 70 42.600 42.600 42.988 -0.388 19947
6244 1 18 . 1 1 70 70 ASP H H 70 8.140 8.140 8.081 0.059 19947
6245 1 18 . 1 1 71 71 TYR N N 71 118.900 118.900 123.398 -4.498 19947
6246 1 18 . 1 1 71 71 TYR HA H 71 5.210 5.210 5.006 0.204 19947
6247 1 18 . 1 1 71 71 TYR CA C 71 56.300 56.300 57.096 -0.797 19947
6248 1 18 . 1 1 71 71 TYR CB C 71 42.200 42.200 42.841 -0.641 19947
6249 1 18 . 1 1 71 71 TYR H H 71 8.450 8.450 8.209 0.241 19947
6250 1 18 . 1 1 72 72 CYS N N 72 119.800 119.800 121.054 -1.254 19947
6251 1 18 . 1 1 72 72 CYS HA H 72 4.900 4.900 4.382 0.518 19947
6252 1 18 . 1 1 72 72 CYS CA C 72 53.400 53.400 60.478 -7.078 19947
6253 1 18 . 1 1 72 72 CYS CB C 72 37.200 37.200 28.274 8.925 19947
6254 1 18 . 1 1 72 72 CYS H H 72 9.330 9.330 8.694 0.636 19947
6255 1 18 . 1 1 73 73 THR N N 73 112.700 112.700 114.177 -1.477 19947
6256 1 18 . 1 1 73 73 THR HA H 73 4.430 4.430 4.384 0.046 19947
6257 1 18 . 1 1 73 73 THR CA C 73 62.300 62.300 62.068 0.232 19947
6258 1 18 . 1 1 73 73 THR CB C 73 71.300 71.300 70.387 0.913 19947
6259 1 18 . 1 1 73 73 THR H H 73 9.980 9.980 8.659 1.321 19947
6260 1 18 . 1 1 74 74 GLY N N 74 111.500 111.500 111.886 -0.386 19947
6261 1 18 . 1 1 74 74 GLY CA C 74 45.300 45.300 46.469 -1.169 19947
6262 1 18 . 1 1 74 74 GLY H H 74 8.580 8.580 8.048 0.532 19947
6263 1 18 . 1 1 75 75 LYS N N 75 115.900 115.900 117.949 -2.049 19947
6264 1 18 . 1 1 75 75 LYS HA H 75 4.140 4.140 4.580 -0.440 19947
6265 1 18 . 1 1 75 75 LYS CA C 75 54.800 54.800 55.809 -1.009 19947
6266 1 18 . 1 1 75 75 LYS CB C 75 34.200 34.200 33.853 0.347 19947
6267 1 18 . 1 1 75 75 LYS H H 75 7.900 7.900 7.578 0.322 19947
6268 1 18 . 1 1 76 76 SER N N 76 111.000 111.000 111.837 -0.837 19947
6269 1 18 . 1 1 76 76 SER HA H 76 4.160 4.160 3.910 0.249 19947
6270 1 18 . 1 1 76 76 SER CA C 76 61.400 61.400 56.293 5.107 19947
6271 1 18 . 1 1 76 76 SER CB C 76 64.300 64.300 64.956 -0.656 19947
6272 1 18 . 1 1 76 76 SER H H 76 6.520 6.520 6.877 -0.357 19947
6273 1 18 . 1 1 77 77 SER N N 77 117.100 117.100 114.427 2.673 19947
6274 1 18 . 1 1 77 77 SER HA H 77 4.220 4.220 4.393 -0.173 19947
6275 1 18 . 1 1 77 77 SER CA C 77 59.800 59.800 58.250 1.550 19947
6276 1 18 . 1 1 77 77 SER CB C 77 64.400 64.400 63.636 0.764 19947
6277 1 18 . 1 1 77 77 SER H H 77 9.030 9.030 8.281 0.749 19947
6278 1 18 . 1 1 78 78 ASP N N 78 122.100 122.100 123.380 -1.280 19947
6279 1 18 . 1 1 78 78 ASP HA H 78 4.930 4.930 4.728 0.202 19947
6280 1 18 . 1 1 78 78 ASP CA C 78 52.400 52.400 54.049 -1.649 19947
6281 1 18 . 1 1 78 78 ASP CB C 78 40.800 40.800 43.127 -2.327 19947
6282 1 18 . 1 1 78 78 ASP H H 78 8.340 8.340 7.457 0.883 19947
6283 1 18 . 1 1 79 79 CYS N N 79 122.200 122.200 121.614 0.586 19947
6284 1 18 . 1 1 79 79 CYS HA H 79 5.320 5.320 4.809 0.511 19947
6285 1 18 . 1 1 79 79 CYS CA C 79 52.000 52.000 55.502 -3.502 19947
6286 1 18 . 1 1 79 79 CYS CB C 79 39.300 39.300 28.540 10.760 19947
6287 1 18 . 1 1 79 79 CYS H H 79 8.960 8.960 8.514 0.446 19947
6288 1 18 . 1 1 80 80 PRO HA H 80 4.410 4.410 4.610 -0.200 19947
6289 1 18 . 1 1 80 80 PRO CA C 80 63.500 63.500 62.982 0.518 19947
6290 1 18 . 1 1 80 80 PRO CB C 80 32.400 32.400 32.260 0.140 19947
6291 1 18 . 1 1 81 81 TRP N N 81 120.500 120.500 121.681 -1.181 19947
6292 1 18 . 1 1 81 81 TRP HA H 81 4.550 4.550 4.602 -0.052 19947
6293 1 18 . 1 1 81 81 TRP CA C 81 56.400 56.400 54.898 1.502 19947
6294 1 18 . 1 1 81 81 TRP CB C 81 29.500 29.500 28.793 0.707 19947
6295 1 18 . 1 1 81 81 TRP H H 81 8.400 8.400 8.509 -0.109 19947
6296 1 18 . 1 1 82 82 ASN N N 82 120.400 120.400 115.956 4.444 19947
6297 1 18 . 1 1 82 82 ASN HA H 82 4.750 4.750 4.378 0.372 19947
6298 1 18 . 1 1 82 82 ASN CA C 82 53.100 53.100 54.028 -0.928 19947
6299 1 18 . 1 1 82 82 ASN CB C 82 39.000 39.000 36.811 2.189 19947
6300 1 18 . 1 1 82 82 ASN H H 82 8.040 8.040 8.582 -0.542 19947
6301 1 19 . 1 1 2 2 PRO HA H 2 4.820 4.820 4.501 0.319 19947
6302 1 19 . 1 1 2 2 PRO CA C 2 61.900 61.900 62.190 -0.290 19947
6303 1 19 . 1 1 2 2 PRO CB C 2 30.700 30.700 31.782 -1.082 19947
6304 1 19 . 1 1 3 3 PRO HA H 3 4.540 4.540 4.433 0.107 19947
6305 1 19 . 1 1 3 3 PRO CA C 3 62.900 62.900 62.877 0.023 19947
6306 1 19 . 1 1 3 3 PRO CB C 3 32.100 32.100 32.858 -0.759 19947
6307 1 19 . 1 1 4 4 VAL N N 4 121.900 121.900 122.870 -0.970 19947
6308 1 19 . 1 1 4 4 VAL HA H 4 4.200 4.200 4.291 -0.091 19947
6309 1 19 . 1 1 4 4 VAL CA C 4 62.300 62.300 62.109 0.191 19947
6310 1 19 . 1 1 4 4 VAL CB C 4 32.800 32.800 32.669 0.131 19947
6311 1 19 . 1 1 4 4 VAL H H 4 8.330 8.330 8.287 0.043 19947
6312 1 19 . 1 1 5 5 CYS N N 5 120.900 120.900 124.482 -3.582 19947
6313 1 19 . 1 1 5 5 CYS HA H 5 4.700 4.700 4.515 0.185 19947
6314 1 19 . 1 1 5 5 CYS CA C 5 53.600 53.600 58.640 -5.040 19947
6315 1 19 . 1 1 5 5 CYS H H 5 8.500 8.500 8.471 0.029 19947
6316 1 19 . 1 1 6 6 GLY N N 6 110.200 110.200 112.865 -2.665 19947
6317 1 19 . 1 1 6 6 GLY CA C 6 46.300 46.300 46.059 0.241 19947
6318 1 19 . 1 1 6 6 GLY H H 6 8.490 8.490 8.831 -0.341 19947
6319 1 19 . 1 1 7 7 ASN N N 7 120.100 120.100 115.113 4.987 19947
6320 1 19 . 1 1 7 7 ASN HA H 7 4.730 4.730 4.318 0.412 19947
6321 1 19 . 1 1 7 7 ASN CA C 7 53.200 53.200 53.580 -0.379 19947
6322 1 19 . 1 1 7 7 ASN CB C 7 38.700 38.700 38.512 0.188 19947
6323 1 19 . 1 1 7 7 ASN H H 7 8.320 8.320 8.343 -0.023 19947
6324 1 19 . 1 1 8 8 LYS N N 8 121.300 121.300 121.966 -0.666 19947
6325 1 19 . 1 1 8 8 LYS HA H 8 4.340 4.340 4.010 0.330 19947
6326 1 19 . 1 1 8 8 LYS CA C 8 56.600 56.600 56.906 -0.306 19947
6327 1 19 . 1 1 8 8 LYS CB C 8 32.900 32.900 31.619 1.281 19947
6328 1 19 . 1 1 8 8 LYS H H 8 8.260 8.260 8.287 -0.027 19947
6329 1 19 . 1 1 9 9 ILE N N 9 136.600 136.600 120.267 16.333 19947
6330 1 19 . 1 1 9 9 ILE HA H 9 4.140 4.140 3.861 0.279 19947
6331 1 19 . 1 1 9 9 ILE CA C 9 61.300 61.300 62.281 -0.981 19947
6332 1 19 . 1 1 9 9 ILE CB C 9 38.200 38.200 38.236 -0.036 19947
6333 1 19 . 1 1 9 9 ILE H H 9 8.150 8.150 7.942 0.208 19947
6334 1 19 . 1 1 10 10 LEU N N 10 125.700 125.700 119.070 6.630 19947
6335 1 19 . 1 1 10 10 LEU HA H 10 4.420 4.420 4.555 -0.135 19947
6336 1 19 . 1 1 10 10 LEU CA C 10 55.200 55.200 54.729 0.471 19947
6337 1 19 . 1 1 10 10 LEU CB C 10 42.300 42.300 40.517 1.783 19947
6338 1 19 . 1 1 10 10 LEU H H 10 8.230 8.230 8.373 -0.143 19947
6339 1 19 . 1 1 11 11 GLU N N 11 120.600 120.600 116.569 4.031 19947
6340 1 19 . 1 1 11 11 GLU HA H 11 4.470 4.470 3.952 0.518 19947
6341 1 19 . 1 1 11 11 GLU CA C 11 55.500 55.500 56.344 -0.844 19947
6342 1 19 . 1 1 11 11 GLU CB C 11 28.900 28.900 28.896 0.004 19947
6343 1 19 . 1 1 11 11 GLU H H 11 8.250 8.250 7.942 0.308 19947
6344 1 19 . 1 1 12 12 GLN N N 12 121.600 121.600 116.288 5.312 19947
6345 1 19 . 1 1 12 12 GLN HA H 12 4.350 4.350 4.476 -0.126 19947
6346 1 19 . 1 1 12 12 GLN CA C 12 56.600 56.600 54.952 1.648 19947
6347 1 19 . 1 1 12 12 GLN CB C 12 29.200 29.200 28.472 0.728 19947
6348 1 19 . 1 1 12 12 GLN H H 12 8.460 8.460 7.688 0.772 19947
6349 1 19 . 1 1 13 13 GLY N N 13 110.700 110.700 109.441 1.259 19947
6350 1 19 . 1 1 13 13 GLY CA C 13 45.700 45.700 47.771 -2.071 19947
6351 1 19 . 1 1 13 13 GLY H H 13 8.660 8.660 8.711 -0.051 19947
6352 1 19 . 1 1 14 14 GLU N N 14 118.900 118.900 116.375 2.525 19947
6353 1 19 . 1 1 14 14 GLU HA H 14 4.530 4.530 4.216 0.314 19947
6354 1 19 . 1 1 14 14 GLU CA C 14 55.600 55.600 56.815 -1.215 19947
6355 1 19 . 1 1 14 14 GLU CB C 14 29.700 29.700 29.402 0.298 19947
6356 1 19 . 1 1 14 14 GLU H H 14 8.230 8.230 8.567 -0.337 19947
6357 1 19 . 1 1 15 15 ASP N N 15 118.400 118.400 120.416 -2.016 19947
6358 1 19 . 1 1 15 15 ASP HA H 15 4.990 4.990 4.515 0.475 19947
6359 1 19 . 1 1 15 15 ASP CA C 15 53.500 53.500 55.895 -2.395 19947
6360 1 19 . 1 1 15 15 ASP CB C 15 39.700 39.700 40.868 -1.168 19947
6361 1 19 . 1 1 15 15 ASP H H 15 8.330 8.330 8.373 -0.043 19947
6362 1 19 . 1 1 16 16 CYS HA H 16 4.340 4.340 4.503 -0.163 19947
6363 1 19 . 1 1 16 16 CYS H H 16 8.510 8.510 7.798 0.712 19947
6364 1 19 . 1 1 17 17 ASP N N 17 116.700 116.700 121.504 -4.804 19947
6365 1 19 . 1 1 17 17 ASP HA H 17 4.740 4.740 4.316 0.424 19947
6366 1 19 . 1 1 17 17 ASP CA C 17 53.100 53.100 55.401 -2.301 19947
6367 1 19 . 1 1 17 17 ASP CB C 17 38.600 38.600 40.815 -2.215 19947
6368 1 19 . 1 1 17 17 ASP H H 17 8.180 8.180 8.596 -0.416 19947
6369 1 19 . 1 1 18 18 CYS HA H 18 4.730 4.730 4.064 0.666 19947
6370 1 19 . 1 1 18 18 CYS CB C 18 41.900 41.900 27.124 14.776 19947
6371 1 19 . 1 1 19 19 GLY H H 19 8.220 8.220 8.756 -0.536 19947
6372 1 19 . 1 1 20 20 SER HA H 20 4.920 4.920 4.835 0.085 19947
6373 1 19 . 1 1 20 20 SER CA C 20 55.700 55.700 55.080 0.620 19947
6374 1 19 . 1 1 20 20 SER CB C 20 63.500 63.500 63.146 0.354 19947
6375 1 19 . 1 1 20 20 SER H H 20 7.830 7.830 7.973 -0.143 19947
6376 1 19 . 1 1 21 21 PRO HA H 21 4.240 4.240 4.212 0.028 19947
6377 1 19 . 1 1 21 21 PRO CA C 21 63.400 63.400 65.063 -1.663 19947
6378 1 19 . 1 1 21 21 PRO CB C 21 31.800 31.800 31.516 0.284 19947
6379 1 19 . 1 1 22 22 ALA N N 22 119.900 119.900 118.573 1.327 19947
6380 1 19 . 1 1 22 22 ALA HA H 22 4.220 4.220 4.126 0.094 19947
6381 1 19 . 1 1 22 22 ALA CA C 22 54.200 54.200 53.535 0.665 19947
6382 1 19 . 1 1 22 22 ALA CB C 22 18.500 18.500 19.026 -0.525 19947
6383 1 19 . 1 1 22 22 ALA H H 22 8.180 8.180 8.127 0.053 19947
6384 1 19 . 1 1 23 23 ASN N N 23 116.300 116.300 114.794 1.506 19947
6385 1 19 . 1 1 23 23 ASN HA H 23 4.670 4.670 4.847 -0.177 19947
6386 1 19 . 1 1 23 23 ASN CA C 23 53.200 53.200 53.419 -0.218 19947
6387 1 19 . 1 1 23 23 ASN CB C 23 39.300 39.300 40.772 -1.472 19947
6388 1 19 . 1 1 23 23 ASN H H 23 7.960 7.960 8.201 -0.241 19947
6389 1 19 . 1 1 24 24 CYS HA H 24 4.720 4.720 4.231 0.489 19947
6390 1 19 . 1 1 24 24 CYS H H 24 8.510 8.510 8.514 -0.004 19947
6391 1 19 . 1 1 25 25 GLN HA H 25 4.460 4.460 4.657 -0.198 19947
6392 1 19 . 1 1 25 25 GLN H H 25 8.320 8.320 8.197 0.123 19947
6393 1 19 . 1 1 26 26 ASP HA H 26 4.740 4.740 4.830 -0.090 19947
6394 1 19 . 1 1 26 26 ASP H H 26 8.580 8.580 7.606 0.974 19947
6395 1 19 . 1 1 27 27 ARG HA H 27 4.680 4.680 3.932 0.748 19947
6396 1 19 . 1 1 27 27 ARG CA C 27 54.700 54.700 58.480 -3.780 19947
6397 1 19 . 1 1 27 27 ARG H H 27 8.550 8.550 8.725 -0.175 19947
6398 1 19 . 1 1 28 28 CYS HA H 28 4.120 4.120 5.058 -0.938 19947
6399 1 19 . 1 1 28 28 CYS CA C 28 54.400 54.400 56.644 -2.244 19947
6400 1 19 . 1 1 28 28 CYS CB C 28 19.000 19.000 27.020 -8.020 19947
6401 1 19 . 1 1 28 28 CYS H H 28 8.910 8.910 8.014 0.896 19947
6402 1 19 . 1 1 29 29 CYS N N 29 113.300 113.300 117.911 -4.611 19947
6403 1 19 . 1 1 29 29 CYS HA H 29 5.010 5.010 4.584 0.426 19947
6404 1 19 . 1 1 29 29 CYS CA C 29 54.300 54.300 58.205 -3.905 19947
6405 1 19 . 1 1 29 29 CYS H H 29 7.730 7.730 8.021 -0.291 19947
6406 1 19 . 1 1 30 30 ASN HA H 30 4.730 4.730 5.025 -0.295 19947
6407 1 19 . 1 1 30 30 ASN CB C 30 38.700 38.700 39.885 -1.185 19947
6408 1 19 . 1 1 30 30 ASN H H 30 8.870 8.870 8.607 0.263 19947
6409 1 19 . 1 1 31 31 ALA N N 31 129.400 129.400 126.033 3.367 19947
6410 1 19 . 1 1 31 31 ALA HA H 31 4.120 4.120 4.190 -0.070 19947
6411 1 19 . 1 1 31 31 ALA CA C 31 54.400 54.400 54.098 0.302 19947
6412 1 19 . 1 1 31 31 ALA CB C 31 19.000 19.000 18.805 0.195 19947
6413 1 19 . 1 1 31 31 ALA H H 31 8.890 8.890 8.552 0.338 19947
6414 1 19 . 1 1 32 32 ALA N N 32 116.400 116.400 119.493 -3.093 19947
6415 1 19 . 1 1 32 32 ALA HA H 32 4.340 4.340 4.182 0.158 19947
6416 1 19 . 1 1 32 32 ALA CA C 32 53.800 53.800 54.253 -0.453 19947
6417 1 19 . 1 1 32 32 ALA CB C 32 19.100 19.100 18.859 0.241 19947
6418 1 19 . 1 1 32 32 ALA H H 32 8.250 8.250 7.571 0.679 19947
6419 1 19 . 1 1 33 33 THR N N 33 104.300 104.300 113.222 -8.922 19947
6420 1 19 . 1 1 33 33 THR HA H 33 4.430 4.430 4.326 0.104 19947
6421 1 19 . 1 1 33 33 THR CA C 33 60.500 60.500 61.666 -1.166 19947
6422 1 19 . 1 1 33 33 THR CB C 33 70.600 70.600 69.144 1.456 19947
6423 1 19 . 1 1 33 33 THR H H 33 7.320 7.320 7.419 -0.099 19947
6424 1 19 . 1 1 34 34 CYS N N 34 123.400 123.400 119.672 3.728 19947
6425 1 19 . 1 1 34 34 CYS HA H 34 4.170 4.170 4.139 0.031 19947
6426 1 19 . 1 1 34 34 CYS CA C 34 56.500 56.500 60.012 -3.512 19947
6427 1 19 . 1 1 34 34 CYS H H 34 8.710 8.710 8.268 0.442 19947
6428 1 19 . 1 1 35 35 LYS N N 35 116.900 116.900 118.230 -1.330 19947
6429 1 19 . 1 1 35 35 LYS HA H 35 4.960 4.960 4.615 0.345 19947
6430 1 19 . 1 1 35 35 LYS CA C 35 53.900 53.900 54.902 -1.002 19947
6431 1 19 . 1 1 35 35 LYS CB C 35 35.900 35.900 36.517 -0.617 19947
6432 1 19 . 1 1 35 35 LYS H H 35 7.450 7.450 7.660 -0.210 19947
6433 1 19 . 1 1 36 36 LEU N N 36 119.300 119.300 120.523 -1.223 19947
6434 1 19 . 1 1 36 36 LEU HA H 36 4.800 4.800 4.352 0.448 19947
6435 1 19 . 1 1 36 36 LEU CB C 36 42.400 42.400 42.392 0.008 19947
6436 1 19 . 1 1 36 36 LEU H H 36 8.290 8.290 8.455 -0.165 19947
6437 1 19 . 1 1 37 37 THR HA H 37 4.340 4.340 4.641 -0.301 19947
6438 1 19 . 1 1 37 37 THR CA C 37 60.200 60.200 59.422 0.778 19947
6439 1 19 . 1 1 37 37 THR CB C 37 67.700 67.700 68.782 -1.082 19947
6440 1 19 . 1 1 37 37 THR H H 37 8.380 8.380 8.087 0.293 19947
6441 1 19 . 1 1 38 38 PRO HA H 38 4.380 4.380 4.151 0.229 19947
6442 1 19 . 1 1 38 38 PRO CA C 38 64.800 64.800 64.085 0.715 19947
6443 1 19 . 1 1 38 38 PRO CB C 38 31.500 31.500 31.699 -0.199 19947
6444 1 19 . 1 1 39 39 GLY N N 39 113.300 113.300 111.624 1.676 19947
6445 1 19 . 1 1 39 39 GLY CA C 39 45.100 45.100 45.036 0.064 19947
6446 1 19 . 1 1 39 39 GLY H H 39 8.830 8.830 8.430 0.400 19947
6447 1 19 . 1 1 40 40 SER N N 40 116.700 116.700 118.723 -2.023 19947
6448 1 19 . 1 1 40 40 SER HA H 40 4.610 4.610 4.700 -0.090 19947
6449 1 19 . 1 1 40 40 SER CA C 40 58.800 58.800 58.237 0.563 19947
6450 1 19 . 1 1 40 40 SER CB C 40 63.800 63.800 63.588 0.212 19947
6451 1 19 . 1 1 40 40 SER H H 40 8.280 8.280 7.663 0.617 19947
6452 1 19 . 1 1 41 41 GLN N N 41 120.600 120.600 125.474 -4.874 19947
6453 1 19 . 1 1 41 41 GLN HA H 41 4.110 4.110 3.975 0.135 19947
6454 1 19 . 1 1 41 41 GLN CA C 41 55.200 55.200 57.309 -2.110 19947
6455 1 19 . 1 1 41 41 GLN CB C 41 31.100 31.100 28.967 2.133 19947
6456 1 19 . 1 1 41 41 GLN H H 41 9.190 9.190 8.029 1.161 19947
6457 1 19 . 1 1 42 42 CYS N N 42 113.200 113.200 114.832 -1.632 19947
6458 1 19 . 1 1 42 42 CYS HA H 42 4.630 4.630 4.782 -0.152 19947
6459 1 19 . 1 1 42 42 CYS CA C 42 53.700 53.700 58.151 -4.451 19947
6460 1 19 . 1 1 42 42 CYS CB C 42 45.500 45.500 29.597 15.903 19947
6461 1 19 . 1 1 42 42 CYS H H 42 7.710 7.710 7.322 0.388 19947
6462 1 19 . 1 1 43 43 ASN N N 43 114.200 114.200 120.337 -6.137 19947
6463 1 19 . 1 1 43 43 ASN HA H 43 4.940 4.940 4.724 0.216 19947
6464 1 19 . 1 1 43 43 ASN CA C 43 53.000 53.000 53.657 -0.657 19947
6465 1 19 . 1 1 43 43 ASN CB C 43 39.300 39.300 40.733 -1.433 19947
6466 1 19 . 1 1 43 43 ASN H H 43 8.870 8.870 8.565 0.305 19947
6467 1 19 . 1 1 44 44 TYR N N 44 118.400 118.400 117.450 0.950 19947
6468 1 19 . 1 1 44 44 TYR HA H 44 4.850 4.850 4.785 0.065 19947
6469 1 19 . 1 1 44 44 TYR CA C 44 55.300 55.300 57.287 -1.987 19947
6470 1 19 . 1 1 44 44 TYR CB C 44 40.700 40.700 40.744 -0.044 19947
6471 1 19 . 1 1 44 44 TYR H H 44 7.840 7.840 7.324 0.516 19947
6472 1 19 . 1 1 45 45 GLY N N 45 110.600 110.600 112.684 -2.084 19947
6473 1 19 . 1 1 45 45 GLY CA C 45 44.000 44.000 44.959 -0.959 19947
6474 1 19 . 1 1 45 45 GLY H H 45 7.960 7.960 7.958 0.002 19947
6475 1 19 . 1 1 46 46 GLU N N 46 120.700 120.700 119.342 1.358 19947
6476 1 19 . 1 1 46 46 GLU HA H 46 4.280 4.280 4.093 0.187 19947
6477 1 19 . 1 1 46 46 GLU CA C 46 58.500 58.500 59.452 -0.952 19947
6478 1 19 . 1 1 46 46 GLU CB C 46 29.300 29.300 30.018 -0.718 19947
6479 1 19 . 1 1 46 46 GLU H H 46 9.160 9.160 8.647 0.513 19947
6480 1 19 . 1 1 47 47 CYS N N 47 112.400 112.400 117.482 -5.082 19947
6481 1 19 . 1 1 47 47 CYS HA H 47 4.850 4.850 4.894 -0.044 19947
6482 1 19 . 1 1 47 47 CYS CA C 47 57.100 57.100 57.626 -0.526 19947
6483 1 19 . 1 1 47 47 CYS CB C 47 41.200 41.200 26.375 14.825 19947
6484 1 19 . 1 1 47 47 CYS H H 47 8.510 8.510 7.419 1.091 19947
6485 1 19 . 1 1 48 48 CYS N N 48 123.200 123.200 120.651 2.549 19947
6486 1 19 . 1 1 48 48 CYS HA H 48 5.160 5.160 5.343 -0.183 19947
6487 1 19 . 1 1 48 48 CYS CA C 48 54.700 54.700 58.193 -3.493 19947
6488 1 19 . 1 1 48 48 CYS CB C 48 45.700 45.700 28.782 16.918 19947
6489 1 19 . 1 1 48 48 CYS H H 48 7.810 7.810 7.909 -0.099 19947
6490 1 19 . 1 1 49 49 ASP N N 49 127.400 127.400 124.403 2.997 19947
6491 1 19 . 1 1 49 49 ASP HA H 49 4.890 4.890 4.980 -0.090 19947
6492 1 19 . 1 1 49 49 ASP CA C 49 53.500 53.500 53.390 0.110 19947
6493 1 19 . 1 1 49 49 ASP CB C 49 42.400 42.400 44.075 -1.675 19947
6494 1 19 . 1 1 49 49 ASP H H 49 9.670 9.670 8.828 0.842 19947
6495 1 19 . 1 1 50 50 GLN N N 50 127.000 127.000 121.411 5.589 19947
6496 1 19 . 1 1 50 50 GLN HA H 50 3.940 3.940 3.895 0.045 19947
6497 1 19 . 1 1 50 50 GLN CA C 50 56.800 56.800 59.308 -2.508 19947
6498 1 19 . 1 1 50 50 GLN CB C 50 26.500 26.500 28.182 -1.682 19947
6499 1 19 . 1 1 50 50 GLN H H 50 9.450 9.450 8.945 0.505 19947
6500 1 19 . 1 1 51 51 CYS N N 51 106.100 106.100 117.250 -11.150 19947
6501 1 19 . 1 1 51 51 CYS HA H 51 4.760 4.760 4.894 -0.134 19947
6502 1 19 . 1 1 51 51 CYS CB C 51 43.200 43.200 28.377 14.823 19947
6503 1 19 . 1 1 51 51 CYS H H 51 8.700 8.700 8.271 0.429 19947
6504 1 19 . 1 1 52 52 ARG N N 52 121.000 121.000 118.568 2.432 19947
6505 1 19 . 1 1 52 52 ARG HA H 52 4.690 4.690 4.540 0.150 19947
6506 1 19 . 1 1 52 52 ARG CA C 52 55.400 55.400 54.230 1.170 19947
6507 1 19 . 1 1 52 52 ARG CB C 52 33.100 33.100 34.608 -1.508 19947
6508 1 19 . 1 1 52 52 ARG H H 52 7.960 7.960 8.178 -0.218 19947
6509 1 19 . 1 1 53 53 PHE N N 53 120.300 120.300 119.759 0.541 19947
6510 1 19 . 1 1 53 53 PHE HA H 53 5.050 5.050 5.371 -0.321 19947
6511 1 19 . 1 1 53 53 PHE CA C 53 56.100 56.100 55.966 0.134 19947
6512 1 19 . 1 1 53 53 PHE CB C 53 38.200 38.200 39.291 -1.091 19947
6513 1 19 . 1 1 53 53 PHE H H 53 8.400 8.400 8.377 0.023 19947
6514 1 19 . 1 1 54 54 LYS N N 54 123.300 123.300 126.322 -3.022 19947
6515 1 19 . 1 1 54 54 LYS HA H 54 4.250 4.250 4.200 0.050 19947
6516 1 19 . 1 1 54 54 LYS CA C 54 57.500 57.500 56.663 0.837 19947
6517 1 19 . 1 1 54 54 LYS CB C 54 34.300 34.300 31.905 2.395 19947
6518 1 19 . 1 1 54 54 LYS H H 54 8.540 8.540 9.020 -0.480 19947
6519 1 19 . 1 1 55 55 LYS N N 55 119.400 119.400 123.103 -3.703 19947
6520 1 19 . 1 1 55 55 LYS HA H 55 4.110 4.110 4.054 0.056 19947
6521 1 19 . 1 1 55 55 LYS CA C 55 56.500 56.500 57.049 -0.549 19947
6522 1 19 . 1 1 55 55 LYS CB C 55 33.400 33.400 32.616 0.784 19947
6523 1 19 . 1 1 55 55 LYS H H 55 8.440 8.440 7.954 0.486 19947
6524 1 19 . 1 1 56 56 ALA N N 56 126.700 126.700 125.573 1.127 19947
6525 1 19 . 1 1 56 56 ALA HA H 56 3.920 3.920 4.088 -0.168 19947
6526 1 19 . 1 1 56 56 ALA CA C 56 52.900 52.900 53.694 -0.794 19947
6527 1 19 . 1 1 56 56 ALA CB C 56 18.100 18.100 18.405 -0.305 19947
6528 1 19 . 1 1 56 56 ALA H H 56 8.930 8.930 8.385 0.545 19947
6529 1 19 . 1 1 57 57 GLY N N 57 109.300 109.300 110.696 -1.396 19947
6530 1 19 . 1 1 57 57 GLY CA C 57 45.100 45.100 44.922 0.177 19947
6531 1 19 . 1 1 57 57 GLY H H 57 8.460 8.460 8.419 0.041 19947
6532 1 19 . 1 1 58 58 THR N N 58 117.200 117.200 120.001 -2.801 19947
6533 1 19 . 1 1 58 58 THR HA H 58 4.260 4.260 4.467 -0.207 19947
6534 1 19 . 1 1 58 58 THR CA C 58 63.300 63.300 62.959 0.341 19947
6535 1 19 . 1 1 58 58 THR CB C 58 69.600 69.600 68.824 0.776 19947
6536 1 19 . 1 1 58 58 THR H H 58 7.660 7.660 7.805 -0.145 19947
6537 1 19 . 1 1 59 59 VAL N N 59 130.400 130.400 127.389 3.011 19947
6538 1 19 . 1 1 59 59 VAL HA H 59 3.900 3.900 4.114 -0.214 19947
6539 1 19 . 1 1 59 59 VAL CA C 59 64.400 64.400 62.603 1.797 19947
6540 1 19 . 1 1 59 59 VAL CB C 59 31.900 31.900 32.186 -0.286 19947
6541 1 19 . 1 1 59 59 VAL H H 59 9.190 9.190 8.804 0.386 19947
6542 1 19 . 1 1 60 60 CYS N N 60 121.800 121.800 126.451 -4.651 19947
6543 1 19 . 1 1 60 60 CYS HA H 60 5.050 5.050 4.672 0.378 19947
6544 1 19 . 1 1 60 60 CYS CA C 60 54.400 54.400 57.992 -3.592 19947
6545 1 19 . 1 1 60 60 CYS CB C 60 43.000 43.000 27.489 15.511 19947
6546 1 19 . 1 1 60 60 CYS H H 60 9.130 9.130 8.280 0.850 19947
6547 1 19 . 1 1 61 61 ARG N N 61 124.100 124.100 118.712 5.388 19947
6548 1 19 . 1 1 61 61 ARG HA H 61 4.360 4.360 4.614 -0.254 19947
6549 1 19 . 1 1 61 61 ARG CA C 61 56.800 56.800 55.519 1.281 19947
6550 1 19 . 1 1 61 61 ARG CB C 61 32.800 32.800 34.681 -1.881 19947
6551 1 19 . 1 1 61 61 ARG H H 61 7.580 7.580 7.407 0.173 19947
6552 1 19 . 1 1 62 62 ILE N N 62 126.200 126.200 116.551 9.649 19947
6553 1 19 . 1 1 62 62 ILE HA H 62 4.090 4.090 4.449 -0.359 19947
6554 1 19 . 1 1 62 62 ILE CA C 62 60.300 60.300 61.417 -1.117 19947
6555 1 19 . 1 1 62 62 ILE CB C 62 38.700 38.700 40.745 -2.045 19947
6556 1 19 . 1 1 62 62 ILE H H 62 8.490 8.490 8.425 0.065 19947
6557 1 19 . 1 1 63 63 ALA N N 63 129.400 129.400 131.255 -1.855 19947
6558 1 19 . 1 1 63 63 ALA HA H 63 4.310 4.310 4.473 -0.163 19947
6559 1 19 . 1 1 63 63 ALA CA C 63 51.900 51.900 54.034 -2.134 19947
6560 1 19 . 1 1 63 63 ALA CB C 63 20.600 20.600 19.485 1.115 19947
6561 1 19 . 1 1 63 63 ALA H H 63 8.100 8.100 8.799 -0.699 19947
6562 1 19 . 1 1 64 64 ARG N N 64 120.500 120.500 120.710 -0.210 19947
6563 1 19 . 1 1 64 64 ARG HA H 64 4.290 4.290 4.512 -0.222 19947
6564 1 19 . 1 1 64 64 ARG CA C 64 56.200 56.200 56.150 0.050 19947
6565 1 19 . 1 1 64 64 ARG CB C 64 30.500 30.500 30.891 -0.391 19947
6566 1 19 . 1 1 64 64 ARG H H 64 8.140 8.140 8.931 -0.791 19947
6567 1 19 . 1 1 65 65 GLY N N 65 110.500 110.500 111.203 -0.703 19947
6568 1 19 . 1 1 65 65 GLY CA C 65 45.100 45.100 44.487 0.613 19947
6569 1 19 . 1 1 65 65 GLY H H 65 8.040 8.040 8.335 -0.295 19947
6570 1 19 . 1 1 66 66 ASP N N 66 120.700 120.700 119.396 1.304 19947
6571 1 19 . 1 1 66 66 ASP HA H 66 4.610 4.610 4.486 0.124 19947
6572 1 19 . 1 1 66 66 ASP CA C 66 53.300 53.300 54.131 -0.831 19947
6573 1 19 . 1 1 66 66 ASP CB C 66 37.600 37.600 40.936 -3.336 19947
6574 1 19 . 1 1 66 66 ASP H H 66 8.380 8.380 7.304 1.076 19947
6575 1 19 . 1 1 67 67 TRP N N 67 120.100 120.100 123.109 -3.009 19947
6576 1 19 . 1 1 67 67 TRP HA H 67 4.760 4.760 4.955 -0.195 19947
6577 1 19 . 1 1 67 67 TRP CA C 67 57.200 57.200 57.762 -0.562 19947
6578 1 19 . 1 1 67 67 TRP CB C 67 29.100 29.100 29.204 -0.104 19947
6579 1 19 . 1 1 67 67 TRP H H 67 7.950 7.950 7.783 0.167 19947
6580 1 19 . 1 1 68 68 ASN N N 68 118.400 118.400 118.874 -0.474 19947
6581 1 19 . 1 1 68 68 ASN HA H 68 4.790 4.790 4.722 0.068 19947
6582 1 19 . 1 1 68 68 ASN CA C 68 52.800 52.800 53.500 -0.700 19947
6583 1 19 . 1 1 68 68 ASN CB C 68 39.300 39.300 39.278 0.022 19947
6584 1 19 . 1 1 68 68 ASN H H 68 8.180 8.180 8.312 -0.132 19947
6585 1 19 . 1 1 69 69 ASP N N 69 118.500 118.500 118.778 -0.278 19947
6586 1 19 . 1 1 69 69 ASP HA H 69 4.620 4.620 4.428 0.192 19947
6587 1 19 . 1 1 69 69 ASP CA C 69 53.200 53.200 55.936 -2.736 19947
6588 1 19 . 1 1 69 69 ASP CB C 69 38.000 38.000 41.441 -3.441 19947
6589 1 19 . 1 1 69 69 ASP H H 69 8.130 8.130 8.226 -0.096 19947
6590 1 19 . 1 1 70 70 ASP N N 70 120.500 120.500 121.266 -0.766 19947
6591 1 19 . 1 1 70 70 ASP HA H 70 5.100 5.100 5.348 -0.248 19947
6592 1 19 . 1 1 70 70 ASP CA C 70 52.500 52.500 52.965 -0.465 19947
6593 1 19 . 1 1 70 70 ASP CB C 70 42.600 42.600 42.666 -0.066 19947
6594 1 19 . 1 1 70 70 ASP H H 70 8.140 8.140 8.030 0.110 19947
6595 1 19 . 1 1 71 71 TYR N N 71 118.900 118.900 123.759 -4.859 19947
6596 1 19 . 1 1 71 71 TYR HA H 71 5.210 5.210 5.092 0.118 19947
6597 1 19 . 1 1 71 71 TYR CA C 71 56.300 56.300 57.105 -0.805 19947
6598 1 19 . 1 1 71 71 TYR CB C 71 42.200 42.200 42.784 -0.584 19947
6599 1 19 . 1 1 71 71 TYR H H 71 8.450 8.450 8.432 0.018 19947
6600 1 19 . 1 1 72 72 CYS N N 72 119.800 119.800 121.058 -1.258 19947
6601 1 19 . 1 1 72 72 CYS HA H 72 4.900 4.900 4.529 0.371 19947
6602 1 19 . 1 1 72 72 CYS CA C 72 53.400 53.400 60.435 -7.035 19947
6603 1 19 . 1 1 72 72 CYS CB C 72 37.200 37.200 28.498 8.702 19947
6604 1 19 . 1 1 72 72 CYS H H 72 9.330 9.330 8.818 0.512 19947
6605 1 19 . 1 1 73 73 THR N N 73 112.700 112.700 112.494 0.206 19947
6606 1 19 . 1 1 73 73 THR HA H 73 4.430 4.430 4.426 0.004 19947
6607 1 19 . 1 1 73 73 THR CA C 73 62.300 62.300 61.439 0.861 19947
6608 1 19 . 1 1 73 73 THR CB C 73 71.300 71.300 69.892 1.408 19947
6609 1 19 . 1 1 73 73 THR H H 73 9.980 9.980 8.712 1.268 19947
6610 1 19 . 1 1 74 74 GLY N N 74 111.500 111.500 110.627 0.873 19947
6611 1 19 . 1 1 74 74 GLY CA C 74 45.300 45.300 46.487 -1.187 19947
6612 1 19 . 1 1 74 74 GLY H H 74 8.580 8.580 8.172 0.408 19947
6613 1 19 . 1 1 75 75 LYS N N 75 115.900 115.900 116.674 -0.774 19947
6614 1 19 . 1 1 75 75 LYS HA H 75 4.140 4.140 4.651 -0.511 19947
6615 1 19 . 1 1 75 75 LYS CA C 75 54.800 54.800 55.715 -0.915 19947
6616 1 19 . 1 1 75 75 LYS CB C 75 34.200 34.200 34.271 -0.071 19947
6617 1 19 . 1 1 75 75 LYS H H 75 7.900 7.900 7.558 0.342 19947
6618 1 19 . 1 1 76 76 SER N N 76 111.000 111.000 112.442 -1.442 19947
6619 1 19 . 1 1 76 76 SER HA H 76 4.160 4.160 3.880 0.280 19947
6620 1 19 . 1 1 76 76 SER CA C 76 61.400 61.400 56.728 4.672 19947
6621 1 19 . 1 1 76 76 SER CB C 76 64.300 64.300 64.112 0.188 19947
6622 1 19 . 1 1 76 76 SER H H 76 6.520 6.520 6.765 -0.245 19947
6623 1 19 . 1 1 77 77 SER N N 77 117.100 117.100 114.143 2.957 19947
6624 1 19 . 1 1 77 77 SER HA H 77 4.220 4.220 4.380 -0.160 19947
6625 1 19 . 1 1 77 77 SER CA C 77 59.800 59.800 58.686 1.114 19947
6626 1 19 . 1 1 77 77 SER CB C 77 64.400 64.400 63.731 0.669 19947
6627 1 19 . 1 1 77 77 SER H H 77 9.030 9.030 8.316 0.714 19947
6628 1 19 . 1 1 78 78 ASP N N 78 122.100 122.100 121.387 0.713 19947
6629 1 19 . 1 1 78 78 ASP HA H 78 4.930 4.930 4.765 0.165 19947
6630 1 19 . 1 1 78 78 ASP CA C 78 52.400 52.400 53.836 -1.435 19947
6631 1 19 . 1 1 78 78 ASP CB C 78 40.800 40.800 44.332 -3.532 19947
6632 1 19 . 1 1 78 78 ASP H H 78 8.340 8.340 7.648 0.692 19947
6633 1 19 . 1 1 79 79 CYS N N 79 122.200 122.200 121.642 0.558 19947
6634 1 19 . 1 1 79 79 CYS HA H 79 5.320 5.320 4.855 0.465 19947
6635 1 19 . 1 1 79 79 CYS CA C 79 52.000 52.000 55.644 -3.644 19947
6636 1 19 . 1 1 79 79 CYS CB C 79 39.300 39.300 28.362 10.938 19947
6637 1 19 . 1 1 79 79 CYS H H 79 8.960 8.960 8.634 0.326 19947
6638 1 19 . 1 1 80 80 PRO HA H 80 4.410 4.410 4.667 -0.257 19947
6639 1 19 . 1 1 80 80 PRO CA C 80 63.500 63.500 63.109 0.391 19947
6640 1 19 . 1 1 80 80 PRO CB C 80 32.400 32.400 32.298 0.102 19947
6641 1 19 . 1 1 81 81 TRP N N 81 120.500 120.500 121.649 -1.149 19947
6642 1 19 . 1 1 81 81 TRP HA H 81 4.550 4.550 4.816 -0.266 19947
6643 1 19 . 1 1 81 81 TRP CA C 81 56.400 56.400 54.094 2.306 19947
6644 1 19 . 1 1 81 81 TRP CB C 81 29.500 29.500 28.994 0.506 19947
6645 1 19 . 1 1 81 81 TRP H H 81 8.400 8.400 8.612 -0.212 19947
6646 1 19 . 1 1 82 82 ASN N N 82 120.400 120.400 118.367 2.033 19947
6647 1 19 . 1 1 82 82 ASN HA H 82 4.750 4.750 4.353 0.397 19947
6648 1 19 . 1 1 82 82 ASN CA C 82 53.100 53.100 54.343 -1.242 19947
6649 1 19 . 1 1 82 82 ASN CB C 82 39.000 39.000 37.447 1.553 19947
6650 1 19 . 1 1 82 82 ASN H H 82 8.040 8.040 8.368 -0.328 19947
6651 1 20 . 1 1 2 2 PRO HA H 2 4.820 4.820 4.516 0.304 19947
6652 1 20 . 1 1 2 2 PRO CA C 2 61.900 61.900 62.211 -0.311 19947
6653 1 20 . 1 1 2 2 PRO CB C 2 30.700 30.700 31.830 -1.130 19947
6654 1 20 . 1 1 3 3 PRO HA H 3 4.540 4.540 4.354 0.186 19947
6655 1 20 . 1 1 3 3 PRO CA C 3 62.900 62.900 62.965 -0.064 19947
6656 1 20 . 1 1 3 3 PRO CB C 3 32.100 32.100 32.461 -0.361 19947
6657 1 20 . 1 1 4 4 VAL N N 4 121.900 121.900 123.612 -1.712 19947
6658 1 20 . 1 1 4 4 VAL HA H 4 4.200 4.200 4.396 -0.196 19947
6659 1 20 . 1 1 4 4 VAL CA C 4 62.300 62.300 61.166 1.134 19947
6660 1 20 . 1 1 4 4 VAL CB C 4 32.800 32.800 33.782 -0.982 19947
6661 1 20 . 1 1 4 4 VAL H H 4 8.330 8.330 8.046 0.284 19947
6662 1 20 . 1 1 5 5 CYS N N 5 120.900 120.900 126.837 -5.937 19947
6663 1 20 . 1 1 5 5 CYS HA H 5 4.700 4.700 4.762 -0.062 19947
6664 1 20 . 1 1 5 5 CYS CA C 5 53.600 53.600 57.188 -3.588 19947
6665 1 20 . 1 1 5 5 CYS H H 5 8.500 8.500 8.697 -0.197 19947
6666 1 20 . 1 1 6 6 GLY N N 6 110.200 110.200 115.245 -5.045 19947
6667 1 20 . 1 1 6 6 GLY CA C 6 46.300 46.300 44.812 1.488 19947
6668 1 20 . 1 1 6 6 GLY H H 6 8.490 8.490 8.274 0.216 19947
6669 1 20 . 1 1 7 7 ASN N N 7 120.100 120.100 117.321 2.779 19947
6670 1 20 . 1 1 7 7 ASN HA H 7 4.730 4.730 4.341 0.389 19947
6671 1 20 . 1 1 7 7 ASN CA C 7 53.200 53.200 53.984 -0.784 19947
6672 1 20 . 1 1 7 7 ASN CB C 7 38.700 38.700 38.913 -0.213 19947
6673 1 20 . 1 1 7 7 ASN H H 7 8.320 8.320 8.245 0.075 19947
6674 1 20 . 1 1 8 8 LYS N N 8 121.300 121.300 125.500 -4.200 19947
6675 1 20 . 1 1 8 8 LYS HA H 8 4.340 4.340 4.163 0.177 19947
6676 1 20 . 1 1 8 8 LYS CA C 8 56.600 56.600 57.173 -0.574 19947
6677 1 20 . 1 1 8 8 LYS CB C 8 32.900 32.900 31.633 1.267 19947
6678 1 20 . 1 1 8 8 LYS H H 8 8.260 8.260 8.376 -0.116 19947
6679 1 20 . 1 1 9 9 ILE N N 9 136.600 136.600 122.583 14.017 19947
6680 1 20 . 1 1 9 9 ILE HA H 9 4.140 4.140 3.891 0.249 19947
6681 1 20 . 1 1 9 9 ILE CA C 9 61.300 61.300 62.430 -1.130 19947
6682 1 20 . 1 1 9 9 ILE CB C 9 38.200 38.200 37.814 0.386 19947
6683 1 20 . 1 1 9 9 ILE H H 9 8.150 8.150 8.164 -0.014 19947
6684 1 20 . 1 1 10 10 LEU N N 10 125.700 125.700 122.308 3.392 19947
6685 1 20 . 1 1 10 10 LEU HA H 10 4.420 4.420 4.425 -0.005 19947
6686 1 20 . 1 1 10 10 LEU CA C 10 55.200 55.200 55.914 -0.714 19947
6687 1 20 . 1 1 10 10 LEU CB C 10 42.300 42.300 40.371 1.929 19947
6688 1 20 . 1 1 10 10 LEU H H 10 8.230 8.230 8.422 -0.192 19947
6689 1 20 . 1 1 11 11 GLU N N 11 120.600 120.600 113.384 7.216 19947
6690 1 20 . 1 1 11 11 GLU HA H 11 4.470 4.470 4.119 0.351 19947
6691 1 20 . 1 1 11 11 GLU CA C 11 55.500 55.500 56.756 -1.256 19947
6692 1 20 . 1 1 11 11 GLU CB C 11 28.900 28.900 28.172 0.728 19947
6693 1 20 . 1 1 11 11 GLU H H 11 8.250 8.250 7.906 0.344 19947
6694 1 20 . 1 1 12 12 GLN N N 12 121.600 121.600 119.697 1.903 19947
6695 1 20 . 1 1 12 12 GLN HA H 12 4.350 4.350 4.427 -0.077 19947
6696 1 20 . 1 1 12 12 GLN CA C 12 56.600 56.600 55.755 0.845 19947
6697 1 20 . 1 1 12 12 GLN CB C 12 29.200 29.200 29.469 -0.269 19947
6698 1 20 . 1 1 12 12 GLN H H 12 8.460 8.460 7.660 0.800 19947
6699 1 20 . 1 1 13 13 GLY N N 13 110.700 110.700 107.186 3.514 19947
6700 1 20 . 1 1 13 13 GLY CA C 13 45.700 45.700 45.781 -0.081 19947
6701 1 20 . 1 1 13 13 GLY H H 13 8.660 8.660 8.549 0.111 19947
6702 1 20 . 1 1 14 14 GLU N N 14 118.900 118.900 114.160 4.740 19947
6703 1 20 . 1 1 14 14 GLU HA H 14 4.530 4.530 4.168 0.362 19947
6704 1 20 . 1 1 14 14 GLU CA C 14 55.600 55.600 56.841 -1.241 19947
6705 1 20 . 1 1 14 14 GLU CB C 14 29.700 29.700 29.664 0.036 19947
6706 1 20 . 1 1 14 14 GLU H H 14 8.230 8.230 8.106 0.124 19947
6707 1 20 . 1 1 15 15 ASP N N 15 118.400 118.400 120.162 -1.762 19947
6708 1 20 . 1 1 15 15 ASP HA H 15 4.990 4.990 4.508 0.482 19947
6709 1 20 . 1 1 15 15 ASP CA C 15 53.500 53.500 57.060 -3.560 19947
6710 1 20 . 1 1 15 15 ASP CB C 15 39.700 39.700 41.483 -1.783 19947
6711 1 20 . 1 1 15 15 ASP H H 15 8.330 8.330 8.485 -0.155 19947
6712 1 20 . 1 1 16 16 CYS HA H 16 4.340 4.340 4.481 -0.141 19947
6713 1 20 . 1 1 16 16 CYS H H 16 8.510 8.510 8.156 0.354 19947
6714 1 20 . 1 1 17 17 ASP N N 17 116.700 116.700 123.577 -6.877 19947
6715 1 20 . 1 1 17 17 ASP HA H 17 4.740 4.740 4.272 0.468 19947
6716 1 20 . 1 1 17 17 ASP CA C 17 53.100 53.100 55.426 -2.326 19947
6717 1 20 . 1 1 17 17 ASP CB C 17 38.600 38.600 39.433 -0.833 19947
6718 1 20 . 1 1 17 17 ASP H H 17 8.180 8.180 8.773 -0.593 19947
6719 1 20 . 1 1 18 18 CYS HA H 18 4.730 4.730 4.030 0.700 19947
6720 1 20 . 1 1 18 18 CYS CB C 18 41.900 41.900 26.670 15.230 19947
6721 1 20 . 1 1 19 19 GLY H H 19 8.220 8.220 8.275 -0.055 19947
6722 1 20 . 1 1 20 20 SER HA H 20 4.920 4.920 4.428 0.492 19947
6723 1 20 . 1 1 20 20 SER CA C 20 55.700 55.700 57.999 -2.299 19947
6724 1 20 . 1 1 20 20 SER CB C 20 63.500 63.500 63.138 0.362 19947
6725 1 20 . 1 1 20 20 SER H H 20 7.830 7.830 8.215 -0.385 19947
6726 1 20 . 1 1 21 21 PRO HA H 21 4.240 4.240 4.222 0.018 19947
6727 1 20 . 1 1 21 21 PRO CA C 21 63.400 63.400 65.286 -1.886 19947
6728 1 20 . 1 1 21 21 PRO CB C 21 31.800 31.800 31.522 0.278 19947
6729 1 20 . 1 1 22 22 ALA N N 22 119.900 119.900 119.515 0.385 19947
6730 1 20 . 1 1 22 22 ALA HA H 22 4.220 4.220 4.074 0.146 19947
6731 1 20 . 1 1 22 22 ALA CA C 22 54.200 54.200 54.216 -0.016 19947
6732 1 20 . 1 1 22 22 ALA CB C 22 18.500 18.500 18.295 0.205 19947
6733 1 20 . 1 1 22 22 ALA H H 22 8.180 8.180 8.477 -0.297 19947
6734 1 20 . 1 1 23 23 ASN N N 23 116.300 116.300 112.900 3.400 19947
6735 1 20 . 1 1 23 23 ASN HA H 23 4.670 4.670 4.982 -0.312 19947
6736 1 20 . 1 1 23 23 ASN CA C 23 53.200 53.200 52.148 1.052 19947
6737 1 20 . 1 1 23 23 ASN CB C 23 39.300 39.300 40.667 -1.367 19947
6738 1 20 . 1 1 23 23 ASN H H 23 7.960 7.960 7.946 0.014 19947
6739 1 20 . 1 1 24 24 CYS HA H 24 4.720 4.720 4.425 0.295 19947
6740 1 20 . 1 1 24 24 CYS H H 24 8.510 8.510 8.236 0.274 19947
6741 1 20 . 1 1 25 25 GLN HA H 25 4.460 4.460 3.911 0.549 19947
6742 1 20 . 1 1 25 25 GLN H H 25 8.320 8.320 8.571 -0.251 19947
6743 1 20 . 1 1 26 26 ASP HA H 26 4.740 4.740 4.684 0.056 19947
6744 1 20 . 1 1 26 26 ASP H H 26 8.580 8.580 8.548 0.032 19947
6745 1 20 . 1 1 27 27 ARG HA H 27 4.680 4.680 4.406 0.274 19947
6746 1 20 . 1 1 27 27 ARG CA C 27 54.700 54.700 57.699 -2.998 19947
6747 1 20 . 1 1 27 27 ARG H H 27 8.550 8.550 8.689 -0.139 19947
6748 1 20 . 1 1 28 28 CYS HA H 28 4.120 4.120 4.854 -0.734 19947
6749 1 20 . 1 1 28 28 CYS CA C 28 54.400 54.400 57.729 -3.329 19947
6750 1 20 . 1 1 28 28 CYS CB C 28 19.000 19.000 27.166 -8.166 19947
6751 1 20 . 1 1 28 28 CYS H H 28 8.910 8.910 8.316 0.594 19947
6752 1 20 . 1 1 29 29 CYS N N 29 113.300 113.300 121.248 -7.948 19947
6753 1 20 . 1 1 29 29 CYS HA H 29 5.010 5.010 4.629 0.381 19947
6754 1 20 . 1 1 29 29 CYS CA C 29 54.300 54.300 58.340 -4.040 19947
6755 1 20 . 1 1 29 29 CYS H H 29 7.730 7.730 8.059 -0.329 19947
6756 1 20 . 1 1 30 30 ASN HA H 30 4.730 4.730 5.041 -0.311 19947
6757 1 20 . 1 1 30 30 ASN CB C 30 38.700 38.700 40.155 -1.455 19947
6758 1 20 . 1 1 30 30 ASN H H 30 8.870 8.870 8.943 -0.073 19947
6759 1 20 . 1 1 31 31 ALA N N 31 129.400 129.400 126.671 2.729 19947
6760 1 20 . 1 1 31 31 ALA HA H 31 4.120 4.120 4.329 -0.209 19947
6761 1 20 . 1 1 31 31 ALA CA C 31 54.400 54.400 54.587 -0.187 19947
6762 1 20 . 1 1 31 31 ALA CB C 31 19.000 19.000 19.139 -0.139 19947
6763 1 20 . 1 1 31 31 ALA H H 31 8.890 8.890 8.608 0.282 19947
6764 1 20 . 1 1 32 32 ALA N N 32 116.400 116.400 118.080 -1.680 19947
6765 1 20 . 1 1 32 32 ALA HA H 32 4.340 4.340 4.294 0.046 19947
6766 1 20 . 1 1 32 32 ALA CA C 32 53.800 53.800 53.278 0.522 19947
6767 1 20 . 1 1 32 32 ALA CB C 32 19.100 19.100 18.864 0.236 19947
6768 1 20 . 1 1 32 32 ALA H H 32 8.250 8.250 8.359 -0.109 19947
6769 1 20 . 1 1 33 33 THR N N 33 104.300 104.300 109.564 -5.264 19947
6770 1 20 . 1 1 33 33 THR HA H 33 4.430 4.430 4.422 0.008 19947
6771 1 20 . 1 1 33 33 THR CA C 33 60.500 60.500 60.589 -0.089 19947
6772 1 20 . 1 1 33 33 THR CB C 33 70.600 70.600 69.962 0.638 19947
6773 1 20 . 1 1 33 33 THR H H 33 7.320 7.320 7.390 -0.070 19947
6774 1 20 . 1 1 34 34 CYS N N 34 123.400 123.400 121.010 2.390 19947
6775 1 20 . 1 1 34 34 CYS HA H 34 4.170 4.170 4.269 -0.099 19947
6776 1 20 . 1 1 34 34 CYS CA C 34 56.500 56.500 60.002 -3.502 19947
6777 1 20 . 1 1 34 34 CYS H H 34 8.710 8.710 8.185 0.525 19947
6778 1 20 . 1 1 35 35 LYS N N 35 116.900 116.900 117.242 -0.342 19947
6779 1 20 . 1 1 35 35 LYS HA H 35 4.960 4.960 4.886 0.074 19947
6780 1 20 . 1 1 35 35 LYS CA C 35 53.900 53.900 55.494 -1.594 19947
6781 1 20 . 1 1 35 35 LYS CB C 35 35.900 35.900 35.835 0.065 19947
6782 1 20 . 1 1 35 35 LYS H H 35 7.450 7.450 7.714 -0.264 19947
6783 1 20 . 1 1 36 36 LEU N N 36 119.300 119.300 118.254 1.046 19947
6784 1 20 . 1 1 36 36 LEU HA H 36 4.800 4.800 4.891 -0.091 19947
6785 1 20 . 1 1 36 36 LEU CB C 36 42.400 42.400 43.011 -0.611 19947
6786 1 20 . 1 1 36 36 LEU H H 36 8.290 8.290 8.454 -0.164 19947
6787 1 20 . 1 1 37 37 THR HA H 37 4.340 4.340 4.777 -0.437 19947
6788 1 20 . 1 1 37 37 THR CA C 37 60.200 60.200 59.290 0.910 19947
6789 1 20 . 1 1 37 37 THR CB C 37 67.700 67.700 68.607 -0.907 19947
6790 1 20 . 1 1 37 37 THR H H 37 8.380 8.380 8.040 0.340 19947
6791 1 20 . 1 1 38 38 PRO HA H 38 4.380 4.380 4.108 0.272 19947
6792 1 20 . 1 1 38 38 PRO CA C 38 64.800 64.800 64.271 0.529 19947
6793 1 20 . 1 1 38 38 PRO CB C 38 31.500 31.500 31.702 -0.202 19947
6794 1 20 . 1 1 39 39 GLY N N 39 113.300 113.300 110.631 2.669 19947
6795 1 20 . 1 1 39 39 GLY CA C 39 45.100 45.100 45.084 0.016 19947
6796 1 20 . 1 1 39 39 GLY H H 39 8.830 8.830 8.420 0.410 19947
6797 1 20 . 1 1 40 40 SER N N 40 116.700 116.700 117.376 -0.676 19947
6798 1 20 . 1 1 40 40 SER HA H 40 4.610 4.610 4.900 -0.290 19947
6799 1 20 . 1 1 40 40 SER CA C 40 58.800 58.800 57.127 1.673 19947
6800 1 20 . 1 1 40 40 SER CB C 40 63.800 63.800 63.389 0.410 19947
6801 1 20 . 1 1 40 40 SER H H 40 8.280 8.280 7.631 0.649 19947
6802 1 20 . 1 1 41 41 GLN N N 41 120.600 120.600 125.359 -4.759 19947
6803 1 20 . 1 1 41 41 GLN HA H 41 4.110 4.110 4.046 0.064 19947
6804 1 20 . 1 1 41 41 GLN CA C 41 55.200 55.200 56.929 -1.729 19947
6805 1 20 . 1 1 41 41 GLN CB C 41 31.100 31.100 28.878 2.222 19947
6806 1 20 . 1 1 41 41 GLN H H 41 9.190 9.190 7.955 1.235 19947
6807 1 20 . 1 1 42 42 CYS N N 42 113.200 113.200 117.651 -4.451 19947
6808 1 20 . 1 1 42 42 CYS HA H 42 4.630 4.630 4.601 0.029 19947
6809 1 20 . 1 1 42 42 CYS CA C 42 53.700 53.700 57.407 -3.707 19947
6810 1 20 . 1 1 42 42 CYS CB C 42 45.500 45.500 30.347 15.153 19947
6811 1 20 . 1 1 42 42 CYS H H 42 7.710 7.710 7.769 -0.059 19947
6812 1 20 . 1 1 43 43 ASN N N 43 114.200 114.200 122.867 -8.667 19947
6813 1 20 . 1 1 43 43 ASN HA H 43 4.940 4.940 4.686 0.254 19947
6814 1 20 . 1 1 43 43 ASN CA C 43 53.000 53.000 54.658 -1.658 19947
6815 1 20 . 1 1 43 43 ASN CB C 43 39.300 39.300 39.386 -0.086 19947
6816 1 20 . 1 1 43 43 ASN H H 43 8.870 8.870 8.738 0.132 19947
6817 1 20 . 1 1 44 44 TYR N N 44 118.400 118.400 113.868 4.532 19947
6818 1 20 . 1 1 44 44 TYR HA H 44 4.850 4.850 4.634 0.216 19947
6819 1 20 . 1 1 44 44 TYR CA C 44 55.300 55.300 57.831 -2.531 19947
6820 1 20 . 1 1 44 44 TYR CB C 44 40.700 40.700 39.853 0.847 19947
6821 1 20 . 1 1 44 44 TYR H H 44 7.840 7.840 7.282 0.558 19947
6822 1 20 . 1 1 45 45 GLY N N 45 110.600 110.600 108.043 2.557 19947
6823 1 20 . 1 1 45 45 GLY CA C 45 44.000 44.000 44.934 -0.934 19947
6824 1 20 . 1 1 45 45 GLY H H 45 7.960 7.960 8.227 -0.267 19947
6825 1 20 . 1 1 46 46 GLU N N 46 120.700 120.700 119.982 0.718 19947
6826 1 20 . 1 1 46 46 GLU HA H 46 4.280 4.280 4.060 0.220 19947
6827 1 20 . 1 1 46 46 GLU CA C 46 58.500 58.500 59.953 -1.453 19947
6828 1 20 . 1 1 46 46 GLU CB C 46 29.300 29.300 30.221 -0.921 19947
6829 1 20 . 1 1 46 46 GLU H H 46 9.160 9.160 8.680 0.480 19947
6830 1 20 . 1 1 47 47 CYS N N 47 112.400 112.400 117.419 -5.019 19947
6831 1 20 . 1 1 47 47 CYS HA H 47 4.850 4.850 4.736 0.114 19947
6832 1 20 . 1 1 47 47 CYS CA C 47 57.100 57.100 58.466 -1.366 19947
6833 1 20 . 1 1 47 47 CYS CB C 47 41.200 41.200 25.680 15.520 19947
6834 1 20 . 1 1 47 47 CYS H H 47 8.510 8.510 7.558 0.952 19947
6835 1 20 . 1 1 48 48 CYS N N 48 123.200 123.200 119.483 3.717 19947
6836 1 20 . 1 1 48 48 CYS HA H 48 5.160 5.160 5.171 -0.011 19947
6837 1 20 . 1 1 48 48 CYS CA C 48 54.700 54.700 58.075 -3.376 19947
6838 1 20 . 1 1 48 48 CYS CB C 48 45.700 45.700 29.695 16.005 19947
6839 1 20 . 1 1 48 48 CYS H H 48 7.810 7.810 7.693 0.117 19947
6840 1 20 . 1 1 49 49 ASP N N 49 127.400 127.400 123.312 4.088 19947
6841 1 20 . 1 1 49 49 ASP HA H 49 4.890 4.890 4.995 -0.105 19947
6842 1 20 . 1 1 49 49 ASP CA C 49 53.500 53.500 53.902 -0.402 19947
6843 1 20 . 1 1 49 49 ASP CB C 49 42.400 42.400 44.538 -2.138 19947
6844 1 20 . 1 1 49 49 ASP H H 49 9.670 9.670 8.349 1.321 19947
6845 1 20 . 1 1 50 50 GLN N N 50 127.000 127.000 122.887 4.113 19947
6846 1 20 . 1 1 50 50 GLN HA H 50 3.940 3.940 3.889 0.051 19947
6847 1 20 . 1 1 50 50 GLN CA C 50 56.800 56.800 58.810 -2.010 19947
6848 1 20 . 1 1 50 50 GLN CB C 50 26.500 26.500 28.163 -1.663 19947
6849 1 20 . 1 1 50 50 GLN H H 50 9.450 9.450 8.980 0.470 19947
6850 1 20 . 1 1 51 51 CYS N N 51 106.100 106.100 113.217 -7.117 19947
6851 1 20 . 1 1 51 51 CYS HA H 51 4.760 4.760 5.078 -0.318 19947
6852 1 20 . 1 1 51 51 CYS CB C 51 43.200 43.200 27.579 15.621 19947
6853 1 20 . 1 1 51 51 CYS H H 51 8.700 8.700 8.407 0.293 19947
6854 1 20 . 1 1 52 52 ARG N N 52 121.000 121.000 118.185 2.815 19947
6855 1 20 . 1 1 52 52 ARG HA H 52 4.690 4.690 4.497 0.193 19947
6856 1 20 . 1 1 52 52 ARG CA C 52 55.400 55.400 55.063 0.337 19947
6857 1 20 . 1 1 52 52 ARG CB C 52 33.100 33.100 35.020 -1.921 19947
6858 1 20 . 1 1 52 52 ARG H H 52 7.960 7.960 7.754 0.206 19947
6859 1 20 . 1 1 53 53 PHE N N 53 120.300 120.300 121.274 -0.974 19947
6860 1 20 . 1 1 53 53 PHE HA H 53 5.050 5.050 4.948 0.102 19947
6861 1 20 . 1 1 53 53 PHE CA C 53 56.100 56.100 56.643 -0.543 19947
6862 1 20 . 1 1 53 53 PHE CB C 53 38.200 38.200 39.026 -0.826 19947
6863 1 20 . 1 1 53 53 PHE H H 53 8.400 8.400 8.185 0.215 19947
6864 1 20 . 1 1 54 54 LYS N N 54 123.300 123.300 125.885 -2.585 19947
6865 1 20 . 1 1 54 54 LYS HA H 54 4.250 4.250 4.151 0.099 19947
6866 1 20 . 1 1 54 54 LYS CA C 54 57.500 57.500 56.522 0.978 19947
6867 1 20 . 1 1 54 54 LYS CB C 54 34.300 34.300 32.408 1.892 19947
6868 1 20 . 1 1 54 54 LYS H H 54 8.540 8.540 8.157 0.383 19947
6869 1 20 . 1 1 55 55 LYS N N 55 119.400 119.400 125.241 -5.841 19947
6870 1 20 . 1 1 55 55 LYS HA H 55 4.110 4.110 4.005 0.105 19947
6871 1 20 . 1 1 55 55 LYS CA C 55 56.500 56.500 56.637 -0.137 19947
6872 1 20 . 1 1 55 55 LYS CB C 55 33.400 33.400 33.302 0.098 19947
6873 1 20 . 1 1 55 55 LYS H H 55 8.440 8.440 8.330 0.110 19947
6874 1 20 . 1 1 56 56 ALA N N 56 126.700 126.700 127.582 -0.882 19947
6875 1 20 . 1 1 56 56 ALA HA H 56 3.920 3.920 4.003 -0.083 19947
6876 1 20 . 1 1 56 56 ALA CA C 56 52.900 52.900 53.645 -0.745 19947
6877 1 20 . 1 1 56 56 ALA CB C 56 18.100 18.100 18.507 -0.407 19947
6878 1 20 . 1 1 56 56 ALA H H 56 8.930 8.930 8.654 0.276 19947
6879 1 20 . 1 1 57 57 GLY N N 57 109.300 109.300 111.531 -2.231 19947
6880 1 20 . 1 1 57 57 GLY CA C 57 45.100 45.100 44.828 0.272 19947
6881 1 20 . 1 1 57 57 GLY H H 57 8.460 8.460 8.438 0.022 19947
6882 1 20 . 1 1 58 58 THR N N 58 117.200 117.200 120.232 -3.032 19947
6883 1 20 . 1 1 58 58 THR HA H 58 4.260 4.260 4.417 -0.157 19947
6884 1 20 . 1 1 58 58 THR CA C 58 63.300 63.300 62.981 0.319 19947
6885 1 20 . 1 1 58 58 THR CB C 58 69.600 69.600 68.767 0.832 19947
6886 1 20 . 1 1 58 58 THR H H 58 7.660 7.660 7.813 -0.153 19947
6887 1 20 . 1 1 59 59 VAL N N 59 130.400 130.400 127.487 2.913 19947
6888 1 20 . 1 1 59 59 VAL HA H 59 3.900 3.900 3.895 0.005 19947
6889 1 20 . 1 1 59 59 VAL CA C 59 64.400 64.400 63.386 1.014 19947
6890 1 20 . 1 1 59 59 VAL CB C 59 31.900 31.900 32.154 -0.254 19947
6891 1 20 . 1 1 59 59 VAL H H 59 9.190 9.190 8.614 0.576 19947
6892 1 20 . 1 1 60 60 CYS N N 60 121.800 121.800 126.205 -4.405 19947
6893 1 20 . 1 1 60 60 CYS HA H 60 5.050 5.050 4.549 0.501 19947
6894 1 20 . 1 1 60 60 CYS CA C 60 54.400 54.400 58.066 -3.666 19947
6895 1 20 . 1 1 60 60 CYS CB C 60 43.000 43.000 27.035 15.965 19947
6896 1 20 . 1 1 60 60 CYS H H 60 9.130 9.130 8.259 0.871 19947
6897 1 20 . 1 1 61 61 ARG N N 61 124.100 124.100 118.303 5.797 19947
6898 1 20 . 1 1 61 61 ARG HA H 61 4.360 4.360 4.563 -0.203 19947
6899 1 20 . 1 1 61 61 ARG CA C 61 56.800 56.800 55.442 1.358 19947
6900 1 20 . 1 1 61 61 ARG CB C 61 32.800 32.800 34.497 -1.697 19947
6901 1 20 . 1 1 61 61 ARG H H 61 7.580 7.580 7.355 0.225 19947
6902 1 20 . 1 1 62 62 ILE N N 62 126.200 126.200 116.419 9.781 19947
6903 1 20 . 1 1 62 62 ILE HA H 62 4.090 4.090 4.588 -0.498 19947
6904 1 20 . 1 1 62 62 ILE CA C 62 60.300 60.300 61.317 -1.017 19947
6905 1 20 . 1 1 62 62 ILE CB C 62 38.700 38.700 40.523 -1.823 19947
6906 1 20 . 1 1 62 62 ILE H H 62 8.490 8.490 8.369 0.121 19947
6907 1 20 . 1 1 63 63 ALA N N 63 129.400 129.400 131.591 -2.191 19947
6908 1 20 . 1 1 63 63 ALA HA H 63 4.310 4.310 4.357 -0.047 19947
6909 1 20 . 1 1 63 63 ALA CA C 63 51.900 51.900 53.836 -1.936 19947
6910 1 20 . 1 1 63 63 ALA CB C 63 20.600 20.600 19.307 1.293 19947
6911 1 20 . 1 1 63 63 ALA H H 63 8.100 8.100 8.675 -0.575 19947
6912 1 20 . 1 1 64 64 ARG N N 64 120.500 120.500 120.590 -0.090 19947
6913 1 20 . 1 1 64 64 ARG HA H 64 4.290 4.290 4.449 -0.159 19947
6914 1 20 . 1 1 64 64 ARG CA C 64 56.200 56.200 55.668 0.532 19947
6915 1 20 . 1 1 64 64 ARG CB C 64 30.500 30.500 30.059 0.441 19947
6916 1 20 . 1 1 64 64 ARG H H 64 8.140 8.140 8.881 -0.741 19947
6917 1 20 . 1 1 65 65 GLY N N 65 110.500 110.500 111.937 -1.437 19947
6918 1 20 . 1 1 65 65 GLY CA C 65 45.100 45.100 44.507 0.593 19947
6919 1 20 . 1 1 65 65 GLY H H 65 8.040 8.040 8.302 -0.262 19947
6920 1 20 . 1 1 66 66 ASP N N 66 120.700 120.700 120.856 -0.156 19947
6921 1 20 . 1 1 66 66 ASP HA H 66 4.610 4.610 4.765 -0.155 19947
6922 1 20 . 1 1 66 66 ASP CA C 66 53.300 53.300 54.007 -0.707 19947
6923 1 20 . 1 1 66 66 ASP CB C 66 37.600 37.600 41.087 -3.487 19947
6924 1 20 . 1 1 66 66 ASP H H 66 8.380 8.380 7.114 1.266 19947
6925 1 20 . 1 1 67 67 TRP N N 67 120.100 120.100 124.073 -3.973 19947
6926 1 20 . 1 1 67 67 TRP HA H 67 4.760 4.760 5.056 -0.296 19947
6927 1 20 . 1 1 67 67 TRP CA C 67 57.200 57.200 58.334 -1.134 19947
6928 1 20 . 1 1 67 67 TRP CB C 67 29.100 29.100 29.689 -0.589 19947
6929 1 20 . 1 1 67 67 TRP H H 67 7.950 7.950 8.048 -0.098 19947
6930 1 20 . 1 1 68 68 ASN N N 68 118.400 118.400 117.695 0.705 19947
6931 1 20 . 1 1 68 68 ASN HA H 68 4.790 4.790 4.946 -0.156 19947
6932 1 20 . 1 1 68 68 ASN CA C 68 52.800 52.800 53.757 -0.957 19947
6933 1 20 . 1 1 68 68 ASN CB C 68 39.300 39.300 40.102 -0.802 19947
6934 1 20 . 1 1 68 68 ASN H H 68 8.180 8.180 8.747 -0.567 19947
6935 1 20 . 1 1 69 69 ASP N N 69 118.500 118.500 118.534 -0.034 19947
6936 1 20 . 1 1 69 69 ASP HA H 69 4.620 4.620 4.457 0.163 19947
6937 1 20 . 1 1 69 69 ASP CA C 69 53.200 53.200 55.973 -2.773 19947
6938 1 20 . 1 1 69 69 ASP CB C 69 38.000 38.000 41.068 -3.068 19947
6939 1 20 . 1 1 69 69 ASP H H 69 8.130 8.130 8.440 -0.310 19947
6940 1 20 . 1 1 70 70 ASP N N 70 120.500 120.500 121.182 -0.682 19947
6941 1 20 . 1 1 70 70 ASP HA H 70 5.100 5.100 5.011 0.089 19947
6942 1 20 . 1 1 70 70 ASP CA C 70 52.500 52.500 53.136 -0.636 19947
6943 1 20 . 1 1 70 70 ASP CB C 70 42.600 42.600 42.453 0.147 19947
6944 1 20 . 1 1 70 70 ASP H H 70 8.140 8.140 8.062 0.078 19947
6945 1 20 . 1 1 71 71 TYR N N 71 118.900 118.900 123.937 -5.037 19947
6946 1 20 . 1 1 71 71 TYR HA H 71 5.210 5.210 4.998 0.212 19947
6947 1 20 . 1 1 71 71 TYR CA C 71 56.300 56.300 57.046 -0.746 19947
6948 1 20 . 1 1 71 71 TYR CB C 71 42.200 42.200 42.883 -0.683 19947
6949 1 20 . 1 1 71 71 TYR H H 71 8.450 8.450 8.231 0.219 19947
6950 1 20 . 1 1 72 72 CYS N N 72 119.800 119.800 121.543 -1.743 19947
6951 1 20 . 1 1 72 72 CYS HA H 72 4.900 4.900 4.528 0.372 19947
6952 1 20 . 1 1 72 72 CYS CA C 72 53.400 53.400 59.310 -5.910 19947
6953 1 20 . 1 1 72 72 CYS CB C 72 37.200 37.200 29.219 7.981 19947
6954 1 20 . 1 1 72 72 CYS H H 72 9.330 9.330 8.631 0.699 19947
6955 1 20 . 1 1 73 73 THR N N 73 112.700 112.700 114.754 -2.054 19947
6956 1 20 . 1 1 73 73 THR HA H 73 4.430 4.430 4.449 -0.019 19947
6957 1 20 . 1 1 73 73 THR CA C 73 62.300 62.300 61.224 1.076 19947
6958 1 20 . 1 1 73 73 THR CB C 73 71.300 71.300 69.801 1.499 19947
6959 1 20 . 1 1 73 73 THR H H 73 9.980 9.980 8.759 1.221 19947
6960 1 20 . 1 1 74 74 GLY N N 74 111.500 111.500 111.526 -0.026 19947
6961 1 20 . 1 1 74 74 GLY CA C 74 45.300 45.300 46.745 -1.445 19947
6962 1 20 . 1 1 74 74 GLY H H 74 8.580 8.580 7.828 0.752 19947
6963 1 20 . 1 1 75 75 LYS N N 75 115.900 115.900 117.460 -1.560 19947
6964 1 20 . 1 1 75 75 LYS HA H 75 4.140 4.140 4.593 -0.453 19947
6965 1 20 . 1 1 75 75 LYS CA C 75 54.800 54.800 55.590 -0.790 19947
6966 1 20 . 1 1 75 75 LYS CB C 75 34.200 34.200 34.226 -0.026 19947
6967 1 20 . 1 1 75 75 LYS H H 75 7.900 7.900 7.424 0.476 19947
6968 1 20 . 1 1 76 76 SER N N 76 111.000 111.000 112.656 -1.656 19947
6969 1 20 . 1 1 76 76 SER HA H 76 4.160 4.160 3.887 0.273 19947
6970 1 20 . 1 1 76 76 SER CA C 76 61.400 61.400 56.824 4.576 19947
6971 1 20 . 1 1 76 76 SER CB C 76 64.300 64.300 65.603 -1.303 19947
6972 1 20 . 1 1 76 76 SER H H 76 6.520 6.520 6.849 -0.329 19947
6973 1 20 . 1 1 77 77 SER N N 77 117.100 117.100 113.151 3.949 19947
6974 1 20 . 1 1 77 77 SER HA H 77 4.220 4.220 4.505 -0.285 19947
6975 1 20 . 1 1 77 77 SER CA C 77 59.800 59.800 58.804 0.996 19947
6976 1 20 . 1 1 77 77 SER CB C 77 64.400 64.400 63.925 0.475 19947
6977 1 20 . 1 1 77 77 SER H H 77 9.030 9.030 8.303 0.727 19947
6978 1 20 . 1 1 78 78 ASP N N 78 122.100 122.100 121.635 0.465 19947
6979 1 20 . 1 1 78 78 ASP HA H 78 4.930 4.930 4.828 0.102 19947
6980 1 20 . 1 1 78 78 ASP CA C 78 52.400 52.400 53.798 -1.398 19947
6981 1 20 . 1 1 78 78 ASP CB C 78 40.800 40.800 44.557 -3.757 19947
6982 1 20 . 1 1 78 78 ASP H H 78 8.340 8.340 7.383 0.957 19947
6983 1 20 . 1 1 79 79 CYS N N 79 122.200 122.200 122.212 -0.012 19947
6984 1 20 . 1 1 79 79 CYS HA H 79 5.320 5.320 5.044 0.276 19947
6985 1 20 . 1 1 79 79 CYS CA C 79 52.000 52.000 55.698 -3.698 19947
6986 1 20 . 1 1 79 79 CYS CB C 79 39.300 39.300 27.752 11.548 19947
6987 1 20 . 1 1 79 79 CYS H H 79 8.960 8.960 8.361 0.599 19947
6988 1 20 . 1 1 80 80 PRO HA H 80 4.410 4.410 4.612 -0.202 19947
6989 1 20 . 1 1 80 80 PRO CA C 80 63.500 63.500 63.379 0.121 19947
6990 1 20 . 1 1 80 80 PRO CB C 80 32.400 32.400 32.406 -0.006 19947
6991 1 20 . 1 1 81 81 TRP N N 81 120.500 120.500 119.289 1.211 19947
6992 1 20 . 1 1 81 81 TRP HA H 81 4.550 4.550 4.748 -0.198 19947
6993 1 20 . 1 1 81 81 TRP CA C 81 56.400 56.400 53.930 2.470 19947
6994 1 20 . 1 1 81 81 TRP CB C 81 29.500 29.500 29.091 0.409 19947
6995 1 20 . 1 1 81 81 TRP H H 81 8.400 8.400 8.385 0.015 19947
6996 1 20 . 1 1 82 82 ASN N N 82 120.400 120.400 116.458 3.942 19947
6997 1 20 . 1 1 82 82 ASN HA H 82 4.750 4.750 4.136 0.614 19947
6998 1 20 . 1 1 82 82 ASN CA C 82 53.100 53.100 54.403 -1.303 19947
6999 1 20 . 1 1 82 82 ASN CB C 82 39.000 39.000 37.150 1.850 19947
7000 1 20 . 1 1 82 82 ASN H H 82 8.040 8.040 8.208 -0.168 19947
7001 1 21 . 1 1 2 2 PRO HA H 2 4.820 4.820 4.797 0.023 19947
7002 1 21 . 1 1 2 2 PRO CA C 2 61.900 61.900 62.396 -0.496 19947
7003 1 21 . 1 1 2 2 PRO CB C 2 30.700 30.700 31.527 -0.827 19947
7004 1 21 . 1 1 3 3 PRO HA H 3 4.540 4.540 4.255 0.285 19947
7005 1 21 . 1 1 3 3 PRO CA C 3 62.900 62.900 63.591 -0.691 19947
7006 1 21 . 1 1 3 3 PRO CB C 3 32.100 32.100 32.188 -0.088 19947
7007 1 21 . 1 1 4 4 VAL N N 4 121.900 121.900 124.526 -2.626 19947
7008 1 21 . 1 1 4 4 VAL HA H 4 4.200 4.200 4.291 -0.091 19947
7009 1 21 . 1 1 4 4 VAL CA C 4 62.300 62.300 62.342 -0.042 19947
7010 1 21 . 1 1 4 4 VAL CB C 4 32.800 32.800 33.071 -0.271 19947
7011 1 21 . 1 1 4 4 VAL H H 4 8.330 8.330 8.355 -0.025 19947
7012 1 21 . 1 1 5 5 CYS N N 5 120.900 120.900 125.970 -5.070 19947
7013 1 21 . 1 1 5 5 CYS HA H 5 4.700 4.700 4.483 0.217 19947
7014 1 21 . 1 1 5 5 CYS CA C 5 53.600 53.600 58.460 -4.860 19947
7015 1 21 . 1 1 5 5 CYS H H 5 8.500 8.500 8.270 0.230 19947
7016 1 21 . 1 1 6 6 GLY N N 6 110.200 110.200 115.093 -4.893 19947
7017 1 21 . 1 1 6 6 GLY CA C 6 46.300 46.300 46.184 0.116 19947
7018 1 21 . 1 1 6 6 GLY H H 6 8.490 8.490 8.746 -0.256 19947
7019 1 21 . 1 1 7 7 ASN N N 7 120.100 120.100 113.755 6.345 19947
7020 1 21 . 1 1 7 7 ASN HA H 7 4.730 4.730 4.291 0.439 19947
7021 1 21 . 1 1 7 7 ASN CA C 7 53.200 53.200 53.339 -0.139 19947
7022 1 21 . 1 1 7 7 ASN CB C 7 38.700 38.700 38.582 0.118 19947
7023 1 21 . 1 1 7 7 ASN H H 7 8.320 8.320 8.178 0.142 19947
7024 1 21 . 1 1 8 8 LYS N N 8 121.300 121.300 120.900 0.400 19947
7025 1 21 . 1 1 8 8 LYS HA H 8 4.340 4.340 4.259 0.081 19947
7026 1 21 . 1 1 8 8 LYS CA C 8 56.600 56.600 56.816 -0.216 19947
7027 1 21 . 1 1 8 8 LYS CB C 8 32.900 32.900 32.400 0.500 19947
7028 1 21 . 1 1 8 8 LYS H H 8 8.260 8.260 8.196 0.064 19947
7029 1 21 . 1 1 9 9 ILE N N 9 136.600 136.600 121.230 15.370 19947
7030 1 21 . 1 1 9 9 ILE HA H 9 4.140 4.140 3.935 0.205 19947
7031 1 21 . 1 1 9 9 ILE CA C 9 61.300 61.300 62.260 -0.960 19947
7032 1 21 . 1 1 9 9 ILE CB C 9 38.200 38.200 38.097 0.103 19947
7033 1 21 . 1 1 9 9 ILE H H 9 8.150 8.150 8.571 -0.421 19947
7034 1 21 . 1 1 10 10 LEU N N 10 125.700 125.700 123.878 1.822 19947
7035 1 21 . 1 1 10 10 LEU HA H 10 4.420 4.420 4.474 -0.054 19947
7036 1 21 . 1 1 10 10 LEU CA C 10 55.200 55.200 54.794 0.406 19947
7037 1 21 . 1 1 10 10 LEU CB C 10 42.300 42.300 41.191 1.109 19947
7038 1 21 . 1 1 10 10 LEU H H 10 8.230 8.230 8.380 -0.150 19947
7039 1 21 . 1 1 11 11 GLU N N 11 120.600 120.600 114.937 5.663 19947
7040 1 21 . 1 1 11 11 GLU HA H 11 4.470 4.470 3.922 0.548 19947
7041 1 21 . 1 1 11 11 GLU CA C 11 55.500 55.500 56.094 -0.594 19947
7042 1 21 . 1 1 11 11 GLU CB C 11 28.900 28.900 28.721 0.179 19947
7043 1 21 . 1 1 11 11 GLU H H 11 8.250 8.250 8.011 0.239 19947
7044 1 21 . 1 1 12 12 GLN N N 12 121.600 121.600 116.426 5.174 19947
7045 1 21 . 1 1 12 12 GLN HA H 12 4.350 4.350 4.842 -0.492 19947
7046 1 21 . 1 1 12 12 GLN CA C 12 56.600 56.600 55.373 1.227 19947
7047 1 21 . 1 1 12 12 GLN CB C 12 29.200 29.200 28.961 0.239 19947
7048 1 21 . 1 1 12 12 GLN H H 12 8.460 8.460 7.700 0.760 19947
7049 1 21 . 1 1 13 13 GLY N N 13 110.700 110.700 110.130 0.570 19947
7050 1 21 . 1 1 13 13 GLY CA C 13 45.700 45.700 47.265 -1.565 19947
7051 1 21 . 1 1 13 13 GLY H H 13 8.660 8.660 8.941 -0.281 19947
7052 1 21 . 1 1 14 14 GLU N N 14 118.900 118.900 116.625 2.275 19947
7053 1 21 . 1 1 14 14 GLU HA H 14 4.530 4.530 4.249 0.281 19947
7054 1 21 . 1 1 14 14 GLU CA C 14 55.600 55.600 56.776 -1.176 19947
7055 1 21 . 1 1 14 14 GLU CB C 14 29.700 29.700 30.562 -0.862 19947
7056 1 21 . 1 1 14 14 GLU H H 14 8.230 8.230 8.326 -0.096 19947
7057 1 21 . 1 1 15 15 ASP N N 15 118.400 118.400 119.193 -0.793 19947
7058 1 21 . 1 1 15 15 ASP HA H 15 4.990 4.990 4.426 0.564 19947
7059 1 21 . 1 1 15 15 ASP CA C 15 53.500 53.500 57.390 -3.890 19947
7060 1 21 . 1 1 15 15 ASP CB C 15 39.700 39.700 41.395 -1.695 19947
7061 1 21 . 1 1 15 15 ASP H H 15 8.330 8.330 8.396 -0.066 19947
7062 1 21 . 1 1 16 16 CYS HA H 16 4.340 4.340 4.532 -0.192 19947
7063 1 21 . 1 1 16 16 CYS H H 16 8.510 8.510 7.676 0.834 19947
7064 1 21 . 1 1 17 17 ASP N N 17 116.700 116.700 125.829 -9.129 19947
7065 1 21 . 1 1 17 17 ASP HA H 17 4.740 4.740 4.509 0.231 19947
7066 1 21 . 1 1 17 17 ASP CA C 17 53.100 53.100 55.265 -2.165 19947
7067 1 21 . 1 1 17 17 ASP CB C 17 38.600 38.600 41.086 -2.486 19947
7068 1 21 . 1 1 17 17 ASP H H 17 8.180 8.180 8.347 -0.167 19947
7069 1 21 . 1 1 18 18 CYS HA H 18 4.730 4.730 4.032 0.698 19947
7070 1 21 . 1 1 18 18 CYS CB C 18 41.900 41.900 27.426 14.474 19947
7071 1 21 . 1 1 19 19 GLY H H 19 8.220 8.220 8.339 -0.119 19947
7072 1 21 . 1 1 20 20 SER HA H 20 4.920 4.920 4.846 0.074 19947
7073 1 21 . 1 1 20 20 SER CA C 20 55.700 55.700 55.602 0.097 19947
7074 1 21 . 1 1 20 20 SER CB C 20 63.500 63.500 63.591 -0.091 19947
7075 1 21 . 1 1 20 20 SER H H 20 7.830 7.830 8.027 -0.197 19947
7076 1 21 . 1 1 21 21 PRO HA H 21 4.240 4.240 4.360 -0.120 19947
7077 1 21 . 1 1 21 21 PRO CA C 21 63.400 63.400 64.429 -1.029 19947
7078 1 21 . 1 1 21 21 PRO CB C 21 31.800 31.800 31.704 0.095 19947
7079 1 21 . 1 1 22 22 ALA N N 22 119.900 119.900 119.483 0.417 19947
7080 1 21 . 1 1 22 22 ALA HA H 22 4.220 4.220 4.105 0.115 19947
7081 1 21 . 1 1 22 22 ALA CA C 22 54.200 54.200 54.028 0.172 19947
7082 1 21 . 1 1 22 22 ALA CB C 22 18.500 18.500 18.810 -0.310 19947
7083 1 21 . 1 1 22 22 ALA H H 22 8.180 8.180 8.457 -0.277 19947
7084 1 21 . 1 1 23 23 ASN N N 23 116.300 116.300 112.551 3.749 19947
7085 1 21 . 1 1 23 23 ASN HA H 23 4.670 4.670 4.730 -0.060 19947
7086 1 21 . 1 1 23 23 ASN CA C 23 53.200 53.200 54.456 -1.256 19947
7087 1 21 . 1 1 23 23 ASN CB C 23 39.300 39.300 41.062 -1.762 19947
7088 1 21 . 1 1 23 23 ASN H H 23 7.960 7.960 7.541 0.419 19947
7089 1 21 . 1 1 24 24 CYS HA H 24 4.720 4.720 3.943 0.777 19947
7090 1 21 . 1 1 24 24 CYS H H 24 8.510 8.510 9.127 -0.617 19947
7091 1 21 . 1 1 25 25 GLN HA H 25 4.460 4.460 4.292 0.168 19947
7092 1 21 . 1 1 25 25 GLN H H 25 8.320 8.320 8.360 -0.040 19947
7093 1 21 . 1 1 26 26 ASP HA H 26 4.740 4.740 4.561 0.179 19947
7094 1 21 . 1 1 26 26 ASP H H 26 8.580 8.580 7.834 0.746 19947
7095 1 21 . 1 1 27 27 ARG HA H 27 4.680 4.680 3.966 0.714 19947
7096 1 21 . 1 1 27 27 ARG CA C 27 54.700 54.700 57.713 -3.013 19947
7097 1 21 . 1 1 27 27 ARG H H 27 8.550 8.550 8.662 -0.112 19947
7098 1 21 . 1 1 28 28 CYS HA H 28 4.120 4.120 4.909 -0.789 19947
7099 1 21 . 1 1 28 28 CYS CA C 28 54.400 54.400 57.052 -2.652 19947
7100 1 21 . 1 1 28 28 CYS CB C 28 19.000 19.000 26.110 -7.110 19947
7101 1 21 . 1 1 28 28 CYS H H 28 8.910 8.910 8.561 0.349 19947
7102 1 21 . 1 1 29 29 CYS N N 29 113.300 113.300 119.349 -6.049 19947
7103 1 21 . 1 1 29 29 CYS HA H 29 5.010 5.010 4.691 0.319 19947
7104 1 21 . 1 1 29 29 CYS CA C 29 54.300 54.300 56.392 -2.092 19947
7105 1 21 . 1 1 29 29 CYS H H 29 7.730 7.730 7.480 0.250 19947
7106 1 21 . 1 1 30 30 ASN HA H 30 4.730 4.730 4.846 -0.116 19947
7107 1 21 . 1 1 30 30 ASN CB C 30 38.700 38.700 39.699 -0.999 19947
7108 1 21 . 1 1 30 30 ASN H H 30 8.870 8.870 8.886 -0.016 19947
7109 1 21 . 1 1 31 31 ALA N N 31 129.400 129.400 127.413 1.987 19947
7110 1 21 . 1 1 31 31 ALA HA H 31 4.120 4.120 4.560 -0.440 19947
7111 1 21 . 1 1 31 31 ALA CA C 31 54.400 54.400 54.107 0.293 19947
7112 1 21 . 1 1 31 31 ALA CB C 31 19.000 19.000 19.382 -0.382 19947
7113 1 21 . 1 1 31 31 ALA H H 31 8.890 8.890 8.949 -0.059 19947
7114 1 21 . 1 1 32 32 ALA N N 32 116.400 116.400 117.563 -1.163 19947
7115 1 21 . 1 1 32 32 ALA HA H 32 4.340 4.340 4.341 -0.001 19947
7116 1 21 . 1 1 32 32 ALA CA C 32 53.800 53.800 53.515 0.285 19947
7117 1 21 . 1 1 32 32 ALA CB C 32 19.100 19.100 19.171 -0.071 19947
7118 1 21 . 1 1 32 32 ALA H H 32 8.250 8.250 8.285 -0.035 19947
7119 1 21 . 1 1 33 33 THR N N 33 104.300 104.300 110.018 -5.718 19947
7120 1 21 . 1 1 33 33 THR HA H 33 4.430 4.430 4.401 0.029 19947
7121 1 21 . 1 1 33 33 THR CA C 33 60.500 60.500 61.132 -0.632 19947
7122 1 21 . 1 1 33 33 THR CB C 33 70.600 70.600 69.552 1.048 19947
7123 1 21 . 1 1 33 33 THR H H 33 7.320 7.320 7.387 -0.067 19947
7124 1 21 . 1 1 34 34 CYS N N 34 123.400 123.400 121.774 1.626 19947
7125 1 21 . 1 1 34 34 CYS HA H 34 4.170 4.170 4.124 0.046 19947
7126 1 21 . 1 1 34 34 CYS CA C 34 56.500 56.500 60.422 -3.922 19947
7127 1 21 . 1 1 34 34 CYS H H 34 8.710 8.710 8.339 0.371 19947
7128 1 21 . 1 1 35 35 LYS N N 35 116.900 116.900 117.723 -0.823 19947
7129 1 21 . 1 1 35 35 LYS HA H 35 4.960 4.960 4.613 0.347 19947
7130 1 21 . 1 1 35 35 LYS CA C 35 53.900 53.900 55.484 -1.584 19947
7131 1 21 . 1 1 35 35 LYS CB C 35 35.900 35.900 36.349 -0.449 19947
7132 1 21 . 1 1 35 35 LYS H H 35 7.450 7.450 7.744 -0.294 19947
7133 1 21 . 1 1 36 36 LEU N N 36 119.300 119.300 121.153 -1.853 19947
7134 1 21 . 1 1 36 36 LEU HA H 36 4.800 4.800 4.775 0.025 19947
7135 1 21 . 1 1 36 36 LEU CB C 36 42.400 42.400 42.060 0.340 19947
7136 1 21 . 1 1 36 36 LEU H H 36 8.290 8.290 8.307 -0.017 19947
7137 1 21 . 1 1 37 37 THR HA H 37 4.340 4.340 4.386 -0.046 19947
7138 1 21 . 1 1 37 37 THR CA C 37 60.200 60.200 61.221 -1.022 19947
7139 1 21 . 1 1 37 37 THR CB C 37 67.700 67.700 68.119 -0.419 19947
7140 1 21 . 1 1 37 37 THR H H 37 8.380 8.380 8.123 0.257 19947
7141 1 21 . 1 1 38 38 PRO HA H 38 4.380 4.380 4.260 0.120 19947
7142 1 21 . 1 1 38 38 PRO CA C 38 64.800 64.800 64.573 0.228 19947
7143 1 21 . 1 1 38 38 PRO CB C 38 31.500 31.500 31.694 -0.194 19947
7144 1 21 . 1 1 39 39 GLY N N 39 113.300 113.300 111.308 1.992 19947
7145 1 21 . 1 1 39 39 GLY CA C 39 45.100 45.100 44.907 0.193 19947
7146 1 21 . 1 1 39 39 GLY H H 39 8.830 8.830 8.561 0.269 19947
7147 1 21 . 1 1 40 40 SER N N 40 116.700 116.700 116.917 -0.217 19947
7148 1 21 . 1 1 40 40 SER HA H 40 4.610 4.610 4.844 -0.234 19947
7149 1 21 . 1 1 40 40 SER CA C 40 58.800 58.800 57.897 0.903 19947
7150 1 21 . 1 1 40 40 SER CB C 40 63.800 63.800 63.871 -0.071 19947
7151 1 21 . 1 1 40 40 SER H H 40 8.280 8.280 7.609 0.671 19947
7152 1 21 . 1 1 41 41 GLN N N 41 120.600 120.600 124.456 -3.856 19947
7153 1 21 . 1 1 41 41 GLN HA H 41 4.110 4.110 4.171 -0.061 19947
7154 1 21 . 1 1 41 41 GLN CA C 41 55.200 55.200 56.724 -1.524 19947
7155 1 21 . 1 1 41 41 GLN CB C 41 31.100 31.100 29.579 1.520 19947
7156 1 21 . 1 1 41 41 GLN H H 41 9.190 9.190 8.036 1.154 19947
7157 1 21 . 1 1 42 42 CYS N N 42 113.200 113.200 115.377 -2.177 19947
7158 1 21 . 1 1 42 42 CYS HA H 42 4.630 4.630 4.504 0.126 19947
7159 1 21 . 1 1 42 42 CYS CA C 42 53.700 53.700 57.829 -4.129 19947
7160 1 21 . 1 1 42 42 CYS CB C 42 45.500 45.500 29.075 16.425 19947
7161 1 21 . 1 1 42 42 CYS H H 42 7.710 7.710 7.824 -0.114 19947
7162 1 21 . 1 1 43 43 ASN N N 43 114.200 114.200 119.125 -4.925 19947
7163 1 21 . 1 1 43 43 ASN HA H 43 4.940 4.940 4.708 0.232 19947
7164 1 21 . 1 1 43 43 ASN CA C 43 53.000 53.000 54.265 -1.265 19947
7165 1 21 . 1 1 43 43 ASN CB C 43 39.300 39.300 41.067 -1.767 19947
7166 1 21 . 1 1 43 43 ASN H H 43 8.870 8.870 8.663 0.207 19947
7167 1 21 . 1 1 44 44 TYR N N 44 118.400 118.400 117.713 0.687 19947
7168 1 21 . 1 1 44 44 TYR HA H 44 4.850 4.850 4.743 0.107 19947
7169 1 21 . 1 1 44 44 TYR CA C 44 55.300 55.300 56.812 -1.512 19947
7170 1 21 . 1 1 44 44 TYR CB C 44 40.700 40.700 40.705 -0.005 19947
7171 1 21 . 1 1 44 44 TYR H H 44 7.840 7.840 7.337 0.503 19947
7172 1 21 . 1 1 45 45 GLY N N 45 110.600 110.600 113.244 -2.644 19947
7173 1 21 . 1 1 45 45 GLY CA C 45 44.000 44.000 45.000 -1.000 19947
7174 1 21 . 1 1 45 45 GLY H H 45 7.960 7.960 8.034 -0.074 19947
7175 1 21 . 1 1 46 46 GLU N N 46 120.700 120.700 119.376 1.324 19947
7176 1 21 . 1 1 46 46 GLU HA H 46 4.280 4.280 4.119 0.161 19947
7177 1 21 . 1 1 46 46 GLU CA C 46 58.500 58.500 58.880 -0.380 19947
7178 1 21 . 1 1 46 46 GLU CB C 46 29.300 29.300 29.841 -0.541 19947
7179 1 21 . 1 1 46 46 GLU H H 46 9.160 9.160 8.672 0.488 19947
7180 1 21 . 1 1 47 47 CYS N N 47 112.400 112.400 116.784 -4.384 19947
7181 1 21 . 1 1 47 47 CYS HA H 47 4.850 4.850 4.687 0.163 19947
7182 1 21 . 1 1 47 47 CYS CA C 47 57.100 57.100 57.876 -0.776 19947
7183 1 21 . 1 1 47 47 CYS CB C 47 41.200 41.200 26.829 14.371 19947
7184 1 21 . 1 1 47 47 CYS H H 47 8.510 8.510 7.477 1.033 19947
7185 1 21 . 1 1 48 48 CYS N N 48 123.200 123.200 120.174 3.026 19947
7186 1 21 . 1 1 48 48 CYS HA H 48 5.160 5.160 5.334 -0.174 19947
7187 1 21 . 1 1 48 48 CYS CA C 48 54.700 54.700 57.708 -3.008 19947
7188 1 21 . 1 1 48 48 CYS CB C 48 45.700 45.700 30.701 14.999 19947
7189 1 21 . 1 1 48 48 CYS H H 48 7.810 7.810 8.012 -0.202 19947
7190 1 21 . 1 1 49 49 ASP N N 49 127.400 127.400 122.148 5.252 19947
7191 1 21 . 1 1 49 49 ASP HA H 49 4.890 4.890 4.849 0.041 19947
7192 1 21 . 1 1 49 49 ASP CA C 49 53.500 53.500 53.756 -0.256 19947
7193 1 21 . 1 1 49 49 ASP CB C 49 42.400 42.400 43.270 -0.870 19947
7194 1 21 . 1 1 49 49 ASP H H 49 9.670 9.670 8.454 1.216 19947
7195 1 21 . 1 1 50 50 GLN N N 50 127.000 127.000 121.128 5.872 19947
7196 1 21 . 1 1 50 50 GLN HA H 50 3.940 3.940 3.827 0.113 19947
7197 1 21 . 1 1 50 50 GLN CA C 50 56.800 56.800 58.896 -2.096 19947
7198 1 21 . 1 1 50 50 GLN CB C 50 26.500 26.500 28.040 -1.540 19947
7199 1 21 . 1 1 50 50 GLN H H 50 9.450 9.450 9.040 0.410 19947
7200 1 21 . 1 1 51 51 CYS N N 51 106.100 106.100 116.821 -10.721 19947
7201 1 21 . 1 1 51 51 CYS HA H 51 4.760 4.760 5.096 -0.336 19947
7202 1 21 . 1 1 51 51 CYS CB C 51 43.200 43.200 28.803 14.396 19947
7203 1 21 . 1 1 51 51 CYS H H 51 8.700 8.700 8.162 0.538 19947
7204 1 21 . 1 1 52 52 ARG N N 52 121.000 121.000 118.935 2.065 19947
7205 1 21 . 1 1 52 52 ARG HA H 52 4.690 4.690 4.553 0.137 19947
7206 1 21 . 1 1 52 52 ARG CA C 52 55.400 55.400 54.206 1.194 19947
7207 1 21 . 1 1 52 52 ARG CB C 52 33.100 33.100 34.884 -1.784 19947
7208 1 21 . 1 1 52 52 ARG H H 52 7.960 7.960 7.844 0.116 19947
7209 1 21 . 1 1 53 53 PHE N N 53 120.300 120.300 119.544 0.756 19947
7210 1 21 . 1 1 53 53 PHE HA H 53 5.050 5.050 5.045 0.005 19947
7211 1 21 . 1 1 53 53 PHE CA C 53 56.100 56.100 56.060 0.040 19947
7212 1 21 . 1 1 53 53 PHE CB C 53 38.200 38.200 39.348 -1.148 19947
7213 1 21 . 1 1 53 53 PHE H H 53 8.400 8.400 8.356 0.044 19947
7214 1 21 . 1 1 54 54 LYS N N 54 123.300 123.300 124.000 -0.700 19947
7215 1 21 . 1 1 54 54 LYS HA H 54 4.250 4.250 4.267 -0.017 19947
7216 1 21 . 1 1 54 54 LYS CA C 54 57.500 57.500 55.468 2.032 19947
7217 1 21 . 1 1 54 54 LYS CB C 54 34.300 34.300 30.841 3.459 19947
7218 1 21 . 1 1 54 54 LYS H H 54 8.540 8.540 8.080 0.460 19947
7219 1 21 . 1 1 55 55 LYS N N 55 119.400 119.400 123.704 -4.304 19947
7220 1 21 . 1 1 55 55 LYS HA H 55 4.110 4.110 3.938 0.172 19947
7221 1 21 . 1 1 55 55 LYS CA C 55 56.500 56.500 57.045 -0.545 19947
7222 1 21 . 1 1 55 55 LYS CB C 55 33.400 33.400 33.036 0.364 19947
7223 1 21 . 1 1 55 55 LYS H H 55 8.440 8.440 8.129 0.311 19947
7224 1 21 . 1 1 56 56 ALA N N 56 126.700 126.700 127.996 -1.296 19947
7225 1 21 . 1 1 56 56 ALA HA H 56 3.920 3.920 3.944 -0.024 19947
7226 1 21 . 1 1 56 56 ALA CA C 56 52.900 52.900 53.659 -0.759 19947
7227 1 21 . 1 1 56 56 ALA CB C 56 18.100 18.100 18.669 -0.569 19947
7228 1 21 . 1 1 56 56 ALA H H 56 8.930 8.930 8.715 0.215 19947
7229 1 21 . 1 1 57 57 GLY N N 57 109.300 109.300 111.230 -1.930 19947
7230 1 21 . 1 1 57 57 GLY CA C 57 45.100 45.100 44.818 0.282 19947
7231 1 21 . 1 1 57 57 GLY H H 57 8.460 8.460 8.477 -0.017 19947
7232 1 21 . 1 1 58 58 THR N N 58 117.200 117.200 120.185 -2.985 19947
7233 1 21 . 1 1 58 58 THR HA H 58 4.260 4.260 4.392 -0.132 19947
7234 1 21 . 1 1 58 58 THR CA C 58 63.300 63.300 63.481 -0.181 19947
7235 1 21 . 1 1 58 58 THR CB C 58 69.600 69.600 69.273 0.327 19947
7236 1 21 . 1 1 58 58 THR H H 58 7.660 7.660 7.761 -0.101 19947
7237 1 21 . 1 1 59 59 VAL N N 59 130.400 130.400 129.610 0.790 19947
7238 1 21 . 1 1 59 59 VAL HA H 59 3.900 3.900 3.736 0.164 19947
7239 1 21 . 1 1 59 59 VAL CA C 59 64.400 64.400 61.969 2.431 19947
7240 1 21 . 1 1 59 59 VAL CB C 59 31.900 31.900 31.105 0.795 19947
7241 1 21 . 1 1 59 59 VAL H H 59 9.190 9.190 8.765 0.425 19947
7242 1 21 . 1 1 60 60 CYS N N 60 121.800 121.800 125.929 -4.129 19947
7243 1 21 . 1 1 60 60 CYS HA H 60 5.050 5.050 4.524 0.526 19947
7244 1 21 . 1 1 60 60 CYS CA C 60 54.400 54.400 58.566 -4.166 19947
7245 1 21 . 1 1 60 60 CYS CB C 60 43.000 43.000 28.535 14.465 19947
7246 1 21 . 1 1 60 60 CYS H H 60 9.130 9.130 8.502 0.628 19947
7247 1 21 . 1 1 61 61 ARG N N 61 124.100 124.100 119.077 5.023 19947
7248 1 21 . 1 1 61 61 ARG HA H 61 4.360 4.360 4.570 -0.210 19947
7249 1 21 . 1 1 61 61 ARG CA C 61 56.800 56.800 54.866 1.934 19947
7250 1 21 . 1 1 61 61 ARG CB C 61 32.800 32.800 32.253 0.547 19947
7251 1 21 . 1 1 61 61 ARG H H 61 7.580 7.580 7.445 0.135 19947
7252 1 21 . 1 1 62 62 ILE N N 62 126.200 126.200 118.393 7.807 19947
7253 1 21 . 1 1 62 62 ILE HA H 62 4.090 4.090 4.860 -0.770 19947
7254 1 21 . 1 1 62 62 ILE CA C 62 60.300 60.300 59.747 0.553 19947
7255 1 21 . 1 1 62 62 ILE CB C 62 38.700 38.700 42.090 -3.390 19947
7256 1 21 . 1 1 62 62 ILE H H 62 8.490 8.490 8.086 0.404 19947
7257 1 21 . 1 1 63 63 ALA N N 63 129.400 129.400 132.613 -3.213 19947
7258 1 21 . 1 1 63 63 ALA HA H 63 4.310 4.310 4.318 -0.008 19947
7259 1 21 . 1 1 63 63 ALA CA C 63 51.900 51.900 55.020 -3.120 19947
7260 1 21 . 1 1 63 63 ALA CB C 63 20.600 20.600 19.464 1.136 19947
7261 1 21 . 1 1 63 63 ALA H H 63 8.100 8.100 8.553 -0.453 19947
7262 1 21 . 1 1 64 64 ARG N N 64 120.500 120.500 120.226 0.274 19947
7263 1 21 . 1 1 64 64 ARG HA H 64 4.290 4.290 4.460 -0.170 19947
7264 1 21 . 1 1 64 64 ARG CA C 64 56.200 56.200 55.665 0.535 19947
7265 1 21 . 1 1 64 64 ARG CB C 64 30.500 30.500 30.008 0.492 19947
7266 1 21 . 1 1 64 64 ARG H H 64 8.140 8.140 8.855 -0.715 19947
7267 1 21 . 1 1 65 65 GLY N N 65 110.500 110.500 112.854 -2.354 19947
7268 1 21 . 1 1 65 65 GLY CA C 65 45.100 45.100 44.576 0.524 19947
7269 1 21 . 1 1 65 65 GLY H H 65 8.040 8.040 8.362 -0.322 19947
7270 1 21 . 1 1 66 66 ASP N N 66 120.700 120.700 119.513 1.187 19947
7271 1 21 . 1 1 66 66 ASP HA H 66 4.610 4.610 4.453 0.157 19947
7272 1 21 . 1 1 66 66 ASP CA C 66 53.300 53.300 53.608 -0.309 19947
7273 1 21 . 1 1 66 66 ASP CB C 66 37.600 37.600 40.386 -2.786 19947
7274 1 21 . 1 1 66 66 ASP H H 66 8.380 8.380 7.331 1.049 19947
7275 1 21 . 1 1 67 67 TRP N N 67 120.100 120.100 123.453 -3.353 19947
7276 1 21 . 1 1 67 67 TRP HA H 67 4.760 4.760 4.993 -0.233 19947
7277 1 21 . 1 1 67 67 TRP CA C 67 57.200 57.200 57.936 -0.736 19947
7278 1 21 . 1 1 67 67 TRP CB C 67 29.100 29.100 29.289 -0.189 19947
7279 1 21 . 1 1 67 67 TRP H H 67 7.950 7.950 7.836 0.114 19947
7280 1 21 . 1 1 68 68 ASN N N 68 118.400 118.400 118.435 -0.035 19947
7281 1 21 . 1 1 68 68 ASN HA H 68 4.790 4.790 4.916 -0.126 19947
7282 1 21 . 1 1 68 68 ASN CA C 68 52.800 52.800 53.863 -1.063 19947
7283 1 21 . 1 1 68 68 ASN CB C 68 39.300 39.300 39.952 -0.652 19947
7284 1 21 . 1 1 68 68 ASN H H 68 8.180 8.180 8.651 -0.471 19947
7285 1 21 . 1 1 69 69 ASP N N 69 118.500 118.500 119.048 -0.548 19947
7286 1 21 . 1 1 69 69 ASP HA H 69 4.620 4.620 4.440 0.180 19947
7287 1 21 . 1 1 69 69 ASP CA C 69 53.200 53.200 56.127 -2.928 19947
7288 1 21 . 1 1 69 69 ASP CB C 69 38.000 38.000 41.383 -3.383 19947
7289 1 21 . 1 1 69 69 ASP H H 69 8.130 8.130 8.529 -0.399 19947
7290 1 21 . 1 1 70 70 ASP N N 70 120.500 120.500 121.689 -1.189 19947
7291 1 21 . 1 1 70 70 ASP HA H 70 5.100 5.100 4.822 0.278 19947
7292 1 21 . 1 1 70 70 ASP CA C 70 52.500 52.500 54.038 -1.538 19947
7293 1 21 . 1 1 70 70 ASP CB C 70 42.600 42.600 41.104 1.496 19947
7294 1 21 . 1 1 70 70 ASP H H 70 8.140 8.140 8.359 -0.219 19947
7295 1 21 . 1 1 71 71 TYR N N 71 118.900 118.900 122.474 -3.574 19947
7296 1 21 . 1 1 71 71 TYR HA H 71 5.210 5.210 4.946 0.264 19947
7297 1 21 . 1 1 71 71 TYR CA C 71 56.300 56.300 57.210 -0.910 19947
7298 1 21 . 1 1 71 71 TYR CB C 71 42.200 42.200 42.780 -0.580 19947
7299 1 21 . 1 1 71 71 TYR H H 71 8.450 8.450 8.071 0.379 19947
7300 1 21 . 1 1 72 72 CYS N N 72 119.800 119.800 119.230 0.570 19947
7301 1 21 . 1 1 72 72 CYS HA H 72 4.900 4.900 4.613 0.287 19947
7302 1 21 . 1 1 72 72 CYS CA C 72 53.400 53.400 58.133 -4.733 19947
7303 1 21 . 1 1 72 72 CYS CB C 72 37.200 37.200 29.046 8.154 19947
7304 1 21 . 1 1 72 72 CYS H H 72 9.330 9.330 8.593 0.737 19947
7305 1 21 . 1 1 73 73 THR N N 73 112.700 112.700 114.283 -1.583 19947
7306 1 21 . 1 1 73 73 THR HA H 73 4.430 4.430 4.444 -0.014 19947
7307 1 21 . 1 1 73 73 THR CA C 73 62.300 62.300 61.519 0.781 19947
7308 1 21 . 1 1 73 73 THR CB C 73 71.300 71.300 70.370 0.930 19947
7309 1 21 . 1 1 73 73 THR H H 73 9.980 9.980 8.724 1.256 19947
7310 1 21 . 1 1 74 74 GLY N N 74 111.500 111.500 110.824 0.676 19947
7311 1 21 . 1 1 74 74 GLY CA C 74 45.300 45.300 46.176 -0.876 19947
7312 1 21 . 1 1 74 74 GLY H H 74 8.580 8.580 7.677 0.903 19947
7313 1 21 . 1 1 75 75 LYS N N 75 115.900 115.900 117.166 -1.266 19947
7314 1 21 . 1 1 75 75 LYS HA H 75 4.140 4.140 4.552 -0.412 19947
7315 1 21 . 1 1 75 75 LYS CA C 75 54.800 54.800 55.816 -1.016 19947
7316 1 21 . 1 1 75 75 LYS CB C 75 34.200 34.200 34.439 -0.239 19947
7317 1 21 . 1 1 75 75 LYS H H 75 7.900 7.900 7.624 0.276 19947
7318 1 21 . 1 1 76 76 SER N N 76 111.000 111.000 112.610 -1.610 19947
7319 1 21 . 1 1 76 76 SER HA H 76 4.160 4.160 3.731 0.429 19947
7320 1 21 . 1 1 76 76 SER CA C 76 61.400 61.400 56.229 5.171 19947
7321 1 21 . 1 1 76 76 SER CB C 76 64.300 64.300 65.194 -0.894 19947
7322 1 21 . 1 1 76 76 SER H H 76 6.520 6.520 7.027 -0.507 19947
7323 1 21 . 1 1 77 77 SER N N 77 117.100 117.100 115.130 1.970 19947
7324 1 21 . 1 1 77 77 SER HA H 77 4.220 4.220 4.576 -0.356 19947
7325 1 21 . 1 1 77 77 SER CA C 77 59.800 59.800 58.574 1.226 19947
7326 1 21 . 1 1 77 77 SER CB C 77 64.400 64.400 63.770 0.631 19947
7327 1 21 . 1 1 77 77 SER H H 77 9.030 9.030 8.252 0.778 19947
7328 1 21 . 1 1 78 78 ASP N N 78 122.100 122.100 121.096 1.004 19947
7329 1 21 . 1 1 78 78 ASP HA H 78 4.930 4.930 4.771 0.159 19947
7330 1 21 . 1 1 78 78 ASP CA C 78 52.400 52.400 53.221 -0.821 19947
7331 1 21 . 1 1 78 78 ASP CB C 78 40.800 40.800 43.812 -3.012 19947
7332 1 21 . 1 1 78 78 ASP H H 78 8.340 8.340 7.542 0.798 19947
7333 1 21 . 1 1 79 79 CYS N N 79 122.200 122.200 123.676 -1.476 19947
7334 1 21 . 1 1 79 79 CYS HA H 79 5.320 5.320 4.789 0.531 19947
7335 1 21 . 1 1 79 79 CYS CA C 79 52.000 52.000 54.441 -2.441 19947
7336 1 21 . 1 1 79 79 CYS CB C 79 39.300 39.300 27.402 11.898 19947
7337 1 21 . 1 1 79 79 CYS H H 79 8.960 8.960 8.347 0.613 19947
7338 1 21 . 1 1 80 80 PRO HA H 80 4.410 4.410 4.007 0.403 19947
7339 1 21 . 1 1 80 80 PRO CA C 80 63.500 63.500 62.616 0.884 19947
7340 1 21 . 1 1 80 80 PRO CB C 80 32.400 32.400 32.669 -0.269 19947
7341 1 21 . 1 1 81 81 TRP N N 81 120.500 120.500 118.062 2.438 19947
7342 1 21 . 1 1 81 81 TRP HA H 81 4.550 4.550 4.488 0.062 19947
7343 1 21 . 1 1 81 81 TRP CA C 81 56.400 56.400 57.178 -0.778 19947
7344 1 21 . 1 1 81 81 TRP CB C 81 29.500 29.500 29.063 0.437 19947
7345 1 21 . 1 1 81 81 TRP H H 81 8.400 8.400 7.735 0.665 19947
7346 1 21 . 1 1 82 82 ASN N N 82 120.400 120.400 113.202 7.198 19947
7347 1 21 . 1 1 82 82 ASN HA H 82 4.750 4.750 4.520 0.230 19947
7348 1 21 . 1 1 82 82 ASN CA C 82 53.100 53.100 53.255 -0.155 19947
7349 1 21 . 1 1 82 82 ASN CB C 82 39.000 39.000 37.693 1.307 19947
7350 1 21 . 1 1 82 82 ASN H H 82 8.040 8.040 8.182 -0.142 19947
7351 1 22 . 1 1 2 2 PRO HA H 2 4.820 4.820 4.725 0.095 19947
7352 1 22 . 1 1 2 2 PRO CA C 2 61.900 61.900 62.305 -0.405 19947
7353 1 22 . 1 1 2 2 PRO CB C 2 30.700 30.700 31.547 -0.847 19947
7354 1 22 . 1 1 3 3 PRO HA H 3 4.540 4.540 4.583 -0.043 19947
7355 1 22 . 1 1 3 3 PRO CA C 3 62.900 62.900 62.121 0.779 19947
7356 1 22 . 1 1 3 3 PRO CB C 3 32.100 32.100 32.984 -0.884 19947
7357 1 22 . 1 1 4 4 VAL N N 4 121.900 121.900 120.035 1.865 19947
7358 1 22 . 1 1 4 4 VAL HA H 4 4.200 4.200 4.228 -0.028 19947
7359 1 22 . 1 1 4 4 VAL CA C 4 62.300 62.300 62.260 0.040 19947
7360 1 22 . 1 1 4 4 VAL CB C 4 32.800 32.800 30.605 2.195 19947
7361 1 22 . 1 1 4 4 VAL H H 4 8.330 8.330 8.260 0.070 19947
7362 1 22 . 1 1 5 5 CYS N N 5 120.900 120.900 128.377 -7.477 19947
7363 1 22 . 1 1 5 5 CYS HA H 5 4.700 4.700 4.367 0.333 19947
7364 1 22 . 1 1 5 5 CYS CA C 5 53.600 53.600 60.143 -6.543 19947
7365 1 22 . 1 1 5 5 CYS H H 5 8.500 8.500 8.543 -0.043 19947
7366 1 22 . 1 1 6 6 GLY N N 6 110.200 110.200 114.175 -3.975 19947
7367 1 22 . 1 1 6 6 GLY CA C 6 46.300 46.300 44.819 1.481 19947
7368 1 22 . 1 1 6 6 GLY H H 6 8.490 8.490 8.428 0.062 19947
7369 1 22 . 1 1 7 7 ASN N N 7 120.100 120.100 117.143 2.957 19947
7370 1 22 . 1 1 7 7 ASN HA H 7 4.730 4.730 4.248 0.482 19947
7371 1 22 . 1 1 7 7 ASN CA C 7 53.200 53.200 54.195 -0.995 19947
7372 1 22 . 1 1 7 7 ASN CB C 7 38.700 38.700 38.969 -0.270 19947
7373 1 22 . 1 1 7 7 ASN H H 7 8.320 8.320 8.283 0.037 19947
7374 1 22 . 1 1 8 8 LYS N N 8 121.300 121.300 123.546 -2.246 19947
7375 1 22 . 1 1 8 8 LYS HA H 8 4.340 4.340 4.121 0.219 19947
7376 1 22 . 1 1 8 8 LYS CA C 8 56.600 56.600 56.521 0.079 19947
7377 1 22 . 1 1 8 8 LYS CB C 8 32.900 32.900 31.696 1.204 19947
7378 1 22 . 1 1 8 8 LYS H H 8 8.260 8.260 8.360 -0.100 19947
7379 1 22 . 1 1 9 9 ILE N N 9 136.600 136.600 121.241 15.359 19947
7380 1 22 . 1 1 9 9 ILE HA H 9 4.140 4.140 3.807 0.333 19947
7381 1 22 . 1 1 9 9 ILE CA C 9 61.300 61.300 62.462 -1.162 19947
7382 1 22 . 1 1 9 9 ILE CB C 9 38.200 38.200 38.486 -0.286 19947
7383 1 22 . 1 1 9 9 ILE H H 9 8.150 8.150 8.327 -0.177 19947
7384 1 22 . 1 1 10 10 LEU N N 10 125.700 125.700 121.067 4.633 19947
7385 1 22 . 1 1 10 10 LEU HA H 10 4.420 4.420 4.538 -0.118 19947
7386 1 22 . 1 1 10 10 LEU CA C 10 55.200 55.200 54.380 0.820 19947
7387 1 22 . 1 1 10 10 LEU CB C 10 42.300 42.300 41.396 0.904 19947
7388 1 22 . 1 1 10 10 LEU H H 10 8.230 8.230 8.078 0.152 19947
7389 1 22 . 1 1 11 11 GLU N N 11 120.600 120.600 115.517 5.083 19947
7390 1 22 . 1 1 11 11 GLU HA H 11 4.470 4.470 4.200 0.270 19947
7391 1 22 . 1 1 11 11 GLU CA C 11 55.500 55.500 56.506 -1.006 19947
7392 1 22 . 1 1 11 11 GLU CB C 11 28.900 28.900 28.988 -0.089 19947
7393 1 22 . 1 1 11 11 GLU H H 11 8.250 8.250 8.202 0.048 19947
7394 1 22 . 1 1 12 12 GLN N N 12 121.600 121.600 116.092 5.508 19947
7395 1 22 . 1 1 12 12 GLN HA H 12 4.350 4.350 4.674 -0.324 19947
7396 1 22 . 1 1 12 12 GLN CA C 12 56.600 56.600 55.283 1.317 19947
7397 1 22 . 1 1 12 12 GLN CB C 12 29.200 29.200 28.555 0.645 19947
7398 1 22 . 1 1 12 12 GLN H H 12 8.460 8.460 7.822 0.638 19947
7399 1 22 . 1 1 13 13 GLY N N 13 110.700 110.700 109.770 0.930 19947
7400 1 22 . 1 1 13 13 GLY CA C 13 45.700 45.700 47.816 -2.116 19947
7401 1 22 . 1 1 13 13 GLY H H 13 8.660 8.660 8.844 -0.184 19947
7402 1 22 . 1 1 14 14 GLU N N 14 118.900 118.900 116.294 2.606 19947
7403 1 22 . 1 1 14 14 GLU HA H 14 4.530 4.530 4.310 0.220 19947
7404 1 22 . 1 1 14 14 GLU CA C 14 55.600 55.600 56.723 -1.123 19947
7405 1 22 . 1 1 14 14 GLU CB C 14 29.700 29.700 29.521 0.179 19947
7406 1 22 . 1 1 14 14 GLU H H 14 8.230 8.230 7.963 0.267 19947
7407 1 22 . 1 1 15 15 ASP N N 15 118.400 118.400 122.266 -3.866 19947
7408 1 22 . 1 1 15 15 ASP HA H 15 4.990 4.990 4.410 0.580 19947
7409 1 22 . 1 1 15 15 ASP CA C 15 53.500 53.500 56.835 -3.335 19947
7410 1 22 . 1 1 15 15 ASP CB C 15 39.700 39.700 40.995 -1.295 19947
7411 1 22 . 1 1 15 15 ASP H H 15 8.330 8.330 8.583 -0.253 19947
7412 1 22 . 1 1 16 16 CYS HA H 16 4.340 4.340 4.493 -0.153 19947
7413 1 22 . 1 1 16 16 CYS H H 16 8.510 8.510 7.788 0.722 19947
7414 1 22 . 1 1 17 17 ASP N N 17 116.700 116.700 124.782 -8.082 19947
7415 1 22 . 1 1 17 17 ASP HA H 17 4.740 4.740 4.516 0.224 19947
7416 1 22 . 1 1 17 17 ASP CA C 17 53.100 53.100 55.314 -2.214 19947
7417 1 22 . 1 1 17 17 ASP CB C 17 38.600 38.600 40.216 -1.616 19947
7418 1 22 . 1 1 17 17 ASP H H 17 8.180 8.180 8.330 -0.150 19947
7419 1 22 . 1 1 18 18 CYS HA H 18 4.730 4.730 4.618 0.112 19947
7420 1 22 . 1 1 18 18 CYS CB C 18 41.900 41.900 30.706 11.194 19947
7421 1 22 . 1 1 19 19 GLY H H 19 8.220 8.220 8.114 0.106 19947
7422 1 22 . 1 1 20 20 SER HA H 20 4.920 4.920 4.797 0.123 19947
7423 1 22 . 1 1 20 20 SER CA C 20 55.700 55.700 54.890 0.810 19947
7424 1 22 . 1 1 20 20 SER CB C 20 63.500 63.500 62.823 0.677 19947
7425 1 22 . 1 1 20 20 SER H H 20 7.830 7.830 7.881 -0.051 19947
7426 1 22 . 1 1 21 21 PRO HA H 21 4.240 4.240 4.123 0.117 19947
7427 1 22 . 1 1 21 21 PRO CA C 21 63.400 63.400 65.114 -1.714 19947
7428 1 22 . 1 1 21 21 PRO CB C 21 31.800 31.800 31.408 0.392 19947
7429 1 22 . 1 1 22 22 ALA N N 22 119.900 119.900 118.047 1.853 19947
7430 1 22 . 1 1 22 22 ALA HA H 22 4.220 4.220 4.118 0.102 19947
7431 1 22 . 1 1 22 22 ALA CA C 22 54.200 54.200 53.625 0.575 19947
7432 1 22 . 1 1 22 22 ALA CB C 22 18.500 18.500 18.463 0.037 19947
7433 1 22 . 1 1 22 22 ALA H H 22 8.180 8.180 8.176 0.004 19947
7434 1 22 . 1 1 23 23 ASN N N 23 116.300 116.300 112.120 4.180 19947
7435 1 22 . 1 1 23 23 ASN HA H 23 4.670 4.670 4.906 -0.236 19947
7436 1 22 . 1 1 23 23 ASN CA C 23 53.200 53.200 51.912 1.288 19947
7437 1 22 . 1 1 23 23 ASN CB C 23 39.300 39.300 40.526 -1.226 19947
7438 1 22 . 1 1 23 23 ASN H H 23 7.960 7.960 8.354 -0.394 19947
7439 1 22 . 1 1 24 24 CYS HA H 24 4.720 4.720 4.218 0.502 19947
7440 1 22 . 1 1 24 24 CYS H H 24 8.510 8.510 7.598 0.912 19947
7441 1 22 . 1 1 25 25 GLN HA H 25 4.460 4.460 3.874 0.586 19947
7442 1 22 . 1 1 25 25 GLN H H 25 8.320 8.320 8.683 -0.363 19947
7443 1 22 . 1 1 26 26 ASP HA H 26 4.740 4.740 4.595 0.145 19947
7444 1 22 . 1 1 26 26 ASP H H 26 8.580 8.580 8.169 0.411 19947
7445 1 22 . 1 1 27 27 ARG HA H 27 4.680 4.680 4.224 0.456 19947
7446 1 22 . 1 1 27 27 ARG CA C 27 54.700 54.700 58.278 -3.578 19947
7447 1 22 . 1 1 27 27 ARG H H 27 8.550 8.550 8.257 0.293 19947
7448 1 22 . 1 1 28 28 CYS HA H 28 4.120 4.120 4.877 -0.757 19947
7449 1 22 . 1 1 28 28 CYS CA C 28 54.400 54.400 58.197 -3.796 19947
7450 1 22 . 1 1 28 28 CYS CB C 28 19.000 19.000 27.556 -8.556 19947
7451 1 22 . 1 1 28 28 CYS H H 28 8.910 8.910 8.514 0.396 19947
7452 1 22 . 1 1 29 29 CYS N N 29 113.300 113.300 118.912 -5.612 19947
7453 1 22 . 1 1 29 29 CYS HA H 29 5.010 5.010 4.740 0.270 19947
7454 1 22 . 1 1 29 29 CYS CA C 29 54.300 54.300 56.939 -2.639 19947
7455 1 22 . 1 1 29 29 CYS H H 29 7.730 7.730 7.844 -0.114 19947
7456 1 22 . 1 1 30 30 ASN HA H 30 4.730 4.730 4.896 -0.166 19947
7457 1 22 . 1 1 30 30 ASN CB C 30 38.700 38.700 39.394 -0.694 19947
7458 1 22 . 1 1 30 30 ASN H H 30 8.870 8.870 8.383 0.487 19947
7459 1 22 . 1 1 31 31 ALA N N 31 129.400 129.400 126.862 2.538 19947
7460 1 22 . 1 1 31 31 ALA HA H 31 4.120 4.120 4.153 -0.033 19947
7461 1 22 . 1 1 31 31 ALA CA C 31 54.400 54.400 54.606 -0.206 19947
7462 1 22 . 1 1 31 31 ALA CB C 31 19.000 19.000 19.277 -0.277 19947
7463 1 22 . 1 1 31 31 ALA H H 31 8.890 8.890 8.217 0.673 19947
7464 1 22 . 1 1 32 32 ALA N N 32 116.400 116.400 117.039 -0.639 19947
7465 1 22 . 1 1 32 32 ALA HA H 32 4.340 4.340 4.325 0.015 19947
7466 1 22 . 1 1 32 32 ALA CA C 32 53.800 53.800 53.666 0.133 19947
7467 1 22 . 1 1 32 32 ALA CB C 32 19.100 19.100 18.291 0.809 19947
7468 1 22 . 1 1 32 32 ALA H H 32 8.250 8.250 8.262 -0.012 19947
7469 1 22 . 1 1 33 33 THR N N 33 104.300 104.300 109.269 -4.969 19947
7470 1 22 . 1 1 33 33 THR HA H 33 4.430 4.430 4.378 0.052 19947
7471 1 22 . 1 1 33 33 THR CA C 33 60.500 60.500 61.118 -0.618 19947
7472 1 22 . 1 1 33 33 THR CB C 33 70.600 70.600 69.642 0.958 19947
7473 1 22 . 1 1 33 33 THR H H 33 7.320 7.320 7.397 -0.077 19947
7474 1 22 . 1 1 34 34 CYS N N 34 123.400 123.400 121.656 1.744 19947
7475 1 22 . 1 1 34 34 CYS HA H 34 4.170 4.170 4.310 -0.140 19947
7476 1 22 . 1 1 34 34 CYS CA C 34 56.500 56.500 60.413 -3.913 19947
7477 1 22 . 1 1 34 34 CYS H H 34 8.710 8.710 8.309 0.401 19947
7478 1 22 . 1 1 35 35 LYS N N 35 116.900 116.900 117.922 -1.022 19947
7479 1 22 . 1 1 35 35 LYS HA H 35 4.960 4.960 4.612 0.348 19947
7480 1 22 . 1 1 35 35 LYS CA C 35 53.900 53.900 55.450 -1.550 19947
7481 1 22 . 1 1 35 35 LYS CB C 35 35.900 35.900 35.988 -0.088 19947
7482 1 22 . 1 1 35 35 LYS H H 35 7.450 7.450 7.652 -0.202 19947
7483 1 22 . 1 1 36 36 LEU N N 36 119.300 119.300 122.750 -3.450 19947
7484 1 22 . 1 1 36 36 LEU HA H 36 4.800 4.800 4.320 0.480 19947
7485 1 22 . 1 1 36 36 LEU CB C 36 42.400 42.400 40.906 1.494 19947
7486 1 22 . 1 1 36 36 LEU H H 36 8.290 8.290 8.436 -0.146 19947
7487 1 22 . 1 1 37 37 THR HA H 37 4.340 4.340 4.565 -0.225 19947
7488 1 22 . 1 1 37 37 THR CA C 37 60.200 60.200 59.838 0.362 19947
7489 1 22 . 1 1 37 37 THR CB C 37 67.700 67.700 68.717 -1.017 19947
7490 1 22 . 1 1 37 37 THR H H 37 8.380 8.380 7.852 0.528 19947
7491 1 22 . 1 1 38 38 PRO HA H 38 4.380 4.380 4.140 0.240 19947
7492 1 22 . 1 1 38 38 PRO CA C 38 64.800 64.800 64.095 0.705 19947
7493 1 22 . 1 1 38 38 PRO CB C 38 31.500 31.500 31.668 -0.168 19947
7494 1 22 . 1 1 39 39 GLY N N 39 113.300 113.300 111.028 2.272 19947
7495 1 22 . 1 1 39 39 GLY CA C 39 45.100 45.100 45.007 0.093 19947
7496 1 22 . 1 1 39 39 GLY H H 39 8.830 8.830 8.436 0.394 19947
7497 1 22 . 1 1 40 40 SER N N 40 116.700 116.700 116.935 -0.235 19947
7498 1 22 . 1 1 40 40 SER HA H 40 4.610 4.610 4.901 -0.291 19947
7499 1 22 . 1 1 40 40 SER CA C 40 58.800 58.800 56.725 2.075 19947
7500 1 22 . 1 1 40 40 SER CB C 40 63.800 63.800 64.010 -0.210 19947
7501 1 22 . 1 1 40 40 SER H H 40 8.280 8.280 7.676 0.604 19947
7502 1 22 . 1 1 41 41 GLN N N 41 120.600 120.600 125.827 -5.227 19947
7503 1 22 . 1 1 41 41 GLN HA H 41 4.110 4.110 4.010 0.100 19947
7504 1 22 . 1 1 41 41 GLN CA C 41 55.200 55.200 57.185 -1.985 19947
7505 1 22 . 1 1 41 41 GLN CB C 41 31.100 31.100 28.971 2.129 19947
7506 1 22 . 1 1 41 41 GLN H H 41 9.190 9.190 8.089 1.101 19947
7507 1 22 . 1 1 42 42 CYS N N 42 113.200 113.200 110.824 2.376 19947
7508 1 22 . 1 1 42 42 CYS HA H 42 4.630 4.630 4.580 0.050 19947
7509 1 22 . 1 1 42 42 CYS CA C 42 53.700 53.700 57.665 -3.965 19947
7510 1 22 . 1 1 42 42 CYS CB C 42 45.500 45.500 29.073 16.427 19947
7511 1 22 . 1 1 42 42 CYS H H 42 7.710 7.710 7.238 0.472 19947
7512 1 22 . 1 1 43 43 ASN N N 43 114.200 114.200 117.906 -3.706 19947
7513 1 22 . 1 1 43 43 ASN HA H 43 4.940 4.940 4.698 0.242 19947
7514 1 22 . 1 1 43 43 ASN CA C 43 53.000 53.000 53.626 -0.626 19947
7515 1 22 . 1 1 43 43 ASN CB C 43 39.300 39.300 40.870 -1.571 19947
7516 1 22 . 1 1 43 43 ASN H H 43 8.870 8.870 8.739 0.131 19947
7517 1 22 . 1 1 44 44 TYR N N 44 118.400 118.400 117.137 1.263 19947
7518 1 22 . 1 1 44 44 TYR HA H 44 4.850 4.850 4.805 0.045 19947
7519 1 22 . 1 1 44 44 TYR CA C 44 55.300 55.300 56.766 -1.466 19947
7520 1 22 . 1 1 44 44 TYR CB C 44 40.700 40.700 40.801 -0.101 19947
7521 1 22 . 1 1 44 44 TYR H H 44 7.840 7.840 7.968 -0.128 19947
7522 1 22 . 1 1 45 45 GLY N N 45 110.600 110.600 111.047 -0.447 19947
7523 1 22 . 1 1 45 45 GLY CA C 45 44.000 44.000 44.971 -0.971 19947
7524 1 22 . 1 1 45 45 GLY H H 45 7.960 7.960 7.829 0.131 19947
7525 1 22 . 1 1 46 46 GLU N N 46 120.700 120.700 119.652 1.048 19947
7526 1 22 . 1 1 46 46 GLU HA H 46 4.280 4.280 4.083 0.197 19947
7527 1 22 . 1 1 46 46 GLU CA C 46 58.500 58.500 60.230 -1.730 19947
7528 1 22 . 1 1 46 46 GLU CB C 46 29.300 29.300 30.197 -0.897 19947
7529 1 22 . 1 1 46 46 GLU H H 46 9.160 9.160 8.663 0.497 19947
7530 1 22 . 1 1 47 47 CYS N N 47 112.400 112.400 118.699 -6.299 19947
7531 1 22 . 1 1 47 47 CYS HA H 47 4.850 4.850 4.879 -0.029 19947
7532 1 22 . 1 1 47 47 CYS CA C 47 57.100 57.100 57.789 -0.689 19947
7533 1 22 . 1 1 47 47 CYS CB C 47 41.200 41.200 25.539 15.661 19947
7534 1 22 . 1 1 47 47 CYS H H 47 8.510 8.510 7.596 0.914 19947
7535 1 22 . 1 1 48 48 CYS N N 48 123.200 123.200 122.399 0.801 19947
7536 1 22 . 1 1 48 48 CYS HA H 48 5.160 5.160 5.134 0.026 19947
7537 1 22 . 1 1 48 48 CYS CA C 48 54.700 54.700 59.403 -4.703 19947
7538 1 22 . 1 1 48 48 CYS CB C 48 45.700 45.700 29.306 16.393 19947
7539 1 22 . 1 1 48 48 CYS H H 48 7.810 7.810 7.918 -0.108 19947
7540 1 22 . 1 1 49 49 ASP N N 49 127.400 127.400 125.213 2.187 19947
7541 1 22 . 1 1 49 49 ASP HA H 49 4.890 4.890 4.874 0.016 19947
7542 1 22 . 1 1 49 49 ASP CA C 49 53.500 53.500 54.383 -0.883 19947
7543 1 22 . 1 1 49 49 ASP CB C 49 42.400 42.400 43.568 -1.168 19947
7544 1 22 . 1 1 49 49 ASP H H 49 9.670 9.670 8.907 0.763 19947
7545 1 22 . 1 1 50 50 GLN N N 50 127.000 127.000 125.198 1.802 19947
7546 1 22 . 1 1 50 50 GLN HA H 50 3.940 3.940 3.977 -0.037 19947
7547 1 22 . 1 1 50 50 GLN CA C 50 56.800 56.800 56.591 0.209 19947
7548 1 22 . 1 1 50 50 GLN CB C 50 26.500 26.500 27.694 -1.194 19947
7549 1 22 . 1 1 50 50 GLN H H 50 9.450 9.450 8.708 0.742 19947
7550 1 22 . 1 1 51 51 CYS N N 51 106.100 106.100 111.816 -5.716 19947
7551 1 22 . 1 1 51 51 CYS HA H 51 4.760 4.760 4.353 0.407 19947
7552 1 22 . 1 1 51 51 CYS CB C 51 43.200 43.200 24.895 18.305 19947
7553 1 22 . 1 1 51 51 CYS H H 51 8.700 8.700 8.601 0.099 19947
7554 1 22 . 1 1 52 52 ARG N N 52 121.000 121.000 117.054 3.946 19947
7555 1 22 . 1 1 52 52 ARG HA H 52 4.690 4.690 4.489 0.201 19947
7556 1 22 . 1 1 52 52 ARG CA C 52 55.400 55.400 53.604 1.796 19947
7557 1 22 . 1 1 52 52 ARG CB C 52 33.100 33.100 33.480 -0.380 19947
7558 1 22 . 1 1 52 52 ARG H H 52 7.960 7.960 7.154 0.806 19947
7559 1 22 . 1 1 53 53 PHE N N 53 120.300 120.300 121.298 -0.998 19947
7560 1 22 . 1 1 53 53 PHE HA H 53 5.050 5.050 5.053 -0.003 19947
7561 1 22 . 1 1 53 53 PHE CA C 53 56.100 56.100 56.670 -0.570 19947
7562 1 22 . 1 1 53 53 PHE CB C 53 38.200 38.200 39.289 -1.089 19947
7563 1 22 . 1 1 53 53 PHE H H 53 8.400 8.400 8.430 -0.030 19947
7564 1 22 . 1 1 54 54 LYS N N 54 123.300 123.300 125.888 -2.588 19947
7565 1 22 . 1 1 54 54 LYS HA H 54 4.250 4.250 4.135 0.115 19947
7566 1 22 . 1 1 54 54 LYS CA C 54 57.500 57.500 56.764 0.736 19947
7567 1 22 . 1 1 54 54 LYS CB C 54 34.300 34.300 32.471 1.829 19947
7568 1 22 . 1 1 54 54 LYS H H 54 8.540 8.540 8.807 -0.267 19947
7569 1 22 . 1 1 55 55 LYS N N 55 119.400 119.400 125.290 -5.890 19947
7570 1 22 . 1 1 55 55 LYS HA H 55 4.110 4.110 4.013 0.097 19947
7571 1 22 . 1 1 55 55 LYS CA C 55 56.500 56.500 56.757 -0.257 19947
7572 1 22 . 1 1 55 55 LYS CB C 55 33.400 33.400 33.391 0.009 19947
7573 1 22 . 1 1 55 55 LYS H H 55 8.440 8.440 8.295 0.145 19947
7574 1 22 . 1 1 56 56 ALA N N 56 126.700 126.700 128.011 -1.311 19947
7575 1 22 . 1 1 56 56 ALA HA H 56 3.920 3.920 4.093 -0.173 19947
7576 1 22 . 1 1 56 56 ALA CA C 56 52.900 52.900 53.814 -0.914 19947
7577 1 22 . 1 1 56 56 ALA CB C 56 18.100 18.100 18.365 -0.265 19947
7578 1 22 . 1 1 56 56 ALA H H 56 8.930 8.930 8.673 0.257 19947
7579 1 22 . 1 1 57 57 GLY N N 57 109.300 109.300 111.461 -2.161 19947
7580 1 22 . 1 1 57 57 GLY CA C 57 45.100 45.100 44.884 0.216 19947
7581 1 22 . 1 1 57 57 GLY H H 57 8.460 8.460 8.415 0.045 19947
7582 1 22 . 1 1 58 58 THR N N 58 117.200 117.200 119.988 -2.788 19947
7583 1 22 . 1 1 58 58 THR HA H 58 4.260 4.260 4.498 -0.238 19947
7584 1 22 . 1 1 58 58 THR CA C 58 63.300 63.300 62.694 0.606 19947
7585 1 22 . 1 1 58 58 THR CB C 58 69.600 69.600 68.527 1.073 19947
7586 1 22 . 1 1 58 58 THR H H 58 7.660 7.660 7.806 -0.146 19947
7587 1 22 . 1 1 59 59 VAL N N 59 130.400 130.400 127.523 2.877 19947
7588 1 22 . 1 1 59 59 VAL HA H 59 3.900 3.900 3.620 0.280 19947
7589 1 22 . 1 1 59 59 VAL CA C 59 64.400 64.400 63.102 1.298 19947
7590 1 22 . 1 1 59 59 VAL CB C 59 31.900 31.900 31.800 0.100 19947
7591 1 22 . 1 1 59 59 VAL H H 59 9.190 9.190 8.839 0.351 19947
7592 1 22 . 1 1 60 60 CYS N N 60 121.800 121.800 126.038 -4.238 19947
7593 1 22 . 1 1 60 60 CYS HA H 60 5.050 5.050 4.653 0.397 19947
7594 1 22 . 1 1 60 60 CYS CA C 60 54.400 54.400 58.109 -3.709 19947
7595 1 22 . 1 1 60 60 CYS CB C 60 43.000 43.000 28.112 14.888 19947
7596 1 22 . 1 1 60 60 CYS H H 60 9.130 9.130 8.474 0.656 19947
7597 1 22 . 1 1 61 61 ARG N N 61 124.100 124.100 118.844 5.256 19947
7598 1 22 . 1 1 61 61 ARG HA H 61 4.360 4.360 4.548 -0.188 19947
7599 1 22 . 1 1 61 61 ARG CA C 61 56.800 56.800 55.436 1.364 19947
7600 1 22 . 1 1 61 61 ARG CB C 61 32.800 32.800 34.430 -1.630 19947
7601 1 22 . 1 1 61 61 ARG H H 61 7.580 7.580 7.406 0.174 19947
7602 1 22 . 1 1 62 62 ILE N N 62 126.200 126.200 117.904 8.296 19947
7603 1 22 . 1 1 62 62 ILE HA H 62 4.090 4.090 4.405 -0.315 19947
7604 1 22 . 1 1 62 62 ILE CA C 62 60.300 60.300 60.732 -0.432 19947
7605 1 22 . 1 1 62 62 ILE CB C 62 38.700 38.700 40.184 -1.484 19947
7606 1 22 . 1 1 62 62 ILE H H 62 8.490 8.490 8.099 0.391 19947
7607 1 22 . 1 1 63 63 ALA N N 63 129.400 129.400 131.234 -1.834 19947
7608 1 22 . 1 1 63 63 ALA HA H 63 4.310 4.310 4.383 -0.073 19947
7609 1 22 . 1 1 63 63 ALA CA C 63 51.900 51.900 54.367 -2.467 19947
7610 1 22 . 1 1 63 63 ALA CB C 63 20.600 20.600 19.122 1.478 19947
7611 1 22 . 1 1 63 63 ALA H H 63 8.100 8.100 8.133 -0.033 19947
7612 1 22 . 1 1 64 64 ARG N N 64 120.500 120.500 120.493 0.007 19947
7613 1 22 . 1 1 64 64 ARG HA H 64 4.290 4.290 4.527 -0.237 19947
7614 1 22 . 1 1 64 64 ARG CA C 64 56.200 56.200 55.676 0.524 19947
7615 1 22 . 1 1 64 64 ARG CB C 64 30.500 30.500 29.412 1.088 19947
7616 1 22 . 1 1 64 64 ARG H H 64 8.140 8.140 8.879 -0.739 19947
7617 1 22 . 1 1 65 65 GLY N N 65 110.500 110.500 112.714 -2.214 19947
7618 1 22 . 1 1 65 65 GLY CA C 65 45.100 45.100 44.602 0.497 19947
7619 1 22 . 1 1 65 65 GLY H H 65 8.040 8.040 8.364 -0.324 19947
7620 1 22 . 1 1 66 66 ASP N N 66 120.700 120.700 119.193 1.507 19947
7621 1 22 . 1 1 66 66 ASP HA H 66 4.610 4.610 4.544 0.066 19947
7622 1 22 . 1 1 66 66 ASP CA C 66 53.300 53.300 53.483 -0.183 19947
7623 1 22 . 1 1 66 66 ASP CB C 66 37.600 37.600 40.315 -2.715 19947
7624 1 22 . 1 1 66 66 ASP H H 66 8.380 8.380 7.256 1.124 19947
7625 1 22 . 1 1 67 67 TRP N N 67 120.100 120.100 122.579 -2.479 19947
7626 1 22 . 1 1 67 67 TRP HA H 67 4.760 4.760 5.064 -0.304 19947
7627 1 22 . 1 1 67 67 TRP CA C 67 57.200 57.200 57.921 -0.721 19947
7628 1 22 . 1 1 67 67 TRP CB C 67 29.100 29.100 29.606 -0.506 19947
7629 1 22 . 1 1 67 67 TRP H H 67 7.950 7.950 7.748 0.202 19947
7630 1 22 . 1 1 68 68 ASN N N 68 118.400 118.400 117.283 1.117 19947
7631 1 22 . 1 1 68 68 ASN HA H 68 4.790 4.790 5.010 -0.220 19947
7632 1 22 . 1 1 68 68 ASN CA C 68 52.800 52.800 53.760 -0.960 19947
7633 1 22 . 1 1 68 68 ASN CB C 68 39.300 39.300 40.454 -1.154 19947
7634 1 22 . 1 1 68 68 ASN H H 68 8.180 8.180 8.743 -0.563 19947
7635 1 22 . 1 1 69 69 ASP N N 69 118.500 118.500 119.484 -0.984 19947
7636 1 22 . 1 1 69 69 ASP HA H 69 4.620 4.620 4.464 0.156 19947
7637 1 22 . 1 1 69 69 ASP CA C 69 53.200 53.200 56.038 -2.838 19947
7638 1 22 . 1 1 69 69 ASP CB C 69 38.000 38.000 41.063 -3.063 19947
7639 1 22 . 1 1 69 69 ASP H H 69 8.130 8.130 8.590 -0.460 19947
7640 1 22 . 1 1 70 70 ASP N N 70 120.500 120.500 122.087 -1.587 19947
7641 1 22 . 1 1 70 70 ASP HA H 70 5.100 5.100 4.820 0.280 19947
7642 1 22 . 1 1 70 70 ASP CA C 70 52.500 52.500 54.947 -2.447 19947
7643 1 22 . 1 1 70 70 ASP CB C 70 42.600 42.600 42.096 0.504 19947
7644 1 22 . 1 1 70 70 ASP H H 70 8.140 8.140 8.393 -0.253 19947
7645 1 22 . 1 1 71 71 TYR N N 71 118.900 118.900 123.534 -4.634 19947
7646 1 22 . 1 1 71 71 TYR HA H 71 5.210 5.210 4.881 0.329 19947
7647 1 22 . 1 1 71 71 TYR CA C 71 56.300 56.300 57.492 -1.192 19947
7648 1 22 . 1 1 71 71 TYR CB C 71 42.200 42.200 43.058 -0.858 19947
7649 1 22 . 1 1 71 71 TYR H H 71 8.450 8.450 8.012 0.438 19947
7650 1 22 . 1 1 72 72 CYS N N 72 119.800 119.800 121.108 -1.308 19947
7651 1 22 . 1 1 72 72 CYS HA H 72 4.900 4.900 4.419 0.481 19947
7652 1 22 . 1 1 72 72 CYS CA C 72 53.400 53.400 60.442 -7.042 19947
7653 1 22 . 1 1 72 72 CYS CB C 72 37.200 37.200 28.595 8.605 19947
7654 1 22 . 1 1 72 72 CYS H H 72 9.330 9.330 8.572 0.758 19947
7655 1 22 . 1 1 73 73 THR N N 73 112.700 112.700 113.946 -1.246 19947
7656 1 22 . 1 1 73 73 THR HA H 73 4.430 4.430 4.379 0.051 19947
7657 1 22 . 1 1 73 73 THR CA C 73 62.300 62.300 61.052 1.248 19947
7658 1 22 . 1 1 73 73 THR CB C 73 71.300 71.300 69.591 1.709 19947
7659 1 22 . 1 1 73 73 THR H H 73 9.980 9.980 8.840 1.140 19947
7660 1 22 . 1 1 74 74 GLY N N 74 111.500 111.500 111.065 0.435 19947
7661 1 22 . 1 1 74 74 GLY CA C 74 45.300 45.300 46.467 -1.167 19947
7662 1 22 . 1 1 74 74 GLY H H 74 8.580 8.580 8.008 0.573 19947
7663 1 22 . 1 1 75 75 LYS N N 75 115.900 115.900 117.123 -1.223 19947
7664 1 22 . 1 1 75 75 LYS HA H 75 4.140 4.140 4.661 -0.521 19947
7665 1 22 . 1 1 75 75 LYS CA C 75 54.800 54.800 55.609 -0.809 19947
7666 1 22 . 1 1 75 75 LYS CB C 75 34.200 34.200 34.196 0.004 19947
7667 1 22 . 1 1 75 75 LYS H H 75 7.900 7.900 7.632 0.268 19947
7668 1 22 . 1 1 76 76 SER N N 76 111.000 111.000 112.801 -1.801 19947
7669 1 22 . 1 1 76 76 SER HA H 76 4.160 4.160 3.787 0.373 19947
7670 1 22 . 1 1 76 76 SER CA C 76 61.400 61.400 56.880 4.520 19947
7671 1 22 . 1 1 76 76 SER CB C 76 64.300 64.300 65.148 -0.848 19947
7672 1 22 . 1 1 76 76 SER H H 76 6.520 6.520 7.145 -0.625 19947
7673 1 22 . 1 1 77 77 SER N N 77 117.100 117.100 115.394 1.706 19947
7674 1 22 . 1 1 77 77 SER HA H 77 4.220 4.220 4.369 -0.149 19947
7675 1 22 . 1 1 77 77 SER CA C 77 59.800 59.800 58.889 0.911 19947
7676 1 22 . 1 1 77 77 SER CB C 77 64.400 64.400 63.923 0.477 19947
7677 1 22 . 1 1 77 77 SER H H 77 9.030 9.030 8.263 0.767 19947
7678 1 22 . 1 1 78 78 ASP N N 78 122.100 122.100 121.420 0.680 19947
7679 1 22 . 1 1 78 78 ASP HA H 78 4.930 4.930 4.820 0.110 19947
7680 1 22 . 1 1 78 78 ASP CA C 78 52.400 52.400 53.449 -1.049 19947
7681 1 22 . 1 1 78 78 ASP CB C 78 40.800 40.800 43.142 -2.342 19947
7682 1 22 . 1 1 78 78 ASP H H 78 8.340 8.340 7.657 0.683 19947
7683 1 22 . 1 1 79 79 CYS N N 79 122.200 122.200 124.674 -2.474 19947
7684 1 22 . 1 1 79 79 CYS HA H 79 5.320 5.320 4.835 0.485 19947
7685 1 22 . 1 1 79 79 CYS CA C 79 52.000 52.000 55.768 -3.768 19947
7686 1 22 . 1 1 79 79 CYS CB C 79 39.300 39.300 27.515 11.785 19947
7687 1 22 . 1 1 79 79 CYS H H 79 8.960 8.960 8.614 0.346 19947
7688 1 22 . 1 1 80 80 PRO HA H 80 4.410 4.410 4.654 -0.244 19947
7689 1 22 . 1 1 80 80 PRO CA C 80 63.500 63.500 63.062 0.438 19947
7690 1 22 . 1 1 80 80 PRO CB C 80 32.400 32.400 32.930 -0.530 19947
7691 1 22 . 1 1 81 81 TRP N N 81 120.500 120.500 121.068 -0.568 19947
7692 1 22 . 1 1 81 81 TRP HA H 81 4.550 4.550 4.893 -0.343 19947
7693 1 22 . 1 1 81 81 TRP CA C 81 56.400 56.400 53.361 3.039 19947
7694 1 22 . 1 1 81 81 TRP CB C 81 29.500 29.500 28.776 0.724 19947
7695 1 22 . 1 1 81 81 TRP H H 81 8.400 8.400 8.402 -0.002 19947
7696 1 22 . 1 1 82 82 ASN N N 82 120.400 120.400 123.980 -3.580 19947
7697 1 22 . 1 1 82 82 ASN HA H 82 4.750 4.750 4.187 0.563 19947
7698 1 22 . 1 1 82 82 ASN CA C 82 53.100 53.100 53.868 -0.768 19947
7699 1 22 . 1 1 82 82 ASN CB C 82 39.000 39.000 37.225 1.775 19947
7700 1 22 . 1 1 82 82 ASN H H 82 8.040 8.040 8.587 -0.547 19947
7701 1 23 . 1 1 2 2 PRO HA H 2 4.820 4.820 4.834 -0.014 19947
7702 1 23 . 1 1 2 2 PRO CA C 2 61.900 61.900 61.933 -0.033 19947
7703 1 23 . 1 1 2 2 PRO CB C 2 30.700 30.700 32.112 -1.412 19947
7704 1 23 . 1 1 3 3 PRO HA H 3 4.540 4.540 4.472 0.068 19947
7705 1 23 . 1 1 3 3 PRO CA C 3 62.900 62.900 62.574 0.326 19947
7706 1 23 . 1 1 3 3 PRO CB C 3 32.100 32.100 32.706 -0.607 19947
7707 1 23 . 1 1 4 4 VAL N N 4 121.900 121.900 125.463 -3.563 19947
7708 1 23 . 1 1 4 4 VAL HA H 4 4.200 4.200 4.173 0.027 19947
7709 1 23 . 1 1 4 4 VAL CA C 4 62.300 62.300 62.330 -0.030 19947
7710 1 23 . 1 1 4 4 VAL CB C 4 32.800 32.800 31.949 0.851 19947
7711 1 23 . 1 1 4 4 VAL H H 4 8.330 8.330 8.382 -0.052 19947
7712 1 23 . 1 1 5 5 CYS N N 5 120.900 120.900 128.274 -7.374 19947
7713 1 23 . 1 1 5 5 CYS HA H 5 4.700 4.700 4.501 0.199 19947
7714 1 23 . 1 1 5 5 CYS CA C 5 53.600 53.600 58.315 -4.715 19947
7715 1 23 . 1 1 5 5 CYS H H 5 8.500 8.500 8.524 -0.024 19947
7716 1 23 . 1 1 6 6 GLY N N 6 110.200 110.200 113.660 -3.460 19947
7717 1 23 . 1 1 6 6 GLY CA C 6 46.300 46.300 44.661 1.639 19947
7718 1 23 . 1 1 6 6 GLY H H 6 8.490 8.490 8.387 0.103 19947
7719 1 23 . 1 1 7 7 ASN N N 7 120.100 120.100 116.703 3.397 19947
7720 1 23 . 1 1 7 7 ASN HA H 7 4.730 4.730 4.313 0.417 19947
7721 1 23 . 1 1 7 7 ASN CA C 7 53.200 53.200 53.999 -0.799 19947
7722 1 23 . 1 1 7 7 ASN CB C 7 38.700 38.700 39.211 -0.511 19947
7723 1 23 . 1 1 7 7 ASN H H 7 8.320 8.320 8.250 0.070 19947
7724 1 23 . 1 1 8 8 LYS N N 8 121.300 121.300 124.539 -3.239 19947
7725 1 23 . 1 1 8 8 LYS HA H 8 4.340 4.340 4.303 0.037 19947
7726 1 23 . 1 1 8 8 LYS CA C 8 56.600 56.600 56.624 -0.024 19947
7727 1 23 . 1 1 8 8 LYS CB C 8 32.900 32.900 31.762 1.137 19947
7728 1 23 . 1 1 8 8 LYS H H 8 8.260 8.260 8.470 -0.210 19947
7729 1 23 . 1 1 9 9 ILE N N 9 136.600 136.600 124.092 12.508 19947
7730 1 23 . 1 1 9 9 ILE HA H 9 4.140 4.140 4.013 0.127 19947
7731 1 23 . 1 1 9 9 ILE CA C 9 61.300 61.300 62.480 -1.180 19947
7732 1 23 . 1 1 9 9 ILE CB C 9 38.200 38.200 37.431 0.769 19947
7733 1 23 . 1 1 9 9 ILE H H 9 8.150 8.150 7.959 0.191 19947
7734 1 23 . 1 1 10 10 LEU N N 10 125.700 125.700 121.648 4.052 19947
7735 1 23 . 1 1 10 10 LEU HA H 10 4.420 4.420 4.481 -0.061 19947
7736 1 23 . 1 1 10 10 LEU CA C 10 55.200 55.200 55.899 -0.699 19947
7737 1 23 . 1 1 10 10 LEU CB C 10 42.300 42.300 41.153 1.147 19947
7738 1 23 . 1 1 10 10 LEU H H 10 8.230 8.230 8.617 -0.387 19947
7739 1 23 . 1 1 11 11 GLU N N 11 120.600 120.600 113.699 6.901 19947
7740 1 23 . 1 1 11 11 GLU HA H 11 4.470 4.470 4.488 -0.018 19947
7741 1 23 . 1 1 11 11 GLU CA C 11 55.500 55.500 56.399 -0.899 19947
7742 1 23 . 1 1 11 11 GLU CB C 11 28.900 28.900 28.769 0.131 19947
7743 1 23 . 1 1 11 11 GLU H H 11 8.250 8.250 8.106 0.144 19947
7744 1 23 . 1 1 12 12 GLN N N 12 121.600 121.600 116.736 4.864 19947
7745 1 23 . 1 1 12 12 GLN HA H 12 4.350 4.350 4.842 -0.492 19947
7746 1 23 . 1 1 12 12 GLN CA C 12 56.600 56.600 55.342 1.258 19947
7747 1 23 . 1 1 12 12 GLN CB C 12 29.200 29.200 29.610 -0.410 19947
7748 1 23 . 1 1 12 12 GLN H H 12 8.460 8.460 7.764 0.696 19947
7749 1 23 . 1 1 13 13 GLY N N 13 110.700 110.700 108.423 2.277 19947
7750 1 23 . 1 1 13 13 GLY CA C 13 45.700 45.700 45.595 0.105 19947
7751 1 23 . 1 1 13 13 GLY H H 13 8.660 8.660 8.396 0.264 19947
7752 1 23 . 1 1 14 14 GLU N N 14 118.900 118.900 116.976 1.924 19947
7753 1 23 . 1 1 14 14 GLU HA H 14 4.530 4.530 4.293 0.237 19947
7754 1 23 . 1 1 14 14 GLU CA C 14 55.600 55.600 56.505 -0.905 19947
7755 1 23 . 1 1 14 14 GLU CB C 14 29.700 29.700 29.653 0.047 19947
7756 1 23 . 1 1 14 14 GLU H H 14 8.230 8.230 7.312 0.918 19947
7757 1 23 . 1 1 15 15 ASP N N 15 118.400 118.400 118.600 -0.200 19947
7758 1 23 . 1 1 15 15 ASP HA H 15 4.990 4.990 4.974 0.016 19947
7759 1 23 . 1 1 15 15 ASP CA C 15 53.500 53.500 55.411 -1.911 19947
7760 1 23 . 1 1 15 15 ASP CB C 15 39.700 39.700 44.777 -5.077 19947
7761 1 23 . 1 1 15 15 ASP H H 15 8.330 8.330 7.804 0.526 19947
7762 1 23 . 1 1 16 16 CYS HA H 16 4.340 4.340 4.653 -0.313 19947
7763 1 23 . 1 1 16 16 CYS H H 16 8.510 8.510 7.615 0.895 19947
7764 1 23 . 1 1 17 17 ASP N N 17 116.700 116.700 120.417 -3.717 19947
7765 1 23 . 1 1 17 17 ASP HA H 17 4.740 4.740 4.229 0.511 19947
7766 1 23 . 1 1 17 17 ASP CA C 17 53.100 53.100 55.777 -2.677 19947
7767 1 23 . 1 1 17 17 ASP CB C 17 38.600 38.600 39.365 -0.765 19947
7768 1 23 . 1 1 17 17 ASP H H 17 8.180 8.180 8.858 -0.678 19947
7769 1 23 . 1 1 18 18 CYS HA H 18 4.730 4.730 4.017 0.713 19947
7770 1 23 . 1 1 18 18 CYS CB C 18 41.900 41.900 26.577 15.323 19947
7771 1 23 . 1 1 19 19 GLY H H 19 8.220 8.220 8.441 -0.221 19947
7772 1 23 . 1 1 20 20 SER HA H 20 4.920 4.920 4.406 0.514 19947
7773 1 23 . 1 1 20 20 SER CA C 20 55.700 55.700 57.728 -2.028 19947
7774 1 23 . 1 1 20 20 SER CB C 20 63.500 63.500 63.016 0.485 19947
7775 1 23 . 1 1 20 20 SER H H 20 7.830 7.830 8.564 -0.734 19947
7776 1 23 . 1 1 21 21 PRO HA H 21 4.240 4.240 4.170 0.070 19947
7777 1 23 . 1 1 21 21 PRO CA C 21 63.400 63.400 64.888 -1.488 19947
7778 1 23 . 1 1 21 21 PRO CB C 21 31.800 31.800 31.422 0.378 19947
7779 1 23 . 1 1 22 22 ALA N N 22 119.900 119.900 117.045 2.855 19947
7780 1 23 . 1 1 22 22 ALA HA H 22 4.220 4.220 4.057 0.163 19947
7781 1 23 . 1 1 22 22 ALA CA C 22 54.200 54.200 53.889 0.311 19947
7782 1 23 . 1 1 22 22 ALA CB C 22 18.500 18.500 18.710 -0.210 19947
7783 1 23 . 1 1 22 22 ALA H H 22 8.180 8.180 8.293 -0.113 19947
7784 1 23 . 1 1 23 23 ASN N N 23 116.300 116.300 113.540 2.760 19947
7785 1 23 . 1 1 23 23 ASN HA H 23 4.670 4.670 4.949 -0.279 19947
7786 1 23 . 1 1 23 23 ASN CA C 23 53.200 53.200 52.541 0.659 19947
7787 1 23 . 1 1 23 23 ASN CB C 23 39.300 39.300 40.354 -1.054 19947
7788 1 23 . 1 1 23 23 ASN H H 23 7.960 7.960 8.165 -0.205 19947
7789 1 23 . 1 1 24 24 CYS HA H 24 4.720 4.720 4.281 0.439 19947
7790 1 23 . 1 1 24 24 CYS H H 24 8.510 8.510 7.371 1.139 19947
7791 1 23 . 1 1 25 25 GLN HA H 25 4.460 4.460 4.007 0.453 19947
7792 1 23 . 1 1 25 25 GLN H H 25 8.320 8.320 8.511 -0.191 19947
7793 1 23 . 1 1 26 26 ASP HA H 26 4.740 4.740 4.674 0.066 19947
7794 1 23 . 1 1 26 26 ASP H H 26 8.580 8.580 8.247 0.333 19947
7795 1 23 . 1 1 27 27 ARG HA H 27 4.680 4.680 4.276 0.404 19947
7796 1 23 . 1 1 27 27 ARG CA C 27 54.700 54.700 56.494 -1.794 19947
7797 1 23 . 1 1 27 27 ARG H H 27 8.550 8.550 8.233 0.317 19947
7798 1 23 . 1 1 28 28 CYS HA H 28 4.120 4.120 4.721 -0.601 19947
7799 1 23 . 1 1 28 28 CYS CA C 28 54.400 54.400 58.905 -4.505 19947
7800 1 23 . 1 1 28 28 CYS CB C 28 19.000 19.000 25.844 -6.844 19947
7801 1 23 . 1 1 28 28 CYS H H 28 8.910 8.910 8.608 0.302 19947
7802 1 23 . 1 1 29 29 CYS N N 29 113.300 113.300 119.286 -5.986 19947
7803 1 23 . 1 1 29 29 CYS HA H 29 5.010 5.010 4.508 0.502 19947
7804 1 23 . 1 1 29 29 CYS CA C 29 54.300 54.300 58.088 -3.788 19947
7805 1 23 . 1 1 29 29 CYS H H 29 7.730 7.730 7.880 -0.150 19947
7806 1 23 . 1 1 30 30 ASN HA H 30 4.730 4.730 4.852 -0.122 19947
7807 1 23 . 1 1 30 30 ASN CB C 30 38.700 38.700 39.952 -1.252 19947
7808 1 23 . 1 1 30 30 ASN H H 30 8.870 8.870 8.196 0.674 19947
7809 1 23 . 1 1 31 31 ALA N N 31 129.400 129.400 126.795 2.605 19947
7810 1 23 . 1 1 31 31 ALA HA H 31 4.120 4.120 4.237 -0.117 19947
7811 1 23 . 1 1 31 31 ALA CA C 31 54.400 54.400 54.196 0.204 19947
7812 1 23 . 1 1 31 31 ALA CB C 31 19.000 19.000 18.765 0.235 19947
7813 1 23 . 1 1 31 31 ALA H H 31 8.890 8.890 8.447 0.443 19947
7814 1 23 . 1 1 32 32 ALA N N 32 116.400 116.400 119.159 -2.759 19947
7815 1 23 . 1 1 32 32 ALA HA H 32 4.340 4.340 4.262 0.078 19947
7816 1 23 . 1 1 32 32 ALA CA C 32 53.800 53.800 53.276 0.524 19947
7817 1 23 . 1 1 32 32 ALA CB C 32 19.100 19.100 19.266 -0.166 19947
7818 1 23 . 1 1 32 32 ALA H H 32 8.250 8.250 8.028 0.222 19947
7819 1 23 . 1 1 33 33 THR N N 33 104.300 104.300 110.556 -6.256 19947
7820 1 23 . 1 1 33 33 THR HA H 33 4.430 4.430 4.404 0.026 19947
7821 1 23 . 1 1 33 33 THR CA C 33 60.500 60.500 61.472 -0.972 19947
7822 1 23 . 1 1 33 33 THR CB C 33 70.600 70.600 69.684 0.916 19947
7823 1 23 . 1 1 33 33 THR H H 33 7.320 7.320 8.231 -0.911 19947
7824 1 23 . 1 1 34 34 CYS N N 34 123.400 123.400 120.213 3.187 19947
7825 1 23 . 1 1 34 34 CYS HA H 34 4.170 4.170 4.269 -0.099 19947
7826 1 23 . 1 1 34 34 CYS CA C 34 56.500 56.500 59.851 -3.351 19947
7827 1 23 . 1 1 34 34 CYS H H 34 8.710 8.710 7.967 0.743 19947
7828 1 23 . 1 1 35 35 LYS N N 35 116.900 116.900 117.035 -0.135 19947
7829 1 23 . 1 1 35 35 LYS HA H 35 4.960 4.960 4.527 0.433 19947
7830 1 23 . 1 1 35 35 LYS CA C 35 53.900 53.900 54.883 -0.983 19947
7831 1 23 . 1 1 35 35 LYS CB C 35 35.900 35.900 34.721 1.179 19947
7832 1 23 . 1 1 35 35 LYS H H 35 7.450 7.450 7.549 -0.099 19947
7833 1 23 . 1 1 36 36 LEU N N 36 119.300 119.300 117.989 1.311 19947
7834 1 23 . 1 1 36 36 LEU HA H 36 4.800 4.800 4.466 0.334 19947
7835 1 23 . 1 1 36 36 LEU CB C 36 42.400 42.400 41.997 0.403 19947
7836 1 23 . 1 1 36 36 LEU H H 36 8.290 8.290 8.559 -0.269 19947
7837 1 23 . 1 1 37 37 THR HA H 37 4.340 4.340 4.714 -0.374 19947
7838 1 23 . 1 1 37 37 THR CA C 37 60.200 60.200 58.792 1.408 19947
7839 1 23 . 1 1 37 37 THR CB C 37 67.700 67.700 68.835 -1.135 19947
7840 1 23 . 1 1 37 37 THR H H 37 8.380 8.380 7.916 0.464 19947
7841 1 23 . 1 1 38 38 PRO HA H 38 4.380 4.380 4.128 0.252 19947
7842 1 23 . 1 1 38 38 PRO CA C 38 64.800 64.800 64.360 0.440 19947
7843 1 23 . 1 1 38 38 PRO CB C 38 31.500 31.500 31.651 -0.151 19947
7844 1 23 . 1 1 39 39 GLY N N 39 113.300 113.300 113.646 -0.346 19947
7845 1 23 . 1 1 39 39 GLY CA C 39 45.100 45.100 44.792 0.308 19947
7846 1 23 . 1 1 39 39 GLY H H 39 8.830 8.830 8.298 0.532 19947
7847 1 23 . 1 1 40 40 SER N N 40 116.700 116.700 118.089 -1.389 19947
7848 1 23 . 1 1 40 40 SER HA H 40 4.610 4.610 4.394 0.216 19947
7849 1 23 . 1 1 40 40 SER CA C 40 58.800 58.800 58.752 0.048 19947
7850 1 23 . 1 1 40 40 SER CB C 40 63.800 63.800 63.025 0.775 19947
7851 1 23 . 1 1 40 40 SER H H 40 8.280 8.280 7.805 0.475 19947
7852 1 23 . 1 1 41 41 GLN N N 41 120.600 120.600 125.039 -4.439 19947
7853 1 23 . 1 1 41 41 GLN HA H 41 4.110 4.110 4.053 0.057 19947
7854 1 23 . 1 1 41 41 GLN CA C 41 55.200 55.200 57.212 -2.012 19947
7855 1 23 . 1 1 41 41 GLN CB C 41 31.100 31.100 29.388 1.712 19947
7856 1 23 . 1 1 41 41 GLN H H 41 9.190 9.190 7.833 1.357 19947
7857 1 23 . 1 1 42 42 CYS N N 42 113.200 113.200 112.996 0.204 19947
7858 1 23 . 1 1 42 42 CYS HA H 42 4.630 4.630 4.505 0.125 19947
7859 1 23 . 1 1 42 42 CYS CA C 42 53.700 53.700 56.329 -2.629 19947
7860 1 23 . 1 1 42 42 CYS CB C 42 45.500 45.500 29.680 15.820 19947
7861 1 23 . 1 1 42 42 CYS H H 42 7.710 7.710 7.376 0.334 19947
7862 1 23 . 1 1 43 43 ASN N N 43 114.200 114.200 119.265 -5.065 19947
7863 1 23 . 1 1 43 43 ASN HA H 43 4.940 4.940 4.942 -0.002 19947
7864 1 23 . 1 1 43 43 ASN CA C 43 53.000 53.000 54.090 -1.091 19947
7865 1 23 . 1 1 43 43 ASN CB C 43 39.300 39.300 41.947 -2.647 19947
7866 1 23 . 1 1 43 43 ASN H H 43 8.870 8.870 8.789 0.081 19947
7867 1 23 . 1 1 44 44 TYR N N 44 118.400 118.400 118.640 -0.240 19947
7868 1 23 . 1 1 44 44 TYR HA H 44 4.850 4.850 4.590 0.260 19947
7869 1 23 . 1 1 44 44 TYR CA C 44 55.300 55.300 58.482 -3.182 19947
7870 1 23 . 1 1 44 44 TYR CB C 44 40.700 40.700 39.473 1.227 19947
7871 1 23 . 1 1 44 44 TYR H H 44 7.840 7.840 7.821 0.019 19947
7872 1 23 . 1 1 45 45 GLY N N 45 110.600 110.600 112.426 -1.826 19947
7873 1 23 . 1 1 45 45 GLY CA C 45 44.000 44.000 45.136 -1.136 19947
7874 1 23 . 1 1 45 45 GLY H H 45 7.960 7.960 7.654 0.306 19947
7875 1 23 . 1 1 46 46 GLU N N 46 120.700 120.700 120.512 0.188 19947
7876 1 23 . 1 1 46 46 GLU HA H 46 4.280 4.280 3.999 0.281 19947
7877 1 23 . 1 1 46 46 GLU CA C 46 58.500 58.500 59.831 -1.331 19947
7878 1 23 . 1 1 46 46 GLU CB C 46 29.300 29.300 29.717 -0.417 19947
7879 1 23 . 1 1 46 46 GLU H H 46 9.160 9.160 8.807 0.353 19947
7880 1 23 . 1 1 47 47 CYS N N 47 112.400 112.400 117.066 -4.666 19947
7881 1 23 . 1 1 47 47 CYS HA H 47 4.850 4.850 4.386 0.464 19947
7882 1 23 . 1 1 47 47 CYS CA C 47 57.100 57.100 60.561 -3.461 19947
7883 1 23 . 1 1 47 47 CYS CB C 47 41.200 41.200 26.106 15.094 19947
7884 1 23 . 1 1 47 47 CYS H H 47 8.510 8.510 7.637 0.873 19947
7885 1 23 . 1 1 48 48 CYS N N 48 123.200 123.200 121.748 1.452 19947
7886 1 23 . 1 1 48 48 CYS HA H 48 5.160 5.160 4.325 0.835 19947
7887 1 23 . 1 1 48 48 CYS CA C 48 54.700 54.700 60.173 -5.473 19947
7888 1 23 . 1 1 48 48 CYS CB C 48 45.700 45.700 26.399 19.301 19947
7889 1 23 . 1 1 48 48 CYS H H 48 7.810 7.810 8.093 -0.283 19947
7890 1 23 . 1 1 49 49 ASP N N 49 127.400 127.400 128.588 -1.188 19947
7891 1 23 . 1 1 49 49 ASP HA H 49 4.890 4.890 4.955 -0.065 19947
7892 1 23 . 1 1 49 49 ASP CA C 49 53.500 53.500 53.859 -0.359 19947
7893 1 23 . 1 1 49 49 ASP CB C 49 42.400 42.400 43.662 -1.262 19947
7894 1 23 . 1 1 49 49 ASP H H 49 9.670 9.670 8.210 1.460 19947
7895 1 23 . 1 1 50 50 GLN N N 50 127.000 127.000 120.850 6.150 19947
7896 1 23 . 1 1 50 50 GLN HA H 50 3.940 3.940 3.822 0.118 19947
7897 1 23 . 1 1 50 50 GLN CA C 50 56.800 56.800 59.373 -2.573 19947
7898 1 23 . 1 1 50 50 GLN CB C 50 26.500 26.500 27.879 -1.379 19947
7899 1 23 . 1 1 50 50 GLN H H 50 9.450 9.450 8.892 0.558 19947
7900 1 23 . 1 1 51 51 CYS N N 51 106.100 106.100 117.739 -11.639 19947
7901 1 23 . 1 1 51 51 CYS HA H 51 4.760 4.760 4.650 0.110 19947
7902 1 23 . 1 1 51 51 CYS CB C 51 43.200 43.200 27.913 15.287 19947
7903 1 23 . 1 1 51 51 CYS H H 51 8.700 8.700 8.139 0.561 19947
7904 1 23 . 1 1 52 52 ARG N N 52 121.000 121.000 118.860 2.140 19947
7905 1 23 . 1 1 52 52 ARG HA H 52 4.690 4.690 4.452 0.238 19947
7906 1 23 . 1 1 52 52 ARG CA C 52 55.400 55.400 55.550 -0.150 19947
7907 1 23 . 1 1 52 52 ARG CB C 52 33.100 33.100 34.415 -1.315 19947
7908 1 23 . 1 1 52 52 ARG H H 52 7.960 7.960 7.806 0.154 19947
7909 1 23 . 1 1 53 53 PHE N N 53 120.300 120.300 121.879 -1.579 19947
7910 1 23 . 1 1 53 53 PHE HA H 53 5.050 5.050 4.589 0.461 19947
7911 1 23 . 1 1 53 53 PHE CA C 53 56.100 56.100 57.699 -1.599 19947
7912 1 23 . 1 1 53 53 PHE CB C 53 38.200 38.200 39.004 -0.804 19947
7913 1 23 . 1 1 53 53 PHE H H 53 8.400 8.400 8.459 -0.059 19947
7914 1 23 . 1 1 54 54 LYS N N 54 123.300 123.300 125.848 -2.548 19947
7915 1 23 . 1 1 54 54 LYS HA H 54 4.250 4.250 4.074 0.176 19947
7916 1 23 . 1 1 54 54 LYS CA C 54 57.500 57.500 56.855 0.645 19947
7917 1 23 . 1 1 54 54 LYS CB C 54 34.300 34.300 31.976 2.324 19947
7918 1 23 . 1 1 54 54 LYS H H 54 8.540 8.540 8.849 -0.309 19947
7919 1 23 . 1 1 55 55 LYS N N 55 119.400 119.400 124.622 -5.222 19947
7920 1 23 . 1 1 55 55 LYS HA H 55 4.110 4.110 3.981 0.129 19947
7921 1 23 . 1 1 55 55 LYS CA C 55 56.500 56.500 57.160 -0.660 19947
7922 1 23 . 1 1 55 55 LYS CB C 55 33.400 33.400 33.199 0.201 19947
7923 1 23 . 1 1 55 55 LYS H H 55 8.440 8.440 8.015 0.425 19947
7924 1 23 . 1 1 56 56 ALA N N 56 126.700 126.700 127.040 -0.340 19947
7925 1 23 . 1 1 56 56 ALA HA H 56 3.920 3.920 4.074 -0.154 19947
7926 1 23 . 1 1 56 56 ALA CA C 56 52.900 52.900 53.576 -0.676 19947
7927 1 23 . 1 1 56 56 ALA CB C 56 18.100 18.100 18.175 -0.075 19947
7928 1 23 . 1 1 56 56 ALA H H 56 8.930 8.930 8.515 0.415 19947
7929 1 23 . 1 1 57 57 GLY N N 57 109.300 109.300 111.389 -2.089 19947
7930 1 23 . 1 1 57 57 GLY CA C 57 45.100 45.100 44.815 0.285 19947
7931 1 23 . 1 1 57 57 GLY H H 57 8.460 8.460 8.472 -0.012 19947
7932 1 23 . 1 1 58 58 THR N N 58 117.200 117.200 120.229 -3.029 19947
7933 1 23 . 1 1 58 58 THR HA H 58 4.260 4.260 4.375 -0.115 19947
7934 1 23 . 1 1 58 58 THR CA C 58 63.300 63.300 63.585 -0.285 19947
7935 1 23 . 1 1 58 58 THR CB C 58 69.600 69.600 69.102 0.498 19947
7936 1 23 . 1 1 58 58 THR H H 58 7.660 7.660 7.786 -0.126 19947
7937 1 23 . 1 1 59 59 VAL N N 59 130.400 130.400 128.030 2.370 19947
7938 1 23 . 1 1 59 59 VAL HA H 59 3.900 3.900 3.735 0.165 19947
7939 1 23 . 1 1 59 59 VAL CA C 59 64.400 64.400 63.577 0.823 19947
7940 1 23 . 1 1 59 59 VAL CB C 59 31.900 31.900 32.162 -0.262 19947
7941 1 23 . 1 1 59 59 VAL H H 59 9.190 9.190 8.617 0.573 19947
7942 1 23 . 1 1 60 60 CYS N N 60 121.800 121.800 126.739 -4.939 19947
7943 1 23 . 1 1 60 60 CYS HA H 60 5.050 5.050 4.611 0.439 19947
7944 1 23 . 1 1 60 60 CYS CA C 60 54.400 54.400 58.358 -3.958 19947
7945 1 23 . 1 1 60 60 CYS CB C 60 43.000 43.000 27.070 15.930 19947
7946 1 23 . 1 1 60 60 CYS H H 60 9.130 9.130 8.321 0.809 19947
7947 1 23 . 1 1 61 61 ARG N N 61 124.100 124.100 118.040 6.060 19947
7948 1 23 . 1 1 61 61 ARG HA H 61 4.360 4.360 4.714 -0.354 19947
7949 1 23 . 1 1 61 61 ARG CA C 61 56.800 56.800 55.119 1.681 19947
7950 1 23 . 1 1 61 61 ARG CB C 61 32.800 32.800 33.716 -0.916 19947
7951 1 23 . 1 1 61 61 ARG H H 61 7.580 7.580 7.392 0.188 19947
7952 1 23 . 1 1 62 62 ILE N N 62 126.200 126.200 116.655 9.545 19947
7953 1 23 . 1 1 62 62 ILE HA H 62 4.090 4.090 4.522 -0.432 19947
7954 1 23 . 1 1 62 62 ILE CA C 62 60.300 60.300 61.010 -0.710 19947
7955 1 23 . 1 1 62 62 ILE CB C 62 38.700 38.700 40.862 -2.162 19947
7956 1 23 . 1 1 62 62 ILE H H 62 8.490 8.490 8.411 0.079 19947
7957 1 23 . 1 1 63 63 ALA N N 63 129.400 129.400 132.159 -2.759 19947
7958 1 23 . 1 1 63 63 ALA HA H 63 4.310 4.310 4.330 -0.020 19947
7959 1 23 . 1 1 63 63 ALA CA C 63 51.900 51.900 54.507 -2.607 19947
7960 1 23 . 1 1 63 63 ALA CB C 63 20.600 20.600 19.462 1.138 19947
7961 1 23 . 1 1 63 63 ALA H H 63 8.100 8.100 8.798 -0.698 19947
7962 1 23 . 1 1 64 64 ARG N N 64 120.500 120.500 121.223 -0.723 19947
7963 1 23 . 1 1 64 64 ARG HA H 64 4.290 4.290 4.482 -0.192 19947
7964 1 23 . 1 1 64 64 ARG CA C 64 56.200 56.200 56.008 0.192 19947
7965 1 23 . 1 1 64 64 ARG CB C 64 30.500 30.500 30.450 0.050 19947
7966 1 23 . 1 1 64 64 ARG H H 64 8.140 8.140 8.788 -0.648 19947
7967 1 23 . 1 1 65 65 GLY N N 65 110.500 110.500 113.155 -2.655 19947
7968 1 23 . 1 1 65 65 GLY CA C 65 45.100 45.100 44.611 0.488 19947
7969 1 23 . 1 1 65 65 GLY H H 65 8.040 8.040 8.368 -0.328 19947
7970 1 23 . 1 1 66 66 ASP N N 66 120.700 120.700 119.144 1.556 19947
7971 1 23 . 1 1 66 66 ASP HA H 66 4.610 4.610 4.496 0.114 19947
7972 1 23 . 1 1 66 66 ASP CA C 66 53.300 53.300 53.624 -0.325 19947
7973 1 23 . 1 1 66 66 ASP CB C 66 37.600 37.600 40.086 -2.486 19947
7974 1 23 . 1 1 66 66 ASP H H 66 8.380 8.380 7.198 1.182 19947
7975 1 23 . 1 1 67 67 TRP N N 67 120.100 120.100 123.137 -3.037 19947
7976 1 23 . 1 1 67 67 TRP HA H 67 4.760 4.760 5.025 -0.265 19947
7977 1 23 . 1 1 67 67 TRP CA C 67 57.200 57.200 57.950 -0.750 19947
7978 1 23 . 1 1 67 67 TRP CB C 67 29.100 29.100 29.438 -0.338 19947
7979 1 23 . 1 1 67 67 TRP H H 67 7.950 7.950 7.806 0.144 19947
7980 1 23 . 1 1 68 68 ASN N N 68 118.400 118.400 118.181 0.219 19947
7981 1 23 . 1 1 68 68 ASN HA H 68 4.790 4.790 4.937 -0.147 19947
7982 1 23 . 1 1 68 68 ASN CA C 68 52.800 52.800 53.865 -1.065 19947
7983 1 23 . 1 1 68 68 ASN CB C 68 39.300 39.300 40.017 -0.717 19947
7984 1 23 . 1 1 68 68 ASN H H 68 8.180 8.180 8.656 -0.476 19947
7985 1 23 . 1 1 69 69 ASP N N 69 118.500 118.500 118.555 -0.055 19947
7986 1 23 . 1 1 69 69 ASP HA H 69 4.620 4.620 4.382 0.238 19947
7987 1 23 . 1 1 69 69 ASP CA C 69 53.200 53.200 56.312 -3.111 19947
7988 1 23 . 1 1 69 69 ASP CB C 69 38.000 38.000 41.177 -3.177 19947
7989 1 23 . 1 1 69 69 ASP H H 69 8.130 8.130 8.518 -0.388 19947
7990 1 23 . 1 1 70 70 ASP N N 70 120.500 120.500 121.046 -0.546 19947
7991 1 23 . 1 1 70 70 ASP HA H 70 5.100 5.100 4.921 0.179 19947
7992 1 23 . 1 1 70 70 ASP CA C 70 52.500 52.500 53.436 -0.936 19947
7993 1 23 . 1 1 70 70 ASP CB C 70 42.600 42.600 42.283 0.317 19947
7994 1 23 . 1 1 70 70 ASP H H 70 8.140 8.140 8.092 0.048 19947
7995 1 23 . 1 1 71 71 TYR N N 71 118.900 118.900 124.082 -5.182 19947
7996 1 23 . 1 1 71 71 TYR HA H 71 5.210 5.210 4.882 0.328 19947
7997 1 23 . 1 1 71 71 TYR CA C 71 56.300 56.300 57.059 -0.759 19947
7998 1 23 . 1 1 71 71 TYR CB C 71 42.200 42.200 42.600 -0.400 19947
7999 1 23 . 1 1 71 71 TYR H H 71 8.450 8.450 8.186 0.264 19947
8000 1 23 . 1 1 72 72 CYS N N 72 119.800 119.800 121.984 -2.184 19947
8001 1 23 . 1 1 72 72 CYS HA H 72 4.900 4.900 4.457 0.443 19947
8002 1 23 . 1 1 72 72 CYS CA C 72 53.400 53.400 59.013 -5.613 19947
8003 1 23 . 1 1 72 72 CYS CB C 72 37.200 37.200 29.184 8.016 19947
8004 1 23 . 1 1 72 72 CYS H H 72 9.330 9.330 8.538 0.792 19947
8005 1 23 . 1 1 73 73 THR N N 73 112.700 112.700 115.772 -3.072 19947
8006 1 23 . 1 1 73 73 THR HA H 73 4.430 4.430 4.396 0.034 19947
8007 1 23 . 1 1 73 73 THR CA C 73 62.300 62.300 61.198 1.102 19947
8008 1 23 . 1 1 73 73 THR CB C 73 71.300 71.300 69.118 2.182 19947
8009 1 23 . 1 1 73 73 THR H H 73 9.980 9.980 8.720 1.260 19947
8010 1 23 . 1 1 74 74 GLY N N 74 111.500 111.500 111.351 0.149 19947
8011 1 23 . 1 1 74 74 GLY CA C 74 45.300 45.300 46.700 -1.401 19947
8012 1 23 . 1 1 74 74 GLY H H 74 8.580 8.580 7.934 0.646 19947
8013 1 23 . 1 1 75 75 LYS N N 75 115.900 115.900 117.195 -1.295 19947
8014 1 23 . 1 1 75 75 LYS HA H 75 4.140 4.140 4.636 -0.496 19947
8015 1 23 . 1 1 75 75 LYS CA C 75 54.800 54.800 55.878 -1.078 19947
8016 1 23 . 1 1 75 75 LYS CB C 75 34.200 34.200 34.350 -0.150 19947
8017 1 23 . 1 1 75 75 LYS H H 75 7.900 7.900 7.576 0.324 19947
8018 1 23 . 1 1 76 76 SER N N 76 111.000 111.000 112.458 -1.458 19947
8019 1 23 . 1 1 76 76 SER HA H 76 4.160 4.160 3.844 0.316 19947
8020 1 23 . 1 1 76 76 SER CA C 76 61.400 61.400 56.533 4.867 19947
8021 1 23 . 1 1 76 76 SER CB C 76 64.300 64.300 65.922 -1.622 19947
8022 1 23 . 1 1 76 76 SER H H 76 6.520 6.520 7.173 -0.653 19947
8023 1 23 . 1 1 77 77 SER N N 77 117.100 117.100 116.059 1.041 19947
8024 1 23 . 1 1 77 77 SER HA H 77 4.220 4.220 4.412 -0.192 19947
8025 1 23 . 1 1 77 77 SER CA C 77 59.800 59.800 59.303 0.497 19947
8026 1 23 . 1 1 77 77 SER CB C 77 64.400 64.400 63.808 0.592 19947
8027 1 23 . 1 1 77 77 SER H H 77 9.030 9.030 8.357 0.673 19947
8028 1 23 . 1 1 78 78 ASP N N 78 122.100 122.100 121.033 1.067 19947
8029 1 23 . 1 1 78 78 ASP HA H 78 4.930 4.930 4.730 0.200 19947
8030 1 23 . 1 1 78 78 ASP CA C 78 52.400 52.400 54.107 -1.707 19947
8031 1 23 . 1 1 78 78 ASP CB C 78 40.800 40.800 44.070 -3.270 19947
8032 1 23 . 1 1 78 78 ASP H H 78 8.340 8.340 7.635 0.705 19947
8033 1 23 . 1 1 79 79 CYS N N 79 122.200 122.200 122.926 -0.726 19947
8034 1 23 . 1 1 79 79 CYS HA H 79 5.320 5.320 4.718 0.602 19947
8035 1 23 . 1 1 79 79 CYS CA C 79 52.000 52.000 54.887 -2.887 19947
8036 1 23 . 1 1 79 79 CYS CB C 79 39.300 39.300 27.135 12.165 19947
8037 1 23 . 1 1 79 79 CYS H H 79 8.960 8.960 8.443 0.517 19947
8038 1 23 . 1 1 80 80 PRO HA H 80 4.410 4.410 4.081 0.329 19947
8039 1 23 . 1 1 80 80 PRO CA C 80 63.500 63.500 62.803 0.697 19947
8040 1 23 . 1 1 80 80 PRO CB C 80 32.400 32.400 33.042 -0.642 19947
8041 1 23 . 1 1 81 81 TRP N N 81 120.500 120.500 121.732 -1.232 19947
8042 1 23 . 1 1 81 81 TRP HA H 81 4.550 4.550 4.282 0.268 19947
8043 1 23 . 1 1 81 81 TRP CA C 81 56.400 56.400 57.572 -1.172 19947
8044 1 23 . 1 1 81 81 TRP CB C 81 29.500 29.500 28.763 0.737 19947
8045 1 23 . 1 1 81 81 TRP H H 81 8.400 8.400 7.606 0.794 19947
8046 1 23 . 1 1 82 82 ASN N N 82 120.400 120.400 112.311 8.089 19947
8047 1 23 . 1 1 82 82 ASN HA H 82 4.750 4.750 4.440 0.310 19947
8048 1 23 . 1 1 82 82 ASN CA C 82 53.100 53.100 54.510 -1.410 19947
8049 1 23 . 1 1 82 82 ASN CB C 82 39.000 39.000 36.910 2.090 19947
8050 1 23 . 1 1 82 82 ASN H H 82 8.040 8.040 8.601 -0.561 19947
8051 1 24 . 1 1 2 2 PRO HA H 2 4.820 4.820 4.640 0.180 19947
8052 1 24 . 1 1 2 2 PRO CA C 2 61.900 61.900 62.128 -0.228 19947
8053 1 24 . 1 1 2 2 PRO CB C 2 30.700 30.700 31.686 -0.986 19947
8054 1 24 . 1 1 3 3 PRO HA H 3 4.540 4.540 4.442 0.098 19947
8055 1 24 . 1 1 3 3 PRO CA C 3 62.900 62.900 62.366 0.534 19947
8056 1 24 . 1 1 3 3 PRO CB C 3 32.100 32.100 32.249 -0.149 19947
8057 1 24 . 1 1 4 4 VAL N N 4 121.900 121.900 126.107 -4.207 19947
8058 1 24 . 1 1 4 4 VAL HA H 4 4.200 4.200 4.128 0.072 19947
8059 1 24 . 1 1 4 4 VAL CA C 4 62.300 62.300 62.220 0.080 19947
8060 1 24 . 1 1 4 4 VAL CB C 4 32.800 32.800 31.452 1.348 19947
8061 1 24 . 1 1 4 4 VAL H H 4 8.330 8.330 8.428 -0.098 19947
8062 1 24 . 1 1 5 5 CYS N N 5 120.900 120.900 127.623 -6.723 19947
8063 1 24 . 1 1 5 5 CYS HA H 5 4.700 4.700 4.460 0.240 19947
8064 1 24 . 1 1 5 5 CYS CA C 5 53.600 53.600 58.207 -4.607 19947
8065 1 24 . 1 1 5 5 CYS H H 5 8.500 8.500 8.583 -0.083 19947
8066 1 24 . 1 1 6 6 GLY N N 6 110.200 110.200 113.255 -3.055 19947
8067 1 24 . 1 1 6 6 GLY CA C 6 46.300 46.300 44.695 1.605 19947
8068 1 24 . 1 1 6 6 GLY H H 6 8.490 8.490 8.394 0.096 19947
8069 1 24 . 1 1 7 7 ASN N N 7 120.100 120.100 117.111 2.989 19947
8070 1 24 . 1 1 7 7 ASN HA H 7 4.730 4.730 4.377 0.353 19947
8071 1 24 . 1 1 7 7 ASN CA C 7 53.200 53.200 54.105 -0.904 19947
8072 1 24 . 1 1 7 7 ASN CB C 7 38.700 38.700 39.245 -0.545 19947
8073 1 24 . 1 1 7 7 ASN H H 7 8.320 8.320 8.254 0.066 19947
8074 1 24 . 1 1 8 8 LYS N N 8 121.300 121.300 124.232 -2.932 19947
8075 1 24 . 1 1 8 8 LYS HA H 8 4.340 4.340 4.170 0.171 19947
8076 1 24 . 1 1 8 8 LYS CA C 8 56.600 56.600 56.476 0.124 19947
8077 1 24 . 1 1 8 8 LYS CB C 8 32.900 32.900 31.385 1.515 19947
8078 1 24 . 1 1 8 8 LYS H H 8 8.260 8.260 8.499 -0.239 19947
8079 1 24 . 1 1 9 9 ILE N N 9 136.600 136.600 123.658 12.942 19947
8080 1 24 . 1 1 9 9 ILE HA H 9 4.140 4.140 3.935 0.205 19947
8081 1 24 . 1 1 9 9 ILE CA C 9 61.300 61.300 62.405 -1.105 19947
8082 1 24 . 1 1 9 9 ILE CB C 9 38.200 38.200 37.639 0.561 19947
8083 1 24 . 1 1 9 9 ILE H H 9 8.150 8.150 7.835 0.315 19947
8084 1 24 . 1 1 10 10 LEU N N 10 125.700 125.700 120.771 4.929 19947
8085 1 24 . 1 1 10 10 LEU HA H 10 4.420 4.420 4.466 -0.046 19947
8086 1 24 . 1 1 10 10 LEU CA C 10 55.200 55.200 55.438 -0.238 19947
8087 1 24 . 1 1 10 10 LEU CB C 10 42.300 42.300 41.003 1.297 19947
8088 1 24 . 1 1 10 10 LEU H H 10 8.230 8.230 8.419 -0.189 19947
8089 1 24 . 1 1 11 11 GLU N N 11 120.600 120.600 114.690 5.910 19947
8090 1 24 . 1 1 11 11 GLU HA H 11 4.470 4.470 4.130 0.340 19947
8091 1 24 . 1 1 11 11 GLU CA C 11 55.500 55.500 56.345 -0.845 19947
8092 1 24 . 1 1 11 11 GLU CB C 11 28.900 28.900 29.125 -0.225 19947
8093 1 24 . 1 1 11 11 GLU H H 11 8.250 8.250 8.018 0.232 19947
8094 1 24 . 1 1 12 12 GLN N N 12 121.600 121.600 116.728 4.872 19947
8095 1 24 . 1 1 12 12 GLN HA H 12 4.350 4.350 4.811 -0.461 19947
8096 1 24 . 1 1 12 12 GLN CA C 12 56.600 56.600 55.155 1.445 19947
8097 1 24 . 1 1 12 12 GLN CB C 12 29.200 29.200 29.264 -0.064 19947
8098 1 24 . 1 1 12 12 GLN H H 12 8.460 8.460 7.841 0.619 19947
8099 1 24 . 1 1 13 13 GLY N N 13 110.700 110.700 111.588 -0.888 19947
8100 1 24 . 1 1 13 13 GLY CA C 13 45.700 45.700 47.438 -1.738 19947
8101 1 24 . 1 1 13 13 GLY H H 13 8.660 8.660 8.700 -0.040 19947
8102 1 24 . 1 1 14 14 GLU N N 14 118.900 118.900 114.981 3.919 19947
8103 1 24 . 1 1 14 14 GLU HA H 14 4.530 4.530 4.476 0.054 19947
8104 1 24 . 1 1 14 14 GLU CA C 14 55.600 55.600 56.087 -0.487 19947
8105 1 24 . 1 1 14 14 GLU CB C 14 29.700 29.700 29.800 -0.100 19947
8106 1 24 . 1 1 14 14 GLU H H 14 8.230 8.230 8.328 -0.098 19947
8107 1 24 . 1 1 15 15 ASP N N 15 118.400 118.400 121.188 -2.788 19947
8108 1 24 . 1 1 15 15 ASP HA H 15 4.990 4.990 4.576 0.414 19947
8109 1 24 . 1 1 15 15 ASP CA C 15 53.500 53.500 54.786 -1.286 19947
8110 1 24 . 1 1 15 15 ASP CB C 15 39.700 39.700 42.194 -2.494 19947
8111 1 24 . 1 1 15 15 ASP H H 15 8.330 8.330 8.194 0.136 19947
8112 1 24 . 1 1 16 16 CYS HA H 16 4.340 4.340 4.460 -0.120 19947
8113 1 24 . 1 1 16 16 CYS H H 16 8.510 8.510 7.546 0.964 19947
8114 1 24 . 1 1 17 17 ASP N N 17 116.700 116.700 120.049 -3.349 19947
8115 1 24 . 1 1 17 17 ASP HA H 17 4.740 4.740 4.223 0.517 19947
8116 1 24 . 1 1 17 17 ASP CA C 17 53.100 53.100 55.825 -2.725 19947
8117 1 24 . 1 1 17 17 ASP CB C 17 38.600 38.600 38.973 -0.373 19947
8118 1 24 . 1 1 17 17 ASP H H 17 8.180 8.180 8.827 -0.647 19947
8119 1 24 . 1 1 18 18 CYS HA H 18 4.730 4.730 4.006 0.724 19947
8120 1 24 . 1 1 18 18 CYS CB C 18 41.900 41.900 26.767 15.133 19947
8121 1 24 . 1 1 19 19 GLY H H 19 8.220 8.220 8.609 -0.389 19947
8122 1 24 . 1 1 20 20 SER HA H 20 4.920 4.920 4.414 0.506 19947
8123 1 24 . 1 1 20 20 SER CA C 20 55.700 55.700 56.791 -1.091 19947
8124 1 24 . 1 1 20 20 SER CB C 20 63.500 63.500 62.785 0.715 19947
8125 1 24 . 1 1 20 20 SER H H 20 7.830 7.830 8.522 -0.692 19947
8126 1 24 . 1 1 21 21 PRO HA H 21 4.240 4.240 4.108 0.132 19947
8127 1 24 . 1 1 21 21 PRO CA C 21 63.400 63.400 65.342 -1.942 19947
8128 1 24 . 1 1 21 21 PRO CB C 21 31.800 31.800 31.006 0.794 19947
8129 1 24 . 1 1 22 22 ALA N N 22 119.900 119.900 119.129 0.771 19947
8130 1 24 . 1 1 22 22 ALA HA H 22 4.220 4.220 4.033 0.187 19947
8131 1 24 . 1 1 22 22 ALA CA C 22 54.200 54.200 54.067 0.133 19947
8132 1 24 . 1 1 22 22 ALA CB C 22 18.500 18.500 18.604 -0.104 19947
8133 1 24 . 1 1 22 22 ALA H H 22 8.180 8.180 8.125 0.055 19947
8134 1 24 . 1 1 23 23 ASN N N 23 116.300 116.300 112.607 3.693 19947
8135 1 24 . 1 1 23 23 ASN HA H 23 4.670 4.670 4.907 -0.237 19947
8136 1 24 . 1 1 23 23 ASN CA C 23 53.200 53.200 52.610 0.590 19947
8137 1 24 . 1 1 23 23 ASN CB C 23 39.300 39.300 40.071 -0.771 19947
8138 1 24 . 1 1 23 23 ASN H H 23 7.960 7.960 8.372 -0.412 19947
8139 1 24 . 1 1 24 24 CYS HA H 24 4.720 4.720 4.242 0.478 19947
8140 1 24 . 1 1 24 24 CYS H H 24 8.510 8.510 7.462 1.048 19947
8141 1 24 . 1 1 25 25 GLN HA H 25 4.460 4.460 3.928 0.532 19947
8142 1 24 . 1 1 25 25 GLN H H 25 8.320 8.320 8.714 -0.394 19947
8143 1 24 . 1 1 26 26 ASP HA H 26 4.740 4.740 4.791 -0.051 19947
8144 1 24 . 1 1 26 26 ASP H H 26 8.580 8.580 7.961 0.619 19947
8145 1 24 . 1 1 27 27 ARG HA H 27 4.680 4.680 3.969 0.711 19947
8146 1 24 . 1 1 27 27 ARG CA C 27 54.700 54.700 58.716 -4.016 19947
8147 1 24 . 1 1 27 27 ARG H H 27 8.550 8.550 8.731 -0.181 19947
8148 1 24 . 1 1 28 28 CYS HA H 28 4.120 4.120 4.899 -0.779 19947
8149 1 24 . 1 1 28 28 CYS CA C 28 54.400 54.400 57.053 -2.653 19947
8150 1 24 . 1 1 28 28 CYS CB C 28 19.000 19.000 26.791 -7.790 19947
8151 1 24 . 1 1 28 28 CYS H H 28 8.910 8.910 8.188 0.722 19947
8152 1 24 . 1 1 29 29 CYS N N 29 113.300 113.300 119.797 -6.497 19947
8153 1 24 . 1 1 29 29 CYS HA H 29 5.010 5.010 4.623 0.387 19947
8154 1 24 . 1 1 29 29 CYS CA C 29 54.300 54.300 58.337 -4.037 19947
8155 1 24 . 1 1 29 29 CYS H H 29 7.730 7.730 8.146 -0.416 19947
8156 1 24 . 1 1 30 30 ASN HA H 30 4.730 4.730 5.089 -0.359 19947
8157 1 24 . 1 1 30 30 ASN CB C 30 38.700 38.700 41.459 -2.759 19947
8158 1 24 . 1 1 30 30 ASN H H 30 8.870 8.870 8.497 0.373 19947
8159 1 24 . 1 1 31 31 ALA N N 31 129.400 129.400 127.041 2.359 19947
8160 1 24 . 1 1 31 31 ALA HA H 31 4.120 4.120 4.356 -0.236 19947
8161 1 24 . 1 1 31 31 ALA CA C 31 54.400 54.400 53.792 0.608 19947
8162 1 24 . 1 1 31 31 ALA CB C 31 19.000 19.000 18.985 0.015 19947
8163 1 24 . 1 1 31 31 ALA H H 31 8.890 8.890 8.876 0.014 19947
8164 1 24 . 1 1 32 32 ALA N N 32 116.400 116.400 121.076 -4.676 19947
8165 1 24 . 1 1 32 32 ALA HA H 32 4.340 4.340 4.226 0.114 19947
8166 1 24 . 1 1 32 32 ALA CA C 32 53.800 53.800 54.279 -0.479 19947
8167 1 24 . 1 1 32 32 ALA CB C 32 19.100 19.100 19.327 -0.227 19947
8168 1 24 . 1 1 32 32 ALA H H 32 8.250 8.250 7.476 0.774 19947
8169 1 24 . 1 1 33 33 THR N N 33 104.300 104.300 109.287 -4.987 19947
8170 1 24 . 1 1 33 33 THR HA H 33 4.430 4.430 4.297 0.133 19947
8171 1 24 . 1 1 33 33 THR CA C 33 60.500 60.500 61.108 -0.608 19947
8172 1 24 . 1 1 33 33 THR CB C 33 70.600 70.600 69.016 1.584 19947
8173 1 24 . 1 1 33 33 THR H H 33 7.320 7.320 7.930 -0.610 19947
8174 1 24 . 1 1 34 34 CYS N N 34 123.400 123.400 119.173 4.227 19947
8175 1 24 . 1 1 34 34 CYS HA H 34 4.170 4.170 4.258 -0.088 19947
8176 1 24 . 1 1 34 34 CYS CA C 34 56.500 56.500 59.837 -3.337 19947
8177 1 24 . 1 1 34 34 CYS H H 34 8.710 8.710 7.919 0.791 19947
8178 1 24 . 1 1 35 35 LYS N N 35 116.900 116.900 117.152 -0.252 19947
8179 1 24 . 1 1 35 35 LYS HA H 35 4.960 4.960 4.507 0.453 19947
8180 1 24 . 1 1 35 35 LYS CA C 35 53.900 53.900 55.291 -1.391 19947
8181 1 24 . 1 1 35 35 LYS CB C 35 35.900 35.900 36.138 -0.238 19947
8182 1 24 . 1 1 35 35 LYS H H 35 7.450 7.450 7.635 -0.185 19947
8183 1 24 . 1 1 36 36 LEU N N 36 119.300 119.300 118.865 0.435 19947
8184 1 24 . 1 1 36 36 LEU HA H 36 4.800 4.800 4.292 0.508 19947
8185 1 24 . 1 1 36 36 LEU CB C 36 42.400 42.400 41.774 0.626 19947
8186 1 24 . 1 1 36 36 LEU H H 36 8.290 8.290 8.268 0.022 19947
8187 1 24 . 1 1 37 37 THR HA H 37 4.340 4.340 4.743 -0.403 19947
8188 1 24 . 1 1 37 37 THR CA C 37 60.200 60.200 58.659 1.541 19947
8189 1 24 . 1 1 37 37 THR CB C 37 67.700 67.700 68.811 -1.111 19947
8190 1 24 . 1 1 37 37 THR H H 37 8.380 8.380 8.237 0.143 19947
8191 1 24 . 1 1 38 38 PRO HA H 38 4.380 4.380 4.100 0.280 19947
8192 1 24 . 1 1 38 38 PRO CA C 38 64.800 64.800 64.301 0.499 19947
8193 1 24 . 1 1 38 38 PRO CB C 38 31.500 31.500 31.743 -0.243 19947
8194 1 24 . 1 1 39 39 GLY N N 39 113.300 113.300 111.710 1.590 19947
8195 1 24 . 1 1 39 39 GLY CA C 39 45.100 45.100 44.786 0.314 19947
8196 1 24 . 1 1 39 39 GLY H H 39 8.830 8.830 8.419 0.411 19947
8197 1 24 . 1 1 40 40 SER N N 40 116.700 116.700 117.624 -0.924 19947
8198 1 24 . 1 1 40 40 SER HA H 40 4.610 4.610 4.619 -0.009 19947
8199 1 24 . 1 1 40 40 SER CA C 40 58.800 58.800 58.005 0.795 19947
8200 1 24 . 1 1 40 40 SER CB C 40 63.800 63.800 63.938 -0.138 19947
8201 1 24 . 1 1 40 40 SER H H 40 8.280 8.280 7.845 0.435 19947
8202 1 24 . 1 1 41 41 GLN N N 41 120.600 120.600 124.949 -4.349 19947
8203 1 24 . 1 1 41 41 GLN HA H 41 4.110 4.110 3.985 0.125 19947
8204 1 24 . 1 1 41 41 GLN CA C 41 55.200 55.200 57.384 -2.184 19947
8205 1 24 . 1 1 41 41 GLN CB C 41 31.100 31.100 29.100 2.000 19947
8206 1 24 . 1 1 41 41 GLN H H 41 9.190 9.190 8.011 1.179 19947
8207 1 24 . 1 1 42 42 CYS N N 42 113.200 113.200 115.470 -2.270 19947
8208 1 24 . 1 1 42 42 CYS HA H 42 4.630 4.630 4.605 0.025 19947
8209 1 24 . 1 1 42 42 CYS CA C 42 53.700 53.700 57.834 -4.134 19947
8210 1 24 . 1 1 42 42 CYS CB C 42 45.500 45.500 29.993 15.507 19947
8211 1 24 . 1 1 42 42 CYS H H 42 7.710 7.710 7.561 0.149 19947
8212 1 24 . 1 1 43 43 ASN N N 43 114.200 114.200 121.252 -7.052 19947
8213 1 24 . 1 1 43 43 ASN HA H 43 4.940 4.940 4.567 0.373 19947
8214 1 24 . 1 1 43 43 ASN CA C 43 53.000 53.000 54.484 -1.484 19947
8215 1 24 . 1 1 43 43 ASN CB C 43 39.300 39.300 39.184 0.116 19947
8216 1 24 . 1 1 43 43 ASN H H 43 8.870 8.870 8.555 0.315 19947
8217 1 24 . 1 1 44 44 TYR N N 44 118.400 118.400 113.036 5.364 19947
8218 1 24 . 1 1 44 44 TYR HA H 44 4.850 4.850 4.693 0.157 19947
8219 1 24 . 1 1 44 44 TYR CA C 44 55.300 55.300 57.744 -2.444 19947
8220 1 24 . 1 1 44 44 TYR CB C 44 40.700 40.700 39.890 0.810 19947
8221 1 24 . 1 1 44 44 TYR H H 44 7.840 7.840 7.275 0.565 19947
8222 1 24 . 1 1 45 45 GLY N N 45 110.600 110.600 108.459 2.141 19947
8223 1 24 . 1 1 45 45 GLY CA C 45 44.000 44.000 45.081 -1.081 19947
8224 1 24 . 1 1 45 45 GLY H H 45 7.960 7.960 8.146 -0.186 19947
8225 1 24 . 1 1 46 46 GLU N N 46 120.700 120.700 120.227 0.473 19947
8226 1 24 . 1 1 46 46 GLU HA H 46 4.280 4.280 4.169 0.111 19947
8227 1 24 . 1 1 46 46 GLU CA C 46 58.500 58.500 58.645 -0.145 19947
8228 1 24 . 1 1 46 46 GLU CB C 46 29.300 29.300 29.915 -0.615 19947
8229 1 24 . 1 1 46 46 GLU H H 46 9.160 9.160 8.692 0.468 19947
8230 1 24 . 1 1 47 47 CYS N N 47 112.400 112.400 118.544 -6.144 19947
8231 1 24 . 1 1 47 47 CYS HA H 47 4.850 4.850 4.624 0.226 19947
8232 1 24 . 1 1 47 47 CYS CA C 47 57.100 57.100 58.023 -0.923 19947
8233 1 24 . 1 1 47 47 CYS CB C 47 41.200 41.200 25.990 15.210 19947
8234 1 24 . 1 1 47 47 CYS H H 47 8.510 8.510 7.497 1.013 19947
8235 1 24 . 1 1 48 48 CYS N N 48 123.200 123.200 120.321 2.879 19947
8236 1 24 . 1 1 48 48 CYS HA H 48 5.160 5.160 5.113 0.047 19947
8237 1 24 . 1 1 48 48 CYS CA C 48 54.700 54.700 58.146 -3.446 19947
8238 1 24 . 1 1 48 48 CYS CB C 48 45.700 45.700 27.932 17.768 19947
8239 1 24 . 1 1 48 48 CYS H H 48 7.810 7.810 7.716 0.094 19947
8240 1 24 . 1 1 49 49 ASP N N 49 127.400 127.400 123.786 3.614 19947
8241 1 24 . 1 1 49 49 ASP HA H 49 4.890 4.890 4.948 -0.058 19947
8242 1 24 . 1 1 49 49 ASP CA C 49 53.500 53.500 54.143 -0.643 19947
8243 1 24 . 1 1 49 49 ASP CB C 49 42.400 42.400 44.761 -2.361 19947
8244 1 24 . 1 1 49 49 ASP H H 49 9.670 9.670 8.784 0.886 19947
8245 1 24 . 1 1 50 50 GLN N N 50 127.000 127.000 123.740 3.260 19947
8246 1 24 . 1 1 50 50 GLN HA H 50 3.940 3.940 3.914 0.026 19947
8247 1 24 . 1 1 50 50 GLN CA C 50 56.800 56.800 56.890 -0.090 19947
8248 1 24 . 1 1 50 50 GLN CB C 50 26.500 26.500 27.572 -1.071 19947
8249 1 24 . 1 1 50 50 GLN H H 50 9.450 9.450 8.918 0.532 19947
8250 1 24 . 1 1 51 51 CYS N N 51 106.100 106.100 111.513 -5.413 19947
8251 1 24 . 1 1 51 51 CYS HA H 51 4.760 4.760 4.337 0.423 19947
8252 1 24 . 1 1 51 51 CYS CB C 51 43.200 43.200 24.832 18.368 19947
8253 1 24 . 1 1 51 51 CYS H H 51 8.700 8.700 8.491 0.209 19947
8254 1 24 . 1 1 52 52 ARG N N 52 121.000 121.000 117.013 3.987 19947
8255 1 24 . 1 1 52 52 ARG HA H 52 4.690 4.690 4.538 0.152 19947
8256 1 24 . 1 1 52 52 ARG CA C 52 55.400 55.400 53.755 1.645 19947
8257 1 24 . 1 1 52 52 ARG CB C 52 33.100 33.100 34.041 -0.941 19947
8258 1 24 . 1 1 52 52 ARG H H 52 7.960 7.960 7.458 0.502 19947
8259 1 24 . 1 1 53 53 PHE N N 53 120.300 120.300 121.320 -1.020 19947
8260 1 24 . 1 1 53 53 PHE HA H 53 5.050 5.050 5.025 0.025 19947
8261 1 24 . 1 1 53 53 PHE CA C 53 56.100 56.100 56.336 -0.236 19947
8262 1 24 . 1 1 53 53 PHE CB C 53 38.200 38.200 38.883 -0.683 19947
8263 1 24 . 1 1 53 53 PHE H H 53 8.400 8.400 8.370 0.030 19947
8264 1 24 . 1 1 54 54 LYS N N 54 123.300 123.300 125.904 -2.604 19947
8265 1 24 . 1 1 54 54 LYS HA H 54 4.250 4.250 4.119 0.131 19947
8266 1 24 . 1 1 54 54 LYS CA C 54 57.500 57.500 55.966 1.534 19947
8267 1 24 . 1 1 54 54 LYS CB C 54 34.300 34.300 31.502 2.798 19947
8268 1 24 . 1 1 54 54 LYS H H 54 8.540 8.540 8.079 0.461 19947
8269 1 24 . 1 1 55 55 LYS N N 55 119.400 119.400 124.365 -4.965 19947
8270 1 24 . 1 1 55 55 LYS HA H 55 4.110 4.110 3.960 0.150 19947
8271 1 24 . 1 1 55 55 LYS CA C 55 56.500 56.500 57.139 -0.639 19947
8272 1 24 . 1 1 55 55 LYS CB C 55 33.400 33.400 33.027 0.373 19947
8273 1 24 . 1 1 55 55 LYS H H 55 8.440 8.440 8.142 0.298 19947
8274 1 24 . 1 1 56 56 ALA N N 56 126.700 126.700 127.938 -1.238 19947
8275 1 24 . 1 1 56 56 ALA HA H 56 3.920 3.920 4.032 -0.112 19947
8276 1 24 . 1 1 56 56 ALA CA C 56 52.900 52.900 53.702 -0.802 19947
8277 1 24 . 1 1 56 56 ALA CB C 56 18.100 18.100 18.019 0.081 19947
8278 1 24 . 1 1 56 56 ALA H H 56 8.930 8.930 8.601 0.329 19947
8279 1 24 . 1 1 57 57 GLY N N 57 109.300 109.300 111.548 -2.248 19947
8280 1 24 . 1 1 57 57 GLY CA C 57 45.100 45.100 44.876 0.224 19947
8281 1 24 . 1 1 57 57 GLY H H 57 8.460 8.460 8.431 0.029 19947
8282 1 24 . 1 1 58 58 THR N N 58 117.200 117.200 119.943 -2.743 19947
8283 1 24 . 1 1 58 58 THR HA H 58 4.260 4.260 4.486 -0.226 19947
8284 1 24 . 1 1 58 58 THR CA C 58 63.300 63.300 62.606 0.694 19947
8285 1 24 . 1 1 58 58 THR CB C 58 69.600 69.600 68.501 1.099 19947
8286 1 24 . 1 1 58 58 THR H H 58 7.660 7.660 7.797 -0.137 19947
8287 1 24 . 1 1 59 59 VAL N N 59 130.400 130.400 127.554 2.846 19947
8288 1 24 . 1 1 59 59 VAL HA H 59 3.900 3.900 3.612 0.288 19947
8289 1 24 . 1 1 59 59 VAL CA C 59 64.400 64.400 62.922 1.478 19947
8290 1 24 . 1 1 59 59 VAL CB C 59 31.900 31.900 31.659 0.241 19947
8291 1 24 . 1 1 59 59 VAL H H 59 9.190 9.190 8.811 0.379 19947
8292 1 24 . 1 1 60 60 CYS N N 60 121.800 121.800 126.078 -4.278 19947
8293 1 24 . 1 1 60 60 CYS HA H 60 5.050 5.050 4.602 0.448 19947
8294 1 24 . 1 1 60 60 CYS CA C 60 54.400 54.400 58.061 -3.661 19947
8295 1 24 . 1 1 60 60 CYS CB C 60 43.000 43.000 28.022 14.978 19947
8296 1 24 . 1 1 60 60 CYS H H 60 9.130 9.130 8.404 0.726 19947
8297 1 24 . 1 1 61 61 ARG N N 61 124.100 124.100 117.543 6.557 19947
8298 1 24 . 1 1 61 61 ARG HA H 61 4.360 4.360 4.633 -0.273 19947
8299 1 24 . 1 1 61 61 ARG CA C 61 56.800 56.800 55.650 1.150 19947
8300 1 24 . 1 1 61 61 ARG CB C 61 32.800 32.800 34.564 -1.764 19947
8301 1 24 . 1 1 61 61 ARG H H 61 7.580 7.580 7.355 0.225 19947
8302 1 24 . 1 1 62 62 ILE N N 62 126.200 126.200 115.987 10.213 19947
8303 1 24 . 1 1 62 62 ILE HA H 62 4.090 4.090 4.494 -0.404 19947
8304 1 24 . 1 1 62 62 ILE CA C 62 60.300 60.300 60.970 -0.670 19947
8305 1 24 . 1 1 62 62 ILE CB C 62 38.700 38.700 41.274 -2.574 19947
8306 1 24 . 1 1 62 62 ILE H H 62 8.490 8.490 8.373 0.117 19947
8307 1 24 . 1 1 63 63 ALA N N 63 129.400 129.400 132.298 -2.898 19947
8308 1 24 . 1 1 63 63 ALA HA H 63 4.310 4.310 4.355 -0.045 19947
8309 1 24 . 1 1 63 63 ALA CA C 63 51.900 51.900 54.519 -2.619 19947
8310 1 24 . 1 1 63 63 ALA CB C 63 20.600 20.600 19.446 1.154 19947
8311 1 24 . 1 1 63 63 ALA H H 63 8.100 8.100 8.604 -0.504 19947
8312 1 24 . 1 1 64 64 ARG N N 64 120.500 120.500 121.125 -0.625 19947
8313 1 24 . 1 1 64 64 ARG HA H 64 4.290 4.290 4.486 -0.196 19947
8314 1 24 . 1 1 64 64 ARG CA C 64 56.200 56.200 56.031 0.169 19947
8315 1 24 . 1 1 64 64 ARG CB C 64 30.500 30.500 30.518 -0.018 19947
8316 1 24 . 1 1 64 64 ARG H H 64 8.140 8.140 8.826 -0.686 19947
8317 1 24 . 1 1 65 65 GLY N N 65 110.500 110.500 112.801 -2.301 19947
8318 1 24 . 1 1 65 65 GLY CA C 65 45.100 45.100 44.582 0.518 19947
8319 1 24 . 1 1 65 65 GLY H H 65 8.040 8.040 8.355 -0.315 19947
8320 1 24 . 1 1 66 66 ASP N N 66 120.700 120.700 119.368 1.332 19947
8321 1 24 . 1 1 66 66 ASP HA H 66 4.610 4.610 4.528 0.082 19947
8322 1 24 . 1 1 66 66 ASP CA C 66 53.300 53.300 53.574 -0.274 19947
8323 1 24 . 1 1 66 66 ASP CB C 66 37.600 37.600 40.251 -2.651 19947
8324 1 24 . 1 1 66 66 ASP H H 66 8.380 8.380 7.232 1.148 19947
8325 1 24 . 1 1 67 67 TRP N N 67 120.100 120.100 123.295 -3.195 19947
8326 1 24 . 1 1 67 67 TRP HA H 67 4.760 4.760 5.016 -0.256 19947
8327 1 24 . 1 1 67 67 TRP CA C 67 57.200 57.200 57.940 -0.740 19947
8328 1 24 . 1 1 67 67 TRP CB C 67 29.100 29.100 29.383 -0.283 19947
8329 1 24 . 1 1 67 67 TRP H H 67 7.950 7.950 7.811 0.139 19947
8330 1 24 . 1 1 68 68 ASN N N 68 118.400 118.400 117.454 0.946 19947
8331 1 24 . 1 1 68 68 ASN HA H 68 4.790 4.790 4.957 -0.167 19947
8332 1 24 . 1 1 68 68 ASN CA C 68 52.800 52.800 53.818 -1.018 19947
8333 1 24 . 1 1 68 68 ASN CB C 68 39.300 39.300 40.416 -1.116 19947
8334 1 24 . 1 1 68 68 ASN H H 68 8.180 8.180 8.651 -0.471 19947
8335 1 24 . 1 1 69 69 ASP N N 69 118.500 118.500 118.963 -0.463 19947
8336 1 24 . 1 1 69 69 ASP HA H 69 4.620 4.620 4.416 0.204 19947
8337 1 24 . 1 1 69 69 ASP CA C 69 53.200 53.200 56.099 -2.898 19947
8338 1 24 . 1 1 69 69 ASP CB C 69 38.000 38.000 41.247 -3.247 19947
8339 1 24 . 1 1 69 69 ASP H H 69 8.130 8.130 8.656 -0.526 19947
8340 1 24 . 1 1 70 70 ASP N N 70 120.500 120.500 121.049 -0.549 19947
8341 1 24 . 1 1 70 70 ASP HA H 70 5.100 5.100 5.008 0.092 19947
8342 1 24 . 1 1 70 70 ASP CA C 70 52.500 52.500 53.523 -1.023 19947
8343 1 24 . 1 1 70 70 ASP CB C 70 42.600 42.600 41.993 0.607 19947
8344 1 24 . 1 1 70 70 ASP H H 70 8.140 8.140 8.184 -0.044 19947
8345 1 24 . 1 1 71 71 TYR N N 71 118.900 118.900 124.144 -5.244 19947
8346 1 24 . 1 1 71 71 TYR HA H 71 5.210 5.210 4.864 0.346 19947
8347 1 24 . 1 1 71 71 TYR CA C 71 56.300 56.300 57.146 -0.846 19947
8348 1 24 . 1 1 71 71 TYR CB C 71 42.200 42.200 42.773 -0.573 19947
8349 1 24 . 1 1 71 71 TYR H H 71 8.450 8.450 8.186 0.264 19947
8350 1 24 . 1 1 72 72 CYS N N 72 119.800 119.800 121.596 -1.796 19947
8351 1 24 . 1 1 72 72 CYS HA H 72 4.900 4.900 4.476 0.424 19947
8352 1 24 . 1 1 72 72 CYS CA C 72 53.400 53.400 59.088 -5.688 19947
8353 1 24 . 1 1 72 72 CYS CB C 72 37.200 37.200 29.107 8.093 19947
8354 1 24 . 1 1 72 72 CYS H H 72 9.330 9.330 8.399 0.931 19947
8355 1 24 . 1 1 73 73 THR N N 73 112.700 112.700 115.704 -3.004 19947
8356 1 24 . 1 1 73 73 THR HA H 73 4.430 4.430 4.387 0.043 19947
8357 1 24 . 1 1 73 73 THR CA C 73 62.300 62.300 61.292 1.008 19947
8358 1 24 . 1 1 73 73 THR CB C 73 71.300 71.300 69.279 2.021 19947
8359 1 24 . 1 1 73 73 THR H H 73 9.980 9.980 8.729 1.251 19947
8360 1 24 . 1 1 74 74 GLY N N 74 111.500 111.500 111.313 0.187 19947
8361 1 24 . 1 1 74 74 GLY CA C 74 45.300 45.300 46.635 -1.335 19947
8362 1 24 . 1 1 74 74 GLY H H 74 8.580 8.580 7.936 0.644 19947
8363 1 24 . 1 1 75 75 LYS N N 75 115.900 115.900 117.198 -1.298 19947
8364 1 24 . 1 1 75 75 LYS HA H 75 4.140 4.140 4.608 -0.468 19947
8365 1 24 . 1 1 75 75 LYS CA C 75 54.800 54.800 55.740 -0.940 19947
8366 1 24 . 1 1 75 75 LYS CB C 75 34.200 34.200 34.125 0.075 19947
8367 1 24 . 1 1 75 75 LYS H H 75 7.900 7.900 7.551 0.349 19947
8368 1 24 . 1 1 76 76 SER N N 76 111.000 111.000 111.490 -0.490 19947
8369 1 24 . 1 1 76 76 SER HA H 76 4.160 4.160 3.783 0.377 19947
8370 1 24 . 1 1 76 76 SER CA C 76 61.400 61.400 56.426 4.973 19947
8371 1 24 . 1 1 76 76 SER CB C 76 64.300 64.300 65.235 -0.935 19947
8372 1 24 . 1 1 76 76 SER H H 76 6.520 6.520 6.675 -0.155 19947
8373 1 24 . 1 1 77 77 SER N N 77 117.100 117.100 112.637 4.463 19947
8374 1 24 . 1 1 77 77 SER HA H 77 4.220 4.220 4.666 -0.446 19947
8375 1 24 . 1 1 77 77 SER CA C 77 59.800 59.800 58.459 1.341 19947
8376 1 24 . 1 1 77 77 SER CB C 77 64.400 64.400 63.659 0.741 19947
8377 1 24 . 1 1 77 77 SER H H 77 9.030 9.030 8.144 0.886 19947
8378 1 24 . 1 1 78 78 ASP N N 78 122.100 122.100 118.530 3.570 19947
8379 1 24 . 1 1 78 78 ASP HA H 78 4.930 4.930 4.748 0.182 19947
8380 1 24 . 1 1 78 78 ASP CA C 78 52.400 52.400 52.666 -0.266 19947
8381 1 24 . 1 1 78 78 ASP CB C 78 40.800 40.800 43.238 -2.438 19947
8382 1 24 . 1 1 78 78 ASP H H 78 8.340 8.340 7.558 0.782 19947
8383 1 24 . 1 1 79 79 CYS N N 79 122.200 122.200 121.162 1.038 19947
8384 1 24 . 1 1 79 79 CYS HA H 79 5.320 5.320 4.739 0.581 19947
8385 1 24 . 1 1 79 79 CYS CA C 79 52.000 52.000 55.658 -3.658 19947
8386 1 24 . 1 1 79 79 CYS CB C 79 39.300 39.300 27.326 11.974 19947
8387 1 24 . 1 1 79 79 CYS H H 79 8.960 8.960 8.484 0.476 19947
8388 1 24 . 1 1 80 80 PRO HA H 80 4.410 4.410 4.105 0.305 19947
8389 1 24 . 1 1 80 80 PRO CA C 80 63.500 63.500 62.804 0.696 19947
8390 1 24 . 1 1 80 80 PRO CB C 80 32.400 32.400 32.769 -0.369 19947
8391 1 24 . 1 1 81 81 TRP N N 81 120.500 120.500 122.140 -1.640 19947
8392 1 24 . 1 1 81 81 TRP HA H 81 4.550 4.550 4.192 0.358 19947
8393 1 24 . 1 1 81 81 TRP CA C 81 56.400 56.400 57.953 -1.553 19947
8394 1 24 . 1 1 81 81 TRP CB C 81 29.500 29.500 28.762 0.739 19947
8395 1 24 . 1 1 81 81 TRP H H 81 8.400 8.400 7.563 0.837 19947
8396 1 24 . 1 1 82 82 ASN N N 82 120.400 120.400 113.624 6.776 19947
8397 1 24 . 1 1 82 82 ASN HA H 82 4.750 4.750 4.539 0.211 19947
8398 1 24 . 1 1 82 82 ASN CA C 82 53.100 53.100 53.353 -0.253 19947
8399 1 24 . 1 1 82 82 ASN CB C 82 39.000 39.000 38.088 0.912 19947
8400 1 24 . 1 1 82 82 ASN H H 82 8.040 8.040 8.455 -0.415 19947
8401 1 25 . 1 1 2 2 PRO HA H 2 4.820 4.820 4.589 0.231 19947
8402 1 25 . 1 1 2 2 PRO CA C 2 61.900 61.900 62.112 -0.212 19947
8403 1 25 . 1 1 2 2 PRO CB C 2 30.700 30.700 31.404 -0.704 19947
8404 1 25 . 1 1 3 3 PRO HA H 3 4.540 4.540 4.383 0.157 19947
8405 1 25 . 1 1 3 3 PRO CA C 3 62.900 62.900 63.332 -0.432 19947
8406 1 25 . 1 1 3 3 PRO CB C 3 32.100 32.100 32.135 -0.035 19947
8407 1 25 . 1 1 4 4 VAL N N 4 121.900 121.900 122.736 -0.836 19947
8408 1 25 . 1 1 4 4 VAL HA H 4 4.200 4.200 4.529 -0.329 19947
8409 1 25 . 1 1 4 4 VAL CA C 4 62.300 62.300 60.695 1.605 19947
8410 1 25 . 1 1 4 4 VAL CB C 4 32.800 32.800 33.584 -0.784 19947
8411 1 25 . 1 1 4 4 VAL H H 4 8.330 8.330 7.943 0.387 19947
8412 1 25 . 1 1 5 5 CYS N N 5 120.900 120.900 126.888 -5.988 19947
8413 1 25 . 1 1 5 5 CYS HA H 5 4.700 4.700 4.503 0.197 19947
8414 1 25 . 1 1 5 5 CYS CA C 5 53.600 53.600 58.785 -5.185 19947
8415 1 25 . 1 1 5 5 CYS H H 5 8.500 8.500 8.432 0.068 19947
8416 1 25 . 1 1 6 6 GLY N N 6 110.200 110.200 114.432 -4.232 19947
8417 1 25 . 1 1 6 6 GLY CA C 6 46.300 46.300 44.632 1.668 19947
8418 1 25 . 1 1 6 6 GLY H H 6 8.490 8.490 8.388 0.102 19947
8419 1 25 . 1 1 7 7 ASN N N 7 120.100 120.100 117.422 2.678 19947
8420 1 25 . 1 1 7 7 ASN HA H 7 4.730 4.730 4.312 0.418 19947
8421 1 25 . 1 1 7 7 ASN CA C 7 53.200 53.200 54.216 -1.016 19947
8422 1 25 . 1 1 7 7 ASN CB C 7 38.700 38.700 39.013 -0.313 19947
8423 1 25 . 1 1 7 7 ASN H H 7 8.320 8.320 8.247 0.073 19947
8424 1 25 . 1 1 8 8 LYS N N 8 121.300 121.300 123.943 -2.643 19947
8425 1 25 . 1 1 8 8 LYS HA H 8 4.340 4.340 4.201 0.139 19947
8426 1 25 . 1 1 8 8 LYS CA C 8 56.600 56.600 56.395 0.205 19947
8427 1 25 . 1 1 8 8 LYS CB C 8 32.900 32.900 31.417 1.483 19947
8428 1 25 . 1 1 8 8 LYS H H 8 8.260 8.260 8.444 -0.184 19947
8429 1 25 . 1 1 9 9 ILE N N 9 136.600 136.600 122.937 13.663 19947
8430 1 25 . 1 1 9 9 ILE HA H 9 4.140 4.140 4.009 0.131 19947
8431 1 25 . 1 1 9 9 ILE CA C 9 61.300 61.300 61.656 -0.356 19947
8432 1 25 . 1 1 9 9 ILE CB C 9 38.200 38.200 37.346 0.854 19947
8433 1 25 . 1 1 9 9 ILE H H 9 8.150 8.150 7.727 0.423 19947
8434 1 25 . 1 1 10 10 LEU N N 10 125.700 125.700 122.838 2.862 19947
8435 1 25 . 1 1 10 10 LEU HA H 10 4.420 4.420 4.404 0.016 19947
8436 1 25 . 1 1 10 10 LEU CA C 10 55.200 55.200 55.721 -0.521 19947
8437 1 25 . 1 1 10 10 LEU CB C 10 42.300 42.300 40.152 2.148 19947
8438 1 25 . 1 1 10 10 LEU H H 10 8.230 8.230 8.530 -0.300 19947
8439 1 25 . 1 1 11 11 GLU N N 11 120.600 120.600 115.034 5.566 19947
8440 1 25 . 1 1 11 11 GLU HA H 11 4.470 4.470 4.153 0.317 19947
8441 1 25 . 1 1 11 11 GLU CA C 11 55.500 55.500 55.972 -0.472 19947
8442 1 25 . 1 1 11 11 GLU CB C 11 28.900 28.900 28.176 0.724 19947
8443 1 25 . 1 1 11 11 GLU H H 11 8.250 8.250 7.993 0.257 19947
8444 1 25 . 1 1 12 12 GLN N N 12 121.600 121.600 116.888 4.712 19947
8445 1 25 . 1 1 12 12 GLN HA H 12 4.350 4.350 4.611 -0.261 19947
8446 1 25 . 1 1 12 12 GLN CA C 12 56.600 56.600 55.643 0.957 19947
8447 1 25 . 1 1 12 12 GLN CB C 12 29.200 29.200 29.424 -0.224 19947
8448 1 25 . 1 1 12 12 GLN H H 12 8.460 8.460 7.610 0.850 19947
8449 1 25 . 1 1 13 13 GLY N N 13 110.700 110.700 109.866 0.834 19947
8450 1 25 . 1 1 13 13 GLY CA C 13 45.700 45.700 45.104 0.596 19947
8451 1 25 . 1 1 13 13 GLY H H 13 8.660 8.660 8.707 -0.047 19947
8452 1 25 . 1 1 14 14 GLU N N 14 118.900 118.900 116.884 2.016 19947
8453 1 25 . 1 1 14 14 GLU HA H 14 4.530 4.530 4.257 0.273 19947
8454 1 25 . 1 1 14 14 GLU CA C 14 55.600 55.600 56.451 -0.851 19947
8455 1 25 . 1 1 14 14 GLU CB C 14 29.700 29.700 29.818 -0.118 19947
8456 1 25 . 1 1 14 14 GLU H H 14 8.230 8.230 7.942 0.288 19947
8457 1 25 . 1 1 15 15 ASP N N 15 118.400 118.400 120.034 -1.634 19947
8458 1 25 . 1 1 15 15 ASP HA H 15 4.990 4.990 4.820 0.170 19947
8459 1 25 . 1 1 15 15 ASP CA C 15 53.500 53.500 55.371 -1.871 19947
8460 1 25 . 1 1 15 15 ASP CB C 15 39.700 39.700 43.661 -3.961 19947
8461 1 25 . 1 1 15 15 ASP H H 15 8.330 8.330 7.885 0.445 19947
8462 1 25 . 1 1 16 16 CYS HA H 16 4.340 4.340 4.665 -0.325 19947
8463 1 25 . 1 1 16 16 CYS H H 16 8.510 8.510 8.249 0.261 19947
8464 1 25 . 1 1 17 17 ASP N N 17 116.700 116.700 122.779 -6.079 19947
8465 1 25 . 1 1 17 17 ASP HA H 17 4.740 4.740 4.546 0.194 19947
8466 1 25 . 1 1 17 17 ASP CA C 17 53.100 53.100 55.332 -2.232 19947
8467 1 25 . 1 1 17 17 ASP CB C 17 38.600 38.600 41.757 -3.157 19947
8468 1 25 . 1 1 17 17 ASP H H 17 8.180 8.180 8.640 -0.460 19947
8469 1 25 . 1 1 18 18 CYS HA H 18 4.730 4.730 3.988 0.742 19947
8470 1 25 . 1 1 18 18 CYS CB C 18 41.900 41.900 26.189 15.711 19947
8471 1 25 . 1 1 19 19 GLY H H 19 8.220 8.220 8.882 -0.662 19947
8472 1 25 . 1 1 20 20 SER HA H 20 4.920 4.920 4.472 0.448 19947
8473 1 25 . 1 1 20 20 SER CA C 20 55.700 55.700 56.380 -0.680 19947
8474 1 25 . 1 1 20 20 SER CB C 20 63.500 63.500 63.423 0.077 19947
8475 1 25 . 1 1 20 20 SER H H 20 7.830 7.830 8.369 -0.539 19947
8476 1 25 . 1 1 21 21 PRO HA H 21 4.240 4.240 4.219 0.021 19947
8477 1 25 . 1 1 21 21 PRO CA C 21 63.400 63.400 64.596 -1.196 19947
8478 1 25 . 1 1 21 21 PRO CB C 21 31.800 31.800 31.533 0.267 19947
8479 1 25 . 1 1 22 22 ALA N N 22 119.900 119.900 118.088 1.812 19947
8480 1 25 . 1 1 22 22 ALA HA H 22 4.220 4.220 4.135 0.085 19947
8481 1 25 . 1 1 22 22 ALA CA C 22 54.200 54.200 54.012 0.188 19947
8482 1 25 . 1 1 22 22 ALA CB C 22 18.500 18.500 18.488 0.012 19947
8483 1 25 . 1 1 22 22 ALA H H 22 8.180 8.180 8.277 -0.097 19947
8484 1 25 . 1 1 23 23 ASN N N 23 116.300 116.300 112.040 4.260 19947
8485 1 25 . 1 1 23 23 ASN HA H 23 4.670 4.670 4.844 -0.174 19947
8486 1 25 . 1 1 23 23 ASN CA C 23 53.200 53.200 53.433 -0.233 19947
8487 1 25 . 1 1 23 23 ASN CB C 23 39.300 39.300 41.068 -1.768 19947
8488 1 25 . 1 1 23 23 ASN H H 23 7.960 7.960 8.160 -0.200 19947
8489 1 25 . 1 1 24 24 CYS HA H 24 4.720 4.720 4.286 0.434 19947
8490 1 25 . 1 1 24 24 CYS H H 24 8.510 8.510 7.738 0.772 19947
8491 1 25 . 1 1 25 25 GLN HA H 25 4.460 4.460 3.829 0.631 19947
8492 1 25 . 1 1 25 25 GLN H H 25 8.320 8.320 8.834 -0.514 19947
8493 1 25 . 1 1 26 26 ASP HA H 26 4.740 4.740 4.624 0.116 19947
8494 1 25 . 1 1 26 26 ASP H H 26 8.580 8.580 8.428 0.152 19947
8495 1 25 . 1 1 27 27 ARG HA H 27 4.680 4.680 4.436 0.244 19947
8496 1 25 . 1 1 27 27 ARG CA C 27 54.700 54.700 57.551 -2.852 19947
8497 1 25 . 1 1 27 27 ARG H H 27 8.550 8.550 7.775 0.775 19947
8498 1 25 . 1 1 28 28 CYS HA H 28 4.120 4.120 4.782 -0.662 19947
8499 1 25 . 1 1 28 28 CYS CA C 28 54.400 54.400 58.217 -3.817 19947
8500 1 25 . 1 1 28 28 CYS CB C 28 19.000 19.000 26.566 -7.566 19947
8501 1 25 . 1 1 28 28 CYS H H 28 8.910 8.910 8.254 0.656 19947
8502 1 25 . 1 1 29 29 CYS N N 29 113.300 113.300 120.663 -7.363 19947
8503 1 25 . 1 1 29 29 CYS HA H 29 5.010 5.010 4.636 0.374 19947
8504 1 25 . 1 1 29 29 CYS CA C 29 54.300 54.300 58.786 -4.487 19947
8505 1 25 . 1 1 29 29 CYS H H 29 7.730 7.730 7.886 -0.156 19947
8506 1 25 . 1 1 30 30 ASN HA H 30 4.730 4.730 4.967 -0.237 19947
8507 1 25 . 1 1 30 30 ASN CB C 30 38.700 38.700 39.338 -0.638 19947
8508 1 25 . 1 1 30 30 ASN H H 30 8.870 8.870 8.416 0.454 19947
8509 1 25 . 1 1 31 31 ALA N N 31 129.400 129.400 126.593 2.807 19947
8510 1 25 . 1 1 31 31 ALA HA H 31 4.120 4.120 4.536 -0.416 19947
8511 1 25 . 1 1 31 31 ALA CA C 31 54.400 54.400 54.325 0.075 19947
8512 1 25 . 1 1 31 31 ALA CB C 31 19.000 19.000 19.393 -0.393 19947
8513 1 25 . 1 1 31 31 ALA H H 31 8.890 8.890 8.166 0.724 19947
8514 1 25 . 1 1 32 32 ALA N N 32 116.400 116.400 117.567 -1.167 19947
8515 1 25 . 1 1 32 32 ALA HA H 32 4.340 4.340 4.325 0.015 19947
8516 1 25 . 1 1 32 32 ALA CA C 32 53.800 53.800 53.867 -0.067 19947
8517 1 25 . 1 1 32 32 ALA CB C 32 19.100 19.100 18.396 0.704 19947
8518 1 25 . 1 1 32 32 ALA H H 32 8.250 8.250 8.347 -0.097 19947
8519 1 25 . 1 1 33 33 THR N N 33 104.300 104.300 109.038 -4.738 19947
8520 1 25 . 1 1 33 33 THR HA H 33 4.430 4.430 4.395 0.035 19947
8521 1 25 . 1 1 33 33 THR CA C 33 60.500 60.500 60.892 -0.392 19947
8522 1 25 . 1 1 33 33 THR CB C 33 70.600 70.600 69.255 1.345 19947
8523 1 25 . 1 1 33 33 THR H H 33 7.320 7.320 7.264 0.056 19947
8524 1 25 . 1 1 34 34 CYS N N 34 123.400 123.400 122.100 1.300 19947
8525 1 25 . 1 1 34 34 CYS HA H 34 4.170 4.170 4.172 -0.002 19947
8526 1 25 . 1 1 34 34 CYS CA C 34 56.500 56.500 60.484 -3.984 19947
8527 1 25 . 1 1 34 34 CYS H H 34 8.710 8.710 8.277 0.432 19947
8528 1 25 . 1 1 35 35 LYS N N 35 116.900 116.900 118.686 -1.786 19947
8529 1 25 . 1 1 35 35 LYS HA H 35 4.960 4.960 4.633 0.327 19947
8530 1 25 . 1 1 35 35 LYS CA C 35 53.900 53.900 55.487 -1.587 19947
8531 1 25 . 1 1 35 35 LYS CB C 35 35.900 35.900 36.044 -0.143 19947
8532 1 25 . 1 1 35 35 LYS H H 35 7.450 7.450 7.719 -0.269 19947
8533 1 25 . 1 1 36 36 LEU N N 36 119.300 119.300 122.159 -2.859 19947
8534 1 25 . 1 1 36 36 LEU HA H 36 4.800 4.800 4.209 0.591 19947
8535 1 25 . 1 1 36 36 LEU CB C 36 42.400 42.400 41.795 0.605 19947
8536 1 25 . 1 1 36 36 LEU H H 36 8.290 8.290 8.505 -0.215 19947
8537 1 25 . 1 1 37 37 THR HA H 37 4.340 4.340 4.713 -0.373 19947
8538 1 25 . 1 1 37 37 THR CA C 37 60.200 60.200 60.076 0.124 19947
8539 1 25 . 1 1 37 37 THR CB C 37 67.700 67.700 68.519 -0.819 19947
8540 1 25 . 1 1 37 37 THR H H 37 8.380 8.380 7.909 0.471 19947
8541 1 25 . 1 1 38 38 PRO HA H 38 4.380 4.380 4.289 0.091 19947
8542 1 25 . 1 1 38 38 PRO CA C 38 64.800 64.800 64.541 0.259 19947
8543 1 25 . 1 1 38 38 PRO CB C 38 31.500 31.500 31.654 -0.154 19947
8544 1 25 . 1 1 39 39 GLY N N 39 113.300 113.300 110.038 3.262 19947
8545 1 25 . 1 1 39 39 GLY CA C 39 45.100 45.100 44.880 0.220 19947
8546 1 25 . 1 1 39 39 GLY H H 39 8.830 8.830 8.555 0.275 19947
8547 1 25 . 1 1 40 40 SER N N 40 116.700 116.700 117.115 -0.415 19947
8548 1 25 . 1 1 40 40 SER HA H 40 4.610 4.610 4.768 -0.158 19947
8549 1 25 . 1 1 40 40 SER CA C 40 58.800 58.800 57.957 0.843 19947
8550 1 25 . 1 1 40 40 SER CB C 40 63.800 63.800 63.642 0.158 19947
8551 1 25 . 1 1 40 40 SER H H 40 8.280 8.280 7.632 0.648 19947
8552 1 25 . 1 1 41 41 GLN N N 41 120.600 120.600 123.389 -2.789 19947
8553 1 25 . 1 1 41 41 GLN HA H 41 4.110 4.110 4.031 0.079 19947
8554 1 25 . 1 1 41 41 GLN CA C 41 55.200 55.200 57.386 -2.186 19947
8555 1 25 . 1 1 41 41 GLN CB C 41 31.100 31.100 29.085 2.015 19947
8556 1 25 . 1 1 41 41 GLN H H 41 9.190 9.190 7.935 1.255 19947
8557 1 25 . 1 1 42 42 CYS N N 42 113.200 113.200 114.777 -1.577 19947
8558 1 25 . 1 1 42 42 CYS HA H 42 4.630 4.630 4.422 0.208 19947
8559 1 25 . 1 1 42 42 CYS CA C 42 53.700 53.700 57.456 -3.756 19947
8560 1 25 . 1 1 42 42 CYS CB C 42 45.500 45.500 30.365 15.135 19947
8561 1 25 . 1 1 42 42 CYS H H 42 7.710 7.710 7.456 0.254 19947
8562 1 25 . 1 1 43 43 ASN N N 43 114.200 114.200 120.302 -6.102 19947
8563 1 25 . 1 1 43 43 ASN HA H 43 4.940 4.940 5.045 -0.105 19947
8564 1 25 . 1 1 43 43 ASN CA C 43 53.000 53.000 53.383 -0.383 19947
8565 1 25 . 1 1 43 43 ASN CB C 43 39.300 39.300 40.075 -0.775 19947
8566 1 25 . 1 1 43 43 ASN H H 43 8.870 8.870 8.543 0.327 19947
8567 1 25 . 1 1 44 44 TYR N N 44 118.400 118.400 115.229 3.171 19947
8568 1 25 . 1 1 44 44 TYR HA H 44 4.850 4.850 4.769 0.081 19947
8569 1 25 . 1 1 44 44 TYR CA C 44 55.300 55.300 57.595 -2.295 19947
8570 1 25 . 1 1 44 44 TYR CB C 44 40.700 40.700 39.114 1.586 19947
8571 1 25 . 1 1 44 44 TYR H H 44 7.840 7.840 7.246 0.594 19947
8572 1 25 . 1 1 45 45 GLY N N 45 110.600 110.600 108.181 2.419 19947
8573 1 25 . 1 1 45 45 GLY CA C 45 44.000 44.000 44.872 -0.872 19947
8574 1 25 . 1 1 45 45 GLY H H 45 7.960 7.960 7.823 0.137 19947
8575 1 25 . 1 1 46 46 GLU N N 46 120.700 120.700 120.036 0.664 19947
8576 1 25 . 1 1 46 46 GLU HA H 46 4.280 4.280 4.077 0.203 19947
8577 1 25 . 1 1 46 46 GLU CA C 46 58.500 58.500 59.569 -1.069 19947
8578 1 25 . 1 1 46 46 GLU CB C 46 29.300 29.300 29.960 -0.660 19947
8579 1 25 . 1 1 46 46 GLU H H 46 9.160 9.160 8.625 0.535 19947
8580 1 25 . 1 1 47 47 CYS N N 47 112.400 112.400 118.250 -5.850 19947
8581 1 25 . 1 1 47 47 CYS HA H 47 4.850 4.850 4.577 0.273 19947
8582 1 25 . 1 1 47 47 CYS CA C 47 57.100 57.100 58.531 -1.431 19947
8583 1 25 . 1 1 47 47 CYS CB C 47 41.200 41.200 25.515 15.685 19947
8584 1 25 . 1 1 47 47 CYS H H 47 8.510 8.510 7.455 1.055 19947
8585 1 25 . 1 1 48 48 CYS N N 48 123.200 123.200 120.507 2.693 19947
8586 1 25 . 1 1 48 48 CYS HA H 48 5.160 5.160 4.909 0.251 19947
8587 1 25 . 1 1 48 48 CYS CA C 48 54.700 54.700 58.581 -3.881 19947
8588 1 25 . 1 1 48 48 CYS CB C 48 45.700 45.700 28.901 16.799 19947
8589 1 25 . 1 1 48 48 CYS H H 48 7.810 7.810 7.994 -0.184 19947
8590 1 25 . 1 1 49 49 ASP N N 49 127.400 127.400 127.260 0.140 19947
8591 1 25 . 1 1 49 49 ASP HA H 49 4.890 4.890 4.924 -0.034 19947
8592 1 25 . 1 1 49 49 ASP CA C 49 53.500 53.500 54.324 -0.824 19947
8593 1 25 . 1 1 49 49 ASP CB C 49 42.400 42.400 43.536 -1.137 19947
8594 1 25 . 1 1 49 49 ASP H H 49 9.670 9.670 8.275 1.395 19947
8595 1 25 . 1 1 50 50 GLN N N 50 127.000 127.000 123.110 3.890 19947
8596 1 25 . 1 1 50 50 GLN HA H 50 3.940 3.940 3.928 0.012 19947
8597 1 25 . 1 1 50 50 GLN CA C 50 56.800 56.800 58.555 -1.755 19947
8598 1 25 . 1 1 50 50 GLN CB C 50 26.500 26.500 28.285 -1.784 19947
8599 1 25 . 1 1 50 50 GLN H H 50 9.450 9.450 8.941 0.509 19947
8600 1 25 . 1 1 51 51 CYS N N 51 106.100 106.100 120.462 -14.362 19947
8601 1 25 . 1 1 51 51 CYS HA H 51 4.760 4.760 4.670 0.090 19947
8602 1 25 . 1 1 51 51 CYS CB C 51 43.200 43.200 27.550 15.650 19947
8603 1 25 . 1 1 51 51 CYS H H 51 8.700 8.700 8.240 0.460 19947
8604 1 25 . 1 1 52 52 ARG N N 52 121.000 121.000 118.780 2.220 19947
8605 1 25 . 1 1 52 52 ARG HA H 52 4.690 4.690 4.505 0.185 19947
8606 1 25 . 1 1 52 52 ARG CA C 52 55.400 55.400 54.705 0.696 19947
8607 1 25 . 1 1 52 52 ARG CB C 52 33.100 33.100 35.003 -1.903 19947
8608 1 25 . 1 1 52 52 ARG H H 52 7.960 7.960 7.733 0.227 19947
8609 1 25 . 1 1 53 53 PHE N N 53 120.300 120.300 120.409 -0.109 19947
8610 1 25 . 1 1 53 53 PHE HA H 53 5.050 5.050 5.059 -0.009 19947
8611 1 25 . 1 1 53 53 PHE CA C 53 56.100 56.100 56.374 -0.274 19947
8612 1 25 . 1 1 53 53 PHE CB C 53 38.200 38.200 39.048 -0.848 19947
8613 1 25 . 1 1 53 53 PHE H H 53 8.400 8.400 8.381 0.019 19947
8614 1 25 . 1 1 54 54 LYS N N 54 123.300 123.300 125.641 -2.341 19947
8615 1 25 . 1 1 54 54 LYS HA H 54 4.250 4.250 4.130 0.120 19947
8616 1 25 . 1 1 54 54 LYS CA C 54 57.500 57.500 56.154 1.346 19947
8617 1 25 . 1 1 54 54 LYS CB C 54 34.300 34.300 31.894 2.406 19947
8618 1 25 . 1 1 54 54 LYS H H 54 8.540 8.540 8.090 0.450 19947
8619 1 25 . 1 1 55 55 LYS N N 55 119.400 119.400 124.824 -5.424 19947
8620 1 25 . 1 1 55 55 LYS HA H 55 4.110 4.110 3.949 0.161 19947
8621 1 25 . 1 1 55 55 LYS CA C 55 56.500 56.500 56.888 -0.388 19947
8622 1 25 . 1 1 55 55 LYS CB C 55 33.400 33.400 33.145 0.255 19947
8623 1 25 . 1 1 55 55 LYS H H 55 8.440 8.440 8.150 0.290 19947
8624 1 25 . 1 1 56 56 ALA N N 56 126.700 126.700 127.904 -1.204 19947
8625 1 25 . 1 1 56 56 ALA HA H 56 3.920 3.920 4.006 -0.086 19947
8626 1 25 . 1 1 56 56 ALA CA C 56 52.900 52.900 53.631 -0.731 19947
8627 1 25 . 1 1 56 56 ALA CB C 56 18.100 18.100 18.469 -0.369 19947
8628 1 25 . 1 1 56 56 ALA H H 56 8.930 8.930 8.625 0.305 19947
8629 1 25 . 1 1 57 57 GLY N N 57 109.300 109.300 111.922 -2.622 19947
8630 1 25 . 1 1 57 57 GLY CA C 57 45.100 45.100 44.838 0.262 19947
8631 1 25 . 1 1 57 57 GLY H H 57 8.460 8.460 8.432 0.028 19947
8632 1 25 . 1 1 58 58 THR N N 58 117.200 117.200 120.053 -2.853 19947
8633 1 25 . 1 1 58 58 THR HA H 58 4.260 4.260 4.399 -0.139 19947
8634 1 25 . 1 1 58 58 THR CA C 58 63.300 63.300 63.413 -0.113 19947
8635 1 25 . 1 1 58 58 THR CB C 58 69.600 69.600 69.186 0.414 19947
8636 1 25 . 1 1 58 58 THR H H 58 7.660 7.660 7.739 -0.079 19947
8637 1 25 . 1 1 59 59 VAL N N 59 130.400 130.400 128.301 2.099 19947
8638 1 25 . 1 1 59 59 VAL HA H 59 3.900 3.900 3.725 0.175 19947
8639 1 25 . 1 1 59 59 VAL CA C 59 64.400 64.400 63.437 0.963 19947
8640 1 25 . 1 1 59 59 VAL CB C 59 31.900 31.900 32.079 -0.179 19947
8641 1 25 . 1 1 59 59 VAL H H 59 9.190 9.190 8.728 0.462 19947
8642 1 25 . 1 1 60 60 CYS N N 60 121.800 121.800 126.311 -4.511 19947
8643 1 25 . 1 1 60 60 CYS HA H 60 5.050 5.050 4.648 0.402 19947
8644 1 25 . 1 1 60 60 CYS CA C 60 54.400 54.400 57.920 -3.520 19947
8645 1 25 . 1 1 60 60 CYS CB C 60 43.000 43.000 28.115 14.885 19947
8646 1 25 . 1 1 60 60 CYS H H 60 9.130 9.130 8.338 0.792 19947
8647 1 25 . 1 1 61 61 ARG N N 61 124.100 124.100 117.554 6.546 19947
8648 1 25 . 1 1 61 61 ARG HA H 61 4.360 4.360 4.674 -0.314 19947
8649 1 25 . 1 1 61 61 ARG CA C 61 56.800 56.800 55.055 1.745 19947
8650 1 25 . 1 1 61 61 ARG CB C 61 32.800 32.800 33.853 -1.053 19947
8651 1 25 . 1 1 61 61 ARG H H 61 7.580 7.580 7.443 0.137 19947
8652 1 25 . 1 1 62 62 ILE N N 62 126.200 126.200 116.951 9.249 19947
8653 1 25 . 1 1 62 62 ILE HA H 62 4.090 4.090 4.515 -0.425 19947
8654 1 25 . 1 1 62 62 ILE CA C 62 60.300 60.300 60.911 -0.611 19947
8655 1 25 . 1 1 62 62 ILE CB C 62 38.700 38.700 41.203 -2.503 19947
8656 1 25 . 1 1 62 62 ILE H H 62 8.490 8.490 8.449 0.041 19947
8657 1 25 . 1 1 63 63 ALA N N 63 129.400 129.400 132.261 -2.861 19947
8658 1 25 . 1 1 63 63 ALA HA H 63 4.310 4.310 4.314 -0.004 19947
8659 1 25 . 1 1 63 63 ALA CA C 63 51.900 51.900 54.342 -2.442 19947
8660 1 25 . 1 1 63 63 ALA CB C 63 20.600 20.600 19.595 1.005 19947
8661 1 25 . 1 1 63 63 ALA H H 63 8.100 8.100 8.689 -0.589 19947
8662 1 25 . 1 1 64 64 ARG N N 64 120.500 120.500 120.749 -0.249 19947
8663 1 25 . 1 1 64 64 ARG HA H 64 4.290 4.290 4.510 -0.220 19947
8664 1 25 . 1 1 64 64 ARG CA C 64 56.200 56.200 56.087 0.113 19947
8665 1 25 . 1 1 64 64 ARG CB C 64 30.500 30.500 30.840 -0.341 19947
8666 1 25 . 1 1 64 64 ARG H H 64 8.140 8.140 8.868 -0.728 19947
8667 1 25 . 1 1 65 65 GLY N N 65 110.500 110.500 111.363 -0.863 19947
8668 1 25 . 1 1 65 65 GLY CA C 65 45.100 45.100 44.512 0.588 19947
8669 1 25 . 1 1 65 65 GLY H H 65 8.040 8.040 8.228 -0.188 19947
8670 1 25 . 1 1 66 66 ASP N N 66 120.700 120.700 119.200 1.500 19947
8671 1 25 . 1 1 66 66 ASP HA H 66 4.610 4.610 4.573 0.037 19947
8672 1 25 . 1 1 66 66 ASP CA C 66 53.300 53.300 54.182 -0.882 19947
8673 1 25 . 1 1 66 66 ASP CB C 66 37.600 37.600 40.818 -3.218 19947
8674 1 25 . 1 1 66 66 ASP H H 66 8.380 8.380 7.066 1.314 19947
8675 1 25 . 1 1 67 67 TRP N N 67 120.100 120.100 123.034 -2.934 19947
8676 1 25 . 1 1 67 67 TRP HA H 67 4.760 4.760 5.112 -0.352 19947
8677 1 25 . 1 1 67 67 TRP CA C 67 57.200 57.200 58.178 -0.978 19947
8678 1 25 . 1 1 67 67 TRP CB C 67 29.100 29.100 29.540 -0.440 19947
8679 1 25 . 1 1 67 67 TRP H H 67 7.950 7.950 7.943 0.007 19947
8680 1 25 . 1 1 68 68 ASN N N 68 118.400 118.400 118.594 -0.194 19947
8681 1 25 . 1 1 68 68 ASN HA H 68 4.790 4.790 4.945 -0.155 19947
8682 1 25 . 1 1 68 68 ASN CA C 68 52.800 52.800 53.673 -0.873 19947
8683 1 25 . 1 1 68 68 ASN CB C 68 39.300 39.300 40.188 -0.888 19947
8684 1 25 . 1 1 68 68 ASN H H 68 8.180 8.180 8.710 -0.530 19947
8685 1 25 . 1 1 69 69 ASP N N 69 118.500 118.500 118.626 -0.126 19947
8686 1 25 . 1 1 69 69 ASP HA H 69 4.620 4.620 4.415 0.205 19947
8687 1 25 . 1 1 69 69 ASP CA C 69 53.200 53.200 56.276 -3.076 19947
8688 1 25 . 1 1 69 69 ASP CB C 69 38.000 38.000 41.175 -3.175 19947
8689 1 25 . 1 1 69 69 ASP H H 69 8.130 8.130 8.504 -0.374 19947
8690 1 25 . 1 1 70 70 ASP N N 70 120.500 120.500 121.161 -0.661 19947
8691 1 25 . 1 1 70 70 ASP HA H 70 5.100 5.100 5.050 0.050 19947
8692 1 25 . 1 1 70 70 ASP CA C 70 52.500 52.500 53.522 -1.022 19947
8693 1 25 . 1 1 70 70 ASP CB C 70 42.600 42.600 42.154 0.446 19947
8694 1 25 . 1 1 70 70 ASP H H 70 8.140 8.140 8.125 0.015 19947
8695 1 25 . 1 1 71 71 TYR N N 71 118.900 118.900 124.131 -5.231 19947
8696 1 25 . 1 1 71 71 TYR HA H 71 5.210 5.210 4.871 0.339 19947
8697 1 25 . 1 1 71 71 TYR CA C 71 56.300 56.300 57.107 -0.807 19947
8698 1 25 . 1 1 71 71 TYR CB C 71 42.200 42.200 42.562 -0.362 19947
8699 1 25 . 1 1 71 71 TYR H H 71 8.450 8.450 8.113 0.337 19947
8700 1 25 . 1 1 72 72 CYS N N 72 119.800 119.800 122.439 -2.639 19947
8701 1 25 . 1 1 72 72 CYS HA H 72 4.900 4.900 4.432 0.468 19947
8702 1 25 . 1 1 72 72 CYS CA C 72 53.400 53.400 59.484 -6.084 19947
8703 1 25 . 1 1 72 72 CYS CB C 72 37.200 37.200 29.011 8.189 19947
8704 1 25 . 1 1 72 72 CYS H H 72 9.330 9.330 8.404 0.926 19947
8705 1 25 . 1 1 73 73 THR N N 73 112.700 112.700 114.619 -1.919 19947
8706 1 25 . 1 1 73 73 THR HA H 73 4.430 4.430 4.407 0.023 19947
8707 1 25 . 1 1 73 73 THR CA C 73 62.300 62.300 60.810 1.490 19947
8708 1 25 . 1 1 73 73 THR CB C 73 71.300 71.300 69.012 2.288 19947
8709 1 25 . 1 1 73 73 THR H H 73 9.980 9.980 8.739 1.241 19947
8710 1 25 . 1 1 74 74 GLY N N 74 111.500 111.500 111.955 -0.455 19947
8711 1 25 . 1 1 74 74 GLY CA C 74 45.300 45.300 46.726 -1.426 19947
8712 1 25 . 1 1 74 74 GLY H H 74 8.580 8.580 7.746 0.834 19947
8713 1 25 . 1 1 75 75 LYS N N 75 115.900 115.900 115.187 0.713 19947
8714 1 25 . 1 1 75 75 LYS HA H 75 4.140 4.140 4.636 -0.496 19947
8715 1 25 . 1 1 75 75 LYS CA C 75 54.800 54.800 55.956 -1.156 19947
8716 1 25 . 1 1 75 75 LYS CB C 75 34.200 34.200 34.540 -0.340 19947
8717 1 25 . 1 1 75 75 LYS H H 75 7.900 7.900 7.480 0.420 19947
8718 1 25 . 1 1 76 76 SER N N 76 111.000 111.000 113.766 -2.766 19947
8719 1 25 . 1 1 76 76 SER HA H 76 4.160 4.160 3.934 0.226 19947
8720 1 25 . 1 1 76 76 SER CA C 76 61.400 61.400 56.587 4.813 19947
8721 1 25 . 1 1 76 76 SER CB C 76 64.300 64.300 65.844 -1.544 19947
8722 1 25 . 1 1 76 76 SER H H 76 6.520 6.520 6.818 -0.298 19947
8723 1 25 . 1 1 77 77 SER N N 77 117.100 117.100 114.016 3.084 19947
8724 1 25 . 1 1 77 77 SER HA H 77 4.220 4.220 4.254 -0.034 19947
8725 1 25 . 1 1 77 77 SER CA C 77 59.800 59.800 58.738 1.062 19947
8726 1 25 . 1 1 77 77 SER CB C 77 64.400 64.400 63.678 0.722 19947
8727 1 25 . 1 1 77 77 SER H H 77 9.030 9.030 8.275 0.755 19947
8728 1 25 . 1 1 78 78 ASP N N 78 122.100 122.100 118.360 3.740 19947
8729 1 25 . 1 1 78 78 ASP HA H 78 4.930 4.930 4.685 0.245 19947
8730 1 25 . 1 1 78 78 ASP CA C 78 52.400 52.400 52.397 0.003 19947
8731 1 25 . 1 1 78 78 ASP CB C 78 40.800 40.800 43.470 -2.670 19947
8732 1 25 . 1 1 78 78 ASP H H 78 8.340 8.340 7.525 0.815 19947
8733 1 25 . 1 1 79 79 CYS N N 79 122.200 122.200 120.605 1.595 19947
8734 1 25 . 1 1 79 79 CYS HA H 79 5.320 5.320 4.680 0.640 19947
8735 1 25 . 1 1 79 79 CYS CA C 79 52.000 52.000 55.202 -3.202 19947
8736 1 25 . 1 1 79 79 CYS CB C 79 39.300 39.300 27.609 11.691 19947
8737 1 25 . 1 1 79 79 CYS H H 79 8.960 8.960 8.514 0.446 19947
8738 1 25 . 1 1 80 80 PRO HA H 80 4.410 4.410 4.118 0.292 19947
8739 1 25 . 1 1 80 80 PRO CA C 80 63.500 63.500 62.886 0.613 19947
8740 1 25 . 1 1 80 80 PRO CB C 80 32.400 32.400 32.636 -0.236 19947
8741 1 25 . 1 1 81 81 TRP N N 81 120.500 120.500 122.206 -1.706 19947
8742 1 25 . 1 1 81 81 TRP HA H 81 4.550 4.550 4.178 0.372 19947
8743 1 25 . 1 1 81 81 TRP CA C 81 56.400 56.400 58.453 -2.053 19947
8744 1 25 . 1 1 81 81 TRP CB C 81 29.500 29.500 28.474 1.026 19947
8745 1 25 . 1 1 81 81 TRP H H 81 8.400 8.400 7.288 1.112 19947
8746 1 25 . 1 1 82 82 ASN N N 82 120.400 120.400 113.425 6.975 19947
8747 1 25 . 1 1 82 82 ASN HA H 82 4.750 4.750 4.416 0.334 19947
8748 1 25 . 1 1 82 82 ASN CA C 82 53.100 53.100 53.895 -0.795 19947
8749 1 25 . 1 1 82 82 ASN CB C 82 39.000 39.000 36.769 2.231 19947
8750 1 25 . 1 1 82 82 ASN H H 82 8.040 8.040 8.334 -0.294 19947
8751 1 26 . 1 1 2 2 PRO HA H 2 4.820 4.820 4.832 -0.012 19947
8752 1 26 . 1 1 2 2 PRO CA C 2 61.900 61.900 62.192 -0.292 19947
8753 1 26 . 1 1 2 2 PRO CB C 2 30.700 30.700 31.780 -1.080 19947
8754 1 26 . 1 1 3 3 PRO HA H 3 4.540 4.540 4.537 0.003 19947
8755 1 26 . 1 1 3 3 PRO CA C 3 62.900 62.900 62.555 0.345 19947
8756 1 26 . 1 1 3 3 PRO CB C 3 32.100 32.100 32.586 -0.486 19947
8757 1 26 . 1 1 4 4 VAL N N 4 121.900 121.900 123.492 -1.592 19947
8758 1 26 . 1 1 4 4 VAL HA H 4 4.200 4.200 4.389 -0.189 19947
8759 1 26 . 1 1 4 4 VAL CA C 4 62.300 62.300 61.287 1.013 19947
8760 1 26 . 1 1 4 4 VAL CB C 4 32.800 32.800 30.048 2.752 19947
8761 1 26 . 1 1 4 4 VAL H H 4 8.330 8.330 8.381 -0.051 19947
8762 1 26 . 1 1 5 5 CYS N N 5 120.900 120.900 127.388 -6.488 19947
8763 1 26 . 1 1 5 5 CYS HA H 5 4.700 4.700 4.457 0.243 19947
8764 1 26 . 1 1 5 5 CYS CA C 5 53.600 53.600 58.706 -5.106 19947
8765 1 26 . 1 1 5 5 CYS H H 5 8.500 8.500 8.648 -0.148 19947
8766 1 26 . 1 1 6 6 GLY N N 6 110.200 110.200 112.956 -2.756 19947
8767 1 26 . 1 1 6 6 GLY CA C 6 46.300 46.300 44.687 1.613 19947
8768 1 26 . 1 1 6 6 GLY H H 6 8.490 8.490 8.399 0.091 19947
8769 1 26 . 1 1 7 7 ASN N N 7 120.100 120.100 117.085 3.015 19947
8770 1 26 . 1 1 7 7 ASN HA H 7 4.730 4.730 4.355 0.375 19947
8771 1 26 . 1 1 7 7 ASN CA C 7 53.200 53.200 54.383 -1.183 19947
8772 1 26 . 1 1 7 7 ASN CB C 7 38.700 38.700 39.236 -0.536 19947
8773 1 26 . 1 1 7 7 ASN H H 7 8.320 8.320 8.260 0.060 19947
8774 1 26 . 1 1 8 8 LYS N N 8 121.300 121.300 122.169 -0.869 19947
8775 1 26 . 1 1 8 8 LYS HA H 8 4.340 4.340 4.225 0.115 19947
8776 1 26 . 1 1 8 8 LYS CA C 8 56.600 56.600 57.058 -0.458 19947
8777 1 26 . 1 1 8 8 LYS CB C 8 32.900 32.900 31.145 1.755 19947
8778 1 26 . 1 1 8 8 LYS H H 8 8.260 8.260 8.520 -0.260 19947
8779 1 26 . 1 1 9 9 ILE N N 9 136.600 136.600 121.978 14.622 19947
8780 1 26 . 1 1 9 9 ILE HA H 9 4.140 4.140 3.905 0.235 19947
8781 1 26 . 1 1 9 9 ILE CA C 9 61.300 61.300 61.940 -0.640 19947
8782 1 26 . 1 1 9 9 ILE CB C 9 38.200 38.200 37.898 0.302 19947
8783 1 26 . 1 1 9 9 ILE H H 9 8.150 8.150 8.007 0.143 19947
8784 1 26 . 1 1 10 10 LEU N N 10 125.700 125.700 121.076 4.624 19947
8785 1 26 . 1 1 10 10 LEU HA H 10 4.420 4.420 4.484 -0.064 19947
8786 1 26 . 1 1 10 10 LEU CA C 10 55.200 55.200 55.286 -0.086 19947
8787 1 26 . 1 1 10 10 LEU CB C 10 42.300 42.300 40.817 1.483 19947
8788 1 26 . 1 1 10 10 LEU H H 10 8.230 8.230 8.365 -0.135 19947
8789 1 26 . 1 1 11 11 GLU N N 11 120.600 120.600 113.266 7.334 19947
8790 1 26 . 1 1 11 11 GLU HA H 11 4.470 4.470 4.106 0.364 19947
8791 1 26 . 1 1 11 11 GLU CA C 11 55.500 55.500 56.730 -1.230 19947
8792 1 26 . 1 1 11 11 GLU CB C 11 28.900 28.900 28.218 0.682 19947
8793 1 26 . 1 1 11 11 GLU H H 11 8.250 8.250 7.923 0.327 19947
8794 1 26 . 1 1 12 12 GLN N N 12 121.600 121.600 119.221 2.379 19947
8795 1 26 . 1 1 12 12 GLN HA H 12 4.350 4.350 4.576 -0.226 19947
8796 1 26 . 1 1 12 12 GLN CA C 12 56.600 56.600 55.291 1.309 19947
8797 1 26 . 1 1 12 12 GLN CB C 12 29.200 29.200 30.058 -0.858 19947
8798 1 26 . 1 1 12 12 GLN H H 12 8.460 8.460 7.969 0.491 19947
8799 1 26 . 1 1 13 13 GLY N N 13 110.700 110.700 106.576 4.124 19947
8800 1 26 . 1 1 13 13 GLY CA C 13 45.700 45.700 45.676 0.024 19947
8801 1 26 . 1 1 13 13 GLY H H 13 8.660 8.660 8.462 0.198 19947
8802 1 26 . 1 1 14 14 GLU N N 14 118.900 118.900 111.093 7.807 19947
8803 1 26 . 1 1 14 14 GLU HA H 14 4.530 4.530 4.192 0.338 19947
8804 1 26 . 1 1 14 14 GLU CA C 14 55.600 55.600 56.691 -1.091 19947
8805 1 26 . 1 1 14 14 GLU CB C 14 29.700 29.700 29.187 0.513 19947
8806 1 26 . 1 1 14 14 GLU H H 14 8.230 8.230 8.020 0.210 19947
8807 1 26 . 1 1 15 15 ASP N N 15 118.400 118.400 122.151 -3.751 19947
8808 1 26 . 1 1 15 15 ASP HA H 15 4.990 4.990 4.492 0.498 19947
8809 1 26 . 1 1 15 15 ASP CA C 15 53.500 53.500 57.140 -3.640 19947
8810 1 26 . 1 1 15 15 ASP CB C 15 39.700 39.700 41.628 -1.928 19947
8811 1 26 . 1 1 15 15 ASP H H 15 8.330 8.330 8.512 -0.182 19947
8812 1 26 . 1 1 16 16 CYS HA H 16 4.340 4.340 4.324 0.016 19947
8813 1 26 . 1 1 16 16 CYS H H 16 8.510 8.510 7.817 0.693 19947
8814 1 26 . 1 1 17 17 ASP N N 17 116.700 116.700 123.817 -7.117 19947
8815 1 26 . 1 1 17 17 ASP HA H 17 4.740 4.740 4.423 0.317 19947
8816 1 26 . 1 1 17 17 ASP CA C 17 53.100 53.100 55.402 -2.302 19947
8817 1 26 . 1 1 17 17 ASP CB C 17 38.600 38.600 39.467 -0.867 19947
8818 1 26 . 1 1 17 17 ASP H H 17 8.180 8.180 8.799 -0.619 19947
8819 1 26 . 1 1 18 18 CYS HA H 18 4.730 4.730 3.969 0.761 19947
8820 1 26 . 1 1 18 18 CYS CB C 18 41.900 41.900 26.944 14.956 19947
8821 1 26 . 1 1 19 19 GLY H H 19 8.220 8.220 8.705 -0.485 19947
8822 1 26 . 1 1 20 20 SER HA H 20 4.920 4.920 4.424 0.496 19947
8823 1 26 . 1 1 20 20 SER CA C 20 55.700 55.700 56.517 -0.817 19947
8824 1 26 . 1 1 20 20 SER CB C 20 63.500 63.500 63.106 0.394 19947
8825 1 26 . 1 1 20 20 SER H H 20 7.830 7.830 8.401 -0.571 19947
8826 1 26 . 1 1 21 21 PRO HA H 21 4.240 4.240 4.264 -0.024 19947
8827 1 26 . 1 1 21 21 PRO CA C 21 63.400 63.400 64.728 -1.328 19947
8828 1 26 . 1 1 21 21 PRO CB C 21 31.800 31.800 31.325 0.475 19947
8829 1 26 . 1 1 22 22 ALA N N 22 119.900 119.900 117.022 2.878 19947
8830 1 26 . 1 1 22 22 ALA HA H 22 4.220 4.220 4.108 0.112 19947
8831 1 26 . 1 1 22 22 ALA CA C 22 54.200 54.200 54.240 -0.040 19947
8832 1 26 . 1 1 22 22 ALA CB C 22 18.500 18.500 19.002 -0.502 19947
8833 1 26 . 1 1 22 22 ALA H H 22 8.180 8.180 8.008 0.172 19947
8834 1 26 . 1 1 23 23 ASN N N 23 116.300 116.300 112.968 3.332 19947
8835 1 26 . 1 1 23 23 ASN HA H 23 4.670 4.670 4.981 -0.311 19947
8836 1 26 . 1 1 23 23 ASN CA C 23 53.200 53.200 53.026 0.173 19947
8837 1 26 . 1 1 23 23 ASN CB C 23 39.300 39.300 40.351 -1.051 19947
8838 1 26 . 1 1 23 23 ASN H H 23 7.960 7.960 8.118 -0.158 19947
8839 1 26 . 1 1 24 24 CYS HA H 24 4.720 4.720 4.185 0.535 19947
8840 1 26 . 1 1 24 24 CYS H H 24 8.510 8.510 7.546 0.964 19947
8841 1 26 . 1 1 25 25 GLN HA H 25 4.460 4.460 3.963 0.497 19947
8842 1 26 . 1 1 25 25 GLN H H 25 8.320 8.320 8.316 0.004 19947
8843 1 26 . 1 1 26 26 ASP HA H 26 4.740 4.740 4.757 -0.017 19947
8844 1 26 . 1 1 26 26 ASP H H 26 8.580 8.580 8.434 0.146 19947
8845 1 26 . 1 1 27 27 ARG HA H 27 4.680 4.680 4.189 0.491 19947
8846 1 26 . 1 1 27 27 ARG CA C 27 54.700 54.700 58.289 -3.589 19947
8847 1 26 . 1 1 27 27 ARG H H 27 8.550 8.550 8.527 0.023 19947
8848 1 26 . 1 1 28 28 CYS HA H 28 4.120 4.120 4.833 -0.713 19947
8849 1 26 . 1 1 28 28 CYS CA C 28 54.400 54.400 56.084 -1.684 19947
8850 1 26 . 1 1 28 28 CYS CB C 28 19.000 19.000 26.367 -7.367 19947
8851 1 26 . 1 1 28 28 CYS H H 28 8.910 8.910 8.228 0.682 19947
8852 1 26 . 1 1 29 29 CYS N N 29 113.300 113.300 120.234 -6.934 19947
8853 1 26 . 1 1 29 29 CYS HA H 29 5.010 5.010 4.839 0.171 19947
8854 1 26 . 1 1 29 29 CYS CA C 29 54.300 54.300 56.998 -2.698 19947
8855 1 26 . 1 1 29 29 CYS H H 29 7.730 7.730 7.763 -0.032 19947
8856 1 26 . 1 1 30 30 ASN HA H 30 4.730 4.730 4.882 -0.152 19947
8857 1 26 . 1 1 30 30 ASN CB C 30 38.700 38.700 40.031 -1.331 19947
8858 1 26 . 1 1 30 30 ASN H H 30 8.870 8.870 8.017 0.853 19947
8859 1 26 . 1 1 31 31 ALA N N 31 129.400 129.400 126.380 3.020 19947
8860 1 26 . 1 1 31 31 ALA HA H 31 4.120 4.120 4.324 -0.204 19947
8861 1 26 . 1 1 31 31 ALA CA C 31 54.400 54.400 54.788 -0.388 19947
8862 1 26 . 1 1 31 31 ALA CB C 31 19.000 19.000 19.235 -0.235 19947
8863 1 26 . 1 1 31 31 ALA H H 31 8.890 8.890 8.496 0.394 19947
8864 1 26 . 1 1 32 32 ALA N N 32 116.400 116.400 118.060 -1.660 19947
8865 1 26 . 1 1 32 32 ALA HA H 32 4.340 4.340 4.307 0.033 19947
8866 1 26 . 1 1 32 32 ALA CA C 32 53.800 53.800 53.654 0.146 19947
8867 1 26 . 1 1 32 32 ALA CB C 32 19.100 19.100 18.738 0.362 19947
8868 1 26 . 1 1 32 32 ALA H H 32 8.250 8.250 8.419 -0.169 19947
8869 1 26 . 1 1 33 33 THR N N 33 104.300 104.300 109.544 -5.244 19947
8870 1 26 . 1 1 33 33 THR HA H 33 4.430 4.430 4.384 0.046 19947
8871 1 26 . 1 1 33 33 THR CA C 33 60.500 60.500 60.661 -0.161 19947
8872 1 26 . 1 1 33 33 THR CB C 33 70.600 70.600 69.885 0.715 19947
8873 1 26 . 1 1 33 33 THR H H 33 7.320 7.320 7.279 0.041 19947
8874 1 26 . 1 1 34 34 CYS N N 34 123.400 123.400 120.646 2.754 19947
8875 1 26 . 1 1 34 34 CYS HA H 34 4.170 4.170 4.276 -0.106 19947
8876 1 26 . 1 1 34 34 CYS CA C 34 56.500 56.500 59.775 -3.275 19947
8877 1 26 . 1 1 34 34 CYS H H 34 8.710 8.710 8.074 0.636 19947
8878 1 26 . 1 1 35 35 LYS N N 35 116.900 116.900 118.983 -2.083 19947
8879 1 26 . 1 1 35 35 LYS HA H 35 4.960 4.960 4.757 0.203 19947
8880 1 26 . 1 1 35 35 LYS CA C 35 53.900 53.900 55.277 -1.377 19947
8881 1 26 . 1 1 35 35 LYS CB C 35 35.900 35.900 35.349 0.551 19947
8882 1 26 . 1 1 35 35 LYS H H 35 7.450 7.450 7.591 -0.141 19947
8883 1 26 . 1 1 36 36 LEU N N 36 119.300 119.300 123.148 -3.848 19947
8884 1 26 . 1 1 36 36 LEU HA H 36 4.800 4.800 4.491 0.309 19947
8885 1 26 . 1 1 36 36 LEU CB C 36 42.400 42.400 41.487 0.913 19947
8886 1 26 . 1 1 36 36 LEU H H 36 8.290 8.290 8.418 -0.128 19947
8887 1 26 . 1 1 37 37 THR HA H 37 4.340 4.340 4.469 -0.129 19947
8888 1 26 . 1 1 37 37 THR CA C 37 60.200 60.200 61.228 -1.028 19947
8889 1 26 . 1 1 37 37 THR CB C 37 67.700 67.700 68.611 -0.911 19947
8890 1 26 . 1 1 37 37 THR H H 37 8.380 8.380 7.828 0.552 19947
8891 1 26 . 1 1 38 38 PRO HA H 38 4.380 4.380 4.182 0.198 19947
8892 1 26 . 1 1 38 38 PRO CA C 38 64.800 64.800 64.398 0.402 19947
8893 1 26 . 1 1 38 38 PRO CB C 38 31.500 31.500 31.618 -0.118 19947
8894 1 26 . 1 1 39 39 GLY N N 39 113.300 113.300 112.350 0.950 19947
8895 1 26 . 1 1 39 39 GLY CA C 39 45.100 45.100 44.884 0.216 19947
8896 1 26 . 1 1 39 39 GLY H H 39 8.830 8.830 8.653 0.177 19947
8897 1 26 . 1 1 40 40 SER N N 40 116.700 116.700 118.475 -1.775 19947
8898 1 26 . 1 1 40 40 SER HA H 40 4.610 4.610 5.068 -0.458 19947
8899 1 26 . 1 1 40 40 SER CA C 40 58.800 58.800 56.976 1.824 19947
8900 1 26 . 1 1 40 40 SER CB C 40 63.800 63.800 63.837 -0.037 19947
8901 1 26 . 1 1 40 40 SER H H 40 8.280 8.280 7.668 0.612 19947
8902 1 26 . 1 1 41 41 GLN N N 41 120.600 120.600 125.702 -5.102 19947
8903 1 26 . 1 1 41 41 GLN HA H 41 4.110 4.110 3.958 0.152 19947
8904 1 26 . 1 1 41 41 GLN CA C 41 55.200 55.200 56.561 -1.361 19947
8905 1 26 . 1 1 41 41 GLN CB C 41 31.100 31.100 28.292 2.808 19947
8906 1 26 . 1 1 41 41 GLN H H 41 9.190 9.190 8.100 1.090 19947
8907 1 26 . 1 1 42 42 CYS N N 42 113.200 113.200 109.961 3.239 19947
8908 1 26 . 1 1 42 42 CYS HA H 42 4.630 4.630 4.590 0.040 19947
8909 1 26 . 1 1 42 42 CYS CA C 42 53.700 53.700 57.208 -3.508 19947
8910 1 26 . 1 1 42 42 CYS CB C 42 45.500 45.500 29.921 15.579 19947
8911 1 26 . 1 1 42 42 CYS H H 42 7.710 7.710 7.198 0.512 19947
8912 1 26 . 1 1 43 43 ASN N N 43 114.200 114.200 120.084 -5.884 19947
8913 1 26 . 1 1 43 43 ASN HA H 43 4.940 4.940 4.760 0.180 19947
8914 1 26 . 1 1 43 43 ASN CA C 43 53.000 53.000 53.967 -0.967 19947
8915 1 26 . 1 1 43 43 ASN CB C 43 39.300 39.300 41.426 -2.126 19947
8916 1 26 . 1 1 43 43 ASN H H 43 8.870 8.870 8.906 -0.036 19947
8917 1 26 . 1 1 44 44 TYR N N 44 118.400 118.400 118.558 -0.158 19947
8918 1 26 . 1 1 44 44 TYR HA H 44 4.850 4.850 4.766 0.084 19947
8919 1 26 . 1 1 44 44 TYR CA C 44 55.300 55.300 56.911 -1.611 19947
8920 1 26 . 1 1 44 44 TYR CB C 44 40.700 40.700 40.836 -0.136 19947
8921 1 26 . 1 1 44 44 TYR H H 44 7.840 7.840 7.378 0.462 19947
8922 1 26 . 1 1 45 45 GLY N N 45 110.600 110.600 110.819 -0.219 19947
8923 1 26 . 1 1 45 45 GLY CA C 45 44.000 44.000 44.884 -0.884 19947
8924 1 26 . 1 1 45 45 GLY H H 45 7.960 7.960 7.795 0.165 19947
8925 1 26 . 1 1 46 46 GLU N N 46 120.700 120.700 119.914 0.786 19947
8926 1 26 . 1 1 46 46 GLU HA H 46 4.280 4.280 4.021 0.259 19947
8927 1 26 . 1 1 46 46 GLU CA C 46 58.500 58.500 60.001 -1.500 19947
8928 1 26 . 1 1 46 46 GLU CB C 46 29.300 29.300 30.213 -0.913 19947
8929 1 26 . 1 1 46 46 GLU H H 46 9.160 9.160 8.609 0.551 19947
8930 1 26 . 1 1 47 47 CYS N N 47 112.400 112.400 119.255 -6.855 19947
8931 1 26 . 1 1 47 47 CYS HA H 47 4.850 4.850 4.858 -0.008 19947
8932 1 26 . 1 1 47 47 CYS CA C 47 57.100 57.100 57.461 -0.361 19947
8933 1 26 . 1 1 47 47 CYS CB C 47 41.200 41.200 25.283 15.917 19947
8934 1 26 . 1 1 47 47 CYS H H 47 8.510 8.510 7.593 0.917 19947
8935 1 26 . 1 1 48 48 CYS N N 48 123.200 123.200 123.091 0.109 19947
8936 1 26 . 1 1 48 48 CYS HA H 48 5.160 5.160 5.450 -0.290 19947
8937 1 26 . 1 1 48 48 CYS CA C 48 54.700 54.700 58.264 -3.564 19947
8938 1 26 . 1 1 48 48 CYS CB C 48 45.700 45.700 30.655 15.045 19947
8939 1 26 . 1 1 48 48 CYS H H 48 7.810 7.810 7.842 -0.032 19947
8940 1 26 . 1 1 49 49 ASP N N 49 127.400 127.400 123.516 3.884 19947
8941 1 26 . 1 1 49 49 ASP HA H 49 4.890 4.890 4.827 0.063 19947
8942 1 26 . 1 1 49 49 ASP CA C 49 53.500 53.500 53.856 -0.356 19947
8943 1 26 . 1 1 49 49 ASP CB C 49 42.400 42.400 42.529 -0.128 19947
8944 1 26 . 1 1 49 49 ASP H H 49 9.670 9.670 9.106 0.564 19947
8945 1 26 . 1 1 50 50 GLN N N 50 127.000 127.000 120.354 6.646 19947
8946 1 26 . 1 1 50 50 GLN HA H 50 3.940 3.940 3.916 0.024 19947
8947 1 26 . 1 1 50 50 GLN CA C 50 56.800 56.800 56.889 -0.090 19947
8948 1 26 . 1 1 50 50 GLN CB C 50 26.500 26.500 26.047 0.453 19947
8949 1 26 . 1 1 50 50 GLN H H 50 9.450 9.450 8.555 0.895 19947
8950 1 26 . 1 1 51 51 CYS N N 51 106.100 106.100 114.031 -7.931 19947
8951 1 26 . 1 1 51 51 CYS HA H 51 4.760 4.760 4.232 0.528 19947
8952 1 26 . 1 1 51 51 CYS CB C 51 43.200 43.200 24.898 18.302 19947
8953 1 26 . 1 1 51 51 CYS H H 51 8.700 8.700 8.750 -0.050 19947
8954 1 26 . 1 1 52 52 ARG N N 52 121.000 121.000 115.360 5.640 19947
8955 1 26 . 1 1 52 52 ARG HA H 52 4.690 4.690 4.306 0.384 19947
8956 1 26 . 1 1 52 52 ARG CA C 52 55.400 55.400 54.538 0.862 19947
8957 1 26 . 1 1 52 52 ARG CB C 52 33.100 33.100 34.625 -1.525 19947
8958 1 26 . 1 1 52 52 ARG H H 52 7.960 7.960 7.125 0.835 19947
8959 1 26 . 1 1 53 53 PHE N N 53 120.300 120.300 119.283 1.017 19947
8960 1 26 . 1 1 53 53 PHE HA H 53 5.050 5.050 5.382 -0.332 19947
8961 1 26 . 1 1 53 53 PHE CA C 53 56.100 56.100 55.293 0.807 19947
8962 1 26 . 1 1 53 53 PHE CB C 53 38.200 38.200 39.946 -1.746 19947
8963 1 26 . 1 1 53 53 PHE H H 53 8.400 8.400 8.374 0.026 19947
8964 1 26 . 1 1 54 54 LYS N N 54 123.300 123.300 124.266 -0.966 19947
8965 1 26 . 1 1 54 54 LYS HA H 54 4.250 4.250 4.292 -0.042 19947
8966 1 26 . 1 1 54 54 LYS CA C 54 57.500 57.500 56.683 0.817 19947
8967 1 26 . 1 1 54 54 LYS CB C 54 34.300 34.300 32.650 1.650 19947
8968 1 26 . 1 1 54 54 LYS H H 54 8.540 8.540 8.236 0.304 19947
8969 1 26 . 1 1 55 55 LYS N N 55 119.400 119.400 125.206 -5.806 19947
8970 1 26 . 1 1 55 55 LYS HA H 55 4.110 4.110 4.024 0.086 19947
8971 1 26 . 1 1 55 55 LYS CA C 55 56.500 56.500 57.039 -0.539 19947
8972 1 26 . 1 1 55 55 LYS CB C 55 33.400 33.400 33.143 0.257 19947
8973 1 26 . 1 1 55 55 LYS H H 55 8.440 8.440 8.321 0.119 19947
8974 1 26 . 1 1 56 56 ALA N N 56 126.700 126.700 127.194 -0.494 19947
8975 1 26 . 1 1 56 56 ALA HA H 56 3.920 3.920 4.100 -0.180 19947
8976 1 26 . 1 1 56 56 ALA CA C 56 52.900 52.900 54.056 -1.156 19947
8977 1 26 . 1 1 56 56 ALA CB C 56 18.100 18.100 18.463 -0.363 19947
8978 1 26 . 1 1 56 56 ALA H H 56 8.930 8.930 8.491 0.439 19947
8979 1 26 . 1 1 57 57 GLY N N 57 109.300 109.300 110.691 -1.391 19947
8980 1 26 . 1 1 57 57 GLY CA C 57 45.100 45.100 44.873 0.227 19947
8981 1 26 . 1 1 57 57 GLY H H 57 8.460 8.460 8.439 0.021 19947
8982 1 26 . 1 1 58 58 THR N N 58 117.200 117.200 120.420 -3.220 19947
8983 1 26 . 1 1 58 58 THR HA H 58 4.260 4.260 4.345 -0.085 19947
8984 1 26 . 1 1 58 58 THR CA C 58 63.300 63.300 63.808 -0.508 19947
8985 1 26 . 1 1 58 58 THR CB C 58 69.600 69.600 69.272 0.327 19947
8986 1 26 . 1 1 58 58 THR H H 58 7.660 7.660 7.760 -0.100 19947
8987 1 26 . 1 1 59 59 VAL N N 59 130.400 130.400 127.491 2.909 19947
8988 1 26 . 1 1 59 59 VAL HA H 59 3.900 3.900 3.859 0.041 19947
8989 1 26 . 1 1 59 59 VAL CA C 59 64.400 64.400 63.535 0.865 19947
8990 1 26 . 1 1 59 59 VAL CB C 59 31.900 31.900 32.212 -0.313 19947
8991 1 26 . 1 1 59 59 VAL H H 59 9.190 9.190 8.726 0.464 19947
8992 1 26 . 1 1 60 60 CYS N N 60 121.800 121.800 126.172 -4.372 19947
8993 1 26 . 1 1 60 60 CYS HA H 60 5.050 5.050 4.598 0.452 19947
8994 1 26 . 1 1 60 60 CYS CA C 60 54.400 54.400 57.967 -3.567 19947
8995 1 26 . 1 1 60 60 CYS CB C 60 43.000 43.000 27.373 15.627 19947
8996 1 26 . 1 1 60 60 CYS H H 60 9.130 9.130 8.222 0.908 19947
8997 1 26 . 1 1 61 61 ARG N N 61 124.100 124.100 118.360 5.740 19947
8998 1 26 . 1 1 61 61 ARG HA H 61 4.360 4.360 4.634 -0.274 19947
8999 1 26 . 1 1 61 61 ARG CA C 61 56.800 56.800 55.521 1.279 19947
9000 1 26 . 1 1 61 61 ARG CB C 61 32.800 32.800 34.763 -1.963 19947
9001 1 26 . 1 1 61 61 ARG H H 61 7.580 7.580 7.398 0.182 19947
9002 1 26 . 1 1 62 62 ILE N N 62 126.200 126.200 115.898 10.302 19947
9003 1 26 . 1 1 62 62 ILE HA H 62 4.090 4.090 4.616 -0.526 19947
9004 1 26 . 1 1 62 62 ILE CA C 62 60.300 60.300 61.255 -0.956 19947
9005 1 26 . 1 1 62 62 ILE CB C 62 38.700 38.700 40.683 -1.983 19947
9006 1 26 . 1 1 62 62 ILE H H 62 8.490 8.490 8.462 0.028 19947
9007 1 26 . 1 1 63 63 ALA N N 63 129.400 129.400 132.519 -3.119 19947
9008 1 26 . 1 1 63 63 ALA HA H 63 4.310 4.310 4.426 -0.116 19947
9009 1 26 . 1 1 63 63 ALA CA C 63 51.900 51.900 54.252 -2.352 19947
9010 1 26 . 1 1 63 63 ALA CB C 63 20.600 20.600 18.954 1.646 19947
9011 1 26 . 1 1 63 63 ALA H H 63 8.100 8.100 8.559 -0.459 19947
9012 1 26 . 1 1 64 64 ARG N N 64 120.500 120.500 120.952 -0.452 19947
9013 1 26 . 1 1 64 64 ARG HA H 64 4.290 4.290 4.460 -0.170 19947
9014 1 26 . 1 1 64 64 ARG CA C 64 56.200 56.200 55.955 0.245 19947
9015 1 26 . 1 1 64 64 ARG CB C 64 30.500 30.500 30.479 0.021 19947
9016 1 26 . 1 1 64 64 ARG H H 64 8.140 8.140 8.693 -0.553 19947
9017 1 26 . 1 1 65 65 GLY N N 65 110.500 110.500 112.849 -2.349 19947
9018 1 26 . 1 1 65 65 GLY CA C 65 45.100 45.100 44.562 0.538 19947
9019 1 26 . 1 1 65 65 GLY H H 65 8.040 8.040 8.327 -0.287 19947
9020 1 26 . 1 1 66 66 ASP N N 66 120.700 120.700 119.034 1.666 19947
9021 1 26 . 1 1 66 66 ASP HA H 66 4.610 4.610 4.489 0.121 19947
9022 1 26 . 1 1 66 66 ASP CA C 66 53.300 53.300 53.735 -0.435 19947
9023 1 26 . 1 1 66 66 ASP CB C 66 37.600 37.600 40.336 -2.736 19947
9024 1 26 . 1 1 66 66 ASP H H 66 8.380 8.380 7.192 1.188 19947
9025 1 26 . 1 1 67 67 TRP N N 67 120.100 120.100 123.110 -3.010 19947
9026 1 26 . 1 1 67 67 TRP HA H 67 4.760 4.760 5.057 -0.297 19947
9027 1 26 . 1 1 67 67 TRP CA C 67 57.200 57.200 57.881 -0.681 19947
9028 1 26 . 1 1 67 67 TRP CB C 67 29.100 29.100 29.501 -0.401 19947
9029 1 26 . 1 1 67 67 TRP H H 67 7.950 7.950 7.584 0.366 19947
9030 1 26 . 1 1 68 68 ASN N N 68 118.400 118.400 117.454 0.946 19947
9031 1 26 . 1 1 68 68 ASN HA H 68 4.790 4.790 4.962 -0.172 19947
9032 1 26 . 1 1 68 68 ASN CA C 68 52.800 52.800 53.698 -0.898 19947
9033 1 26 . 1 1 68 68 ASN CB C 68 39.300 39.300 40.433 -1.133 19947
9034 1 26 . 1 1 68 68 ASN H H 68 8.180 8.180 8.874 -0.694 19947
9035 1 26 . 1 1 69 69 ASP N N 69 118.500 118.500 118.205 0.295 19947
9036 1 26 . 1 1 69 69 ASP HA H 69 4.620 4.620 4.543 0.077 19947
9037 1 26 . 1 1 69 69 ASP CA C 69 53.200 53.200 56.350 -3.150 19947
9038 1 26 . 1 1 69 69 ASP CB C 69 38.000 38.000 41.290 -3.290 19947
9039 1 26 . 1 1 69 69 ASP H H 69 8.130 8.130 8.397 -0.267 19947
9040 1 26 . 1 1 70 70 ASP N N 70 120.500 120.500 120.708 -0.208 19947
9041 1 26 . 1 1 70 70 ASP HA H 70 5.100 5.100 5.279 -0.179 19947
9042 1 26 . 1 1 70 70 ASP CA C 70 52.500 52.500 52.896 -0.396 19947
9043 1 26 . 1 1 70 70 ASP CB C 70 42.600 42.600 42.971 -0.371 19947
9044 1 26 . 1 1 70 70 ASP H H 70 8.140 8.140 8.081 0.059 19947
9045 1 26 . 1 1 71 71 TYR N N 71 118.900 118.900 123.391 -4.491 19947
9046 1 26 . 1 1 71 71 TYR HA H 71 5.210 5.210 5.019 0.191 19947
9047 1 26 . 1 1 71 71 TYR CA C 71 56.300 56.300 57.089 -0.789 19947
9048 1 26 . 1 1 71 71 TYR CB C 71 42.200 42.200 42.831 -0.631 19947
9049 1 26 . 1 1 71 71 TYR H H 71 8.450 8.450 8.213 0.237 19947
9050 1 26 . 1 1 72 72 CYS N N 72 119.800 119.800 121.059 -1.259 19947
9051 1 26 . 1 1 72 72 CYS HA H 72 4.900 4.900 4.378 0.522 19947
9052 1 26 . 1 1 72 72 CYS CA C 72 53.400 53.400 60.468 -7.068 19947
9053 1 26 . 1 1 72 72 CYS CB C 72 37.200 37.200 28.299 8.901 19947
9054 1 26 . 1 1 72 72 CYS H H 72 9.330 9.330 8.701 0.629 19947
9055 1 26 . 1 1 73 73 THR N N 73 112.700 112.700 113.381 -0.681 19947
9056 1 26 . 1 1 73 73 THR HA H 73 4.430 4.430 4.395 0.035 19947
9057 1 26 . 1 1 73 73 THR CA C 73 62.300 62.300 61.933 0.367 19947
9058 1 26 . 1 1 73 73 THR CB C 73 71.300 71.300 70.008 1.292 19947
9059 1 26 . 1 1 73 73 THR H H 73 9.980 9.980 8.652 1.328 19947
9060 1 26 . 1 1 74 74 GLY N N 74 111.500 111.500 111.077 0.423 19947
9061 1 26 . 1 1 74 74 GLY CA C 74 45.300 45.300 46.449 -1.149 19947
9062 1 26 . 1 1 74 74 GLY H H 74 8.580 8.580 8.164 0.416 19947
9063 1 26 . 1 1 75 75 LYS N N 75 115.900 115.900 117.211 -1.311 19947
9064 1 26 . 1 1 75 75 LYS HA H 75 4.140 4.140 4.577 -0.437 19947
9065 1 26 . 1 1 75 75 LYS CA C 75 54.800 54.800 55.637 -0.837 19947
9066 1 26 . 1 1 75 75 LYS CB C 75 34.200 34.200 33.928 0.272 19947
9067 1 26 . 1 1 75 75 LYS H H 75 7.900 7.900 7.694 0.206 19947
9068 1 26 . 1 1 76 76 SER N N 76 111.000 111.000 112.639 -1.639 19947
9069 1 26 . 1 1 76 76 SER HA H 76 4.160 4.160 3.830 0.330 19947
9070 1 26 . 1 1 76 76 SER CA C 76 61.400 61.400 56.959 4.441 19947
9071 1 26 . 1 1 76 76 SER CB C 76 64.300 64.300 63.864 0.436 19947
9072 1 26 . 1 1 76 76 SER H H 76 6.520 6.520 6.953 -0.433 19947
9073 1 26 . 1 1 77 77 SER N N 77 117.100 117.100 115.708 1.392 19947
9074 1 26 . 1 1 77 77 SER HA H 77 4.220 4.220 4.654 -0.434 19947
9075 1 26 . 1 1 77 77 SER CA C 77 59.800 59.800 57.914 1.885 19947
9076 1 26 . 1 1 77 77 SER CB C 77 64.400 64.400 63.687 0.713 19947
9077 1 26 . 1 1 77 77 SER H H 77 9.030 9.030 8.364 0.666 19947
9078 1 26 . 1 1 78 78 ASP N N 78 122.100 122.100 123.130 -1.030 19947
9079 1 26 . 1 1 78 78 ASP HA H 78 4.930 4.930 4.761 0.169 19947
9080 1 26 . 1 1 78 78 ASP CA C 78 52.400 52.400 54.371 -1.971 19947
9081 1 26 . 1 1 78 78 ASP CB C 78 40.800 40.800 44.075 -3.275 19947
9082 1 26 . 1 1 78 78 ASP H H 78 8.340 8.340 7.280 1.060 19947
9083 1 26 . 1 1 79 79 CYS N N 79 122.200 122.200 121.930 0.270 19947
9084 1 26 . 1 1 79 79 CYS HA H 79 5.320 5.320 4.923 0.397 19947
9085 1 26 . 1 1 79 79 CYS CA C 79 52.000 52.000 55.668 -3.668 19947
9086 1 26 . 1 1 79 79 CYS CB C 79 39.300 39.300 28.114 11.185 19947
9087 1 26 . 1 1 79 79 CYS H H 79 8.960 8.960 8.352 0.608 19947
9088 1 26 . 1 1 80 80 PRO HA H 80 4.410 4.410 4.585 -0.175 19947
9089 1 26 . 1 1 80 80 PRO CA C 80 63.500 63.500 62.736 0.764 19947
9090 1 26 . 1 1 80 80 PRO CB C 80 32.400 32.400 32.843 -0.443 19947
9091 1 26 . 1 1 81 81 TRP N N 81 120.500 120.500 121.172 -0.672 19947
9092 1 26 . 1 1 81 81 TRP HA H 81 4.550 4.550 4.594 -0.044 19947
9093 1 26 . 1 1 81 81 TRP CA C 81 56.400 56.400 54.507 1.893 19947
9094 1 26 . 1 1 81 81 TRP CB C 81 29.500 29.500 28.914 0.586 19947
9095 1 26 . 1 1 81 81 TRP H H 81 8.400 8.400 8.445 -0.045 19947
9096 1 26 . 1 1 82 82 ASN N N 82 120.400 120.400 116.727 3.673 19947
9097 1 26 . 1 1 82 82 ASN HA H 82 4.750 4.750 4.394 0.356 19947
9098 1 26 . 1 1 82 82 ASN CA C 82 53.100 53.100 54.124 -1.024 19947
9099 1 26 . 1 1 82 82 ASN CB C 82 39.000 39.000 37.499 1.501 19947
9100 1 26 . 1 1 82 82 ASN H H 82 8.040 8.040 8.597 -0.557 19947
9101 1 27 . 1 1 2 2 PRO HA H 2 4.820 4.820 4.737 0.083 19947
9102 1 27 . 1 1 2 2 PRO CA C 2 61.900 61.900 61.887 0.013 19947
9103 1 27 . 1 1 2 2 PRO CB C 2 30.700 30.700 31.767 -1.067 19947
9104 1 27 . 1 1 3 3 PRO HA H 3 4.540 4.540 4.467 0.073 19947
9105 1 27 . 1 1 3 3 PRO CA C 3 62.900 62.900 62.508 0.392 19947
9106 1 27 . 1 1 3 3 PRO CB C 3 32.100 32.100 32.758 -0.658 19947
9107 1 27 . 1 1 4 4 VAL N N 4 121.900 121.900 124.816 -2.916 19947
9108 1 27 . 1 1 4 4 VAL HA H 4 4.200 4.200 4.104 0.096 19947
9109 1 27 . 1 1 4 4 VAL CA C 4 62.300 62.300 62.160 0.140 19947
9110 1 27 . 1 1 4 4 VAL CB C 4 32.800 32.800 31.873 0.926 19947
9111 1 27 . 1 1 4 4 VAL H H 4 8.330 8.330 8.418 -0.088 19947
9112 1 27 . 1 1 5 5 CYS N N 5 120.900 120.900 127.296 -6.396 19947
9113 1 27 . 1 1 5 5 CYS HA H 5 4.700 4.700 4.400 0.300 19947
9114 1 27 . 1 1 5 5 CYS CA C 5 53.600 53.600 59.120 -5.521 19947
9115 1 27 . 1 1 5 5 CYS H H 5 8.500 8.500 8.612 -0.112 19947
9116 1 27 . 1 1 6 6 GLY N N 6 110.200 110.200 113.459 -3.259 19947
9117 1 27 . 1 1 6 6 GLY CA C 6 46.300 46.300 44.652 1.648 19947
9118 1 27 . 1 1 6 6 GLY H H 6 8.490 8.490 8.358 0.132 19947
9119 1 27 . 1 1 7 7 ASN N N 7 120.100 120.100 116.942 3.158 19947
9120 1 27 . 1 1 7 7 ASN HA H 7 4.730 4.730 4.343 0.388 19947
9121 1 27 . 1 1 7 7 ASN CA C 7 53.200 53.200 53.884 -0.684 19947
9122 1 27 . 1 1 7 7 ASN CB C 7 38.700 38.700 39.055 -0.355 19947
9123 1 27 . 1 1 7 7 ASN H H 7 8.320 8.320 8.345 -0.025 19947
9124 1 27 . 1 1 8 8 LYS N N 8 121.300 121.300 122.570 -1.270 19947
9125 1 27 . 1 1 8 8 LYS HA H 8 4.340 4.340 4.097 0.243 19947
9126 1 27 . 1 1 8 8 LYS CA C 8 56.600 56.600 56.554 0.046 19947
9127 1 27 . 1 1 8 8 LYS CB C 8 32.900 32.900 31.061 1.839 19947
9128 1 27 . 1 1 8 8 LYS H H 8 8.260 8.260 8.487 -0.227 19947
9129 1 27 . 1 1 9 9 ILE N N 9 136.600 136.600 121.449 15.151 19947
9130 1 27 . 1 1 9 9 ILE HA H 9 4.140 4.140 3.924 0.216 19947
9131 1 27 . 1 1 9 9 ILE CA C 9 61.300 61.300 61.860 -0.560 19947
9132 1 27 . 1 1 9 9 ILE CB C 9 38.200 38.200 37.958 0.242 19947
9133 1 27 . 1 1 9 9 ILE H H 9 8.150 8.150 7.761 0.389 19947
9134 1 27 . 1 1 10 10 LEU N N 10 125.700 125.700 121.349 4.351 19947
9135 1 27 . 1 1 10 10 LEU HA H 10 4.420 4.420 4.478 -0.058 19947
9136 1 27 . 1 1 10 10 LEU CA C 10 55.200 55.200 55.186 0.014 19947
9137 1 27 . 1 1 10 10 LEU CB C 10 42.300 42.300 40.662 1.638 19947
9138 1 27 . 1 1 10 10 LEU H H 10 8.230 8.230 8.459 -0.229 19947
9139 1 27 . 1 1 11 11 GLU N N 11 120.600 120.600 115.582 5.018 19947
9140 1 27 . 1 1 11 11 GLU HA H 11 4.470 4.470 4.160 0.310 19947
9141 1 27 . 1 1 11 11 GLU CA C 11 55.500 55.500 56.495 -0.995 19947
9142 1 27 . 1 1 11 11 GLU CB C 11 28.900 28.900 28.689 0.211 19947
9143 1 27 . 1 1 11 11 GLU H H 11 8.250 8.250 8.051 0.199 19947
9144 1 27 . 1 1 12 12 GLN N N 12 121.600 121.600 116.988 4.612 19947
9145 1 27 . 1 1 12 12 GLN HA H 12 4.350 4.350 4.720 -0.370 19947
9146 1 27 . 1 1 12 12 GLN CA C 12 56.600 56.600 54.911 1.689 19947
9147 1 27 . 1 1 12 12 GLN CB C 12 29.200 29.200 28.850 0.350 19947
9148 1 27 . 1 1 12 12 GLN H H 12 8.460 8.460 7.856 0.604 19947
9149 1 27 . 1 1 13 13 GLY N N 13 110.700 110.700 109.448 1.252 19947
9150 1 27 . 1 1 13 13 GLY CA C 13 45.700 45.700 47.756 -2.056 19947
9151 1 27 . 1 1 13 13 GLY H H 13 8.660 8.660 8.694 -0.034 19947
9152 1 27 . 1 1 14 14 GLU N N 14 118.900 118.900 115.820 3.080 19947
9153 1 27 . 1 1 14 14 GLU HA H 14 4.530 4.530 4.380 0.150 19947
9154 1 27 . 1 1 14 14 GLU CA C 14 55.600 55.600 55.185 0.415 19947
9155 1 27 . 1 1 14 14 GLU CB C 14 29.700 29.700 28.172 1.528 19947
9156 1 27 . 1 1 14 14 GLU H H 14 8.230 8.230 8.079 0.151 19947
9157 1 27 . 1 1 15 15 ASP N N 15 118.400 118.400 121.343 -2.943 19947
9158 1 27 . 1 1 15 15 ASP HA H 15 4.990 4.990 4.629 0.361 19947
9159 1 27 . 1 1 15 15 ASP CA C 15 53.500 53.500 53.715 -0.215 19947
9160 1 27 . 1 1 15 15 ASP CB C 15 39.700 39.700 40.510 -0.810 19947
9161 1 27 . 1 1 15 15 ASP H H 15 8.330 8.330 7.552 0.778 19947
9162 1 27 . 1 1 16 16 CYS HA H 16 4.340 4.340 4.297 0.043 19947
9163 1 27 . 1 1 16 16 CYS H H 16 8.510 8.510 8.349 0.161 19947
9164 1 27 . 1 1 17 17 ASP N N 17 116.700 116.700 123.047 -6.347 19947
9165 1 27 . 1 1 17 17 ASP HA H 17 4.740 4.740 4.349 0.391 19947
9166 1 27 . 1 1 17 17 ASP CA C 17 53.100 53.100 55.193 -2.093 19947
9167 1 27 . 1 1 17 17 ASP CB C 17 38.600 38.600 40.180 -1.580 19947
9168 1 27 . 1 1 17 17 ASP H H 17 8.180 8.180 8.723 -0.543 19947
9169 1 27 . 1 1 18 18 CYS HA H 18 4.730 4.730 4.028 0.702 19947
9170 1 27 . 1 1 18 18 CYS CB C 18 41.900 41.900 26.963 14.937 19947
9171 1 27 . 1 1 19 19 GLY H H 19 8.220 8.220 8.493 -0.273 19947
9172 1 27 . 1 1 20 20 SER HA H 20 4.920 4.920 4.411 0.509 19947
9173 1 27 . 1 1 20 20 SER CA C 20 55.700 55.700 57.645 -1.945 19947
9174 1 27 . 1 1 20 20 SER CB C 20 63.500 63.500 63.006 0.494 19947
9175 1 27 . 1 1 20 20 SER H H 20 7.830 7.830 8.418 -0.588 19947
9176 1 27 . 1 1 21 21 PRO HA H 21 4.240 4.240 4.144 0.096 19947
9177 1 27 . 1 1 21 21 PRO CA C 21 63.400 63.400 65.136 -1.736 19947
9178 1 27 . 1 1 21 21 PRO CB C 21 31.800 31.800 31.525 0.275 19947
9179 1 27 . 1 1 22 22 ALA N N 22 119.900 119.900 116.416 3.484 19947
9180 1 27 . 1 1 22 22 ALA HA H 22 4.220 4.220 4.047 0.173 19947
9181 1 27 . 1 1 22 22 ALA CA C 22 54.200 54.200 54.215 -0.015 19947
9182 1 27 . 1 1 22 22 ALA CB C 22 18.500 18.500 18.511 -0.011 19947
9183 1 27 . 1 1 22 22 ALA H H 22 8.180 8.180 8.389 -0.209 19947
9184 1 27 . 1 1 23 23 ASN N N 23 116.300 116.300 112.807 3.493 19947
9185 1 27 . 1 1 23 23 ASN HA H 23 4.670 4.670 4.866 -0.196 19947
9186 1 27 . 1 1 23 23 ASN CA C 23 53.200 53.200 53.378 -0.178 19947
9187 1 27 . 1 1 23 23 ASN CB C 23 39.300 39.300 40.765 -1.465 19947
9188 1 27 . 1 1 23 23 ASN H H 23 7.960 7.960 8.225 -0.265 19947
9189 1 27 . 1 1 24 24 CYS HA H 24 4.720 4.720 4.243 0.477 19947
9190 1 27 . 1 1 24 24 CYS H H 24 8.510 8.510 7.778 0.732 19947
9191 1 27 . 1 1 25 25 GLN HA H 25 4.460 4.460 3.888 0.573 19947
9192 1 27 . 1 1 25 25 GLN H H 25 8.320 8.320 8.789 -0.469 19947
9193 1 27 . 1 1 26 26 ASP HA H 26 4.740 4.740 4.465 0.275 19947
9194 1 27 . 1 1 26 26 ASP H H 26 8.580 8.580 8.185 0.395 19947
9195 1 27 . 1 1 27 27 ARG HA H 27 4.680 4.680 4.280 0.400 19947
9196 1 27 . 1 1 27 27 ARG CA C 27 54.700 54.700 56.847 -2.147 19947
9197 1 27 . 1 1 27 27 ARG H H 27 8.550 8.550 7.776 0.774 19947
9198 1 27 . 1 1 28 28 CYS HA H 28 4.120 4.120 4.800 -0.680 19947
9199 1 27 . 1 1 28 28 CYS CA C 28 54.400 54.400 56.329 -1.929 19947
9200 1 27 . 1 1 28 28 CYS CB C 28 19.000 19.000 24.999 -5.999 19947
9201 1 27 . 1 1 28 28 CYS H H 28 8.910 8.910 8.684 0.226 19947
9202 1 27 . 1 1 29 29 CYS N N 29 113.300 113.300 121.462 -8.162 19947
9203 1 27 . 1 1 29 29 CYS HA H 29 5.010 5.010 4.592 0.418 19947
9204 1 27 . 1 1 29 29 CYS CA C 29 54.300 54.300 58.854 -4.554 19947
9205 1 27 . 1 1 29 29 CYS H H 29 7.730 7.730 7.410 0.320 19947
9206 1 27 . 1 1 30 30 ASN HA H 30 4.730 4.730 4.987 -0.257 19947
9207 1 27 . 1 1 30 30 ASN CB C 30 38.700 38.700 39.420 -0.720 19947
9208 1 27 . 1 1 30 30 ASN H H 30 8.870 8.870 8.345 0.525 19947
9209 1 27 . 1 1 31 31 ALA N N 31 129.400 129.400 126.767 2.633 19947
9210 1 27 . 1 1 31 31 ALA HA H 31 4.120 4.120 4.317 -0.197 19947
9211 1 27 . 1 1 31 31 ALA CA C 31 54.400 54.400 54.334 0.066 19947
9212 1 27 . 1 1 31 31 ALA CB C 31 19.000 19.000 19.043 -0.043 19947
9213 1 27 . 1 1 31 31 ALA H H 31 8.890 8.890 8.406 0.484 19947
9214 1 27 . 1 1 32 32 ALA N N 32 116.400 116.400 119.202 -2.802 19947
9215 1 27 . 1 1 32 32 ALA HA H 32 4.340 4.340 4.215 0.125 19947
9216 1 27 . 1 1 32 32 ALA CA C 32 53.800 53.800 53.560 0.240 19947
9217 1 27 . 1 1 32 32 ALA CB C 32 19.100 19.100 19.016 0.084 19947
9218 1 27 . 1 1 32 32 ALA H H 32 8.250 8.250 8.338 -0.088 19947
9219 1 27 . 1 1 33 33 THR N N 33 104.300 104.300 110.034 -5.734 19947
9220 1 27 . 1 1 33 33 THR HA H 33 4.430 4.430 4.384 0.046 19947
9221 1 27 . 1 1 33 33 THR CA C 33 60.500 60.500 60.767 -0.267 19947
9222 1 27 . 1 1 33 33 THR CB C 33 70.600 70.600 69.336 1.264 19947
9223 1 27 . 1 1 33 33 THR H H 33 7.320 7.320 7.482 -0.162 19947
9224 1 27 . 1 1 34 34 CYS N N 34 123.400 123.400 120.699 2.701 19947
9225 1 27 . 1 1 34 34 CYS HA H 34 4.170 4.170 4.282 -0.112 19947
9226 1 27 . 1 1 34 34 CYS CA C 34 56.500 56.500 59.865 -3.365 19947
9227 1 27 . 1 1 34 34 CYS H H 34 8.710 8.710 7.953 0.757 19947
9228 1 27 . 1 1 35 35 LYS N N 35 116.900 116.900 119.467 -2.567 19947
9229 1 27 . 1 1 35 35 LYS HA H 35 4.960 4.960 4.433 0.527 19947
9230 1 27 . 1 1 35 35 LYS CA C 35 53.900 53.900 55.413 -1.513 19947
9231 1 27 . 1 1 35 35 LYS CB C 35 35.900 35.900 35.448 0.452 19947
9232 1 27 . 1 1 35 35 LYS H H 35 7.450 7.450 7.739 -0.289 19947
9233 1 27 . 1 1 36 36 LEU N N 36 119.300 119.300 123.852 -4.552 19947
9234 1 27 . 1 1 36 36 LEU HA H 36 4.800 4.800 4.439 0.361 19947
9235 1 27 . 1 1 36 36 LEU CB C 36 42.400 42.400 41.135 1.265 19947
9236 1 27 . 1 1 36 36 LEU H H 36 8.290 8.290 8.240 0.050 19947
9237 1 27 . 1 1 37 37 THR HA H 37 4.340 4.340 4.549 -0.209 19947
9238 1 27 . 1 1 37 37 THR CA C 37 60.200 60.200 60.851 -0.651 19947
9239 1 27 . 1 1 37 37 THR CB C 37 67.700 67.700 68.611 -0.911 19947
9240 1 27 . 1 1 37 37 THR H H 37 8.380 8.380 7.816 0.564 19947
9241 1 27 . 1 1 38 38 PRO HA H 38 4.380 4.380 4.256 0.124 19947
9242 1 27 . 1 1 38 38 PRO CA C 38 64.800 64.800 64.564 0.236 19947
9243 1 27 . 1 1 38 38 PRO CB C 38 31.500 31.500 31.732 -0.232 19947
9244 1 27 . 1 1 39 39 GLY N N 39 113.300 113.300 110.800 2.500 19947
9245 1 27 . 1 1 39 39 GLY CA C 39 45.100 45.100 44.864 0.236 19947
9246 1 27 . 1 1 39 39 GLY H H 39 8.830 8.830 8.561 0.269 19947
9247 1 27 . 1 1 40 40 SER N N 40 116.700 116.700 117.602 -0.902 19947
9248 1 27 . 1 1 40 40 SER HA H 40 4.610 4.610 4.810 -0.200 19947
9249 1 27 . 1 1 40 40 SER CA C 40 58.800 58.800 56.905 1.895 19947
9250 1 27 . 1 1 40 40 SER CB C 40 63.800 63.800 63.726 0.074 19947
9251 1 27 . 1 1 40 40 SER H H 40 8.280 8.280 7.642 0.638 19947
9252 1 27 . 1 1 41 41 GLN N N 41 120.600 120.600 126.570 -5.970 19947
9253 1 27 . 1 1 41 41 GLN HA H 41 4.110 4.110 3.981 0.129 19947
9254 1 27 . 1 1 41 41 GLN CA C 41 55.200 55.200 57.041 -1.841 19947
9255 1 27 . 1 1 41 41 GLN CB C 41 31.100 31.100 28.688 2.412 19947
9256 1 27 . 1 1 41 41 GLN H H 41 9.190 9.190 8.007 1.183 19947
9257 1 27 . 1 1 42 42 CYS N N 42 113.200 113.200 110.490 2.710 19947
9258 1 27 . 1 1 42 42 CYS HA H 42 4.630 4.630 4.560 0.070 19947
9259 1 27 . 1 1 42 42 CYS CA C 42 53.700 53.700 57.576 -3.876 19947
9260 1 27 . 1 1 42 42 CYS CB C 42 45.500 45.500 29.626 15.874 19947
9261 1 27 . 1 1 42 42 CYS H H 42 7.710 7.710 7.302 0.408 19947
9262 1 27 . 1 1 43 43 ASN N N 43 114.200 114.200 119.298 -5.098 19947
9263 1 27 . 1 1 43 43 ASN HA H 43 4.940 4.940 4.776 0.164 19947
9264 1 27 . 1 1 43 43 ASN CA C 43 53.000 53.000 53.682 -0.682 19947
9265 1 27 . 1 1 43 43 ASN CB C 43 39.300 39.300 42.081 -2.781 19947
9266 1 27 . 1 1 43 43 ASN H H 43 8.870 8.870 9.061 -0.191 19947
9267 1 27 . 1 1 44 44 TYR N N 44 118.400 118.400 118.001 0.399 19947
9268 1 27 . 1 1 44 44 TYR HA H 44 4.850 4.850 4.808 0.042 19947
9269 1 27 . 1 1 44 44 TYR CA C 44 55.300 55.300 56.728 -1.428 19947
9270 1 27 . 1 1 44 44 TYR CB C 44 40.700 40.700 40.623 0.076 19947
9271 1 27 . 1 1 44 44 TYR H H 44 7.840 7.840 8.301 -0.461 19947
9272 1 27 . 1 1 45 45 GLY N N 45 110.600 110.600 112.254 -1.654 19947
9273 1 27 . 1 1 45 45 GLY CA C 45 44.000 44.000 45.136 -1.137 19947
9274 1 27 . 1 1 45 45 GLY H H 45 7.960 7.960 7.768 0.192 19947
9275 1 27 . 1 1 46 46 GLU N N 46 120.700 120.700 119.766 0.934 19947
9276 1 27 . 1 1 46 46 GLU HA H 46 4.280 4.280 4.194 0.086 19947
9277 1 27 . 1 1 46 46 GLU CA C 46 58.500 58.500 58.377 0.123 19947
9278 1 27 . 1 1 46 46 GLU CB C 46 29.300 29.300 29.895 -0.595 19947
9279 1 27 . 1 1 46 46 GLU H H 46 9.160 9.160 8.634 0.526 19947
9280 1 27 . 1 1 47 47 CYS N N 47 112.400 112.400 118.748 -6.348 19947
9281 1 27 . 1 1 47 47 CYS HA H 47 4.850 4.850 4.544 0.306 19947
9282 1 27 . 1 1 47 47 CYS CA C 47 57.100 57.100 58.272 -1.172 19947
9283 1 27 . 1 1 47 47 CYS CB C 47 41.200 41.200 25.687 15.513 19947
9284 1 27 . 1 1 47 47 CYS H H 47 8.510 8.510 7.455 1.055 19947
9285 1 27 . 1 1 48 48 CYS N N 48 123.200 123.200 120.391 2.809 19947
9286 1 27 . 1 1 48 48 CYS HA H 48 5.160 5.160 5.037 0.123 19947
9287 1 27 . 1 1 48 48 CYS CA C 48 54.700 54.700 59.269 -4.569 19947
9288 1 27 . 1 1 48 48 CYS CB C 48 45.700 45.700 28.010 17.690 19947
9289 1 27 . 1 1 48 48 CYS H H 48 7.810 7.810 7.529 0.281 19947
9290 1 27 . 1 1 49 49 ASP N N 49 127.400 127.400 125.444 1.956 19947
9291 1 27 . 1 1 49 49 ASP HA H 49 4.890 4.890 4.778 0.112 19947
9292 1 27 . 1 1 49 49 ASP CA C 49 53.500 53.500 54.374 -0.874 19947
9293 1 27 . 1 1 49 49 ASP CB C 49 42.400 42.400 43.246 -0.846 19947
9294 1 27 . 1 1 49 49 ASP H H 49 9.670 9.670 9.007 0.663 19947
9295 1 27 . 1 1 50 50 GLN N N 50 127.000 127.000 123.340 3.660 19947
9296 1 27 . 1 1 50 50 GLN HA H 50 3.940 3.940 4.004 -0.064 19947
9297 1 27 . 1 1 50 50 GLN CA C 50 56.800 56.800 56.596 0.204 19947
9298 1 27 . 1 1 50 50 GLN CB C 50 26.500 26.500 26.966 -0.466 19947
9299 1 27 . 1 1 50 50 GLN H H 50 9.450 9.450 8.654 0.796 19947
9300 1 27 . 1 1 51 51 CYS N N 51 106.100 106.100 112.491 -6.391 19947
9301 1 27 . 1 1 51 51 CYS HA H 51 4.760 4.760 4.344 0.416 19947
9302 1 27 . 1 1 51 51 CYS CB C 51 43.200 43.200 25.266 17.934 19947
9303 1 27 . 1 1 51 51 CYS H H 51 8.700 8.700 8.583 0.117 19947
9304 1 27 . 1 1 52 52 ARG N N 52 121.000 121.000 115.722 5.278 19947
9305 1 27 . 1 1 52 52 ARG HA H 52 4.690 4.690 4.463 0.227 19947
9306 1 27 . 1 1 52 52 ARG CA C 52 55.400 55.400 53.756 1.644 19947
9307 1 27 . 1 1 52 52 ARG CB C 52 33.100 33.100 33.760 -0.660 19947
9308 1 27 . 1 1 52 52 ARG H H 52 7.960 7.960 7.130 0.830 19947
9309 1 27 . 1 1 53 53 PHE N N 53 120.300 120.300 121.020 -0.720 19947
9310 1 27 . 1 1 53 53 PHE HA H 53 5.050 5.050 5.195 -0.145 19947
9311 1 27 . 1 1 53 53 PHE CA C 53 56.100 56.100 55.980 0.120 19947
9312 1 27 . 1 1 53 53 PHE CB C 53 38.200 38.200 39.244 -1.044 19947
9313 1 27 . 1 1 53 53 PHE H H 53 8.400 8.400 8.334 0.066 19947
9314 1 27 . 1 1 54 54 LYS N N 54 123.300 123.300 125.384 -2.084 19947
9315 1 27 . 1 1 54 54 LYS HA H 54 4.250 4.250 4.161 0.089 19947
9316 1 27 . 1 1 54 54 LYS CA C 54 57.500 57.500 56.264 1.236 19947
9317 1 27 . 1 1 54 54 LYS CB C 54 34.300 34.300 32.044 2.256 19947
9318 1 27 . 1 1 54 54 LYS H H 54 8.540 8.540 8.284 0.256 19947
9319 1 27 . 1 1 55 55 LYS N N 55 119.400 119.400 125.137 -5.737 19947
9320 1 27 . 1 1 55 55 LYS HA H 55 4.110 4.110 3.978 0.132 19947
9321 1 27 . 1 1 55 55 LYS CA C 55 56.500 56.500 56.566 -0.066 19947
9322 1 27 . 1 1 55 55 LYS CB C 55 33.400 33.400 33.225 0.175 19947
9323 1 27 . 1 1 55 55 LYS H H 55 8.440 8.440 8.416 0.024 19947
9324 1 27 . 1 1 56 56 ALA N N 56 126.700 126.700 128.362 -1.662 19947
9325 1 27 . 1 1 56 56 ALA HA H 56 3.920 3.920 3.972 -0.052 19947
9326 1 27 . 1 1 56 56 ALA CA C 56 52.900 52.900 53.719 -0.819 19947
9327 1 27 . 1 1 56 56 ALA CB C 56 18.100 18.100 18.343 -0.243 19947
9328 1 27 . 1 1 56 56 ALA H H 56 8.930 8.930 8.693 0.237 19947
9329 1 27 . 1 1 57 57 GLY N N 57 109.300 109.300 111.313 -2.013 19947
9330 1 27 . 1 1 57 57 GLY CA C 57 45.100 45.100 44.845 0.255 19947
9331 1 27 . 1 1 57 57 GLY H H 57 8.460 8.460 8.421 0.039 19947
9332 1 27 . 1 1 58 58 THR N N 58 117.200 117.200 119.806 -2.606 19947
9333 1 27 . 1 1 58 58 THR HA H 58 4.260 4.260 4.448 -0.188 19947
9334 1 27 . 1 1 58 58 THR CA C 58 63.300 63.300 63.188 0.112 19947
9335 1 27 . 1 1 58 58 THR CB C 58 69.600 69.600 68.714 0.886 19947
9336 1 27 . 1 1 58 58 THR H H 58 7.660 7.660 7.797 -0.137 19947
9337 1 27 . 1 1 59 59 VAL N N 59 130.400 130.400 127.729 2.671 19947
9338 1 27 . 1 1 59 59 VAL HA H 59 3.900 3.900 3.575 0.325 19947
9339 1 27 . 1 1 59 59 VAL CA C 59 64.400 64.400 63.047 1.353 19947
9340 1 27 . 1 1 59 59 VAL CB C 59 31.900 31.900 31.610 0.290 19947
9341 1 27 . 1 1 59 59 VAL H H 59 9.190 9.190 8.875 0.315 19947
9342 1 27 . 1 1 60 60 CYS N N 60 121.800 121.800 126.208 -4.408 19947
9343 1 27 . 1 1 60 60 CYS HA H 60 5.050 5.050 4.608 0.442 19947
9344 1 27 . 1 1 60 60 CYS CA C 60 54.400 54.400 58.256 -3.856 19947
9345 1 27 . 1 1 60 60 CYS CB C 60 43.000 43.000 28.084 14.916 19947
9346 1 27 . 1 1 60 60 CYS H H 60 9.130 9.130 8.375 0.755 19947
9347 1 27 . 1 1 61 61 ARG N N 61 124.100 124.100 117.210 6.890 19947
9348 1 27 . 1 1 61 61 ARG HA H 61 4.360 4.360 4.643 -0.283 19947
9349 1 27 . 1 1 61 61 ARG CA C 61 56.800 56.800 54.972 1.828 19947
9350 1 27 . 1 1 61 61 ARG CB C 61 32.800 32.800 33.707 -0.907 19947
9351 1 27 . 1 1 61 61 ARG H H 61 7.580 7.580 7.373 0.207 19947
9352 1 27 . 1 1 62 62 ILE N N 62 126.200 126.200 116.302 9.898 19947
9353 1 27 . 1 1 62 62 ILE HA H 62 4.090 4.090 4.496 -0.406 19947
9354 1 27 . 1 1 62 62 ILE CA C 62 60.300 60.300 60.845 -0.545 19947
9355 1 27 . 1 1 62 62 ILE CB C 62 38.700 38.700 41.380 -2.680 19947
9356 1 27 . 1 1 62 62 ILE H H 62 8.490 8.490 8.341 0.149 19947
9357 1 27 . 1 1 63 63 ALA N N 63 129.400 129.400 132.080 -2.680 19947
9358 1 27 . 1 1 63 63 ALA HA H 63 4.310 4.310 4.340 -0.030 19947
9359 1 27 . 1 1 63 63 ALA CA C 63 51.900 51.900 54.466 -2.566 19947
9360 1 27 . 1 1 63 63 ALA CB C 63 20.600 20.600 19.518 1.082 19947
9361 1 27 . 1 1 63 63 ALA H H 63 8.100 8.100 8.701 -0.601 19947
9362 1 27 . 1 1 64 64 ARG N N 64 120.500 120.500 120.357 0.143 19947
9363 1 27 . 1 1 64 64 ARG HA H 64 4.290 4.290 4.528 -0.238 19947
9364 1 27 . 1 1 64 64 ARG CA C 64 56.200 56.200 55.898 0.302 19947
9365 1 27 . 1 1 64 64 ARG CB C 64 30.500 30.500 30.499 0.001 19947
9366 1 27 . 1 1 64 64 ARG H H 64 8.140 8.140 8.771 -0.631 19947
9367 1 27 . 1 1 65 65 GLY N N 65 110.500 110.500 111.863 -1.363 19947
9368 1 27 . 1 1 65 65 GLY CA C 65 45.100 45.100 44.622 0.478 19947
9369 1 27 . 1 1 65 65 GLY H H 65 8.040 8.040 8.341 -0.301 19947
9370 1 27 . 1 1 66 66 ASP N N 66 120.700 120.700 119.604 1.096 19947
9371 1 27 . 1 1 66 66 ASP HA H 66 4.610 4.610 4.429 0.181 19947
9372 1 27 . 1 1 66 66 ASP CA C 66 53.300 53.300 53.542 -0.242 19947
9373 1 27 . 1 1 66 66 ASP CB C 66 37.600 37.600 40.136 -2.536 19947
9374 1 27 . 1 1 66 66 ASP H H 66 8.380 8.380 7.191 1.189 19947
9375 1 27 . 1 1 67 67 TRP N N 67 120.100 120.100 123.365 -3.265 19947
9376 1 27 . 1 1 67 67 TRP HA H 67 4.760 4.760 4.999 -0.239 19947
9377 1 27 . 1 1 67 67 TRP CA C 67 57.200 57.200 57.940 -0.740 19947
9378 1 27 . 1 1 67 67 TRP CB C 67 29.100 29.100 29.338 -0.238 19947
9379 1 27 . 1 1 67 67 TRP H H 67 7.950 7.950 7.798 0.152 19947
9380 1 27 . 1 1 68 68 ASN N N 68 118.400 118.400 117.577 0.823 19947
9381 1 27 . 1 1 68 68 ASN HA H 68 4.790 4.790 4.940 -0.150 19947
9382 1 27 . 1 1 68 68 ASN CA C 68 52.800 52.800 53.865 -1.065 19947
9383 1 27 . 1 1 68 68 ASN CB C 68 39.300 39.300 40.306 -1.006 19947
9384 1 27 . 1 1 68 68 ASN H H 68 8.180 8.180 8.623 -0.443 19947
9385 1 27 . 1 1 69 69 ASP N N 69 118.500 118.500 118.923 -0.423 19947
9386 1 27 . 1 1 69 69 ASP HA H 69 4.620 4.620 4.417 0.203 19947
9387 1 27 . 1 1 69 69 ASP CA C 69 53.200 53.200 56.080 -2.880 19947
9388 1 27 . 1 1 69 69 ASP CB C 69 38.000 38.000 41.192 -3.192 19947
9389 1 27 . 1 1 69 69 ASP H H 69 8.130 8.130 8.603 -0.473 19947
9390 1 27 . 1 1 70 70 ASP N N 70 120.500 120.500 121.185 -0.685 19947
9391 1 27 . 1 1 70 70 ASP HA H 70 5.100 5.100 5.029 0.071 19947
9392 1 27 . 1 1 70 70 ASP CA C 70 52.500 52.500 53.609 -1.109 19947
9393 1 27 . 1 1 70 70 ASP CB C 70 42.600 42.600 42.052 0.548 19947
9394 1 27 . 1 1 70 70 ASP H H 70 8.140 8.140 8.181 -0.041 19947
9395 1 27 . 1 1 71 71 TYR N N 71 118.900 118.900 124.087 -5.187 19947
9396 1 27 . 1 1 71 71 TYR HA H 71 5.210 5.210 4.872 0.338 19947
9397 1 27 . 1 1 71 71 TYR CA C 71 56.300 56.300 57.141 -0.841 19947
9398 1 27 . 1 1 71 71 TYR CB C 71 42.200 42.200 42.873 -0.673 19947
9399 1 27 . 1 1 71 71 TYR H H 71 8.450 8.450 8.290 0.160 19947
9400 1 27 . 1 1 72 72 CYS N N 72 119.800 119.800 121.309 -1.509 19947
9401 1 27 . 1 1 72 72 CYS HA H 72 4.900 4.900 4.406 0.494 19947
9402 1 27 . 1 1 72 72 CYS CA C 72 53.400 53.400 59.425 -6.025 19947
9403 1 27 . 1 1 72 72 CYS CB C 72 37.200 37.200 28.934 8.266 19947
9404 1 27 . 1 1 72 72 CYS H H 72 9.330 9.330 8.516 0.814 19947
9405 1 27 . 1 1 73 73 THR N N 73 112.700 112.700 114.595 -1.895 19947
9406 1 27 . 1 1 73 73 THR HA H 73 4.430 4.430 4.405 0.025 19947
9407 1 27 . 1 1 73 73 THR CA C 73 62.300 62.300 61.433 0.867 19947
9408 1 27 . 1 1 73 73 THR CB C 73 71.300 71.300 69.840 1.460 19947
9409 1 27 . 1 1 73 73 THR H H 73 9.980 9.980 8.750 1.230 19947
9410 1 27 . 1 1 74 74 GLY N N 74 111.500 111.500 111.889 -0.389 19947
9411 1 27 . 1 1 74 74 GLY CA C 74 45.300 45.300 46.638 -1.337 19947
9412 1 27 . 1 1 74 74 GLY H H 74 8.580 8.580 7.784 0.796 19947
9413 1 27 . 1 1 75 75 LYS N N 75 115.900 115.900 116.328 -0.428 19947
9414 1 27 . 1 1 75 75 LYS HA H 75 4.140 4.140 4.618 -0.478 19947
9415 1 27 . 1 1 75 75 LYS CA C 75 54.800 54.800 55.844 -1.044 19947
9416 1 27 . 1 1 75 75 LYS CB C 75 34.200 34.200 33.699 0.501 19947
9417 1 27 . 1 1 75 75 LYS H H 75 7.900 7.900 7.558 0.342 19947
9418 1 27 . 1 1 76 76 SER N N 76 111.000 111.000 113.278 -2.278 19947
9419 1 27 . 1 1 76 76 SER HA H 76 4.160 4.160 3.953 0.207 19947
9420 1 27 . 1 1 76 76 SER CA C 76 61.400 61.400 56.502 4.898 19947
9421 1 27 . 1 1 76 76 SER CB C 76 64.300 64.300 64.988 -0.688 19947
9422 1 27 . 1 1 76 76 SER H H 76 6.520 6.520 6.855 -0.335 19947
9423 1 27 . 1 1 77 77 SER N N 77 117.100 117.100 114.460 2.640 19947
9424 1 27 . 1 1 77 77 SER HA H 77 4.220 4.220 4.274 -0.054 19947
9425 1 27 . 1 1 77 77 SER CA C 77 59.800 59.800 58.699 1.101 19947
9426 1 27 . 1 1 77 77 SER CB C 77 64.400 64.400 63.733 0.667 19947
9427 1 27 . 1 1 77 77 SER H H 77 9.030 9.030 8.270 0.760 19947
9428 1 27 . 1 1 78 78 ASP N N 78 122.100 122.100 121.810 0.290 19947
9429 1 27 . 1 1 78 78 ASP HA H 78 4.930 4.930 4.734 0.196 19947
9430 1 27 . 1 1 78 78 ASP CA C 78 52.400 52.400 53.955 -1.555 19947
9431 1 27 . 1 1 78 78 ASP CB C 78 40.800 40.800 43.935 -3.135 19947
9432 1 27 . 1 1 78 78 ASP H H 78 8.340 8.340 7.592 0.748 19947
9433 1 27 . 1 1 79 79 CYS N N 79 122.200 122.200 123.711 -1.511 19947
9434 1 27 . 1 1 79 79 CYS HA H 79 5.320 5.320 4.750 0.570 19947
9435 1 27 . 1 1 79 79 CYS CA C 79 52.000 52.000 55.593 -3.593 19947
9436 1 27 . 1 1 79 79 CYS CB C 79 39.300 39.300 27.254 12.046 19947
9437 1 27 . 1 1 79 79 CYS H H 79 8.960 8.960 8.523 0.437 19947
9438 1 27 . 1 1 80 80 PRO HA H 80 4.410 4.410 4.065 0.345 19947
9439 1 27 . 1 1 80 80 PRO CA C 80 63.500 63.500 62.904 0.596 19947
9440 1 27 . 1 1 80 80 PRO CB C 80 32.400 32.400 32.719 -0.319 19947
9441 1 27 . 1 1 81 81 TRP N N 81 120.500 120.500 121.315 -0.815 19947
9442 1 27 . 1 1 81 81 TRP HA H 81 4.550 4.550 4.244 0.306 19947
9443 1 27 . 1 1 81 81 TRP CA C 81 56.400 56.400 58.059 -1.659 19947
9444 1 27 . 1 1 81 81 TRP CB C 81 29.500 29.500 28.568 0.932 19947
9445 1 27 . 1 1 81 81 TRP H H 81 8.400 8.400 7.544 0.856 19947
9446 1 27 . 1 1 82 82 ASN N N 82 120.400 120.400 113.316 7.084 19947
9447 1 27 . 1 1 82 82 ASN HA H 82 4.750 4.750 4.409 0.341 19947
9448 1 27 . 1 1 82 82 ASN CA C 82 53.100 53.100 53.978 -0.878 19947
9449 1 27 . 1 1 82 82 ASN CB C 82 39.000 39.000 36.697 2.303 19947
9450 1 27 . 1 1 82 82 ASN H H 82 8.040 8.040 8.328 -0.287 19947
9451 1 28 . 1 1 2 2 PRO HA H 2 4.820 4.820 4.729 0.091 19947
9452 1 28 . 1 1 2 2 PRO CA C 2 61.900 61.900 62.022 -0.121 19947
9453 1 28 . 1 1 2 2 PRO CB C 2 30.700 30.700 31.589 -0.889 19947
9454 1 28 . 1 1 3 3 PRO HA H 3 4.540 4.540 4.419 0.121 19947
9455 1 28 . 1 1 3 3 PRO CA C 3 62.900 62.900 62.553 0.347 19947
9456 1 28 . 1 1 3 3 PRO CB C 3 32.100 32.100 32.627 -0.527 19947
9457 1 28 . 1 1 4 4 VAL N N 4 121.900 121.900 125.223 -3.323 19947
9458 1 28 . 1 1 4 4 VAL HA H 4 4.200 4.200 4.109 0.091 19947
9459 1 28 . 1 1 4 4 VAL CA C 4 62.300 62.300 62.759 -0.459 19947
9460 1 28 . 1 1 4 4 VAL CB C 4 32.800 32.800 31.928 0.872 19947
9461 1 28 . 1 1 4 4 VAL H H 4 8.330 8.330 8.362 -0.032 19947
9462 1 28 . 1 1 5 5 CYS N N 5 120.900 120.900 128.443 -7.543 19947
9463 1 28 . 1 1 5 5 CYS HA H 5 4.700 4.700 4.474 0.226 19947
9464 1 28 . 1 1 5 5 CYS CA C 5 53.600 53.600 58.425 -4.825 19947
9465 1 28 . 1 1 5 5 CYS H H 5 8.500 8.500 8.546 -0.046 19947
9466 1 28 . 1 1 6 6 GLY N N 6 110.200 110.200 113.675 -3.475 19947
9467 1 28 . 1 1 6 6 GLY CA C 6 46.300 46.300 44.691 1.609 19947
9468 1 28 . 1 1 6 6 GLY H H 6 8.490 8.490 8.418 0.072 19947
9469 1 28 . 1 1 7 7 ASN N N 7 120.100 120.100 116.675 3.425 19947
9470 1 28 . 1 1 7 7 ASN HA H 7 4.730 4.730 4.315 0.415 19947
9471 1 28 . 1 1 7 7 ASN CA C 7 53.200 53.200 54.117 -0.917 19947
9472 1 28 . 1 1 7 7 ASN CB C 7 38.700 38.700 39.257 -0.557 19947
9473 1 28 . 1 1 7 7 ASN H H 7 8.320 8.320 8.175 0.145 19947
9474 1 28 . 1 1 8 8 LYS N N 8 121.300 121.300 124.521 -3.221 19947
9475 1 28 . 1 1 8 8 LYS HA H 8 4.340 4.340 4.309 0.031 19947
9476 1 28 . 1 1 8 8 LYS CA C 8 56.600 56.600 56.754 -0.154 19947
9477 1 28 . 1 1 8 8 LYS CB C 8 32.900 32.900 31.709 1.191 19947
9478 1 28 . 1 1 8 8 LYS H H 8 8.260 8.260 8.473 -0.213 19947
9479 1 28 . 1 1 9 9 ILE N N 9 136.600 136.600 122.447 14.153 19947
9480 1 28 . 1 1 9 9 ILE HA H 9 4.140 4.140 3.920 0.220 19947
9481 1 28 . 1 1 9 9 ILE CA C 9 61.300 61.300 62.353 -1.053 19947
9482 1 28 . 1 1 9 9 ILE CB C 9 38.200 38.200 38.008 0.192 19947
9483 1 28 . 1 1 9 9 ILE H H 9 8.150 8.150 8.001 0.149 19947
9484 1 28 . 1 1 10 10 LEU N N 10 125.700 125.700 119.530 6.170 19947
9485 1 28 . 1 1 10 10 LEU HA H 10 4.420 4.420 4.453 -0.033 19947
9486 1 28 . 1 1 10 10 LEU CA C 10 55.200 55.200 55.387 -0.187 19947
9487 1 28 . 1 1 10 10 LEU CB C 10 42.300 42.300 41.355 0.945 19947
9488 1 28 . 1 1 10 10 LEU H H 10 8.230 8.230 8.315 -0.085 19947
9489 1 28 . 1 1 11 11 GLU N N 11 120.600 120.600 114.364 6.236 19947
9490 1 28 . 1 1 11 11 GLU HA H 11 4.470 4.470 4.109 0.361 19947
9491 1 28 . 1 1 11 11 GLU CA C 11 55.500 55.500 56.440 -0.940 19947
9492 1 28 . 1 1 11 11 GLU CB C 11 28.900 28.900 28.463 0.437 19947
9493 1 28 . 1 1 11 11 GLU H H 11 8.250 8.250 7.999 0.251 19947
9494 1 28 . 1 1 12 12 GLN N N 12 121.600 121.600 117.115 4.485 19947
9495 1 28 . 1 1 12 12 GLN HA H 12 4.350 4.350 4.648 -0.298 19947
9496 1 28 . 1 1 12 12 GLN CA C 12 56.600 56.600 55.302 1.298 19947
9497 1 28 . 1 1 12 12 GLN CB C 12 29.200 29.200 29.482 -0.282 19947
9498 1 28 . 1 1 12 12 GLN H H 12 8.460 8.460 7.558 0.902 19947
9499 1 28 . 1 1 13 13 GLY N N 13 110.700 110.700 111.483 -0.783 19947
9500 1 28 . 1 1 13 13 GLY CA C 13 45.700 45.700 46.095 -0.395 19947
9501 1 28 . 1 1 13 13 GLY H H 13 8.660 8.660 8.685 -0.025 19947
9502 1 28 . 1 1 14 14 GLU N N 14 118.900 118.900 118.078 0.822 19947
9503 1 28 . 1 1 14 14 GLU HA H 14 4.530 4.530 4.265 0.265 19947
9504 1 28 . 1 1 14 14 GLU CA C 14 55.600 55.600 58.260 -2.660 19947
9505 1 28 . 1 1 14 14 GLU CB C 14 29.700 29.700 29.206 0.494 19947
9506 1 28 . 1 1 14 14 GLU H H 14 8.230 8.230 8.262 -0.032 19947
9507 1 28 . 1 1 15 15 ASP N N 15 118.400 118.400 122.455 -4.055 19947
9508 1 28 . 1 1 15 15 ASP HA H 15 4.990 4.990 4.535 0.455 19947
9509 1 28 . 1 1 15 15 ASP CA C 15 53.500 53.500 57.888 -4.388 19947
9510 1 28 . 1 1 15 15 ASP CB C 15 39.700 39.700 41.559 -1.859 19947
9511 1 28 . 1 1 15 15 ASP H H 15 8.330 8.330 8.283 0.047 19947
9512 1 28 . 1 1 16 16 CYS HA H 16 4.340 4.340 4.526 -0.186 19947
9513 1 28 . 1 1 16 16 CYS H H 16 8.510 8.510 7.517 0.993 19947
9514 1 28 . 1 1 17 17 ASP N N 17 116.700 116.700 120.200 -3.500 19947
9515 1 28 . 1 1 17 17 ASP HA H 17 4.740 4.740 4.263 0.477 19947
9516 1 28 . 1 1 17 17 ASP CA C 17 53.100 53.100 55.551 -2.451 19947
9517 1 28 . 1 1 17 17 ASP CB C 17 38.600 38.600 39.195 -0.595 19947
9518 1 28 . 1 1 17 17 ASP H H 17 8.180 8.180 8.833 -0.653 19947
9519 1 28 . 1 1 18 18 CYS HA H 18 4.730 4.730 3.951 0.779 19947
9520 1 28 . 1 1 18 18 CYS CB C 18 41.900 41.900 27.052 14.848 19947
9521 1 28 . 1 1 19 19 GLY H H 19 8.220 8.220 8.646 -0.425 19947
9522 1 28 . 1 1 20 20 SER HA H 20 4.920 4.920 4.434 0.486 19947
9523 1 28 . 1 1 20 20 SER CA C 20 55.700 55.700 57.865 -2.165 19947
9524 1 28 . 1 1 20 20 SER CB C 20 63.500 63.500 62.770 0.730 19947
9525 1 28 . 1 1 20 20 SER H H 20 7.830 7.830 8.497 -0.667 19947
9526 1 28 . 1 1 21 21 PRO HA H 21 4.240 4.240 4.147 0.093 19947
9527 1 28 . 1 1 21 21 PRO CA C 21 63.400 63.400 65.046 -1.645 19947
9528 1 28 . 1 1 21 21 PRO CB C 21 31.800 31.800 31.402 0.397 19947
9529 1 28 . 1 1 22 22 ALA N N 22 119.900 119.900 116.871 3.029 19947
9530 1 28 . 1 1 22 22 ALA HA H 22 4.220 4.220 4.078 0.142 19947
9531 1 28 . 1 1 22 22 ALA CA C 22 54.200 54.200 53.898 0.302 19947
9532 1 28 . 1 1 22 22 ALA CB C 22 18.500 18.500 18.654 -0.154 19947
9533 1 28 . 1 1 22 22 ALA H H 22 8.180 8.180 8.308 -0.128 19947
9534 1 28 . 1 1 23 23 ASN N N 23 116.300 116.300 113.297 3.003 19947
9535 1 28 . 1 1 23 23 ASN HA H 23 4.670 4.670 4.980 -0.310 19947
9536 1 28 . 1 1 23 23 ASN CA C 23 53.200 53.200 52.646 0.554 19947
9537 1 28 . 1 1 23 23 ASN CB C 23 39.300 39.300 40.512 -1.212 19947
9538 1 28 . 1 1 23 23 ASN H H 23 7.960 7.960 8.221 -0.261 19947
9539 1 28 . 1 1 24 24 CYS HA H 24 4.720 4.720 4.274 0.446 19947
9540 1 28 . 1 1 24 24 CYS H H 24 8.510 8.510 7.389 1.121 19947
9541 1 28 . 1 1 25 25 GLN HA H 25 4.460 4.460 3.971 0.489 19947
9542 1 28 . 1 1 25 25 GLN H H 25 8.320 8.320 8.514 -0.194 19947
9543 1 28 . 1 1 26 26 ASP HA H 26 4.740 4.740 4.668 0.072 19947
9544 1 28 . 1 1 26 26 ASP H H 26 8.580 8.580 8.172 0.408 19947
9545 1 28 . 1 1 27 27 ARG HA H 27 4.680 4.680 4.386 0.294 19947
9546 1 28 . 1 1 27 27 ARG CA C 27 54.700 54.700 56.275 -1.575 19947
9547 1 28 . 1 1 27 27 ARG H H 27 8.550 8.550 8.123 0.427 19947
9548 1 28 . 1 1 28 28 CYS HA H 28 4.120 4.120 4.562 -0.442 19947
9549 1 28 . 1 1 28 28 CYS CA C 28 54.400 54.400 59.557 -5.157 19947
9550 1 28 . 1 1 28 28 CYS CB C 28 19.000 19.000 26.241 -7.240 19947
9551 1 28 . 1 1 28 28 CYS H H 28 8.910 8.910 8.614 0.296 19947
9552 1 28 . 1 1 29 29 CYS N N 29 113.300 113.300 118.488 -5.188 19947
9553 1 28 . 1 1 29 29 CYS HA H 29 5.010 5.010 4.567 0.443 19947
9554 1 28 . 1 1 29 29 CYS CA C 29 54.300 54.300 57.597 -3.297 19947
9555 1 28 . 1 1 29 29 CYS H H 29 7.730 7.730 7.706 0.024 19947
9556 1 28 . 1 1 30 30 ASN HA H 30 4.730 4.730 4.919 -0.189 19947
9557 1 28 . 1 1 30 30 ASN CB C 30 38.700 38.700 40.644 -1.944 19947
9558 1 28 . 1 1 30 30 ASN H H 30 8.870 8.870 8.150 0.720 19947
9559 1 28 . 1 1 31 31 ALA N N 31 129.400 129.400 127.189 2.211 19947
9560 1 28 . 1 1 31 31 ALA HA H 31 4.120 4.120 4.359 -0.239 19947
9561 1 28 . 1 1 31 31 ALA CA C 31 54.400 54.400 53.479 0.921 19947
9562 1 28 . 1 1 31 31 ALA CB C 31 19.000 19.000 18.893 0.107 19947
9563 1 28 . 1 1 31 31 ALA H H 31 8.890 8.890 8.919 -0.029 19947
9564 1 28 . 1 1 32 32 ALA N N 32 116.400 116.400 119.936 -3.536 19947
9565 1 28 . 1 1 32 32 ALA HA H 32 4.340 4.340 4.331 0.009 19947
9566 1 28 . 1 1 32 32 ALA CA C 32 53.800 53.800 53.741 0.059 19947
9567 1 28 . 1 1 32 32 ALA CB C 32 19.100 19.100 19.673 -0.573 19947
9568 1 28 . 1 1 32 32 ALA H H 32 8.250 8.250 7.655 0.595 19947
9569 1 28 . 1 1 33 33 THR N N 33 104.300 104.300 111.053 -6.753 19947
9570 1 28 . 1 1 33 33 THR HA H 33 4.430 4.430 4.300 0.130 19947
9571 1 28 . 1 1 33 33 THR CA C 33 60.500 60.500 61.595 -1.095 19947
9572 1 28 . 1 1 33 33 THR CB C 33 70.600 70.600 69.802 0.798 19947
9573 1 28 . 1 1 33 33 THR H H 33 7.320 7.320 7.945 -0.625 19947
9574 1 28 . 1 1 34 34 CYS N N 34 123.400 123.400 120.889 2.511 19947
9575 1 28 . 1 1 34 34 CYS HA H 34 4.170 4.170 4.227 -0.057 19947
9576 1 28 . 1 1 34 34 CYS CA C 34 56.500 56.500 60.123 -3.623 19947
9577 1 28 . 1 1 34 34 CYS H H 34 8.710 8.710 8.187 0.523 19947
9578 1 28 . 1 1 35 35 LYS N N 35 116.900 116.900 117.830 -0.930 19947
9579 1 28 . 1 1 35 35 LYS HA H 35 4.960 4.960 4.778 0.182 19947
9580 1 28 . 1 1 35 35 LYS CA C 35 53.900 53.900 55.513 -1.613 19947
9581 1 28 . 1 1 35 35 LYS CB C 35 35.900 35.900 36.061 -0.161 19947
9582 1 28 . 1 1 35 35 LYS H H 35 7.450 7.450 7.691 -0.241 19947
9583 1 28 . 1 1 36 36 LEU N N 36 119.300 119.300 122.264 -2.964 19947
9584 1 28 . 1 1 36 36 LEU HA H 36 4.800 4.800 4.332 0.468 19947
9585 1 28 . 1 1 36 36 LEU CB C 36 42.400 42.400 41.184 1.216 19947
9586 1 28 . 1 1 36 36 LEU H H 36 8.290 8.290 8.722 -0.432 19947
9587 1 28 . 1 1 37 37 THR HA H 37 4.340 4.340 4.338 0.002 19947
9588 1 28 . 1 1 37 37 THR CA C 37 60.200 60.200 61.024 -0.824 19947
9589 1 28 . 1 1 37 37 THR CB C 37 67.700 67.700 68.536 -0.836 19947
9590 1 28 . 1 1 37 37 THR H H 37 8.380 8.380 8.318 0.062 19947
9591 1 28 . 1 1 38 38 PRO HA H 38 4.380 4.380 4.223 0.158 19947
9592 1 28 . 1 1 38 38 PRO CA C 38 64.800 64.800 64.610 0.190 19947
9593 1 28 . 1 1 38 38 PRO CB C 38 31.500 31.500 31.431 0.069 19947
9594 1 28 . 1 1 39 39 GLY N N 39 113.300 113.300 111.107 2.193 19947
9595 1 28 . 1 1 39 39 GLY CA C 39 45.100 45.100 45.165 -0.065 19947
9596 1 28 . 1 1 39 39 GLY H H 39 8.830 8.830 8.568 0.262 19947
9597 1 28 . 1 1 40 40 SER N N 40 116.700 116.700 119.496 -2.796 19947
9598 1 28 . 1 1 40 40 SER HA H 40 4.610 4.610 4.360 0.250 19947
9599 1 28 . 1 1 40 40 SER CA C 40 58.800 58.800 58.827 -0.027 19947
9600 1 28 . 1 1 40 40 SER CB C 40 63.800 63.800 63.587 0.213 19947
9601 1 28 . 1 1 40 40 SER H H 40 8.280 8.280 7.757 0.523 19947
9602 1 28 . 1 1 41 41 GLN N N 41 120.600 120.600 123.390 -2.790 19947
9603 1 28 . 1 1 41 41 GLN HA H 41 4.110 4.110 4.044 0.066 19947
9604 1 28 . 1 1 41 41 GLN CA C 41 55.200 55.200 57.253 -2.053 19947
9605 1 28 . 1 1 41 41 GLN CB C 41 31.100 31.100 28.748 2.352 19947
9606 1 28 . 1 1 41 41 GLN H H 41 9.190 9.190 8.107 1.083 19947
9607 1 28 . 1 1 42 42 CYS N N 42 113.200 113.200 113.999 -0.799 19947
9608 1 28 . 1 1 42 42 CYS HA H 42 4.630 4.630 4.413 0.217 19947
9609 1 28 . 1 1 42 42 CYS CA C 42 53.700 53.700 58.425 -4.725 19947
9610 1 28 . 1 1 42 42 CYS CB C 42 45.500 45.500 29.413 16.087 19947
9611 1 28 . 1 1 42 42 CYS H H 42 7.710 7.710 7.552 0.158 19947
9612 1 28 . 1 1 43 43 ASN N N 43 114.200 114.200 120.099 -5.899 19947
9613 1 28 . 1 1 43 43 ASN HA H 43 4.940 4.940 4.838 0.102 19947
9614 1 28 . 1 1 43 43 ASN CA C 43 53.000 53.000 53.841 -0.841 19947
9615 1 28 . 1 1 43 43 ASN CB C 43 39.300 39.300 40.997 -1.697 19947
9616 1 28 . 1 1 43 43 ASN H H 43 8.870 8.870 8.640 0.230 19947
9617 1 28 . 1 1 44 44 TYR N N 44 118.400 118.400 118.234 0.166 19947
9618 1 28 . 1 1 44 44 TYR HA H 44 4.850 4.850 4.719 0.131 19947
9619 1 28 . 1 1 44 44 TYR CA C 44 55.300 55.300 57.118 -1.818 19947
9620 1 28 . 1 1 44 44 TYR CB C 44 40.700 40.700 40.339 0.361 19947
9621 1 28 . 1 1 44 44 TYR H H 44 7.840 7.840 7.332 0.508 19947
9622 1 28 . 1 1 45 45 GLY N N 45 110.600 110.600 112.444 -1.844 19947
9623 1 28 . 1 1 45 45 GLY CA C 45 44.000 44.000 45.036 -1.036 19947
9624 1 28 . 1 1 45 45 GLY H H 45 7.960 7.960 7.838 0.122 19947
9625 1 28 . 1 1 46 46 GLU N N 46 120.700 120.700 119.172 1.528 19947
9626 1 28 . 1 1 46 46 GLU HA H 46 4.280 4.280 4.184 0.096 19947
9627 1 28 . 1 1 46 46 GLU CA C 46 58.500 58.500 59.041 -0.541 19947
9628 1 28 . 1 1 46 46 GLU CB C 46 29.300 29.300 29.910 -0.611 19947
9629 1 28 . 1 1 46 46 GLU H H 46 9.160 9.160 8.676 0.484 19947
9630 1 28 . 1 1 47 47 CYS N N 47 112.400 112.400 116.544 -4.144 19947
9631 1 28 . 1 1 47 47 CYS HA H 47 4.850 4.850 4.749 0.101 19947
9632 1 28 . 1 1 47 47 CYS CA C 47 57.100 57.100 57.795 -0.695 19947
9633 1 28 . 1 1 47 47 CYS CB C 47 41.200 41.200 27.012 14.188 19947
9634 1 28 . 1 1 47 47 CYS H H 47 8.510 8.510 7.517 0.993 19947
9635 1 28 . 1 1 48 48 CYS N N 48 123.200 123.200 120.491 2.709 19947
9636 1 28 . 1 1 48 48 CYS HA H 48 5.160 5.160 4.649 0.511 19947
9637 1 28 . 1 1 48 48 CYS CA C 48 54.700 54.700 59.133 -4.433 19947
9638 1 28 . 1 1 48 48 CYS CB C 48 45.700 45.700 27.558 18.142 19947
9639 1 28 . 1 1 48 48 CYS H H 48 7.810 7.810 7.513 0.297 19947
9640 1 28 . 1 1 49 49 ASP N N 49 127.400 127.400 124.187 3.213 19947
9641 1 28 . 1 1 49 49 ASP HA H 49 4.890 4.890 4.755 0.135 19947
9642 1 28 . 1 1 49 49 ASP CA C 49 53.500 53.500 54.618 -1.118 19947
9643 1 28 . 1 1 49 49 ASP CB C 49 42.400 42.400 43.368 -0.968 19947
9644 1 28 . 1 1 49 49 ASP H H 49 9.670 9.670 8.485 1.185 19947
9645 1 28 . 1 1 50 50 GLN N N 50 127.000 127.000 124.020 2.980 19947
9646 1 28 . 1 1 50 50 GLN HA H 50 3.940 3.940 3.990 -0.050 19947
9647 1 28 . 1 1 50 50 GLN CA C 50 56.800 56.800 56.885 -0.085 19947
9648 1 28 . 1 1 50 50 GLN CB C 50 26.500 26.500 27.116 -0.616 19947
9649 1 28 . 1 1 50 50 GLN H H 50 9.450 9.450 8.864 0.586 19947
9650 1 28 . 1 1 51 51 CYS N N 51 106.100 106.100 112.296 -6.196 19947
9651 1 28 . 1 1 51 51 CYS HA H 51 4.760 4.760 4.240 0.520 19947
9652 1 28 . 1 1 51 51 CYS CB C 51 43.200 43.200 24.534 18.666 19947
9653 1 28 . 1 1 51 51 CYS H H 51 8.700 8.700 8.383 0.317 19947
9654 1 28 . 1 1 52 52 ARG N N 52 121.000 121.000 117.634 3.366 19947
9655 1 28 . 1 1 52 52 ARG HA H 52 4.690 4.690 4.467 0.223 19947
9656 1 28 . 1 1 52 52 ARG CA C 52 55.400 55.400 53.752 1.648 19947
9657 1 28 . 1 1 52 52 ARG CB C 52 33.100 33.100 33.256 -0.156 19947
9658 1 28 . 1 1 52 52 ARG H H 52 7.960 7.960 7.166 0.794 19947
9659 1 28 . 1 1 53 53 PHE N N 53 120.300 120.300 123.499 -3.199 19947
9660 1 28 . 1 1 53 53 PHE HA H 53 5.050 5.050 4.842 0.208 19947
9661 1 28 . 1 1 53 53 PHE CA C 53 56.100 56.100 57.507 -1.407 19947
9662 1 28 . 1 1 53 53 PHE CB C 53 38.200 38.200 39.304 -1.104 19947
9663 1 28 . 1 1 53 53 PHE H H 53 8.400 8.400 8.128 0.272 19947
9664 1 28 . 1 1 54 54 LYS N N 54 123.300 123.300 125.345 -2.045 19947
9665 1 28 . 1 1 54 54 LYS HA H 54 4.250 4.250 4.154 0.096 19947
9666 1 28 . 1 1 54 54 LYS CA C 54 57.500 57.500 55.826 1.674 19947
9667 1 28 . 1 1 54 54 LYS CB C 54 34.300 34.300 31.330 2.970 19947
9668 1 28 . 1 1 54 54 LYS H H 54 8.540 8.540 8.868 -0.328 19947
9669 1 28 . 1 1 55 55 LYS N N 55 119.400 119.400 124.811 -5.411 19947
9670 1 28 . 1 1 55 55 LYS HA H 55 4.110 4.110 3.951 0.159 19947
9671 1 28 . 1 1 55 55 LYS CA C 55 56.500 56.500 56.796 -0.296 19947
9672 1 28 . 1 1 55 55 LYS CB C 55 33.400 33.400 33.227 0.173 19947
9673 1 28 . 1 1 55 55 LYS H H 55 8.440 8.440 8.059 0.381 19947
9674 1 28 . 1 1 56 56 ALA N N 56 126.700 126.700 127.454 -0.754 19947
9675 1 28 . 1 1 56 56 ALA HA H 56 3.920 3.920 4.004 -0.084 19947
9676 1 28 . 1 1 56 56 ALA CA C 56 52.900 52.900 53.654 -0.754 19947
9677 1 28 . 1 1 56 56 ALA CB C 56 18.100 18.100 18.557 -0.457 19947
9678 1 28 . 1 1 56 56 ALA H H 56 8.930 8.930 8.670 0.260 19947
9679 1 28 . 1 1 57 57 GLY N N 57 109.300 109.300 111.423 -2.123 19947
9680 1 28 . 1 1 57 57 GLY CA C 57 45.100 45.100 44.817 0.283 19947
9681 1 28 . 1 1 57 57 GLY H H 57 8.460 8.460 8.456 0.004 19947
9682 1 28 . 1 1 58 58 THR N N 58 117.200 117.200 120.354 -3.154 19947
9683 1 28 . 1 1 58 58 THR HA H 58 4.260 4.260 4.395 -0.135 19947
9684 1 28 . 1 1 58 58 THR CA C 58 63.300 63.300 63.611 -0.311 19947
9685 1 28 . 1 1 58 58 THR CB C 58 69.600 69.600 69.262 0.338 19947
9686 1 28 . 1 1 58 58 THR H H 58 7.660 7.660 7.788 -0.128 19947
9687 1 28 . 1 1 59 59 VAL N N 59 130.400 130.400 127.759 2.641 19947
9688 1 28 . 1 1 59 59 VAL HA H 59 3.900 3.900 3.958 -0.058 19947
9689 1 28 . 1 1 59 59 VAL CA C 59 64.400 64.400 62.209 2.191 19947
9690 1 28 . 1 1 59 59 VAL CB C 59 31.900 31.900 31.673 0.227 19947
9691 1 28 . 1 1 59 59 VAL H H 59 9.190 9.190 8.725 0.465 19947
9692 1 28 . 1 1 60 60 CYS N N 60 121.800 121.800 126.871 -5.071 19947
9693 1 28 . 1 1 60 60 CYS HA H 60 5.050 5.050 4.559 0.491 19947
9694 1 28 . 1 1 60 60 CYS CA C 60 54.400 54.400 58.343 -3.942 19947
9695 1 28 . 1 1 60 60 CYS CB C 60 43.000 43.000 27.608 15.392 19947
9696 1 28 . 1 1 60 60 CYS H H 60 9.130 9.130 8.153 0.977 19947
9697 1 28 . 1 1 61 61 ARG N N 61 124.100 124.100 118.585 5.515 19947
9698 1 28 . 1 1 61 61 ARG HA H 61 4.360 4.360 4.605 -0.245 19947
9699 1 28 . 1 1 61 61 ARG CA C 61 56.800 56.800 55.448 1.352 19947
9700 1 28 . 1 1 61 61 ARG CB C 61 32.800 32.800 34.595 -1.795 19947
9701 1 28 . 1 1 61 61 ARG H H 61 7.580 7.580 7.383 0.197 19947
9702 1 28 . 1 1 62 62 ILE N N 62 126.200 126.200 116.359 9.841 19947
9703 1 28 . 1 1 62 62 ILE HA H 62 4.090 4.090 4.619 -0.529 19947
9704 1 28 . 1 1 62 62 ILE CA C 62 60.300 60.300 61.275 -0.975 19947
9705 1 28 . 1 1 62 62 ILE CB C 62 38.700 38.700 40.732 -2.032 19947
9706 1 28 . 1 1 62 62 ILE H H 62 8.490 8.490 8.418 0.072 19947
9707 1 28 . 1 1 63 63 ALA N N 63 129.400 129.400 131.838 -2.438 19947
9708 1 28 . 1 1 63 63 ALA HA H 63 4.310 4.310 4.503 -0.193 19947
9709 1 28 . 1 1 63 63 ALA CA C 63 51.900 51.900 54.197 -2.296 19947
9710 1 28 . 1 1 63 63 ALA CB C 63 20.600 20.600 19.259 1.341 19947
9711 1 28 . 1 1 63 63 ALA H H 63 8.100 8.100 8.659 -0.559 19947
9712 1 28 . 1 1 64 64 ARG N N 64 120.500 120.500 121.016 -0.516 19947
9713 1 28 . 1 1 64 64 ARG HA H 64 4.290 4.290 4.505 -0.215 19947
9714 1 28 . 1 1 64 64 ARG CA C 64 56.200 56.200 55.898 0.302 19947
9715 1 28 . 1 1 64 64 ARG CB C 64 30.500 30.500 30.164 0.336 19947
9716 1 28 . 1 1 64 64 ARG H H 64 8.140 8.140 8.801 -0.661 19947
9717 1 28 . 1 1 65 65 GLY N N 65 110.500 110.500 112.722 -2.222 19947
9718 1 28 . 1 1 65 65 GLY CA C 65 45.100 45.100 44.593 0.507 19947
9719 1 28 . 1 1 65 65 GLY H H 65 8.040 8.040 8.391 -0.351 19947
9720 1 28 . 1 1 66 66 ASP N N 66 120.700 120.700 119.726 0.974 19947
9721 1 28 . 1 1 66 66 ASP HA H 66 4.610 4.610 4.540 0.070 19947
9722 1 28 . 1 1 66 66 ASP CA C 66 53.300 53.300 53.496 -0.196 19947
9723 1 28 . 1 1 66 66 ASP CB C 66 37.600 37.600 40.369 -2.769 19947
9724 1 28 . 1 1 66 66 ASP H H 66 8.380 8.380 7.220 1.160 19947
9725 1 28 . 1 1 67 67 TRP N N 67 120.100 120.100 123.088 -2.988 19947
9726 1 28 . 1 1 67 67 TRP HA H 67 4.760 4.760 5.031 -0.271 19947
9727 1 28 . 1 1 67 67 TRP CA C 67 57.200 57.200 57.971 -0.771 19947
9728 1 28 . 1 1 67 67 TRP CB C 67 29.100 29.100 29.767 -0.667 19947
9729 1 28 . 1 1 67 67 TRP H H 67 7.950 7.950 7.923 0.027 19947
9730 1 28 . 1 1 68 68 ASN N N 68 118.400 118.400 117.332 1.068 19947
9731 1 28 . 1 1 68 68 ASN HA H 68 4.790 4.790 4.957 -0.167 19947
9732 1 28 . 1 1 68 68 ASN CA C 68 52.800 52.800 53.679 -0.879 19947
9733 1 28 . 1 1 68 68 ASN CB C 68 39.300 39.300 40.384 -1.084 19947
9734 1 28 . 1 1 68 68 ASN H H 68 8.180 8.180 8.876 -0.696 19947
9735 1 28 . 1 1 69 69 ASP N N 69 118.500 118.500 118.262 0.238 19947
9736 1 28 . 1 1 69 69 ASP HA H 69 4.620 4.620 4.561 0.059 19947
9737 1 28 . 1 1 69 69 ASP CA C 69 53.200 53.200 56.227 -3.027 19947
9738 1 28 . 1 1 69 69 ASP CB C 69 38.000 38.000 41.220 -3.220 19947
9739 1 28 . 1 1 69 69 ASP H H 69 8.130 8.130 8.368 -0.238 19947
9740 1 28 . 1 1 70 70 ASP N N 70 120.500 120.500 120.978 -0.478 19947
9741 1 28 . 1 1 70 70 ASP HA H 70 5.100 5.100 5.297 -0.197 19947
9742 1 28 . 1 1 70 70 ASP CA C 70 52.500 52.500 52.879 -0.379 19947
9743 1 28 . 1 1 70 70 ASP CB C 70 42.600 42.600 42.796 -0.196 19947
9744 1 28 . 1 1 70 70 ASP H H 70 8.140 8.140 8.100 0.040 19947
9745 1 28 . 1 1 71 71 TYR N N 71 118.900 118.900 123.947 -5.047 19947
9746 1 28 . 1 1 71 71 TYR HA H 71 5.210 5.210 5.063 0.147 19947
9747 1 28 . 1 1 71 71 TYR CA C 71 56.300 56.300 56.940 -0.640 19947
9748 1 28 . 1 1 71 71 TYR CB C 71 42.200 42.200 42.792 -0.592 19947
9749 1 28 . 1 1 71 71 TYR H H 71 8.450 8.450 8.436 0.014 19947
9750 1 28 . 1 1 72 72 CYS N N 72 119.800 119.800 121.544 -1.744 19947
9751 1 28 . 1 1 72 72 CYS HA H 72 4.900 4.900 4.572 0.329 19947
9752 1 28 . 1 1 72 72 CYS CA C 72 53.400 53.400 59.124 -5.724 19947
9753 1 28 . 1 1 72 72 CYS CB C 72 37.200 37.200 28.873 8.327 19947
9754 1 28 . 1 1 72 72 CYS H H 72 9.330 9.330 8.546 0.784 19947
9755 1 28 . 1 1 73 73 THR N N 73 112.700 112.700 114.014 -1.314 19947
9756 1 28 . 1 1 73 73 THR HA H 73 4.430 4.430 4.456 -0.026 19947
9757 1 28 . 1 1 73 73 THR CA C 73 62.300 62.300 60.988 1.312 19947
9758 1 28 . 1 1 73 73 THR CB C 73 71.300 71.300 69.802 1.498 19947
9759 1 28 . 1 1 73 73 THR H H 73 9.980 9.980 8.753 1.227 19947
9760 1 28 . 1 1 74 74 GLY N N 74 111.500 111.500 111.041 0.459 19947
9761 1 28 . 1 1 74 74 GLY CA C 74 45.300 45.300 46.594 -1.294 19947
9762 1 28 . 1 1 74 74 GLY H H 74 8.580 8.580 7.807 0.773 19947
9763 1 28 . 1 1 75 75 LYS N N 75 115.900 115.900 117.363 -1.463 19947
9764 1 28 . 1 1 75 75 LYS HA H 75 4.140 4.140 4.590 -0.450 19947
9765 1 28 . 1 1 75 75 LYS CA C 75 54.800 54.800 55.655 -0.855 19947
9766 1 28 . 1 1 75 75 LYS CB C 75 34.200 34.200 34.268 -0.068 19947
9767 1 28 . 1 1 75 75 LYS H H 75 7.900 7.900 7.547 0.353 19947
9768 1 28 . 1 1 76 76 SER N N 76 111.000 111.000 111.971 -0.971 19947
9769 1 28 . 1 1 76 76 SER HA H 76 4.160 4.160 3.802 0.358 19947
9770 1 28 . 1 1 76 76 SER CA C 76 61.400 61.400 56.543 4.857 19947
9771 1 28 . 1 1 76 76 SER CB C 76 64.300 64.300 64.123 0.177 19947
9772 1 28 . 1 1 76 76 SER H H 76 6.520 6.520 6.709 -0.189 19947
9773 1 28 . 1 1 77 77 SER N N 77 117.100 117.100 113.717 3.383 19947
9774 1 28 . 1 1 77 77 SER HA H 77 4.220 4.220 4.447 -0.227 19947
9775 1 28 . 1 1 77 77 SER CA C 77 59.800 59.800 58.324 1.476 19947
9776 1 28 . 1 1 77 77 SER CB C 77 64.400 64.400 63.654 0.747 19947
9777 1 28 . 1 1 77 77 SER H H 77 9.030 9.030 8.227 0.803 19947
9778 1 28 . 1 1 78 78 ASP N N 78 122.100 122.100 122.096 0.004 19947
9779 1 28 . 1 1 78 78 ASP HA H 78 4.930 4.930 4.785 0.145 19947
9780 1 28 . 1 1 78 78 ASP CA C 78 52.400 52.400 53.820 -1.420 19947
9781 1 28 . 1 1 78 78 ASP CB C 78 40.800 40.800 44.496 -3.696 19947
9782 1 28 . 1 1 78 78 ASP H H 78 8.340 8.340 7.246 1.094 19947
9783 1 28 . 1 1 79 79 CYS N N 79 122.200 122.200 121.971 0.229 19947
9784 1 28 . 1 1 79 79 CYS HA H 79 5.320 5.320 4.892 0.428 19947
9785 1 28 . 1 1 79 79 CYS CA C 79 52.000 52.000 55.716 -3.716 19947
9786 1 28 . 1 1 79 79 CYS CB C 79 39.300 39.300 27.902 11.398 19947
9787 1 28 . 1 1 79 79 CYS H H 79 8.960 8.960 8.719 0.241 19947
9788 1 28 . 1 1 80 80 PRO HA H 80 4.410 4.410 4.608 -0.198 19947
9789 1 28 . 1 1 80 80 PRO CA C 80 63.500 63.500 63.227 0.273 19947
9790 1 28 . 1 1 80 80 PRO CB C 80 32.400 32.400 32.292 0.108 19947
9791 1 28 . 1 1 81 81 TRP N N 81 120.500 120.500 121.045 -0.545 19947
9792 1 28 . 1 1 81 81 TRP HA H 81 4.550 4.550 4.703 -0.153 19947
9793 1 28 . 1 1 81 81 TRP CA C 81 56.400 56.400 54.366 2.034 19947
9794 1 28 . 1 1 81 81 TRP CB C 81 29.500 29.500 28.555 0.945 19947
9795 1 28 . 1 1 81 81 TRP H H 81 8.400 8.400 8.686 -0.286 19947
9796 1 28 . 1 1 82 82 ASN N N 82 120.400 120.400 116.286 4.114 19947
9797 1 28 . 1 1 82 82 ASN HA H 82 4.750 4.750 4.213 0.537 19947
9798 1 28 . 1 1 82 82 ASN CA C 82 53.100 53.100 54.033 -0.933 19947
9799 1 28 . 1 1 82 82 ASN CB C 82 39.000 39.000 36.919 2.081 19947
9800 1 28 . 1 1 82 82 ASN H H 82 8.040 8.040 8.292 -0.252 19947
9801 1 29 . 1 1 2 2 PRO HA H 2 4.820 4.820 4.695 0.125 19947
9802 1 29 . 1 1 2 2 PRO CA C 2 61.900 61.900 62.149 -0.249 19947
9803 1 29 . 1 1 2 2 PRO CB C 2 30.700 30.700 31.921 -1.221 19947
9804 1 29 . 1 1 3 3 PRO HA H 3 4.540 4.540 4.448 0.092 19947
9805 1 29 . 1 1 3 3 PRO CA C 3 62.900 62.900 62.441 0.459 19947
9806 1 29 . 1 1 3 3 PRO CB C 3 32.100 32.100 32.291 -0.191 19947
9807 1 29 . 1 1 4 4 VAL N N 4 121.900 121.900 122.677 -0.777 19947
9808 1 29 . 1 1 4 4 VAL HA H 4 4.200 4.200 4.109 0.091 19947
9809 1 29 . 1 1 4 4 VAL CA C 4 62.300 62.300 61.350 0.950 19947
9810 1 29 . 1 1 4 4 VAL CB C 4 32.800 32.800 29.438 3.362 19947
9811 1 29 . 1 1 4 4 VAL H H 4 8.330 8.330 8.288 0.042 19947
9812 1 29 . 1 1 5 5 CYS N N 5 120.900 120.900 125.853 -4.953 19947
9813 1 29 . 1 1 5 5 CYS HA H 5 4.700 4.700 4.575 0.125 19947
9814 1 29 . 1 1 5 5 CYS CA C 5 53.600 53.600 58.667 -5.067 19947
9815 1 29 . 1 1 5 5 CYS H H 5 8.500 8.500 8.503 -0.003 19947
9816 1 29 . 1 1 6 6 GLY N N 6 110.200 110.200 117.049 -6.849 19947
9817 1 29 . 1 1 6 6 GLY CA C 6 46.300 46.300 44.779 1.521 19947
9818 1 29 . 1 1 6 6 GLY H H 6 8.490 8.490 8.279 0.211 19947
9819 1 29 . 1 1 7 7 ASN N N 7 120.100 120.100 116.501 3.599 19947
9820 1 29 . 1 1 7 7 ASN HA H 7 4.730 4.730 4.309 0.421 19947
9821 1 29 . 1 1 7 7 ASN CA C 7 53.200 53.200 53.710 -0.510 19947
9822 1 29 . 1 1 7 7 ASN CB C 7 38.700 38.700 39.201 -0.501 19947
9823 1 29 . 1 1 7 7 ASN H H 7 8.320 8.320 8.391 -0.071 19947
9824 1 29 . 1 1 8 8 LYS N N 8 121.300 121.300 122.942 -1.642 19947
9825 1 29 . 1 1 8 8 LYS HA H 8 4.340 4.340 4.166 0.174 19947
9826 1 29 . 1 1 8 8 LYS CA C 8 56.600 56.600 56.287 0.313 19947
9827 1 29 . 1 1 8 8 LYS CB C 8 32.900 32.900 31.611 1.289 19947
9828 1 29 . 1 1 8 8 LYS H H 8 8.260 8.260 8.412 -0.152 19947
9829 1 29 . 1 1 9 9 ILE N N 9 136.600 136.600 123.236 13.364 19947
9830 1 29 . 1 1 9 9 ILE HA H 9 4.140 4.140 3.943 0.197 19947
9831 1 29 . 1 1 9 9 ILE CA C 9 61.300 61.300 62.591 -1.291 19947
9832 1 29 . 1 1 9 9 ILE CB C 9 38.200 38.200 37.564 0.636 19947
9833 1 29 . 1 1 9 9 ILE H H 9 8.150 8.150 7.999 0.151 19947
9834 1 29 . 1 1 10 10 LEU N N 10 125.700 125.700 121.446 4.254 19947
9835 1 29 . 1 1 10 10 LEU HA H 10 4.420 4.420 4.474 -0.054 19947
9836 1 29 . 1 1 10 10 LEU CA C 10 55.200 55.200 55.191 0.009 19947
9837 1 29 . 1 1 10 10 LEU CB C 10 42.300 42.300 41.752 0.548 19947
9838 1 29 . 1 1 10 10 LEU H H 10 8.230 8.230 7.973 0.257 19947
9839 1 29 . 1 1 11 11 GLU N N 11 120.600 120.600 113.367 7.233 19947
9840 1 29 . 1 1 11 11 GLU HA H 11 4.470 4.470 4.119 0.351 19947
9841 1 29 . 1 1 11 11 GLU CA C 11 55.500 55.500 56.338 -0.838 19947
9842 1 29 . 1 1 11 11 GLU CB C 11 28.900 28.900 27.747 1.153 19947
9843 1 29 . 1 1 11 11 GLU H H 11 8.250 8.250 8.079 0.171 19947
9844 1 29 . 1 1 12 12 GLN N N 12 121.600 121.600 118.935 2.665 19947
9845 1 29 . 1 1 12 12 GLN HA H 12 4.350 4.350 4.744 -0.394 19947
9846 1 29 . 1 1 12 12 GLN CA C 12 56.600 56.600 56.561 0.039 19947
9847 1 29 . 1 1 12 12 GLN CB C 12 29.200 29.200 31.017 -1.817 19947
9848 1 29 . 1 1 12 12 GLN H H 12 8.460 8.460 7.960 0.500 19947
9849 1 29 . 1 1 13 13 GLY N N 13 110.700 110.700 105.753 4.947 19947
9850 1 29 . 1 1 13 13 GLY CA C 13 45.700 45.700 46.058 -0.358 19947
9851 1 29 . 1 1 13 13 GLY H H 13 8.660 8.660 8.538 0.122 19947
9852 1 29 . 1 1 14 14 GLU N N 14 118.900 118.900 110.363 8.537 19947
9853 1 29 . 1 1 14 14 GLU HA H 14 4.530 4.530 4.181 0.349 19947
9854 1 29 . 1 1 14 14 GLU CA C 14 55.600 55.600 56.501 -0.901 19947
9855 1 29 . 1 1 14 14 GLU CB C 14 29.700 29.700 28.230 1.470 19947
9856 1 29 . 1 1 14 14 GLU H H 14 8.230 8.230 8.114 0.116 19947
9857 1 29 . 1 1 15 15 ASP N N 15 118.400 118.400 120.670 -2.270 19947
9858 1 29 . 1 1 15 15 ASP HA H 15 4.990 4.990 4.476 0.514 19947
9859 1 29 . 1 1 15 15 ASP CA C 15 53.500 53.500 56.468 -2.968 19947
9860 1 29 . 1 1 15 15 ASP CB C 15 39.700 39.700 41.301 -1.601 19947
9861 1 29 . 1 1 15 15 ASP H H 15 8.330 8.330 8.137 0.193 19947
9862 1 29 . 1 1 16 16 CYS HA H 16 4.340 4.340 4.425 -0.085 19947
9863 1 29 . 1 1 16 16 CYS H H 16 8.510 8.510 7.777 0.733 19947
9864 1 29 . 1 1 17 17 ASP N N 17 116.700 116.700 124.945 -8.245 19947
9865 1 29 . 1 1 17 17 ASP HA H 17 4.740 4.740 4.492 0.248 19947
9866 1 29 . 1 1 17 17 ASP CA C 17 53.100 53.100 55.154 -2.054 19947
9867 1 29 . 1 1 17 17 ASP CB C 17 38.600 38.600 39.400 -0.800 19947
9868 1 29 . 1 1 17 17 ASP H H 17 8.180 8.180 8.654 -0.474 19947
9869 1 29 . 1 1 18 18 CYS HA H 18 4.730 4.730 4.016 0.714 19947
9870 1 29 . 1 1 18 18 CYS CB C 18 41.900 41.900 27.045 14.855 19947
9871 1 29 . 1 1 19 19 GLY H H 19 8.220 8.220 8.140 0.080 19947
9872 1 29 . 1 1 20 20 SER HA H 20 4.920 4.920 4.450 0.470 19947
9873 1 29 . 1 1 20 20 SER CA C 20 55.700 55.700 57.882 -2.182 19947
9874 1 29 . 1 1 20 20 SER CB C 20 63.500 63.500 62.900 0.600 19947
9875 1 29 . 1 1 20 20 SER H H 20 7.830 7.830 8.441 -0.611 19947
9876 1 29 . 1 1 21 21 PRO HA H 21 4.240 4.240 4.252 -0.012 19947
9877 1 29 . 1 1 21 21 PRO CA C 21 63.400 63.400 65.079 -1.679 19947
9878 1 29 . 1 1 21 21 PRO CB C 21 31.800 31.800 31.230 0.570 19947
9879 1 29 . 1 1 22 22 ALA N N 22 119.900 119.900 119.626 0.274 19947
9880 1 29 . 1 1 22 22 ALA HA H 22 4.220 4.220 4.154 0.066 19947
9881 1 29 . 1 1 22 22 ALA CA C 22 54.200 54.200 53.945 0.255 19947
9882 1 29 . 1 1 22 22 ALA CB C 22 18.500 18.500 18.385 0.115 19947
9883 1 29 . 1 1 22 22 ALA H H 22 8.180 8.180 8.485 -0.305 19947
9884 1 29 . 1 1 23 23 ASN N N 23 116.300 116.300 111.711 4.589 19947
9885 1 29 . 1 1 23 23 ASN HA H 23 4.670 4.670 4.974 -0.304 19947
9886 1 29 . 1 1 23 23 ASN CA C 23 53.200 53.200 52.124 1.076 19947
9887 1 29 . 1 1 23 23 ASN CB C 23 39.300 39.300 40.489 -1.189 19947
9888 1 29 . 1 1 23 23 ASN H H 23 7.960 7.960 8.080 -0.120 19947
9889 1 29 . 1 1 24 24 CYS HA H 24 4.720 4.720 4.333 0.387 19947
9890 1 29 . 1 1 24 24 CYS H H 24 8.510 8.510 7.893 0.617 19947
9891 1 29 . 1 1 25 25 GLN HA H 25 4.460 4.460 4.067 0.393 19947
9892 1 29 . 1 1 25 25 GLN H H 25 8.320 8.320 8.689 -0.369 19947
9893 1 29 . 1 1 26 26 ASP HA H 26 4.740 4.740 4.746 -0.006 19947
9894 1 29 . 1 1 26 26 ASP H H 26 8.580 8.580 7.867 0.713 19947
9895 1 29 . 1 1 27 27 ARG HA H 27 4.680 4.680 4.189 0.491 19947
9896 1 29 . 1 1 27 27 ARG CA C 27 54.700 54.700 58.359 -3.659 19947
9897 1 29 . 1 1 27 27 ARG H H 27 8.550 8.550 8.388 0.162 19947
9898 1 29 . 1 1 28 28 CYS HA H 28 4.120 4.120 4.804 -0.684 19947
9899 1 29 . 1 1 28 28 CYS CA C 28 54.400 54.400 56.313 -1.913 19947
9900 1 29 . 1 1 28 28 CYS CB C 28 19.000 19.000 26.181 -7.181 19947
9901 1 29 . 1 1 28 28 CYS H H 28 8.910 8.910 8.208 0.702 19947
9902 1 29 . 1 1 29 29 CYS N N 29 113.300 113.300 119.528 -6.228 19947
9903 1 29 . 1 1 29 29 CYS HA H 29 5.010 5.010 4.695 0.315 19947
9904 1 29 . 1 1 29 29 CYS CA C 29 54.300 54.300 56.732 -2.432 19947
9905 1 29 . 1 1 29 29 CYS H H 29 7.730 7.730 7.724 0.006 19947
9906 1 29 . 1 1 30 30 ASN HA H 30 4.730 4.730 5.033 -0.303 19947
9907 1 29 . 1 1 30 30 ASN CB C 30 38.700 38.700 39.503 -0.803 19947
9908 1 29 . 1 1 30 30 ASN H H 30 8.870 8.870 8.959 -0.089 19947
9909 1 29 . 1 1 31 31 ALA N N 31 129.400 129.400 125.817 3.583 19947
9910 1 29 . 1 1 31 31 ALA HA H 31 4.120 4.120 4.115 0.004 19947
9911 1 29 . 1 1 31 31 ALA CA C 31 54.400 54.400 54.983 -0.584 19947
9912 1 29 . 1 1 31 31 ALA CB C 31 19.000 19.000 19.192 -0.192 19947
9913 1 29 . 1 1 31 31 ALA H H 31 8.890 8.890 8.244 0.646 19947
9914 1 29 . 1 1 32 32 ALA N N 32 116.400 116.400 115.778 0.622 19947
9915 1 29 . 1 1 32 32 ALA HA H 32 4.340 4.340 4.396 -0.056 19947
9916 1 29 . 1 1 32 32 ALA CA C 32 53.800 53.800 52.258 1.542 19947
9917 1 29 . 1 1 32 32 ALA CB C 32 19.100 19.100 18.582 0.518 19947
9918 1 29 . 1 1 32 32 ALA H H 32 8.250 8.250 8.385 -0.135 19947
9919 1 29 . 1 1 33 33 THR N N 33 104.300 104.300 112.012 -7.712 19947
9920 1 29 . 1 1 33 33 THR HA H 33 4.430 4.430 4.445 -0.015 19947
9921 1 29 . 1 1 33 33 THR CA C 33 60.500 60.500 61.337 -0.836 19947
9922 1 29 . 1 1 33 33 THR CB C 33 70.600 70.600 69.969 0.631 19947
9923 1 29 . 1 1 33 33 THR H H 33 7.320 7.320 7.465 -0.145 19947
9924 1 29 . 1 1 34 34 CYS N N 34 123.400 123.400 121.104 2.296 19947
9925 1 29 . 1 1 34 34 CYS HA H 34 4.170 4.170 4.183 -0.013 19947
9926 1 29 . 1 1 34 34 CYS CA C 34 56.500 56.500 60.228 -3.728 19947
9927 1 29 . 1 1 34 34 CYS H H 34 8.710 8.710 8.239 0.471 19947
9928 1 29 . 1 1 35 35 LYS N N 35 116.900 116.900 116.433 0.467 19947
9929 1 29 . 1 1 35 35 LYS HA H 35 4.960 4.960 4.801 0.159 19947
9930 1 29 . 1 1 35 35 LYS CA C 35 53.900 53.900 55.319 -1.419 19947
9931 1 29 . 1 1 35 35 LYS CB C 35 35.900 35.900 35.840 0.060 19947
9932 1 29 . 1 1 35 35 LYS H H 35 7.450 7.450 7.741 -0.291 19947
9933 1 29 . 1 1 36 36 LEU N N 36 119.300 119.300 118.616 0.684 19947
9934 1 29 . 1 1 36 36 LEU HA H 36 4.800 4.800 4.606 0.194 19947
9935 1 29 . 1 1 36 36 LEU CB C 36 42.400 42.400 42.883 -0.483 19947
9936 1 29 . 1 1 36 36 LEU H H 36 8.290 8.290 8.472 -0.182 19947
9937 1 29 . 1 1 37 37 THR HA H 37 4.340 4.340 4.823 -0.483 19947
9938 1 29 . 1 1 37 37 THR CA C 37 60.200 60.200 58.804 1.396 19947
9939 1 29 . 1 1 37 37 THR CB C 37 67.700 67.700 69.212 -1.512 19947
9940 1 29 . 1 1 37 37 THR H H 37 8.380 8.380 8.012 0.368 19947
9941 1 29 . 1 1 38 38 PRO HA H 38 4.380 4.380 4.155 0.225 19947
9942 1 29 . 1 1 38 38 PRO CA C 38 64.800 64.800 64.216 0.584 19947
9943 1 29 . 1 1 38 38 PRO CB C 38 31.500 31.500 31.739 -0.239 19947
9944 1 29 . 1 1 39 39 GLY N N 39 113.300 113.300 110.313 2.987 19947
9945 1 29 . 1 1 39 39 GLY CA C 39 45.100 45.100 45.342 -0.242 19947
9946 1 29 . 1 1 39 39 GLY H H 39 8.830 8.830 8.486 0.344 19947
9947 1 29 . 1 1 40 40 SER N N 40 116.700 116.700 114.824 1.876 19947
9948 1 29 . 1 1 40 40 SER HA H 40 4.610 4.610 4.864 -0.254 19947
9949 1 29 . 1 1 40 40 SER CA C 40 58.800 58.800 57.497 1.303 19947
9950 1 29 . 1 1 40 40 SER CB C 40 63.800 63.800 65.283 -1.483 19947
9951 1 29 . 1 1 40 40 SER H H 40 8.280 8.280 7.638 0.642 19947
9952 1 29 . 1 1 41 41 GLN N N 41 120.600 120.600 122.065 -1.465 19947
9953 1 29 . 1 1 41 41 GLN HA H 41 4.110 4.110 4.225 -0.115 19947
9954 1 29 . 1 1 41 41 GLN CA C 41 55.200 55.200 56.554 -1.355 19947
9955 1 29 . 1 1 41 41 GLN CB C 41 31.100 31.100 30.570 0.530 19947
9956 1 29 . 1 1 41 41 GLN H H 41 9.190 9.190 8.087 1.103 19947
9957 1 29 . 1 1 42 42 CYS N N 42 113.200 113.200 115.768 -2.568 19947
9958 1 29 . 1 1 42 42 CYS HA H 42 4.630 4.630 4.577 0.053 19947
9959 1 29 . 1 1 42 42 CYS CA C 42 53.700 53.700 58.231 -4.531 19947
9960 1 29 . 1 1 42 42 CYS CB C 42 45.500 45.500 29.717 15.783 19947
9961 1 29 . 1 1 42 42 CYS H H 42 7.710 7.710 7.273 0.437 19947
9962 1 29 . 1 1 43 43 ASN N N 43 114.200 114.200 121.870 -7.670 19947
9963 1 29 . 1 1 43 43 ASN HA H 43 4.940 4.940 4.800 0.140 19947
9964 1 29 . 1 1 43 43 ASN CA C 43 53.000 53.000 53.851 -0.851 19947
9965 1 29 . 1 1 43 43 ASN CB C 43 39.300 39.300 41.077 -1.777 19947
9966 1 29 . 1 1 43 43 ASN H H 43 8.870 8.870 8.792 0.078 19947
9967 1 29 . 1 1 44 44 TYR N N 44 118.400 118.400 116.921 1.479 19947
9968 1 29 . 1 1 44 44 TYR HA H 44 4.850 4.850 4.858 -0.008 19947
9969 1 29 . 1 1 44 44 TYR CA C 44 55.300 55.300 56.833 -1.533 19947
9970 1 29 . 1 1 44 44 TYR CB C 44 40.700 40.700 40.920 -0.220 19947
9971 1 29 . 1 1 44 44 TYR H H 44 7.840 7.840 7.203 0.637 19947
9972 1 29 . 1 1 45 45 GLY N N 45 110.600 110.600 111.599 -0.999 19947
9973 1 29 . 1 1 45 45 GLY CA C 45 44.000 44.000 44.950 -0.950 19947
9974 1 29 . 1 1 45 45 GLY H H 45 7.960 7.960 8.048 -0.088 19947
9975 1 29 . 1 1 46 46 GLU N N 46 120.700 120.700 119.249 1.451 19947
9976 1 29 . 1 1 46 46 GLU HA H 46 4.280 4.280 4.065 0.215 19947
9977 1 29 . 1 1 46 46 GLU CA C 46 58.500 58.500 59.492 -0.992 19947
9978 1 29 . 1 1 46 46 GLU CB C 46 29.300 29.300 30.146 -0.846 19947
9979 1 29 . 1 1 46 46 GLU H H 46 9.160 9.160 8.638 0.522 19947
9980 1 29 . 1 1 47 47 CYS N N 47 112.400 112.400 116.957 -4.557 19947
9981 1 29 . 1 1 47 47 CYS HA H 47 4.850 4.850 4.780 0.070 19947
9982 1 29 . 1 1 47 47 CYS CA C 47 57.100 57.100 57.864 -0.764 19947
9983 1 29 . 1 1 47 47 CYS CB C 47 41.200 41.200 26.163 15.037 19947
9984 1 29 . 1 1 47 47 CYS H H 47 8.510 8.510 7.516 0.994 19947
9985 1 29 . 1 1 48 48 CYS N N 48 123.200 123.200 119.822 3.378 19947
9986 1 29 . 1 1 48 48 CYS HA H 48 5.160 5.160 5.304 -0.144 19947
9987 1 29 . 1 1 48 48 CYS CA C 48 54.700 54.700 57.876 -3.176 19947
9988 1 29 . 1 1 48 48 CYS CB C 48 45.700 45.700 30.040 15.660 19947
9989 1 29 . 1 1 48 48 CYS H H 48 7.810 7.810 7.789 0.021 19947
9990 1 29 . 1 1 49 49 ASP N N 49 127.400 127.400 123.140 4.260 19947
9991 1 29 . 1 1 49 49 ASP HA H 49 4.890 4.890 4.851 0.039 19947
9992 1 29 . 1 1 49 49 ASP CA C 49 53.500 53.500 54.297 -0.797 19947
9993 1 29 . 1 1 49 49 ASP CB C 49 42.400 42.400 44.351 -1.951 19947
9994 1 29 . 1 1 49 49 ASP H H 49 9.670 9.670 8.932 0.738 19947
9995 1 29 . 1 1 50 50 GLN N N 50 127.000 127.000 124.150 2.850 19947
9996 1 29 . 1 1 50 50 GLN HA H 50 3.940 3.940 3.859 0.081 19947
9997 1 29 . 1 1 50 50 GLN CA C 50 56.800 56.800 56.927 -0.127 19947
9998 1 29 . 1 1 50 50 GLN CB C 50 26.500 26.500 27.218 -0.718 19947
9999 1 29 . 1 1 50 50 GLN H H 50 9.450 9.450 9.076 0.374 19947
10000 1 29 . 1 1 51 51 CYS N N 51 106.100 106.100 110.892 -4.792 19947
10001 1 29 . 1 1 51 51 CYS HA H 51 4.760 4.760 4.229 0.531 19947
10002 1 29 . 1 1 51 51 CYS CB C 51 43.200 43.200 24.852 18.348 19947
10003 1 29 . 1 1 51 51 CYS H H 51 8.700 8.700 8.566 0.134 19947
10004 1 29 . 1 1 52 52 ARG N N 52 121.000 121.000 117.118 3.882 19947
10005 1 29 . 1 1 52 52 ARG HA H 52 4.690 4.690 4.509 0.181 19947
10006 1 29 . 1 1 52 52 ARG CA C 52 55.400 55.400 53.636 1.764 19947
10007 1 29 . 1 1 52 52 ARG CB C 52 33.100 33.100 33.484 -0.384 19947
10008 1 29 . 1 1 52 52 ARG H H 52 7.960 7.960 7.382 0.578 19947
10009 1 29 . 1 1 53 53 PHE N N 53 120.300 120.300 120.814 -0.514 19947
10010 1 29 . 1 1 53 53 PHE HA H 53 5.050 5.050 5.142 -0.092 19947
10011 1 29 . 1 1 53 53 PHE CA C 53 56.100 56.100 56.256 -0.156 19947
10012 1 29 . 1 1 53 53 PHE CB C 53 38.200 38.200 38.977 -0.777 19947
10013 1 29 . 1 1 53 53 PHE H H 53 8.400 8.400 8.364 0.036 19947
10014 1 29 . 1 1 54 54 LYS N N 54 123.300 123.300 125.700 -2.400 19947
10015 1 29 . 1 1 54 54 LYS HA H 54 4.250 4.250 4.111 0.139 19947
10016 1 29 . 1 1 54 54 LYS CA C 54 57.500 57.500 56.696 0.804 19947
10017 1 29 . 1 1 54 54 LYS CB C 54 34.300 34.300 32.746 1.554 19947
10018 1 29 . 1 1 54 54 LYS H H 54 8.540 8.540 8.119 0.421 19947
10019 1 29 . 1 1 55 55 LYS N N 55 119.400 119.400 124.756 -5.356 19947
10020 1 29 . 1 1 55 55 LYS HA H 55 4.110 4.110 4.028 0.082 19947
10021 1 29 . 1 1 55 55 LYS CA C 55 56.500 56.500 56.764 -0.264 19947
10022 1 29 . 1 1 55 55 LYS CB C 55 33.400 33.400 33.084 0.316 19947
10023 1 29 . 1 1 55 55 LYS H H 55 8.440 8.440 8.518 -0.078 19947
10024 1 29 . 1 1 56 56 ALA N N 56 126.700 126.700 128.723 -2.023 19947
10025 1 29 . 1 1 56 56 ALA HA H 56 3.920 3.920 4.033 -0.113 19947
10026 1 29 . 1 1 56 56 ALA CA C 56 52.900 52.900 53.580 -0.680 19947
10027 1 29 . 1 1 56 56 ALA CB C 56 18.100 18.100 18.452 -0.352 19947
10028 1 29 . 1 1 56 56 ALA H H 56 8.930 8.930 8.632 0.298 19947
10029 1 29 . 1 1 57 57 GLY N N 57 109.300 109.300 111.790 -2.490 19947
10030 1 29 . 1 1 57 57 GLY CA C 57 45.100 45.100 44.859 0.241 19947
10031 1 29 . 1 1 57 57 GLY H H 57 8.460 8.460 8.414 0.046 19947
10032 1 29 . 1 1 58 58 THR N N 58 117.200 117.200 119.737 -2.537 19947
10033 1 29 . 1 1 58 58 THR HA H 58 4.260 4.260 4.404 -0.144 19947
10034 1 29 . 1 1 58 58 THR CA C 58 63.300 63.300 63.192 0.108 19947
10035 1 29 . 1 1 58 58 THR CB C 58 69.600 69.600 69.061 0.539 19947
10036 1 29 . 1 1 58 58 THR H H 58 7.660 7.660 7.753 -0.093 19947
10037 1 29 . 1 1 59 59 VAL N N 59 130.400 130.400 127.137 3.263 19947
10038 1 29 . 1 1 59 59 VAL HA H 59 3.900 3.900 3.602 0.298 19947
10039 1 29 . 1 1 59 59 VAL CA C 59 64.400 64.400 62.974 1.426 19947
10040 1 29 . 1 1 59 59 VAL CB C 59 31.900 31.900 31.834 0.066 19947
10041 1 29 . 1 1 59 59 VAL H H 59 9.190 9.190 8.668 0.522 19947
10042 1 29 . 1 1 60 60 CYS N N 60 121.800 121.800 126.093 -4.293 19947
10043 1 29 . 1 1 60 60 CYS HA H 60 5.050 5.050 4.567 0.483 19947
10044 1 29 . 1 1 60 60 CYS CA C 60 54.400 54.400 57.920 -3.520 19947
10045 1 29 . 1 1 60 60 CYS CB C 60 43.000 43.000 27.450 15.550 19947
10046 1 29 . 1 1 60 60 CYS H H 60 9.130 9.130 8.194 0.936 19947
10047 1 29 . 1 1 61 61 ARG N N 61 124.100 124.100 117.200 6.900 19947
10048 1 29 . 1 1 61 61 ARG HA H 61 4.360 4.360 4.650 -0.290 19947
10049 1 29 . 1 1 61 61 ARG CA C 61 56.800 56.800 55.058 1.742 19947
10050 1 29 . 1 1 61 61 ARG CB C 61 32.800 32.800 33.816 -1.016 19947
10051 1 29 . 1 1 61 61 ARG H H 61 7.580 7.580 7.366 0.214 19947
10052 1 29 . 1 1 62 62 ILE N N 62 126.200 126.200 116.260 9.940 19947
10053 1 29 . 1 1 62 62 ILE HA H 62 4.090 4.090 4.490 -0.400 19947
10054 1 29 . 1 1 62 62 ILE CA C 62 60.300 60.300 60.876 -0.576 19947
10055 1 29 . 1 1 62 62 ILE CB C 62 38.700 38.700 41.361 -2.661 19947
10056 1 29 . 1 1 62 62 ILE H H 62 8.490 8.490 8.343 0.147 19947
10057 1 29 . 1 1 63 63 ALA N N 63 129.400 129.400 131.850 -2.450 19947
10058 1 29 . 1 1 63 63 ALA HA H 63 4.310 4.310 4.363 -0.053 19947
10059 1 29 . 1 1 63 63 ALA CA C 63 51.900 51.900 54.286 -2.386 19947
10060 1 29 . 1 1 63 63 ALA CB C 63 20.600 20.600 19.570 1.030 19947
10061 1 29 . 1 1 63 63 ALA H H 63 8.100 8.100 8.674 -0.574 19947
10062 1 29 . 1 1 64 64 ARG N N 64 120.500 120.500 120.925 -0.425 19947
10063 1 29 . 1 1 64 64 ARG HA H 64 4.290 4.290 4.520 -0.230 19947
10064 1 29 . 1 1 64 64 ARG CA C 64 56.200 56.200 55.902 0.298 19947
10065 1 29 . 1 1 64 64 ARG CB C 64 30.500 30.500 30.184 0.316 19947
10066 1 29 . 1 1 64 64 ARG H H 64 8.140 8.140 8.854 -0.714 19947
10067 1 29 . 1 1 65 65 GLY N N 65 110.500 110.500 111.566 -1.066 19947
10068 1 29 . 1 1 65 65 GLY CA C 65 45.100 45.100 44.516 0.584 19947
10069 1 29 . 1 1 65 65 GLY H H 65 8.040 8.040 8.379 -0.339 19947
10070 1 29 . 1 1 66 66 ASP N N 66 120.700 120.700 120.192 0.508 19947
10071 1 29 . 1 1 66 66 ASP HA H 66 4.610 4.610 4.555 0.055 19947
10072 1 29 . 1 1 66 66 ASP CA C 66 53.300 53.300 54.093 -0.792 19947
10073 1 29 . 1 1 66 66 ASP CB C 66 37.600 37.600 40.997 -3.397 19947
10074 1 29 . 1 1 66 66 ASP H H 66 8.380 8.380 7.144 1.236 19947
10075 1 29 . 1 1 67 67 TRP N N 67 120.100 120.100 124.057 -3.957 19947
10076 1 29 . 1 1 67 67 TRP HA H 67 4.760 4.760 5.063 -0.303 19947
10077 1 29 . 1 1 67 67 TRP CA C 67 57.200 57.200 58.111 -0.911 19947
10078 1 29 . 1 1 67 67 TRP CB C 67 29.100 29.100 29.426 -0.326 19947
10079 1 29 . 1 1 67 67 TRP H H 67 7.950 7.950 8.005 -0.055 19947
10080 1 29 . 1 1 68 68 ASN N N 68 118.400 118.400 118.163 0.237 19947
10081 1 29 . 1 1 68 68 ASN HA H 68 4.790 4.790 4.927 -0.137 19947
10082 1 29 . 1 1 68 68 ASN CA C 68 52.800 52.800 53.875 -1.075 19947
10083 1 29 . 1 1 68 68 ASN CB C 68 39.300 39.300 39.994 -0.694 19947
10084 1 29 . 1 1 68 68 ASN H H 68 8.180 8.180 8.632 -0.452 19947
10085 1 29 . 1 1 69 69 ASP N N 69 118.500 118.500 118.502 -0.002 19947
10086 1 29 . 1 1 69 69 ASP HA H 69 4.620 4.620 4.408 0.212 19947
10087 1 29 . 1 1 69 69 ASP CA C 69 53.200 53.200 56.275 -3.075 19947
10088 1 29 . 1 1 69 69 ASP CB C 69 38.000 38.000 41.171 -3.171 19947
10089 1 29 . 1 1 69 69 ASP H H 69 8.130 8.130 8.497 -0.367 19947
10090 1 29 . 1 1 70 70 ASP N N 70 120.500 120.500 121.155 -0.655 19947
10091 1 29 . 1 1 70 70 ASP HA H 70 5.100 5.100 4.990 0.110 19947
10092 1 29 . 1 1 70 70 ASP CA C 70 52.500 52.500 53.526 -1.026 19947
10093 1 29 . 1 1 70 70 ASP CB C 70 42.600 42.600 42.159 0.441 19947
10094 1 29 . 1 1 70 70 ASP H H 70 8.140 8.140 8.143 -0.003 19947
10095 1 29 . 1 1 71 71 TYR N N 71 118.900 118.900 124.086 -5.186 19947
10096 1 29 . 1 1 71 71 TYR HA H 71 5.210 5.210 4.866 0.344 19947
10097 1 29 . 1 1 71 71 TYR CA C 71 56.300 56.300 57.133 -0.833 19947
10098 1 29 . 1 1 71 71 TYR CB C 71 42.200 42.200 42.828 -0.628 19947
10099 1 29 . 1 1 71 71 TYR H H 71 8.450 8.450 8.200 0.250 19947
10100 1 29 . 1 1 72 72 CYS N N 72 119.800 119.800 121.626 -1.826 19947
10101 1 29 . 1 1 72 72 CYS HA H 72 4.900 4.900 4.393 0.507 19947
10102 1 29 . 1 1 72 72 CYS CA C 72 53.400 53.400 59.757 -6.357 19947
10103 1 29 . 1 1 72 72 CYS CB C 72 37.200 37.200 28.891 8.309 19947
10104 1 29 . 1 1 72 72 CYS H H 72 9.330 9.330 8.584 0.746 19947
10105 1 29 . 1 1 73 73 THR N N 73 112.700 112.700 114.723 -2.023 19947
10106 1 29 . 1 1 73 73 THR HA H 73 4.430 4.430 4.400 0.030 19947
10107 1 29 . 1 1 73 73 THR CA C 73 62.300 62.300 61.005 1.295 19947
10108 1 29 . 1 1 73 73 THR CB C 73 71.300 71.300 69.337 1.963 19947
10109 1 29 . 1 1 73 73 THR H H 73 9.980 9.980 8.742 1.238 19947
10110 1 29 . 1 1 74 74 GLY N N 74 111.500 111.500 111.555 -0.055 19947
10111 1 29 . 1 1 74 74 GLY CA C 74 45.300 45.300 46.672 -1.372 19947
10112 1 29 . 1 1 74 74 GLY H H 74 8.580 8.580 7.707 0.873 19947
10113 1 29 . 1 1 75 75 LYS N N 75 115.900 115.900 117.806 -1.906 19947
10114 1 29 . 1 1 75 75 LYS HA H 75 4.140 4.140 4.594 -0.454 19947
10115 1 29 . 1 1 75 75 LYS CA C 75 54.800 54.800 55.679 -0.880 19947
10116 1 29 . 1 1 75 75 LYS CB C 75 34.200 34.200 34.030 0.170 19947
10117 1 29 . 1 1 75 75 LYS H H 75 7.900 7.900 7.503 0.397 19947
10118 1 29 . 1 1 76 76 SER N N 76 111.000 111.000 111.210 -0.210 19947
10119 1 29 . 1 1 76 76 SER HA H 76 4.160 4.160 3.812 0.348 19947
10120 1 29 . 1 1 76 76 SER CA C 76 61.400 61.400 56.226 5.174 19947
10121 1 29 . 1 1 76 76 SER CB C 76 64.300 64.300 65.247 -0.947 19947
10122 1 29 . 1 1 76 76 SER H H 76 6.520 6.520 6.871 -0.351 19947
10123 1 29 . 1 1 77 77 SER N N 77 117.100 117.100 114.081 3.019 19947
10124 1 29 . 1 1 77 77 SER HA H 77 4.220 4.220 4.431 -0.211 19947
10125 1 29 . 1 1 77 77 SER CA C 77 59.800 59.800 58.627 1.173 19947
10126 1 29 . 1 1 77 77 SER CB C 77 64.400 64.400 63.807 0.593 19947
10127 1 29 . 1 1 77 77 SER H H 77 9.030 9.030 8.243 0.787 19947
10128 1 29 . 1 1 78 78 ASP N N 78 122.100 122.100 122.148 -0.048 19947
10129 1 29 . 1 1 78 78 ASP HA H 78 4.930 4.930 4.699 0.231 19947
10130 1 29 . 1 1 78 78 ASP CA C 78 52.400 52.400 53.748 -1.347 19947
10131 1 29 . 1 1 78 78 ASP CB C 78 40.800 40.800 43.836 -3.036 19947
10132 1 29 . 1 1 78 78 ASP H H 78 8.340 8.340 7.272 1.068 19947
10133 1 29 . 1 1 79 79 CYS N N 79 122.200 122.200 121.640 0.560 19947
10134 1 29 . 1 1 79 79 CYS HA H 79 5.320 5.320 4.847 0.473 19947
10135 1 29 . 1 1 79 79 CYS CA C 79 52.000 52.000 55.629 -3.629 19947
10136 1 29 . 1 1 79 79 CYS CB C 79 39.300 39.300 27.767 11.533 19947
10137 1 29 . 1 1 79 79 CYS H H 79 8.960 8.960 8.138 0.822 19947
10138 1 29 . 1 1 80 80 PRO HA H 80 4.410 4.410 4.090 0.320 19947
10139 1 29 . 1 1 80 80 PRO CA C 80 63.500 63.500 62.910 0.590 19947
10140 1 29 . 1 1 80 80 PRO CB C 80 32.400 32.400 32.782 -0.382 19947
10141 1 29 . 1 1 81 81 TRP N N 81 120.500 120.500 121.370 -0.870 19947
10142 1 29 . 1 1 81 81 TRP HA H 81 4.550 4.550 4.239 0.311 19947
10143 1 29 . 1 1 81 81 TRP CA C 81 56.400 56.400 58.048 -1.648 19947
10144 1 29 . 1 1 81 81 TRP CB C 81 29.500 29.500 28.554 0.946 19947
10145 1 29 . 1 1 81 81 TRP H H 81 8.400 8.400 7.557 0.843 19947
10146 1 29 . 1 1 82 82 ASN N N 82 120.400 120.400 114.589 5.811 19947
10147 1 29 . 1 1 82 82 ASN HA H 82 4.750 4.750 4.501 0.249 19947
10148 1 29 . 1 1 82 82 ASN CA C 82 53.100 53.100 53.594 -0.494 19947
10149 1 29 . 1 1 82 82 ASN CB C 82 39.000 39.000 37.090 1.910 19947
10150 1 29 . 1 1 82 82 ASN H H 82 8.040 8.040 8.241 -0.201 19947
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 65 4.098 -0.034 4.129 19947
2 1 1 "Average Difference" HA 89 0.315 -0.149 0.279 19947
3 1 1 "Average Difference" C 0 0.000 0.000 0.000 19947
4 1 1 "Average Difference" CA 72 1.964 0.885 1.765 19947
5 1 1 "Average Difference" CB 65 5.204 -1.546 5.008 19947
6 1 1 "Average Difference" HN 75 0.534 -0.195 0.500 19947
7 1 2 "Average Difference" N 65 4.167 0.007 4.199 19947
8 1 2 "Average Difference" HA 89 0.317 -0.111 0.299 19947
9 1 2 "Average Difference" C 0 0.000 0.000 0.000 19947
10 1 2 "Average Difference" CA 72 2.113 0.874 1.937 19947
11 1 2 "Average Difference" CB 65 5.286 -1.510 5.106 19947
12 1 2 "Average Difference" HN 75 0.482 -0.149 0.462 19947
13 1 3 "Average Difference" N 65 3.799 -0.187 3.823 19947
14 1 3 "Average Difference" HA 89 0.324 -0.122 0.302 19947
15 1 3 "Average Difference" C 0 0.000 0.000 0.000 19947
16 1 3 "Average Difference" CA 72 2.100 0.891 1.915 19947
17 1 3 "Average Difference" CB 65 5.201 -1.417 5.043 19947
18 1 3 "Average Difference" HN 75 0.494 -0.155 0.472 19947
19 1 4 "Average Difference" N 65 4.501 0.042 4.535 19947
20 1 4 "Average Difference" HA 89 0.325 -0.130 0.300 19947
21 1 4 "Average Difference" C 0 0.000 0.000 0.000 19947
22 1 4 "Average Difference" CA 72 1.963 0.832 1.790 19947
23 1 4 "Average Difference" CB 65 5.331 -1.477 5.162 19947
24 1 4 "Average Difference" HN 75 0.561 -0.243 0.509 19947
25 1 5 "Average Difference" N 65 4.074 0.115 4.104 19947
26 1 5 "Average Difference" HA 89 0.311 -0.102 0.295 19947
27 1 5 "Average Difference" C 0 0.000 0.000 0.000 19947
28 1 5 "Average Difference" CA 72 2.068 0.858 1.895 19947
29 1 5 "Average Difference" CB 65 5.259 -1.445 5.097 19947
30 1 5 "Average Difference" HN 75 0.475 -0.183 0.441 19947
31 1 6 "Average Difference" N 65 4.313 -0.219 4.341 19947
32 1 6 "Average Difference" HA 89 0.315 -0.121 0.293 19947
33 1 6 "Average Difference" C 0 0.000 0.000 0.000 19947
34 1 6 "Average Difference" CA 72 2.009 0.882 1.818 19947
35 1 6 "Average Difference" CB 65 5.184 -1.424 5.023 19947
36 1 6 "Average Difference" HN 75 0.510 -0.201 0.472 19947
37 1 7 "Average Difference" N 65 4.101 0.192 4.129 19947
38 1 7 "Average Difference" HA 89 0.323 -0.129 0.298 19947
39 1 7 "Average Difference" C 0 0.000 0.000 0.000 19947
40 1 7 "Average Difference" CA 72 2.039 0.894 1.846 19947
41 1 7 "Average Difference" CB 65 5.265 -1.519 5.081 19947
42 1 7 "Average Difference" HN 75 0.506 -0.177 0.477 19947
43 1 8 "Average Difference" N 65 4.347 0.213 4.376 19947
44 1 8 "Average Difference" HA 89 0.305 -0.134 0.276 19947
45 1 8 "Average Difference" C 0 0.000 0.000 0.000 19947
46 1 8 "Average Difference" CA 72 2.047 0.872 1.865 19947
47 1 8 "Average Difference" CB 65 5.234 -1.413 5.079 19947
48 1 8 "Average Difference" HN 75 0.524 -0.201 0.487 19947
49 1 9 "Average Difference" N 65 4.131 0.041 4.163 19947
50 1 9 "Average Difference" HA 89 0.322 -0.140 0.292 19947
51 1 9 "Average Difference" C 0 0.000 0.000 0.000 19947
52 1 9 "Average Difference" CA 72 2.017 0.923 1.806 19947
53 1 9 "Average Difference" CB 65 5.223 -1.476 5.049 19947
54 1 9 "Average Difference" HN 75 0.531 -0.196 0.497 19947
55 1 10 "Average Difference" N 65 4.389 0.169 4.420 19947
56 1 10 "Average Difference" HA 89 0.301 -0.131 0.273 19947
57 1 10 "Average Difference" C 0 0.000 0.000 0.000 19947
58 1 10 "Average Difference" CA 72 2.053 0.867 1.875 19947
59 1 10 "Average Difference" CB 65 5.202 -1.478 5.027 19947
60 1 10 "Average Difference" HN 75 0.530 -0.207 0.491 19947
61 1 11 "Average Difference" N 65 4.231 -0.126 4.262 19947
62 1 11 "Average Difference" HA 89 0.315 -0.125 0.291 19947
63 1 11 "Average Difference" C 0 0.000 0.000 0.000 19947
64 1 11 "Average Difference" CA 72 2.077 0.938 1.866 19947
65 1 11 "Average Difference" CB 65 5.221 -1.466 5.050 19947
66 1 11 "Average Difference" HN 75 0.484 -0.171 0.456 19947
67 1 12 "Average Difference" N 65 3.958 -0.080 3.988 19947
68 1 12 "Average Difference" HA 89 0.325 -0.115 0.306 19947
69 1 12 "Average Difference" C 0 0.000 0.000 0.000 19947
70 1 12 "Average Difference" CA 72 2.032 0.849 1.860 19947
71 1 12 "Average Difference" CB 65 5.272 -1.483 5.098 19947
72 1 12 "Average Difference" HN 75 0.491 -0.157 0.468 19947
73 1 13 "Average Difference" N 65 4.105 0.058 4.136 19947
74 1 13 "Average Difference" HA 89 0.321 -0.140 0.291 19947
75 1 13 "Average Difference" C 0 0.000 0.000 0.000 19947
76 1 13 "Average Difference" CA 72 1.857 0.879 1.647 19947
77 1 13 "Average Difference" CB 65 5.515 -1.530 5.340 19947
78 1 13 "Average Difference" HN 75 0.498 -0.174 0.470 19947
79 1 14 "Average Difference" N 65 4.272 -0.084 4.304 19947
80 1 14 "Average Difference" HA 89 0.312 -0.105 0.296 19947
81 1 14 "Average Difference" C 0 0.000 0.000 0.000 19947
82 1 14 "Average Difference" CA 72 2.066 0.821 1.909 19947
83 1 14 "Average Difference" CB 65 5.234 -1.347 5.097 19947
84 1 14 "Average Difference" HN 75 0.488 -0.153 0.466 19947
85 1 15 "Average Difference" N 65 4.240 -0.031 4.272 19947
86 1 15 "Average Difference" HA 89 0.313 -0.111 0.294 19947
87 1 15 "Average Difference" C 0 0.000 0.000 0.000 19947
88 1 15 "Average Difference" CA 72 1.967 0.966 1.726 19947
89 1 15 "Average Difference" CB 65 5.126 -1.431 4.960 19947
90 1 15 "Average Difference" HN 75 0.501 -0.168 0.475 19947
91 1 16 "Average Difference" N 65 4.474 0.034 4.509 19947
92 1 16 "Average Difference" HA 89 0.311 -0.113 0.292 19947
93 1 16 "Average Difference" C 0 0.000 0.000 0.000 19947
94 1 16 "Average Difference" CA 72 2.005 0.874 1.817 19947
95 1 16 "Average Difference" CB 65 5.256 -1.424 5.099 19947
96 1 16 "Average Difference" HN 75 0.519 -0.198 0.483 19947
97 1 17 "Average Difference" N 65 4.208 0.125 4.239 19947
98 1 17 "Average Difference" HA 89 0.310 -0.089 0.299 19947
99 1 17 "Average Difference" C 0 0.000 0.000 0.000 19947
100 1 17 "Average Difference" CA 72 1.987 0.859 1.804 19947
101 1 17 "Average Difference" CB 65 5.092 -1.330 4.954 19947
102 1 17 "Average Difference" HN 75 0.505 -0.224 0.456 19947
103 1 18 "Average Difference" N 65 4.203 -0.052 4.235 19947
104 1 18 "Average Difference" HA 89 0.322 -0.112 0.304 19947
105 1 18 "Average Difference" C 0 0.000 0.000 0.000 19947
106 1 18 "Average Difference" CA 72 1.949 0.731 1.820 19947
107 1 18 "Average Difference" CB 65 5.395 -1.451 5.236 19947
108 1 18 "Average Difference" HN 75 0.514 -0.202 0.476 19947
109 1 19 "Average Difference" N 65 4.126 0.035 4.158 19947
110 1 19 "Average Difference" HA 89 0.330 -0.102 0.316 19947
111 1 19 "Average Difference" C 0 0.000 0.000 0.000 19947
112 1 19 "Average Difference" CA 72 1.993 0.820 1.829 19947
113 1 19 "Average Difference" CB 65 5.251 -1.364 5.110 19947
114 1 19 "Average Difference" HN 75 0.484 -0.188 0.449 19947
115 1 20 "Average Difference" N 65 4.206 0.163 4.235 19947
116 1 20 "Average Difference" HA 89 0.318 -0.103 0.302 19947
117 1 20 "Average Difference" C 0 0.000 0.000 0.000 19947
118 1 20 "Average Difference" CA 72 1.944 0.854 1.759 19947
119 1 20 "Average Difference" CB 65 5.285 -1.349 5.150 19947
120 1 20 "Average Difference" HN 75 0.489 -0.188 0.455 19947
121 1 21 "Average Difference" N 65 4.114 0.112 4.145 19947
122 1 21 "Average Difference" HA 89 0.338 -0.122 0.317 19947
123 1 21 "Average Difference" C 0 0.000 0.000 0.000 19947
124 1 21 "Average Difference" CA 72 1.870 0.771 1.716 19947
125 1 21 "Average Difference" CB 65 5.083 -1.302 4.951 19947
126 1 21 "Average Difference" HN 75 0.490 -0.192 0.453 19947
127 1 22 "Average Difference" N 65 3.912 0.339 3.928 19947
128 1 22 "Average Difference" HA 89 0.317 -0.122 0.295 19947
129 1 22 "Average Difference" C 0 0.000 0.000 0.000 19947
130 1 22 "Average Difference" CA 72 2.147 0.795 2.008 19947
131 1 22 "Average Difference" CB 65 5.307 -1.482 5.135 19947
132 1 22 "Average Difference" HN 75 0.471 -0.196 0.431 19947
133 1 23 "Average Difference" N 65 4.092 0.358 4.108 19947
134 1 23 "Average Difference" HA 89 0.337 -0.152 0.303 19947
135 1 23 "Average Difference" C 0 0.000 0.000 0.000 19947
136 1 23 "Average Difference" CA 72 2.023 0.977 1.784 19947
137 1 23 "Average Difference" CB 65 5.468 -1.459 5.311 19947
138 1 23 "Average Difference" HN 75 0.564 -0.221 0.523 19947
139 1 24 "Average Difference" N 65 4.113 0.013 4.145 19947
140 1 24 "Average Difference" HA 89 0.346 -0.152 0.313 19947
141 1 24 "Average Difference" C 0 0.000 0.000 0.000 19947
142 1 24 "Average Difference" CA 72 1.936 0.774 1.788 19947
143 1 24 "Average Difference" CB 65 5.465 -1.528 5.288 19947
144 1 24 "Average Difference" HN 75 0.532 -0.212 0.491 19947
145 1 25 "Average Difference" N 65 4.248 0.240 4.274 19947
146 1 25 "Average Difference" HA 89 0.319 -0.126 0.295 19947
147 1 25 "Average Difference" C 0 0.000 0.000 0.000 19947
148 1 25 "Average Difference" CA 72 1.966 0.846 1.787 19947
149 1 25 "Average Difference" CB 65 5.332 -1.405 5.184 19947
150 1 25 "Average Difference" HN 75 0.552 -0.254 0.493 19947
151 1 26 "Average Difference" N 65 4.291 0.015 4.324 19947
152 1 26 "Average Difference" HA 89 0.330 -0.111 0.313 19947
153 1 26 "Average Difference" C 0 0.000 0.000 0.000 19947
154 1 26 "Average Difference" CA 72 1.927 0.774 1.778 19947
155 1 26 "Average Difference" CB 65 5.377 -1.501 5.203 19947
156 1 26 "Average Difference" HN 75 0.506 -0.215 0.461 19947
157 1 27 "Average Difference" N 65 4.220 0.219 4.248 19947
158 1 27 "Average Difference" HA 89 0.325 -0.156 0.287 19947
159 1 27 "Average Difference" C 0 0.000 0.000 0.000 19947
160 1 27 "Average Difference" CA 72 1.952 0.759 1.811 19947
161 1 27 "Average Difference" CB 65 5.425 -1.624 5.217 19947
162 1 27 "Average Difference" HN 75 0.513 -0.216 0.468 19947
163 1 28 "Average Difference" N 65 3.946 0.316 3.964 19947
164 1 28 "Average Difference" HA 89 0.324 -0.143 0.293 19947
165 1 28 "Average Difference" C 0 0.000 0.000 0.000 19947
166 1 28 "Average Difference" CA 72 2.090 0.883 1.908 19947
167 1 28 "Average Difference" CB 65 5.458 -1.535 5.278 19947
168 1 28 "Average Difference" HN 75 0.537 -0.209 0.498 19947
169 1 29 "Average Difference" N 65 4.238 -0.131 4.269 19947
170 1 29 "Average Difference" HA 89 0.320 -0.126 0.296 19947
171 1 29 "Average Difference" C 0 0.000 0.000 0.000 19947
172 1 29 "Average Difference" CA 72 1.947 0.755 1.807 19947
173 1 29 "Average Difference" CB 65 5.364 -1.445 5.206 19947
174 1 29 "Average Difference" HN 75 0.511 -0.233 0.458 19947
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 19947
_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 PRO HA H 2 4.820 4.820 4.687 0.133 19947
2 1 . 1 1 2 2 PRO CA C 2 61.900 61.900 62.141 -0.241 19947
3 1 . 1 1 2 2 PRO CB C 2 30.700 30.700 31.706 -1.006 19947
4 1 . 1 1 3 3 PRO HA H 3 4.540 4.540 4.454 0.086 19947
5 1 . 1 1 3 3 PRO CA C 3 62.900 62.900 62.600 0.300 19947
6 1 . 1 1 3 3 PRO CB C 3 32.100 32.100 32.544 -0.444 19947
7 1 . 1 1 4 4 VAL N N 4 121.900 121.900 123.371 -1.471 19947
8 1 . 1 1 4 4 VAL HA H 4 4.200 4.200 4.251 -0.051 19947
9 1 . 1 1 4 4 VAL CA C 4 62.300 62.300 61.819 0.480 19947
10 1 . 1 1 4 4 VAL CB C 4 32.800 32.800 31.482 1.318 19947
11 1 . 1 1 4 4 VAL H H 4 8.330 8.330 8.298 0.032 19947
12 1 . 1 1 5 5 CYS N N 5 120.900 120.900 127.002 -6.102 19947
13 1 . 1 1 5 5 CYS HA H 5 4.700 4.700 4.453 0.247 19947
14 1 . 1 1 5 5 CYS CA C 5 53.600 53.600 58.835 -5.235 19947
15 1 . 1 1 5 5 CYS H H 5 8.500 8.500 8.608 -0.108 19947
16 1 . 1 1 6 6 GLY N N 6 110.200 110.200 113.997 -3.797 19947
17 1 . 1 1 6 6 GLY CA C 6 46.300 46.300 44.888 1.412 19947
18 1 . 1 1 6 6 GLY H H 6 8.490 8.490 8.423 0.067 19947
19 1 . 1 1 7 7 ASN N N 7 120.100 120.100 116.695 3.405 19947
20 1 . 1 1 7 7 ASN HA H 7 4.730 4.730 4.332 0.398 19947
21 1 . 1 1 7 7 ASN CA C 7 53.200 53.200 54.065 -0.865 19947
22 1 . 1 1 7 7 ASN CB C 7 38.700 38.700 39.099 -0.399 19947
23 1 . 1 1 7 7 ASN H H 7 8.320 8.320 8.234 0.086 19947
24 1 . 1 1 8 8 LYS N N 8 121.300 121.300 122.884 -1.584 19947
25 1 . 1 1 8 8 LYS HA H 8 4.340 4.340 4.208 0.132 19947
26 1 . 1 1 8 8 LYS CA C 8 56.600 56.600 56.740 -0.140 19947
27 1 . 1 1 8 8 LYS CB C 8 32.900 32.900 31.603 1.297 19947
28 1 . 1 1 8 8 LYS H H 8 8.260 8.260 8.408 -0.148 19947
29 1 . 1 1 9 9 ILE N N 9 136.600 136.600 122.325 14.275 19947
30 1 . 1 1 9 9 ILE HA H 9 4.140 4.140 3.928 0.212 19947
31 1 . 1 1 9 9 ILE CA C 9 61.300 61.300 62.279 -0.979 19947
32 1 . 1 1 9 9 ILE CB C 9 38.200 38.200 37.878 0.322 19947
33 1 . 1 1 9 9 ILE H H 9 8.150 8.150 8.073 0.077 19947
34 1 . 1 1 10 10 LEU N N 10 125.700 125.700 121.774 3.926 19947
35 1 . 1 1 10 10 LEU HA H 10 4.420 4.420 4.481 -0.061 19947
36 1 . 1 1 10 10 LEU CA C 10 55.200 55.200 55.353 -0.153 19947
37 1 . 1 1 10 10 LEU CB C 10 42.300 42.300 40.902 1.398 19947
38 1 . 1 1 10 10 LEU H H 10 8.230 8.230 8.412 -0.182 19947
39 1 . 1 1 11 11 GLU N N 11 120.600 120.600 114.426 6.174 19947
40 1 . 1 1 11 11 GLU HA H 11 4.470 4.470 4.141 0.329 19947
41 1 . 1 1 11 11 GLU CA C 11 55.500 55.500 56.462 -0.962 19947
42 1 . 1 1 11 11 GLU CB C 11 28.900 28.900 28.564 0.336 19947
43 1 . 1 1 11 11 GLU H H 11 8.250 8.250 7.967 0.283 19947
44 1 . 1 1 12 12 GLN N N 12 121.600 121.600 118.358 3.242 19947
45 1 . 1 1 12 12 GLN HA H 12 4.350 4.350 4.589 -0.239 19947
46 1 . 1 1 12 12 GLN CA C 12 56.600 56.600 55.664 0.936 19947
47 1 . 1 1 12 12 GLN CB C 12 29.200 29.200 29.478 -0.278 19947
48 1 . 1 1 12 12 GLN H H 12 8.460 8.460 7.819 0.641 19947
49 1 . 1 1 13 13 GLY N N 13 110.700 110.700 108.341 2.359 19947
50 1 . 1 1 13 13 GLY CA C 13 45.700 45.700 46.082 -0.382 19947
51 1 . 1 1 13 13 GLY H H 13 8.660 8.660 8.643 0.017 19947
52 1 . 1 1 14 14 GLU N N 14 118.900 118.900 115.361 3.539 19947
53 1 . 1 1 14 14 GLU HA H 14 4.530 4.530 4.242 0.288 19947
54 1 . 1 1 14 14 GLU CA C 14 55.600 55.600 56.769 -1.169 19947
55 1 . 1 1 14 14 GLU CB C 14 29.700 29.700 29.660 0.040 19947
56 1 . 1 1 14 14 GLU H H 14 8.230 8.230 8.161 0.069 19947
57 1 . 1 1 15 15 ASP N N 15 118.400 118.400 120.319 -1.919 19947
58 1 . 1 1 15 15 ASP HA H 15 4.990 4.990 4.560 0.430 19947
59 1 . 1 1 15 15 ASP CA C 15 53.500 53.500 56.622 -3.122 19947
60 1 . 1 1 15 15 ASP CB C 15 39.700 39.700 41.899 -2.199 19947
61 1 . 1 1 15 15 ASP H H 15 8.330 8.330 8.308 0.022 19947
62 1 . 1 1 16 16 CYS HA H 16 4.340 4.340 4.475 -0.135 19947
63 1 . 1 1 16 16 CYS H H 16 8.510 8.510 7.893 0.617 19947
64 1 . 1 1 17 17 ASP N N 17 116.700 116.700 122.881 -6.181 19947
65 1 . 1 1 17 17 ASP HA H 17 4.740 4.740 4.359 0.381 19947
66 1 . 1 1 17 17 ASP CA C 17 53.100 53.100 55.388 -2.288 19947
67 1 . 1 1 17 17 ASP CB C 17 38.600 38.600 39.594 -0.994 19947
68 1 . 1 1 17 17 ASP H H 17 8.180 8.180 8.696 -0.516 19947
69 1 . 1 1 18 18 CYS HA H 18 4.730 4.730 4.058 0.672 19947
70 1 . 1 1 18 18 CYS CB C 18 41.900 41.900 27.149 14.751 19947
71 1 . 1 1 19 19 GLY H H 19 8.220 8.220 8.553 -0.333 19947
72 1 . 1 1 20 20 SER HA H 20 4.920 4.920 4.496 0.424 19947
73 1 . 1 1 20 20 SER CA C 20 55.700 55.700 56.912 -1.212 19947
74 1 . 1 1 20 20 SER CB C 20 63.500 63.500 63.030 0.470 19947
75 1 . 1 1 20 20 SER H H 20 7.830 7.830 8.328 -0.498 19947
76 1 . 1 1 21 21 PRO HA H 21 4.240 4.240 4.193 0.047 19947
77 1 . 1 1 21 21 PRO CA C 21 63.400 63.400 65.035 -1.635 19947
78 1 . 1 1 21 21 PRO CB C 21 31.800 31.800 31.447 0.353 19947
79 1 . 1 1 22 22 ALA N N 22 119.900 119.900 118.043 1.857 19947
80 1 . 1 1 22 22 ALA HA H 22 4.220 4.220 4.086 0.134 19947
81 1 . 1 1 22 22 ALA CA C 22 54.200 54.200 54.018 0.182 19947
82 1 . 1 1 22 22 ALA CB C 22 18.500 18.500 18.628 -0.128 19947
83 1 . 1 1 22 22 ALA H H 22 8.180 8.180 8.301 -0.121 19947
84 1 . 1 1 23 23 ASN N N 23 116.300 116.300 112.570 3.730 19947
85 1 . 1 1 23 23 ASN HA H 23 4.670 4.670 4.914 -0.244 19947
86 1 . 1 1 23 23 ASN CA C 23 53.200 53.200 52.765 0.435 19947
87 1 . 1 1 23 23 ASN CB C 23 39.300 39.300 40.363 -1.063 19947
88 1 . 1 1 23 23 ASN H H 23 7.960 7.960 8.124 -0.164 19947
89 1 . 1 1 24 24 CYS HA H 24 4.720 4.720 4.258 0.462 19947
90 1 . 1 1 24 24 CYS H H 24 8.510 8.510 7.779 0.731 19947
91 1 . 1 1 25 25 GLN HA H 25 4.460 4.460 4.045 0.415 19947
92 1 . 1 1 25 25 GLN H H 25 8.320 8.320 8.523 -0.203 19947
93 1 . 1 1 26 26 ASP HA H 26 4.740 4.740 4.654 0.086 19947
94 1 . 1 1 26 26 ASP H H 26 8.580 8.580 8.224 0.356 19947
95 1 . 1 1 27 27 ARG HA H 27 4.680 4.680 4.262 0.418 19947
96 1 . 1 1 27 27 ARG CA C 27 54.700 54.700 57.478 -2.778 19947
97 1 . 1 1 27 27 ARG H H 27 8.550 8.550 8.261 0.289 19947
98 1 . 1 1 28 28 CYS HA H 28 4.120 4.120 4.703 -0.583 19947
99 1 . 1 1 28 28 CYS CA C 28 54.400 54.400 58.050 -3.650 19947
100 1 . 1 1 28 28 CYS CB C 28 19.000 19.000 26.219 -7.219 19947
101 1 . 1 1 28 28 CYS H H 28 8.910 8.910 8.386 0.524 19947
102 1 . 1 1 29 29 CYS N N 29 113.300 113.300 119.673 -6.373 19947
103 1 . 1 1 29 29 CYS HA H 29 5.010 5.010 4.702 0.308 19947
104 1 . 1 1 29 29 CYS CA C 29 54.300 54.300 57.407 -3.107 19947
105 1 . 1 1 29 29 CYS H H 29 7.730 7.730 7.855 -0.125 19947
106 1 . 1 1 30 30 ASN HA H 30 4.730 4.730 4.995 -0.265 19947
107 1 . 1 1 30 30 ASN CB C 30 38.700 38.700 40.024 -1.324 19947
108 1 . 1 1 30 30 ASN H H 30 8.870 8.870 8.720 0.150 19947
109 1 . 1 1 31 31 ALA N N 31 129.400 129.400 126.653 2.747 19947
110 1 . 1 1 31 31 ALA HA H 31 4.120 4.120 4.317 -0.197 19947
111 1 . 1 1 31 31 ALA CA C 31 54.400 54.400 54.426 -0.026 19947
112 1 . 1 1 31 31 ALA CB C 31 19.000 19.000 19.146 -0.146 19947
113 1 . 1 1 31 31 ALA H H 31 8.890 8.890 8.542 0.348 19947
114 1 . 1 1 32 32 ALA N N 32 116.400 116.400 118.320 -1.920 19947
115 1 . 1 1 32 32 ALA HA H 32 4.340 4.340 4.316 0.024 19947
116 1 . 1 1 32 32 ALA CA C 32 53.800 53.800 53.534 0.265 19947
117 1 . 1 1 32 32 ALA CB C 32 19.100 19.100 18.941 0.159 19947
118 1 . 1 1 32 32 ALA H H 32 8.250 8.250 8.166 0.084 19947
119 1 . 1 1 33 33 THR N N 33 104.300 104.300 110.214 -5.914 19947
120 1 . 1 1 33 33 THR HA H 33 4.430 4.430 4.387 0.043 19947
121 1 . 1 1 33 33 THR CA C 33 60.500 60.500 60.949 -0.449 19947
122 1 . 1 1 33 33 THR CB C 33 70.600 70.600 69.554 1.046 19947
123 1 . 1 1 33 33 THR H H 33 7.320 7.320 7.474 -0.154 19947
124 1 . 1 1 34 34 CYS N N 34 123.400 123.400 120.926 2.474 19947
125 1 . 1 1 34 34 CYS HA H 34 4.170 4.170 4.243 -0.073 19947
126 1 . 1 1 34 34 CYS CA C 34 56.500 56.500 60.085 -3.585 19947
127 1 . 1 1 34 34 CYS H H 34 8.710 8.710 8.175 0.535 19947
128 1 . 1 1 35 35 LYS N N 35 116.900 116.900 117.737 -0.837 19947
129 1 . 1 1 35 35 LYS HA H 35 4.960 4.960 4.759 0.201 19947
130 1 . 1 1 35 35 LYS CA C 35 53.900 53.900 55.333 -1.433 19947
131 1 . 1 1 35 35 LYS CB C 35 35.900 35.900 35.928 -0.028 19947
132 1 . 1 1 35 35 LYS H H 35 7.450 7.450 7.742 -0.292 19947
133 1 . 1 1 36 36 LEU N N 36 119.300 119.300 119.395 -0.095 19947
134 1 . 1 1 36 36 LEU HA H 36 4.800 4.800 4.569 0.231 19947
135 1 . 1 1 36 36 LEU CB C 36 42.400 42.400 42.298 0.102 19947
136 1 . 1 1 36 36 LEU H H 36 8.290 8.290 8.423 -0.133 19947
137 1 . 1 1 37 37 THR HA H 37 4.340 4.340 4.650 -0.310 19947
138 1 . 1 1 37 37 THR CA C 37 60.200 60.200 59.746 0.454 19947
139 1 . 1 1 37 37 THR CB C 37 67.700 67.700 68.640 -0.941 19947
140 1 . 1 1 37 37 THR H H 37 8.380 8.380 8.075 0.305 19947
141 1 . 1 1 38 38 PRO HA H 38 4.380 4.380 4.186 0.194 19947
142 1 . 1 1 38 38 PRO CA C 38 64.800 64.800 64.374 0.427 19947
143 1 . 1 1 38 38 PRO CB C 38 31.500 31.500 31.636 -0.136 19947
144 1 . 1 1 39 39 GLY N N 39 113.300 113.300 111.551 1.749 19947
145 1 . 1 1 39 39 GLY CA C 39 45.100 45.100 44.981 0.119 19947
146 1 . 1 1 39 39 GLY H H 39 8.830 8.830 8.497 0.333 19947
147 1 . 1 1 40 40 SER N N 40 116.700 116.700 117.413 -0.713 19947
148 1 . 1 1 40 40 SER HA H 40 4.610 4.610 4.626 -0.016 19947
149 1 . 1 1 40 40 SER CA C 40 58.800 58.800 58.112 0.688 19947
150 1 . 1 1 40 40 SER CB C 40 63.800 63.800 63.644 0.156 19947
151 1 . 1 1 40 40 SER H H 40 8.280 8.280 7.708 0.572 19947
152 1 . 1 1 41 41 GLN N N 41 120.600 120.600 124.908 -4.308 19947
153 1 . 1 1 41 41 GLN HA H 41 4.110 4.110 4.070 0.040 19947
154 1 . 1 1 41 41 GLN CA C 41 55.200 55.200 57.062 -1.862 19947
155 1 . 1 1 41 41 GLN CB C 41 31.100 31.100 29.164 1.936 19947
156 1 . 1 1 41 41 GLN H H 41 9.190 9.190 7.969 1.221 19947
157 1 . 1 1 42 42 CYS N N 42 113.200 113.200 114.328 -1.128 19947
158 1 . 1 1 42 42 CYS HA H 42 4.630 4.630 4.578 0.052 19947
159 1 . 1 1 42 42 CYS CA C 42 53.700 53.700 57.229 -3.529 19947
160 1 . 1 1 42 42 CYS CB C 42 45.500 45.500 30.085 15.415 19947
161 1 . 1 1 42 42 CYS H H 42 7.710 7.710 7.496 0.214 19947
162 1 . 1 1 43 43 ASN N N 43 114.200 114.200 120.403 -6.203 19947
163 1 . 1 1 43 43 ASN HA H 43 4.940 4.940 4.729 0.211 19947
164 1 . 1 1 43 43 ASN CA C 43 53.000 53.000 54.260 -1.260 19947
165 1 . 1 1 43 43 ASN CB C 43 39.300 39.300 39.950 -0.650 19947
166 1 . 1 1 43 43 ASN H H 43 8.870 8.870 8.700 0.170 19947
167 1 . 1 1 44 44 TYR N N 44 118.400 118.400 115.102 3.298 19947
168 1 . 1 1 44 44 TYR HA H 44 4.850 4.850 4.669 0.181 19947
169 1 . 1 1 44 44 TYR CA C 44 55.300 55.300 57.435 -2.135 19947
170 1 . 1 1 44 44 TYR CB C 44 40.700 40.700 39.961 0.739 19947
171 1 . 1 1 44 44 TYR H H 44 7.840 7.840 7.340 0.500 19947
172 1 . 1 1 45 45 GLY N N 45 110.600 110.600 109.322 1.278 19947
173 1 . 1 1 45 45 GLY CA C 45 44.000 44.000 44.988 -0.988 19947
174 1 . 1 1 45 45 GLY H H 45 7.960 7.960 8.007 -0.047 19947
175 1 . 1 1 46 46 GLU N N 46 120.700 120.700 119.770 0.930 19947
176 1 . 1 1 46 46 GLU HA H 46 4.280 4.280 4.103 0.177 19947
177 1 . 1 1 46 46 GLU CA C 46 58.500 58.500 59.533 -1.033 19947
178 1 . 1 1 46 46 GLU CB C 46 29.300 29.300 30.043 -0.743 19947
179 1 . 1 1 46 46 GLU H H 46 9.160 9.160 8.643 0.517 19947
180 1 . 1 1 47 47 CYS N N 47 112.400 112.400 117.352 -4.952 19947
181 1 . 1 1 47 47 CYS HA H 47 4.850 4.850 4.709 0.141 19947
182 1 . 1 1 47 47 CYS CA C 47 57.100 57.100 58.400 -1.300 19947
183 1 . 1 1 47 47 CYS CB C 47 41.200 41.200 26.012 15.188 19947
184 1 . 1 1 47 47 CYS H H 47 8.510 8.510 7.528 0.982 19947
185 1 . 1 1 48 48 CYS N N 48 123.200 123.200 120.603 2.597 19947
186 1 . 1 1 48 48 CYS HA H 48 5.160 5.160 5.051 0.109 19947
187 1 . 1 1 48 48 CYS CA C 48 54.700 54.700 58.924 -4.224 19947
188 1 . 1 1 48 48 CYS CB C 48 45.700 45.700 28.901 16.799 19947
189 1 . 1 1 48 48 CYS H H 48 7.810 7.810 7.851 -0.041 19947
190 1 . 1 1 49 49 ASP N N 49 127.400 127.400 124.613 2.787 19947
191 1 . 1 1 49 49 ASP HA H 49 4.890 4.890 4.925 -0.035 19947
192 1 . 1 1 49 49 ASP CA C 49 53.500 53.500 54.045 -0.545 19947
193 1 . 1 1 49 49 ASP CB C 49 42.400 42.400 43.853 -1.453 19947
194 1 . 1 1 49 49 ASP H H 49 9.670 9.670 8.585 1.085 19947
195 1 . 1 1 50 50 GLN N N 50 127.000 127.000 122.387 4.613 19947
196 1 . 1 1 50 50 GLN HA H 50 3.940 3.940 3.929 0.011 19947
197 1 . 1 1 50 50 GLN CA C 50 56.800 56.800 58.328 -1.528 19947
198 1 . 1 1 50 50 GLN CB C 50 26.500 26.500 27.792 -1.292 19947
199 1 . 1 1 50 50 GLN H H 50 9.450 9.450 8.884 0.566 19947
200 1 . 1 1 51 51 CYS N N 51 106.100 106.100 115.848 -9.748 19947
201 1 . 1 1 51 51 CYS HA H 51 4.760 4.760 4.696 0.064 19947
202 1 . 1 1 51 51 CYS CB C 51 43.200 43.200 27.190 16.010 19947
203 1 . 1 1 51 51 CYS H H 51 8.700 8.700 8.345 0.355 19947
204 1 . 1 1 52 52 ARG N N 52 121.000 121.000 118.170 2.830 19947
205 1 . 1 1 52 52 ARG HA H 52 4.690 4.690 4.492 0.198 19947
206 1 . 1 1 52 52 ARG CA C 52 55.400 55.400 54.643 0.757 19947
207 1 . 1 1 52 52 ARG CB C 52 33.100 33.100 34.472 -1.372 19947
208 1 . 1 1 52 52 ARG H H 52 7.960 7.960 7.651 0.309 19947
209 1 . 1 1 53 53 PHE N N 53 120.300 120.300 120.608 -0.308 19947
210 1 . 1 1 53 53 PHE HA H 53 5.050 5.050 5.091 -0.041 19947
211 1 . 1 1 53 53 PHE CA C 53 56.100 56.100 56.581 -0.481 19947
212 1 . 1 1 53 53 PHE CB C 53 38.200 38.200 39.273 -1.073 19947
213 1 . 1 1 53 53 PHE H H 53 8.400 8.400 8.394 0.006 19947
214 1 . 1 1 54 54 LYS N N 54 123.300 123.300 125.242 -1.942 19947
215 1 . 1 1 54 54 LYS HA H 54 4.250 4.250 4.163 0.087 19947
216 1 . 1 1 54 54 LYS CA C 54 57.500 57.500 56.331 1.169 19947
217 1 . 1 1 54 54 LYS CB C 54 34.300 34.300 32.004 2.296 19947
218 1 . 1 1 54 54 LYS H H 54 8.540 8.540 8.506 0.034 19947
219 1 . 1 1 55 55 LYS N N 55 119.400 119.400 124.758 -5.358 19947
220 1 . 1 1 55 55 LYS HA H 55 4.110 4.110 3.993 0.117 19947
221 1 . 1 1 55 55 LYS CA C 55 56.500 56.500 56.894 -0.394 19947
222 1 . 1 1 55 55 LYS CB C 55 33.400 33.400 33.180 0.220 19947
223 1 . 1 1 55 55 LYS H H 55 8.440 8.440 8.222 0.218 19947
224 1 . 1 1 56 56 ALA N N 56 126.700 126.700 127.586 -0.886 19947
225 1 . 1 1 56 56 ALA HA H 56 3.920 3.920 4.040 -0.120 19947
226 1 . 1 1 56 56 ALA CA C 56 52.900 52.900 53.682 -0.782 19947
227 1 . 1 1 56 56 ALA CB C 56 18.100 18.100 18.405 -0.305 19947
228 1 . 1 1 56 56 ALA H H 56 8.930 8.930 8.615 0.315 19947
229 1 . 1 1 57 57 GLY N N 57 109.300 109.300 111.434 -2.134 19947
230 1 . 1 1 57 57 GLY CA C 57 45.100 45.100 44.846 0.254 19947
231 1 . 1 1 57 57 GLY H H 57 8.460 8.460 8.444 0.016 19947
232 1 . 1 1 58 58 THR N N 58 117.200 117.200 120.024 -2.824 19947
233 1 . 1 1 58 58 THR HA H 58 4.260 4.260 4.430 -0.170 19947
234 1 . 1 1 58 58 THR CA C 58 63.300 63.300 63.207 0.093 19947
235 1 . 1 1 58 58 THR CB C 58 69.600 69.600 69.003 0.597 19947
236 1 . 1 1 58 58 THR H H 58 7.660 7.660 7.785 -0.125 19947
237 1 . 1 1 59 59 VAL N N 59 130.400 130.400 127.800 2.600 19947
238 1 . 1 1 59 59 VAL HA H 59 3.900 3.900 3.826 0.074 19947
239 1 . 1 1 59 59 VAL CA C 59 64.400 64.400 62.803 1.597 19947
240 1 . 1 1 59 59 VAL CB C 59 31.900 31.900 31.875 0.025 19947
241 1 . 1 1 59 59 VAL H H 59 9.190 9.190 8.743 0.447 19947
242 1 . 1 1 60 60 CYS N N 60 121.800 121.800 126.459 -4.659 19947
243 1 . 1 1 60 60 CYS HA H 60 5.050 5.050 4.596 0.454 19947
244 1 . 1 1 60 60 CYS CA C 60 54.400 54.400 58.128 -3.728 19947
245 1 . 1 1 60 60 CYS CB C 60 43.000 43.000 27.631 15.369 19947
246 1 . 1 1 60 60 CYS H H 60 9.130 9.130 8.309 0.821 19947
247 1 . 1 1 61 61 ARG N N 61 124.100 124.100 118.262 5.838 19947
248 1 . 1 1 61 61 ARG HA H 61 4.360 4.360 4.618 -0.258 19947
249 1 . 1 1 61 61 ARG CA C 61 56.800 56.800 55.303 1.497 19947
250 1 . 1 1 61 61 ARG CB C 61 32.800 32.800 34.146 -1.346 19947
251 1 . 1 1 61 61 ARG H H 61 7.580 7.580 7.417 0.163 19947
252 1 . 1 1 62 62 ILE N N 62 126.200 126.200 116.467 9.733 19947
253 1 . 1 1 62 62 ILE HA H 62 4.090 4.090 4.538 -0.448 19947
254 1 . 1 1 62 62 ILE CA C 62 60.300 60.300 60.977 -0.677 19947
255 1 . 1 1 62 62 ILE CB C 62 38.700 38.700 40.858 -2.158 19947
256 1 . 1 1 62 62 ILE H H 62 8.490 8.490 8.376 0.114 19947
257 1 . 1 1 63 63 ALA N N 63 129.400 129.400 131.816 -2.416 19947
258 1 . 1 1 63 63 ALA HA H 63 4.310 4.310 4.397 -0.087 19947
259 1 . 1 1 63 63 ALA CA C 63 51.900 51.900 54.302 -2.402 19947
260 1 . 1 1 63 63 ALA CB C 63 20.600 20.600 19.351 1.249 19947
261 1 . 1 1 63 63 ALA H H 63 8.100 8.100 8.655 -0.555 19947
262 1 . 1 1 64 64 ARG N N 64 120.500 120.500 120.869 -0.369 19947
263 1 . 1 1 64 64 ARG HA H 64 4.290 4.290 4.489 -0.199 19947
264 1 . 1 1 64 64 ARG CA C 64 56.200 56.200 55.888 0.312 19947
265 1 . 1 1 64 64 ARG CB C 64 30.500 30.500 30.256 0.244 19947
266 1 . 1 1 64 64 ARG H H 64 8.140 8.140 8.821 -0.681 19947
267 1 . 1 1 65 65 GLY N N 65 110.500 110.500 112.318 -1.818 19947
268 1 . 1 1 65 65 GLY CA C 65 45.100 45.100 44.553 0.546 19947
269 1 . 1 1 65 65 GLY H H 65 8.040 8.040 8.344 -0.304 19947
270 1 . 1 1 66 66 ASP N N 66 120.700 120.700 119.540 1.160 19947
271 1 . 1 1 66 66 ASP HA H 66 4.610 4.610 4.535 0.075 19947
272 1 . 1 1 66 66 ASP CA C 66 53.300 53.300 53.823 -0.523 19947
273 1 . 1 1 66 66 ASP CB C 66 37.600 37.600 40.608 -3.008 19947
274 1 . 1 1 66 66 ASP H H 66 8.380 8.380 7.181 1.199 19947
275 1 . 1 1 67 67 TRP N N 67 120.100 120.100 123.367 -3.267 19947
276 1 . 1 1 67 67 TRP HA H 67 4.760 4.760 5.051 -0.291 19947
277 1 . 1 1 67 67 TRP CA C 67 57.200 57.200 58.009 -0.809 19947
278 1 . 1 1 67 67 TRP CB C 67 29.100 29.100 29.495 -0.395 19947
279 1 . 1 1 67 67 TRP H H 67 7.950 7.950 7.858 0.092 19947
280 1 . 1 1 68 68 ASN N N 68 118.400 118.400 117.896 0.504 19947
281 1 . 1 1 68 68 ASN HA H 68 4.790 4.790 4.939 -0.149 19947
282 1 . 1 1 68 68 ASN CA C 68 52.800 52.800 53.765 -0.965 19947
283 1 . 1 1 68 68 ASN CB C 68 39.300 39.300 40.147 -0.847 19947
284 1 . 1 1 68 68 ASN H H 68 8.180 8.180 8.699 -0.519 19947
285 1 . 1 1 69 69 ASP N N 69 118.500 118.500 118.496 0.004 19947
286 1 . 1 1 69 69 ASP HA H 69 4.620 4.620 4.455 0.165 19947
287 1 . 1 1 69 69 ASP CA C 69 53.200 53.200 56.168 -2.968 19947
288 1 . 1 1 69 69 ASP CB C 69 38.000 38.000 41.148 -3.148 19947
289 1 . 1 1 69 69 ASP H H 69 8.130 8.130 8.460 -0.330 19947
290 1 . 1 1 70 70 ASP N N 70 120.500 120.500 121.119 -0.619 19947
291 1 . 1 1 70 70 ASP HA H 70 5.100 5.100 5.091 0.009 19947
292 1 . 1 1 70 70 ASP CA C 70 52.500 52.500 53.404 -0.904 19947
293 1 . 1 1 70 70 ASP CB C 70 42.600 42.600 42.375 0.225 19947
294 1 . 1 1 70 70 ASP H H 70 8.140 8.140 8.133 0.007 19947
295 1 . 1 1 71 71 TYR N N 71 118.900 118.900 123.850 -4.950 19947
296 1 . 1 1 71 71 TYR HA H 71 5.210 5.210 4.978 0.232 19947
297 1 . 1 1 71 71 TYR CA C 71 56.300 56.300 57.080 -0.780 19947
298 1 . 1 1 71 71 TYR CB C 71 42.200 42.200 42.760 -0.560 19947
299 1 . 1 1 71 71 TYR H H 71 8.450 8.450 8.316 0.134 19947
300 1 . 1 1 72 72 CYS N N 72 119.800 119.800 121.482 -1.682 19947
301 1 . 1 1 72 72 CYS HA H 72 4.900 4.900 4.494 0.407 19947
302 1 . 1 1 72 72 CYS CA C 72 53.400 53.400 59.500 -6.100 19947
303 1 . 1 1 72 72 CYS CB C 72 37.200 37.200 28.925 8.275 19947
304 1 . 1 1 72 72 CYS H H 72 9.330 9.330 8.598 0.732 19947
305 1 . 1 1 73 73 THR N N 73 112.700 112.700 114.208 -1.508 19947
306 1 . 1 1 73 73 THR HA H 73 4.430 4.430 4.424 0.006 19947
307 1 . 1 1 73 73 THR CA C 73 62.300 62.300 61.214 1.086 19947
308 1 . 1 1 73 73 THR CB C 73 71.300 71.300 69.697 1.603 19947
309 1 . 1 1 73 73 THR H H 73 9.980 9.980 8.744 1.236 19947
310 1 . 1 1 74 74 GLY N N 74 111.500 111.500 111.121 0.379 19947
311 1 . 1 1 74 74 GLY CA C 74 45.300 45.300 46.565 -1.265 19947
312 1 . 1 1 74 74 GLY H H 74 8.580 8.580 7.853 0.727 19947
313 1 . 1 1 75 75 LYS N N 75 115.900 115.900 116.999 -1.099 19947
314 1 . 1 1 75 75 LYS HA H 75 4.140 4.140 4.567 -0.427 19947
315 1 . 1 1 75 75 LYS CA C 75 54.800 54.800 55.690 -0.890 19947
316 1 . 1 1 75 75 LYS CB C 75 34.200 34.200 34.209 -0.009 19947
317 1 . 1 1 75 75 LYS H H 75 7.900 7.900 7.551 0.349 19947
318 1 . 1 1 76 76 SER N N 76 111.000 111.000 112.697 -1.697 19947
319 1 . 1 1 76 76 SER HA H 76 4.160 4.160 3.877 0.283 19947
320 1 . 1 1 76 76 SER CA C 76 61.400 61.400 56.565 4.835 19947
321 1 . 1 1 76 76 SER CB C 76 64.300 64.300 64.932 -0.632 19947
322 1 . 1 1 76 76 SER H H 76 6.520 6.520 6.928 -0.408 19947
323 1 . 1 1 77 77 SER N N 77 117.100 117.100 114.512 2.588 19947
324 1 . 1 1 77 77 SER HA H 77 4.220 4.220 4.462 -0.242 19947
325 1 . 1 1 77 77 SER CA C 77 59.800 59.800 58.798 1.002 19947
326 1 . 1 1 77 77 SER CB C 77 64.400 64.400 63.721 0.679 19947
327 1 . 1 1 77 77 SER H H 77 9.030 9.030 8.307 0.723 19947
328 1 . 1 1 78 78 ASP N N 78 122.100 122.100 121.112 0.988 19947
329 1 . 1 1 78 78 ASP HA H 78 4.930 4.930 4.768 0.162 19947
330 1 . 1 1 78 78 ASP CA C 78 52.400 52.400 53.545 -1.145 19947
331 1 . 1 1 78 78 ASP CB C 78 40.800 40.800 43.903 -3.103 19947
332 1 . 1 1 78 78 ASP H H 78 8.340 8.340 7.490 0.850 19947
333 1 . 1 1 79 79 CYS N N 79 122.200 122.200 121.838 0.362 19947
334 1 . 1 1 79 79 CYS HA H 79 5.320 5.320 4.856 0.464 19947
335 1 . 1 1 79 79 CYS CA C 79 52.000 52.000 55.476 -3.476 19947
336 1 . 1 1 79 79 CYS CB C 79 39.300 39.300 27.649 11.650 19947
337 1 . 1 1 79 79 CYS H H 79 8.960 8.960 8.497 0.463 19947
338 1 . 1 1 80 80 PRO HA H 80 4.410 4.410 4.368 0.042 19947
339 1 . 1 1 80 80 PRO CA C 80 63.500 63.500 63.004 0.496 19947
340 1 . 1 1 80 80 PRO CB C 80 32.400 32.400 32.606 -0.206 19947
341 1 . 1 1 81 81 TRP N N 81 120.500 120.500 121.280 -0.780 19947
342 1 . 1 1 81 81 TRP HA H 81 4.550 4.550 4.480 0.070 19947
343 1 . 1 1 81 81 TRP CA C 81 56.400 56.400 56.129 0.271 19947
344 1 . 1 1 81 81 TRP CB C 81 29.500 29.500 28.641 0.859 19947
345 1 . 1 1 81 81 TRP H H 81 8.400 8.400 8.073 0.327 19947
346 1 . 1 1 82 82 ASN N N 82 120.400 120.400 114.987 5.413 19947
347 1 . 1 1 82 82 ASN HA H 82 4.750 4.750 4.412 0.338 19947
348 1 . 1 1 82 82 ASN CA C 82 53.100 53.100 53.938 -0.839 19947
349 1 . 1 1 82 82 ASN CB C 82 39.000 39.000 37.028 1.972 19947
350 1 . 1 1 82 82 ASN H H 82 8.040 8.040 8.396 -0.356 19947
stop_
save_