data_18141
save_entry_information
_Entry.Sf_category entry_information
_Entry.NMR_STAR_version 3.0.9.13
_Entry.Entry_ID 18141
_Entry.PDB_ID 2LMZ
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 18141
_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 4.370 4.370 4.397 -0.027 18141
2 1 1 . 1 1 2 2 PRO CA C 2 62.800 62.800 62.541 0.259 18141
3 1 1 . 1 1 3 3 TYR N N 3 120.600 120.600 117.790 2.810 18141
4 1 1 . 1 1 3 3 TYR HA H 3 4.310 4.310 4.101 0.209 18141
5 1 1 . 1 1 3 3 TYR H H 3 8.160 8.160 7.563 0.597 18141
6 1 1 . 1 1 4 4 CYS N N 4 119.100 119.100 121.797 -2.697 18141
7 1 1 . 1 1 4 4 CYS HA H 4 3.330 3.330 4.105 -0.775 18141
8 1 1 . 1 1 4 4 CYS CA C 4 53.500 53.500 60.339 -6.839 18141
9 1 1 . 1 1 4 4 CYS H H 4 7.700 7.700 8.194 -0.494 18141
10 1 1 . 1 1 5 5 GLY N N 5 107.900 107.900 104.353 3.547 18141
11 1 1 . 1 1 5 5 GLY CA C 5 43.700 43.700 45.638 -1.938 18141
12 1 1 . 1 1 5 5 GLY H H 5 5.930 5.930 8.020 -2.090 18141
13 1 1 . 1 1 6 6 GLN N N 6 114.200 114.200 120.727 -6.527 18141
14 1 1 . 1 1 6 6 GLN HA H 6 4.420 4.420 4.582 -0.162 18141
15 1 1 . 1 1 6 6 GLN CA C 6 56.200 56.200 56.908 -0.708 18141
16 1 1 . 1 1 6 6 GLN H H 6 8.710 8.710 8.552 0.158 18141
17 1 1 . 1 1 7 7 THR N N 7 106.600 106.600 107.250 -0.650 18141
18 1 1 . 1 1 7 7 THR HA H 7 4.780 4.780 4.660 0.120 18141
19 1 1 . 1 1 7 7 THR CA C 7 58.700 58.700 59.404 -0.704 18141
20 1 1 . 1 1 7 7 THR H H 7 7.300 7.300 7.452 -0.152 18141
21 1 1 . 1 1 8 8 GLY N N 8 110.400 110.400 106.772 3.628 18141
22 1 1 . 1 1 8 8 GLY CA C 8 48.000 48.000 46.257 1.743 18141
23 1 1 . 1 1 8 8 GLY H H 8 9.260 9.260 8.382 0.878 18141
24 1 1 . 1 1 9 9 ALA N N 9 123.400 123.400 125.437 -2.037 18141
25 1 1 . 1 1 9 9 ALA HA H 9 4.090 4.090 3.950 0.140 18141
26 1 1 . 1 1 9 9 ALA CA C 9 55.600 55.600 55.355 0.245 18141
27 1 1 . 1 1 9 9 ALA H H 9 8.490 8.490 8.235 0.255 18141
28 1 1 . 1 1 10 10 GLU N N 10 119.500 119.500 116.866 2.634 18141
29 1 1 . 1 1 10 10 GLU HA H 10 4.230 4.230 4.126 0.104 18141
30 1 1 . 1 1 10 10 GLU CA C 10 59.300 59.300 59.051 0.249 18141
31 1 1 . 1 1 10 10 GLU H H 10 7.790 7.790 7.828 -0.038 18141
32 1 1 . 1 1 11 11 CYS N N 11 118.300 118.300 120.871 -2.571 18141
33 1 1 . 1 1 11 11 CYS HA H 11 4.850 4.850 4.463 0.387 18141
34 1 1 . 1 1 11 11 CYS H H 11 8.460 8.460 7.655 0.805 18141
35 1 1 . 1 1 12 12 TYR N N 12 121.800 121.800 120.152 1.648 18141
36 1 1 . 1 1 12 12 TYR HA H 12 4.020 4.020 4.287 -0.267 18141
37 1 1 . 1 1 12 12 TYR H H 12 8.860 8.860 9.016 -0.156 18141
38 1 1 . 1 1 13 13 SER N N 13 114.500 114.500 115.327 -0.827 18141
39 1 1 . 1 1 13 13 SER HA H 13 4.130 4.130 4.350 -0.220 18141
40 1 1 . 1 1 13 13 SER CA C 13 62.600 62.600 60.917 1.683 18141
41 1 1 . 1 1 13 13 SER H H 13 7.910 7.910 7.776 0.134 18141
42 1 1 . 1 1 14 14 TRP N N 14 122.400 122.400 124.224 -1.824 18141
43 1 1 . 1 1 14 14 TRP HA H 14 4.020 4.020 4.514 -0.494 18141
44 1 1 . 1 1 14 14 TRP H H 14 8.680 8.680 8.183 0.497 18141
45 1 1 . 1 1 15 15 CYS N N 15 120.500 120.500 117.490 3.010 18141
46 1 1 . 1 1 15 15 CYS HA H 15 3.530 3.530 3.610 -0.080 18141
47 1 1 . 1 1 15 15 CYS CA C 15 60.500 60.500 61.525 -1.025 18141
48 1 1 . 1 1 15 15 CYS H H 15 8.120 8.120 8.144 -0.024 18141
49 1 1 . 1 1 16 16 ILE N N 16 120.300 120.300 121.697 -1.397 18141
50 1 1 . 1 1 16 16 ILE HA H 16 3.930 3.930 4.124 -0.194 18141
51 1 1 . 1 1 16 16 ILE CA C 16 61.700 61.700 62.882 -1.182 18141
52 1 1 . 1 1 16 16 ILE H H 16 8.250 8.250 7.775 0.475 18141
53 1 1 . 1 1 17 17 LYS N N 17 121.700 121.700 120.331 1.369 18141
54 1 1 . 1 1 17 17 LYS HA H 17 4.100 4.100 3.967 0.133 18141
55 1 1 . 1 1 17 17 LYS CA C 17 58.100 58.100 58.740 -0.640 18141
56 1 1 . 1 1 17 17 LYS H H 17 7.800 7.800 7.890 -0.090 18141
57 1 1 . 1 1 18 18 GLN N N 18 117.600 117.600 116.601 0.999 18141
58 1 1 . 1 1 18 18 GLN HA H 18 4.030 4.030 4.007 0.023 18141
59 1 1 . 1 1 18 18 GLN H H 18 7.240 7.240 7.319 -0.079 18141
60 1 1 . 1 1 19 19 ASP N N 19 121.800 121.800 117.973 3.827 18141
61 1 1 . 1 1 19 19 ASP HA H 19 4.320 4.320 4.291 0.029 18141
62 1 1 . 1 1 19 19 ASP H H 19 8.050 8.050 8.345 -0.295 18141
63 1 1 . 1 1 20 20 LEU N N 20 119.400 119.400 117.536 1.864 18141
64 1 1 . 1 1 20 20 LEU HA H 20 4.300 4.300 4.142 0.158 18141
65 1 1 . 1 1 20 20 LEU H H 20 6.430 6.430 7.933 -1.503 18141
66 1 1 . 1 1 21 21 SER N N 21 115.500 115.500 109.100 6.400 18141
67 1 1 . 1 1 21 21 SER HA H 21 4.290 4.290 4.498 -0.208 18141
68 1 1 . 1 1 21 21 SER H H 21 8.260 8.260 7.661 0.599 18141
69 1 1 . 1 1 22 22 LYS N N 22 122.700 122.700 123.528 -0.828 18141
70 1 1 . 1 1 22 22 LYS HA H 22 4.020 4.020 4.181 -0.161 18141
71 1 1 . 1 1 22 22 LYS H H 22 8.690 8.690 8.740 -0.050 18141
72 1 1 . 1 1 23 23 ASP N N 23 117.000 117.000 119.349 -2.349 18141
73 1 1 . 1 1 23 23 ASP HA H 23 4.370 4.370 4.696 -0.326 18141
74 1 1 . 1 1 23 23 ASP CA C 23 55.300 55.300 55.488 -0.188 18141
75 1 1 . 1 1 23 23 ASP H H 23 8.260 8.260 7.800 0.460 18141
76 1 1 . 1 1 24 24 TRP N N 24 122.400 122.400 121.471 0.929 18141
77 1 1 . 1 1 24 24 TRP HA H 24 4.240 4.240 4.267 -0.027 18141
78 1 1 . 1 1 24 24 TRP CA C 24 59.300 59.300 60.730 -1.429 18141
79 1 1 . 1 1 24 24 TRP H H 24 7.910 7.910 7.783 0.127 18141
80 1 1 . 1 1 25 25 CYS N N 25 117.800 117.800 118.098 -0.298 18141
81 1 1 . 1 1 25 25 CYS HA H 25 4.890 4.890 2.995 1.895 18141
82 1 1 . 1 1 25 25 CYS H H 25 9.110 9.110 7.310 1.800 18141
83 1 1 . 1 1 26 26 CYS N N 26 120.700 120.700 119.810 0.890 18141
84 1 1 . 1 1 26 26 CYS HA H 26 4.530 4.530 3.925 0.605 18141
85 1 1 . 1 1 26 26 CYS CA C 26 58.900 58.900 62.707 -3.807 18141
86 1 1 . 1 1 26 26 CYS H H 26 8.940 8.940 7.830 1.110 18141
87 1 1 . 1 1 27 27 ASP N N 27 120.700 120.700 118.625 2.075 18141
88 1 1 . 1 1 27 27 ASP HA H 27 4.330 4.330 4.614 -0.284 18141
89 1 1 . 1 1 27 27 ASP CA C 27 57.100 57.100 56.171 0.929 18141
90 1 1 . 1 1 27 27 ASP H H 27 7.400 7.400 7.828 -0.428 18141
91 1 1 . 1 1 28 28 PHE N N 28 123.100 123.100 121.611 1.489 18141
92 1 1 . 1 1 28 28 PHE HA H 28 4.070 4.070 4.264 -0.194 18141
93 1 1 . 1 1 28 28 PHE CA C 28 60.200 60.200 60.660 -0.460 18141
94 1 1 . 1 1 28 28 PHE H H 28 8.590 8.590 7.602 0.988 18141
95 1 1 . 1 1 29 29 VAL N N 29 116.200 116.200 119.270 -3.070 18141
96 1 1 . 1 1 29 29 VAL HA H 29 3.120 3.120 2.956 0.164 18141
97 1 1 . 1 1 29 29 VAL CA C 29 66.100 66.100 64.945 1.155 18141
98 1 1 . 1 1 29 29 VAL H H 29 7.760 7.760 7.552 0.208 18141
99 1 1 . 1 1 30 30 LYS N N 30 117.300 117.300 116.682 0.618 18141
100 1 1 . 1 1 30 30 LYS HA H 30 4.260 4.260 4.026 0.234 18141
101 1 1 . 1 1 30 30 LYS H H 30 7.280 7.280 7.400 -0.120 18141
102 1 1 . 1 1 31 31 ASP N N 31 122.600 122.600 118.671 3.929 18141
103 1 1 . 1 1 31 31 ASP HA H 31 4.410 4.410 4.491 -0.081 18141
104 1 1 . 1 1 31 31 ASP CA C 31 56.800 56.800 55.861 0.939 18141
105 1 1 . 1 1 31 31 ASP H H 31 8.510 8.510 7.568 0.942 18141
106 1 1 . 1 1 32 32 ILE N N 32 112.500 112.500 120.330 -7.830 18141
107 1 1 . 1 1 32 32 ILE HA H 32 4.310 4.310 3.955 0.354 18141
108 1 1 . 1 1 32 32 ILE CA C 32 62.800 62.800 59.927 2.873 18141
109 1 1 . 1 1 32 32 ILE H H 32 7.320 7.320 7.075 0.245 18141
110 1 1 . 1 1 33 33 ARG N N 33 114.200 114.200 116.356 -2.156 18141
111 1 1 . 1 1 33 33 ARG HA H 33 3.870 3.870 3.872 -0.002 18141
112 1 1 . 1 1 33 33 ARG CA C 33 56.600 56.600 56.983 -0.383 18141
113 1 1 . 1 1 33 33 ARG H H 33 7.880 7.880 7.767 0.113 18141
114 1 1 . 1 1 34 34 MET N N 34 117.100 117.100 117.081 0.019 18141
115 1 1 . 1 1 34 34 MET HA H 34 4.640 4.640 4.555 0.085 18141
116 1 1 . 1 1 34 34 MET CA C 34 54.300 54.300 54.069 0.231 18141
117 1 1 . 1 1 34 34 MET H H 34 7.570 7.570 7.585 -0.015 18141
118 1 1 . 1 1 35 35 ASN N N 35 118.000 118.000 120.083 -2.083 18141
119 1 1 . 1 1 35 35 ASN HA H 35 5.170 5.170 5.204 -0.034 18141
120 1 1 . 1 1 35 35 ASN CA C 35 50.400 50.400 50.605 -0.205 18141
121 1 1 . 1 1 35 35 ASN H H 35 8.390 8.390 8.655 -0.265 18141
122 1 1 . 1 1 37 37 PRO HA H 37 4.320 4.320 4.628 -0.308 18141
123 1 1 . 1 1 37 37 PRO CA C 37 61.200 61.200 62.057 -0.857 18141
124 1 1 . 1 1 38 38 ALA N N 38 114.400 114.400 120.784 -6.384 18141
125 1 1 . 1 1 38 38 ALA HA H 38 3.990 3.990 4.305 -0.315 18141
126 1 1 . 1 1 38 38 ALA CA C 38 54.400 54.400 52.508 1.892 18141
127 1 1 . 1 1 38 38 ALA H H 38 8.770 8.770 8.353 0.417 18141
128 1 1 . 1 1 39 39 ASP N N 39 112.400 112.400 115.323 -2.923 18141
129 1 1 . 1 1 39 39 ASP HA H 39 4.310 4.310 4.645 -0.335 18141
130 1 1 . 1 1 39 39 ASP H H 39 8.710 8.710 8.247 0.463 18141
131 1 1 . 1 1 40 40 LYS N N 40 117.000 117.000 119.294 -2.294 18141
132 1 1 . 1 1 40 40 LYS HA H 40 4.370 4.370 4.250 0.120 18141
133 1 1 . 1 1 40 40 LYS CA C 40 57.000 57.000 56.881 0.119 18141
134 1 1 . 1 1 40 40 LYS H H 40 6.990 6.990 8.065 -1.075 18141
135 1 1 . 1 1 41 41 CYS N N 41 121.600 121.600 121.547 0.053 18141
136 1 1 . 1 1 41 41 CYS HA H 41 5.180 5.180 4.929 0.251 18141
137 1 1 . 1 1 41 41 CYS CA C 41 50.900 50.900 55.895 -4.995 18141
138 1 1 . 1 1 41 41 CYS H H 41 7.520 7.520 8.250 -0.730 18141
139 1 2 . 1 1 2 2 PRO HA H 2 4.370 4.370 4.651 -0.281 18141
140 1 2 . 1 1 2 2 PRO CA C 2 62.800 62.800 62.612 0.188 18141
141 1 2 . 1 1 3 3 TYR N N 3 120.600 120.600 121.098 -0.498 18141
142 1 2 . 1 1 3 3 TYR HA H 3 4.310 4.310 4.643 -0.333 18141
143 1 2 . 1 1 3 3 TYR H H 3 8.160 8.160 8.241 -0.081 18141
144 1 2 . 1 1 4 4 CYS N N 4 119.100 119.100 125.405 -6.305 18141
145 1 2 . 1 1 4 4 CYS HA H 4 3.330 3.330 3.924 -0.594 18141
146 1 2 . 1 1 4 4 CYS CA C 4 53.500 53.500 59.475 -5.975 18141
147 1 2 . 1 1 4 4 CYS H H 4 7.700 7.700 9.334 -1.634 18141
148 1 2 . 1 1 5 5 GLY N N 5 107.900 107.900 104.937 2.963 18141
149 1 2 . 1 1 5 5 GLY CA C 5 43.700 43.700 44.806 -1.105 18141
150 1 2 . 1 1 5 5 GLY H H 5 5.930 5.930 7.718 -1.788 18141
151 1 2 . 1 1 6 6 GLN N N 6 114.200 114.200 116.307 -2.107 18141
152 1 2 . 1 1 6 6 GLN HA H 6 4.420 4.420 3.091 1.329 18141
153 1 2 . 1 1 6 6 GLN CA C 6 56.200 56.200 57.093 -0.893 18141
154 1 2 . 1 1 6 6 GLN H H 6 8.710 8.710 7.812 0.898 18141
155 1 2 . 1 1 7 7 THR N N 7 106.600 106.600 106.116 0.484 18141
156 1 2 . 1 1 7 7 THR HA H 7 4.780 4.780 4.669 0.111 18141
157 1 2 . 1 1 7 7 THR CA C 7 58.700 58.700 60.515 -1.815 18141
158 1 2 . 1 1 7 7 THR H H 7 7.300 7.300 7.072 0.228 18141
159 1 2 . 1 1 8 8 GLY N N 8 110.400 110.400 109.594 0.806 18141
160 1 2 . 1 1 8 8 GLY CA C 8 48.000 48.000 46.868 1.132 18141
161 1 2 . 1 1 8 8 GLY H H 8 9.260 9.260 8.795 0.465 18141
162 1 2 . 1 1 9 9 ALA N N 9 123.400 123.400 122.011 1.389 18141
163 1 2 . 1 1 9 9 ALA HA H 9 4.090 4.090 4.086 0.004 18141
164 1 2 . 1 1 9 9 ALA CA C 9 55.600 55.600 54.215 1.385 18141
165 1 2 . 1 1 9 9 ALA H H 9 8.490 8.490 8.414 0.076 18141
166 1 2 . 1 1 10 10 GLU N N 10 119.500 119.500 117.892 1.608 18141
167 1 2 . 1 1 10 10 GLU HA H 10 4.230 4.230 4.331 -0.101 18141
168 1 2 . 1 1 10 10 GLU CA C 10 59.300 59.300 58.855 0.445 18141
169 1 2 . 1 1 10 10 GLU H H 10 7.790 7.790 7.838 -0.048 18141
170 1 2 . 1 1 11 11 CYS N N 11 118.300 118.300 119.287 -0.987 18141
171 1 2 . 1 1 11 11 CYS HA H 11 4.850 4.850 4.374 0.476 18141
172 1 2 . 1 1 11 11 CYS H H 11 8.460 8.460 7.776 0.684 18141
173 1 2 . 1 1 12 12 TYR N N 12 121.800 121.800 122.407 -0.607 18141
174 1 2 . 1 1 12 12 TYR HA H 12 4.020 4.020 4.171 -0.151 18141
175 1 2 . 1 1 12 12 TYR H H 12 8.860 8.860 7.898 0.962 18141
176 1 2 . 1 1 13 13 SER N N 13 114.500 114.500 114.183 0.317 18141
177 1 2 . 1 1 13 13 SER HA H 13 4.130 4.130 3.349 0.781 18141
178 1 2 . 1 1 13 13 SER CA C 13 62.600 62.600 59.907 2.693 18141
179 1 2 . 1 1 13 13 SER H H 13 7.910 7.910 7.572 0.338 18141
180 1 2 . 1 1 14 14 TRP N N 14 122.400 122.400 122.611 -0.211 18141
181 1 2 . 1 1 14 14 TRP HA H 14 4.020 4.020 4.382 -0.362 18141
182 1 2 . 1 1 14 14 TRP H H 14 8.680 8.680 8.235 0.445 18141
183 1 2 . 1 1 15 15 CYS N N 15 120.500 120.500 117.734 2.766 18141
184 1 2 . 1 1 15 15 CYS HA H 15 3.530 3.530 3.477 0.053 18141
185 1 2 . 1 1 15 15 CYS CA C 15 60.500 60.500 60.783 -0.283 18141
186 1 2 . 1 1 15 15 CYS H H 15 8.120 8.120 7.835 0.285 18141
187 1 2 . 1 1 16 16 ILE N N 16 120.300 120.300 119.909 0.391 18141
188 1 2 . 1 1 16 16 ILE HA H 16 3.930 3.930 3.934 -0.004 18141
189 1 2 . 1 1 16 16 ILE CA C 16 61.700 61.700 63.347 -1.647 18141
190 1 2 . 1 1 16 16 ILE H H 16 8.250 8.250 7.351 0.899 18141
191 1 2 . 1 1 17 17 LYS N N 17 121.700 121.700 120.555 1.145 18141
192 1 2 . 1 1 17 17 LYS HA H 17 4.100 4.100 3.955 0.145 18141
193 1 2 . 1 1 17 17 LYS CA C 17 58.100 58.100 58.372 -0.272 18141
194 1 2 . 1 1 17 17 LYS H H 17 7.800 7.800 8.298 -0.498 18141
195 1 2 . 1 1 18 18 GLN N N 18 117.600 117.600 117.789 -0.189 18141
196 1 2 . 1 1 18 18 GLN HA H 18 4.030 4.030 3.911 0.119 18141
197 1 2 . 1 1 18 18 GLN H H 18 7.240 7.240 7.401 -0.161 18141
198 1 2 . 1 1 19 19 ASP N N 19 121.800 121.800 116.599 5.201 18141
199 1 2 . 1 1 19 19 ASP HA H 19 4.320 4.320 4.211 0.109 18141
200 1 2 . 1 1 19 19 ASP H H 19 8.050 8.050 7.559 0.491 18141
201 1 2 . 1 1 20 20 LEU N N 20 119.400 119.400 115.651 3.749 18141
202 1 2 . 1 1 20 20 LEU HA H 20 4.300 4.300 4.520 -0.220 18141
203 1 2 . 1 1 20 20 LEU H H 20 6.430 6.430 8.322 -1.892 18141
204 1 2 . 1 1 21 21 SER N N 21 115.500 115.500 112.282 3.218 18141
205 1 2 . 1 1 21 21 SER HA H 21 4.290 4.290 4.523 -0.233 18141
206 1 2 . 1 1 21 21 SER H H 21 8.260 8.260 7.460 0.800 18141
207 1 2 . 1 1 22 22 LYS N N 22 122.700 122.700 122.376 0.324 18141
208 1 2 . 1 1 22 22 LYS HA H 22 4.020 4.020 4.120 -0.100 18141
209 1 2 . 1 1 22 22 LYS H H 22 8.690 8.690 8.748 -0.058 18141
210 1 2 . 1 1 23 23 ASP N N 23 117.000 117.000 118.510 -1.510 18141
211 1 2 . 1 1 23 23 ASP HA H 23 4.370 4.370 4.489 -0.119 18141
212 1 2 . 1 1 23 23 ASP CA C 23 55.300 55.300 56.855 -1.555 18141
213 1 2 . 1 1 23 23 ASP H H 23 8.260 8.260 8.758 -0.498 18141
214 1 2 . 1 1 24 24 TRP N N 24 122.400 122.400 121.786 0.614 18141
215 1 2 . 1 1 24 24 TRP HA H 24 4.240 4.240 4.306 -0.066 18141
216 1 2 . 1 1 24 24 TRP CA C 24 59.300 59.300 60.781 -1.480 18141
217 1 2 . 1 1 24 24 TRP H H 24 7.910 7.910 8.087 -0.177 18141
218 1 2 . 1 1 25 25 CYS N N 25 117.800 117.800 117.924 -0.124 18141
219 1 2 . 1 1 25 25 CYS HA H 25 4.890 4.890 4.427 0.463 18141
220 1 2 . 1 1 25 25 CYS H H 25 9.110 9.110 7.982 1.128 18141
221 1 2 . 1 1 26 26 CYS N N 26 120.700 120.700 121.266 -0.566 18141
222 1 2 . 1 1 26 26 CYS HA H 26 4.530 4.530 4.184 0.346 18141
223 1 2 . 1 1 26 26 CYS CA C 26 58.900 58.900 63.809 -4.909 18141
224 1 2 . 1 1 26 26 CYS H H 26 8.940 8.940 8.213 0.727 18141
225 1 2 . 1 1 27 27 ASP N N 27 120.700 120.700 119.074 1.626 18141
226 1 2 . 1 1 27 27 ASP HA H 27 4.330 4.330 4.582 -0.252 18141
227 1 2 . 1 1 27 27 ASP CA C 27 57.100 57.100 56.130 0.970 18141
228 1 2 . 1 1 27 27 ASP H H 27 7.400 7.400 8.169 -0.769 18141
229 1 2 . 1 1 28 28 PHE N N 28 123.100 123.100 121.657 1.443 18141
230 1 2 . 1 1 28 28 PHE HA H 28 4.070 4.070 4.373 -0.303 18141
231 1 2 . 1 1 28 28 PHE CA C 28 60.200 60.200 61.489 -1.289 18141
232 1 2 . 1 1 28 28 PHE H H 28 8.590 8.590 7.851 0.739 18141
233 1 2 . 1 1 29 29 VAL N N 29 116.200 116.200 115.680 0.520 18141
234 1 2 . 1 1 29 29 VAL HA H 29 3.120 3.120 3.660 -0.540 18141
235 1 2 . 1 1 29 29 VAL CA C 29 66.100 66.100 66.930 -0.830 18141
236 1 2 . 1 1 29 29 VAL H H 29 7.760 7.760 8.549 -0.789 18141
237 1 2 . 1 1 30 30 LYS N N 30 117.300 117.300 119.362 -2.062 18141
238 1 2 . 1 1 30 30 LYS HA H 30 4.260 4.260 4.450 -0.190 18141
239 1 2 . 1 1 30 30 LYS H H 30 7.280 7.280 7.634 -0.354 18141
240 1 2 . 1 1 31 31 ASP N N 31 122.600 122.600 120.710 1.890 18141
241 1 2 . 1 1 31 31 ASP HA H 31 4.410 4.410 4.459 -0.049 18141
242 1 2 . 1 1 31 31 ASP CA C 31 56.800 56.800 56.382 0.418 18141
243 1 2 . 1 1 31 31 ASP H H 31 8.510 8.510 7.771 0.739 18141
244 1 2 . 1 1 32 32 ILE N N 32 112.500 112.500 113.301 -0.801 18141
245 1 2 . 1 1 32 32 ILE HA H 32 4.310 4.310 4.237 0.073 18141
246 1 2 . 1 1 32 32 ILE CA C 32 62.800 62.800 60.518 2.282 18141
247 1 2 . 1 1 32 32 ILE H H 32 7.320 7.320 7.254 0.066 18141
248 1 2 . 1 1 33 33 ARG N N 33 114.200 114.200 117.196 -2.996 18141
249 1 2 . 1 1 33 33 ARG HA H 33 3.870 3.870 3.911 -0.041 18141
250 1 2 . 1 1 33 33 ARG CA C 33 56.600 56.600 57.591 -0.991 18141
251 1 2 . 1 1 33 33 ARG H H 33 7.880 7.880 7.616 0.264 18141
252 1 2 . 1 1 34 34 MET N N 34 117.100 117.100 117.438 -0.338 18141
253 1 2 . 1 1 34 34 MET HA H 34 4.640 4.640 4.608 0.032 18141
254 1 2 . 1 1 34 34 MET CA C 34 54.300 54.300 53.058 1.242 18141
255 1 2 . 1 1 34 34 MET H H 34 7.570 7.570 7.599 -0.029 18141
256 1 2 . 1 1 35 35 ASN N N 35 118.000 118.000 120.604 -2.604 18141
257 1 2 . 1 1 35 35 ASN HA H 35 5.170 5.170 5.099 0.071 18141
258 1 2 . 1 1 35 35 ASN CA C 35 50.400 50.400 49.758 0.642 18141
259 1 2 . 1 1 35 35 ASN H H 35 8.390 8.390 8.627 -0.237 18141
260 1 2 . 1 1 37 37 PRO HA H 37 4.320 4.320 4.516 -0.196 18141
261 1 2 . 1 1 37 37 PRO CA C 37 61.200 61.200 62.273 -1.073 18141
262 1 2 . 1 1 38 38 ALA N N 38 114.400 114.400 126.505 -12.105 18141
263 1 2 . 1 1 38 38 ALA HA H 38 3.990 3.990 4.157 -0.167 18141
264 1 2 . 1 1 38 38 ALA CA C 38 54.400 54.400 54.162 0.238 18141
265 1 2 . 1 1 38 38 ALA H H 38 8.770 8.770 8.499 0.271 18141
266 1 2 . 1 1 39 39 ASP N N 39 112.400 112.400 117.558 -5.158 18141
267 1 2 . 1 1 39 39 ASP HA H 39 4.310 4.310 4.539 -0.229 18141
268 1 2 . 1 1 39 39 ASP H H 39 8.710 8.710 8.245 0.465 18141
269 1 2 . 1 1 40 40 LYS N N 40 117.000 117.000 118.640 -1.640 18141
270 1 2 . 1 1 40 40 LYS HA H 40 4.370 4.370 4.347 0.023 18141
271 1 2 . 1 1 40 40 LYS CA C 40 57.000 57.000 56.722 0.278 18141
272 1 2 . 1 1 40 40 LYS H H 40 6.990 6.990 7.850 -0.860 18141
273 1 2 . 1 1 41 41 CYS N N 41 121.600 121.600 119.791 1.809 18141
274 1 2 . 1 1 41 41 CYS HA H 41 5.180 5.180 4.777 0.403 18141
275 1 2 . 1 1 41 41 CYS CA C 41 50.900 50.900 54.685 -3.785 18141
276 1 2 . 1 1 41 41 CYS H H 41 7.520 7.520 7.599 -0.079 18141
277 1 3 . 1 1 2 2 PRO HA H 2 4.370 4.370 4.702 -0.332 18141
278 1 3 . 1 1 2 2 PRO CA C 2 62.800 62.800 62.906 -0.106 18141
279 1 3 . 1 1 3 3 TYR N N 3 120.600 120.600 124.479 -3.879 18141
280 1 3 . 1 1 3 3 TYR HA H 3 4.310 4.310 4.609 -0.299 18141
281 1 3 . 1 1 3 3 TYR H H 3 8.160 8.160 8.422 -0.262 18141
282 1 3 . 1 1 4 4 CYS N N 4 119.100 119.100 114.228 4.872 18141
283 1 3 . 1 1 4 4 CYS HA H 4 3.330 3.330 4.465 -1.135 18141
284 1 3 . 1 1 4 4 CYS CA C 4 53.500 53.500 59.113 -5.613 18141
285 1 3 . 1 1 4 4 CYS H H 4 7.700 7.700 8.045 -0.345 18141
286 1 3 . 1 1 5 5 GLY N N 5 107.900 107.900 109.665 -1.765 18141
287 1 3 . 1 1 5 5 GLY CA C 5 43.700 43.700 45.504 -1.804 18141
288 1 3 . 1 1 5 5 GLY H H 5 5.930 5.930 7.340 -1.410 18141
289 1 3 . 1 1 6 6 GLN N N 6 114.200 114.200 120.405 -6.205 18141
290 1 3 . 1 1 6 6 GLN HA H 6 4.420 4.420 4.127 0.293 18141
291 1 3 . 1 1 6 6 GLN CA C 6 56.200 56.200 57.328 -1.128 18141
292 1 3 . 1 1 6 6 GLN H H 6 8.710 8.710 8.790 -0.080 18141
293 1 3 . 1 1 7 7 THR N N 7 106.600 106.600 107.436 -0.836 18141
294 1 3 . 1 1 7 7 THR HA H 7 4.780 4.780 4.536 0.244 18141
295 1 3 . 1 1 7 7 THR CA C 7 58.700 58.700 59.557 -0.857 18141
296 1 3 . 1 1 7 7 THR H H 7 7.300 7.300 7.250 0.050 18141
297 1 3 . 1 1 8 8 GLY N N 8 110.400 110.400 106.919 3.481 18141
298 1 3 . 1 1 8 8 GLY CA C 8 48.000 48.000 46.459 1.540 18141
299 1 3 . 1 1 8 8 GLY H H 8 9.260 9.260 8.696 0.564 18141
300 1 3 . 1 1 9 9 ALA N N 9 123.400 123.400 121.303 2.097 18141
301 1 3 . 1 1 9 9 ALA HA H 9 4.090 4.090 4.072 0.018 18141
302 1 3 . 1 1 9 9 ALA CA C 9 55.600 55.600 53.823 1.777 18141
303 1 3 . 1 1 9 9 ALA H H 9 8.490 8.490 8.469 0.021 18141
304 1 3 . 1 1 10 10 GLU N N 10 119.500 119.500 117.795 1.705 18141
305 1 3 . 1 1 10 10 GLU HA H 10 4.230 4.230 4.335 -0.105 18141
306 1 3 . 1 1 10 10 GLU CA C 10 59.300 59.300 59.174 0.126 18141
307 1 3 . 1 1 10 10 GLU H H 10 7.790 7.790 7.979 -0.189 18141
308 1 3 . 1 1 11 11 CYS N N 11 118.300 118.300 117.896 0.404 18141
309 1 3 . 1 1 11 11 CYS HA H 11 4.850 4.850 4.466 0.384 18141
310 1 3 . 1 1 11 11 CYS H H 11 8.460 8.460 7.824 0.636 18141
311 1 3 . 1 1 12 12 TYR N N 12 121.800 121.800 122.062 -0.262 18141
312 1 3 . 1 1 12 12 TYR HA H 12 4.020 4.020 4.137 -0.117 18141
313 1 3 . 1 1 12 12 TYR H H 12 8.860 8.860 8.152 0.708 18141
314 1 3 . 1 1 13 13 SER N N 13 114.500 114.500 114.646 -0.146 18141
315 1 3 . 1 1 13 13 SER HA H 13 4.130 4.130 3.675 0.455 18141
316 1 3 . 1 1 13 13 SER CA C 13 62.600 62.600 60.854 1.746 18141
317 1 3 . 1 1 13 13 SER H H 13 7.910 7.910 7.818 0.092 18141
318 1 3 . 1 1 14 14 TRP N N 14 122.400 122.400 122.745 -0.345 18141
319 1 3 . 1 1 14 14 TRP HA H 14 4.020 4.020 4.326 -0.306 18141
320 1 3 . 1 1 14 14 TRP H H 14 8.680 8.680 8.057 0.623 18141
321 1 3 . 1 1 15 15 CYS N N 15 120.500 120.500 118.007 2.493 18141
322 1 3 . 1 1 15 15 CYS HA H 15 3.530 3.530 3.287 0.243 18141
323 1 3 . 1 1 15 15 CYS CA C 15 60.500 60.500 61.579 -1.079 18141
324 1 3 . 1 1 15 15 CYS H H 15 8.120 8.120 8.186 -0.066 18141
325 1 3 . 1 1 16 16 ILE N N 16 120.300 120.300 120.097 0.203 18141
326 1 3 . 1 1 16 16 ILE HA H 16 3.930 3.930 4.026 -0.096 18141
327 1 3 . 1 1 16 16 ILE CA C 16 61.700 61.700 63.418 -1.718 18141
328 1 3 . 1 1 16 16 ILE H H 16 8.250 8.250 7.491 0.759 18141
329 1 3 . 1 1 17 17 LYS N N 17 121.700 121.700 121.110 0.590 18141
330 1 3 . 1 1 17 17 LYS HA H 17 4.100 4.100 3.897 0.203 18141
331 1 3 . 1 1 17 17 LYS CA C 17 58.100 58.100 58.328 -0.229 18141
332 1 3 . 1 1 17 17 LYS H H 17 7.800 7.800 8.124 -0.324 18141
333 1 3 . 1 1 18 18 GLN N N 18 117.600 117.600 116.970 0.630 18141
334 1 3 . 1 1 18 18 GLN HA H 18 4.030 4.030 4.152 -0.122 18141
335 1 3 . 1 1 18 18 GLN H H 18 7.240 7.240 7.450 -0.210 18141
336 1 3 . 1 1 19 19 ASP N N 19 121.800 121.800 117.752 4.048 18141
337 1 3 . 1 1 19 19 ASP HA H 19 4.320 4.320 4.269 0.051 18141
338 1 3 . 1 1 19 19 ASP H H 19 8.050 8.050 8.136 -0.086 18141
339 1 3 . 1 1 20 20 LEU N N 20 119.400 119.400 115.771 3.629 18141
340 1 3 . 1 1 20 20 LEU HA H 20 4.300 4.300 4.534 -0.234 18141
341 1 3 . 1 1 20 20 LEU H H 20 6.430 6.430 8.127 -1.697 18141
342 1 3 . 1 1 21 21 SER N N 21 115.500 115.500 113.411 2.089 18141
343 1 3 . 1 1 21 21 SER HA H 21 4.290 4.290 4.460 -0.170 18141
344 1 3 . 1 1 21 21 SER H H 21 8.260 8.260 7.484 0.776 18141
345 1 3 . 1 1 22 22 LYS N N 22 122.700 122.700 122.717 -0.017 18141
346 1 3 . 1 1 22 22 LYS HA H 22 4.020 4.020 4.308 -0.288 18141
347 1 3 . 1 1 22 22 LYS H H 22 8.690 8.690 8.619 0.071 18141
348 1 3 . 1 1 23 23 ASP N N 23 117.000 117.000 120.781 -3.781 18141
349 1 3 . 1 1 23 23 ASP HA H 23 4.370 4.370 4.611 -0.241 18141
350 1 3 . 1 1 23 23 ASP CA C 23 55.300 55.300 56.392 -1.092 18141
351 1 3 . 1 1 23 23 ASP H H 23 8.260 8.260 7.932 0.328 18141
352 1 3 . 1 1 24 24 TRP N N 24 122.400 122.400 121.267 1.133 18141
353 1 3 . 1 1 24 24 TRP HA H 24 4.240 4.240 4.278 -0.038 18141
354 1 3 . 1 1 24 24 TRP CA C 24 59.300 59.300 60.552 -1.252 18141
355 1 3 . 1 1 24 24 TRP H H 24 7.910 7.910 8.282 -0.372 18141
356 1 3 . 1 1 25 25 CYS N N 25 117.800 117.800 117.944 -0.144 18141
357 1 3 . 1 1 25 25 CYS HA H 25 4.890 4.890 3.730 1.160 18141
358 1 3 . 1 1 25 25 CYS H H 25 9.110 9.110 7.760 1.350 18141
359 1 3 . 1 1 26 26 CYS N N 26 120.700 120.700 120.845 -0.145 18141
360 1 3 . 1 1 26 26 CYS HA H 26 4.530 4.530 4.078 0.452 18141
361 1 3 . 1 1 26 26 CYS CA C 26 58.900 58.900 64.537 -5.637 18141
362 1 3 . 1 1 26 26 CYS H H 26 8.940 8.940 7.936 1.004 18141
363 1 3 . 1 1 27 27 ASP N N 27 120.700 120.700 118.762 1.938 18141
364 1 3 . 1 1 27 27 ASP HA H 27 4.330 4.330 4.575 -0.245 18141
365 1 3 . 1 1 27 27 ASP CA C 27 57.100 57.100 57.237 -0.137 18141
366 1 3 . 1 1 27 27 ASP H H 27 7.400 7.400 7.857 -0.457 18141
367 1 3 . 1 1 28 28 PHE N N 28 123.100 123.100 120.908 2.192 18141
368 1 3 . 1 1 28 28 PHE HA H 28 4.070 4.070 4.103 -0.033 18141
369 1 3 . 1 1 28 28 PHE CA C 28 60.200 60.200 60.890 -0.690 18141
370 1 3 . 1 1 28 28 PHE H H 28 8.590 8.590 7.162 1.428 18141
371 1 3 . 1 1 29 29 VAL N N 29 116.200 116.200 113.965 2.235 18141
372 1 3 . 1 1 29 29 VAL HA H 29 3.120 3.120 3.731 -0.611 18141
373 1 3 . 1 1 29 29 VAL CA C 29 66.100 66.100 65.820 0.280 18141
374 1 3 . 1 1 29 29 VAL H H 29 7.760 7.760 8.201 -0.441 18141
375 1 3 . 1 1 30 30 LYS N N 30 117.300 117.300 119.824 -2.524 18141
376 1 3 . 1 1 30 30 LYS HA H 30 4.260 4.260 4.082 0.178 18141
377 1 3 . 1 1 30 30 LYS H H 30 7.280 7.280 7.507 -0.227 18141
378 1 3 . 1 1 31 31 ASP N N 31 122.600 122.600 118.620 3.980 18141
379 1 3 . 1 1 31 31 ASP HA H 31 4.410 4.410 4.519 -0.109 18141
380 1 3 . 1 1 31 31 ASP CA C 31 56.800 56.800 55.975 0.825 18141
381 1 3 . 1 1 31 31 ASP H H 31 8.510 8.510 7.565 0.945 18141
382 1 3 . 1 1 32 32 ILE N N 32 112.500 112.500 113.639 -1.139 18141
383 1 3 . 1 1 32 32 ILE HA H 32 4.310 4.310 4.318 -0.008 18141
384 1 3 . 1 1 32 32 ILE CA C 32 62.800 62.800 60.297 2.503 18141
385 1 3 . 1 1 32 32 ILE H H 32 7.320 7.320 7.130 0.190 18141
386 1 3 . 1 1 33 33 ARG N N 33 114.200 114.200 118.600 -4.400 18141
387 1 3 . 1 1 33 33 ARG HA H 33 3.870 3.870 3.928 -0.058 18141
388 1 3 . 1 1 33 33 ARG CA C 33 56.600 56.600 57.399 -0.799 18141
389 1 3 . 1 1 33 33 ARG H H 33 7.880 7.880 7.903 -0.023 18141
390 1 3 . 1 1 34 34 MET N N 34 117.100 117.100 115.992 1.108 18141
391 1 3 . 1 1 34 34 MET HA H 34 4.640 4.640 4.753 -0.113 18141
392 1 3 . 1 1 34 34 MET CA C 34 54.300 54.300 53.432 0.868 18141
393 1 3 . 1 1 34 34 MET H H 34 7.570 7.570 7.914 -0.344 18141
394 1 3 . 1 1 35 35 ASN N N 35 118.000 118.000 118.930 -0.930 18141
395 1 3 . 1 1 35 35 ASN HA H 35 5.170 5.170 5.130 0.040 18141
396 1 3 . 1 1 35 35 ASN CA C 35 50.400 50.400 50.946 -0.546 18141
397 1 3 . 1 1 35 35 ASN H H 35 8.390 8.390 8.477 -0.087 18141
398 1 3 . 1 1 37 37 PRO HA H 37 4.320 4.320 4.428 -0.108 18141
399 1 3 . 1 1 37 37 PRO CA C 37 61.200 61.200 62.175 -0.975 18141
400 1 3 . 1 1 38 38 ALA N N 38 114.400 114.400 123.836 -9.436 18141
401 1 3 . 1 1 38 38 ALA HA H 38 3.990 3.990 4.259 -0.269 18141
402 1 3 . 1 1 38 38 ALA CA C 38 54.400 54.400 52.368 2.031 18141
403 1 3 . 1 1 38 38 ALA H H 38 8.770 8.770 8.364 0.406 18141
404 1 3 . 1 1 39 39 ASP N N 39 112.400 112.400 118.853 -6.453 18141
405 1 3 . 1 1 39 39 ASP HA H 39 4.310 4.310 4.615 -0.305 18141
406 1 3 . 1 1 39 39 ASP H H 39 8.710 8.710 7.985 0.725 18141
407 1 3 . 1 1 40 40 LYS N N 40 117.000 117.000 118.078 -1.078 18141
408 1 3 . 1 1 40 40 LYS HA H 40 4.370 4.370 4.494 -0.124 18141
409 1 3 . 1 1 40 40 LYS CA C 40 57.000 57.000 54.905 2.095 18141
410 1 3 . 1 1 40 40 LYS H H 40 6.990 6.990 8.268 -1.278 18141
411 1 3 . 1 1 41 41 CYS N N 41 121.600 121.600 120.695 0.905 18141
412 1 3 . 1 1 41 41 CYS HA H 41 5.180 5.180 4.823 0.357 18141
413 1 3 . 1 1 41 41 CYS CA C 41 50.900 50.900 56.033 -5.133 18141
414 1 3 . 1 1 41 41 CYS H H 41 7.520 7.520 7.837 -0.317 18141
415 1 4 . 1 1 2 2 PRO HA H 2 4.370 4.370 4.632 -0.262 18141
416 1 4 . 1 1 2 2 PRO CA C 2 62.800 62.800 62.949 -0.149 18141
417 1 4 . 1 1 3 3 TYR N N 3 120.600 120.600 119.495 1.105 18141
418 1 4 . 1 1 3 3 TYR HA H 3 4.310 4.310 4.781 -0.471 18141
419 1 4 . 1 1 3 3 TYR H H 3 8.160 8.160 8.046 0.114 18141
420 1 4 . 1 1 4 4 CYS N N 4 119.100 119.100 122.397 -3.297 18141
421 1 4 . 1 1 4 4 CYS HA H 4 3.330 3.330 4.505 -1.175 18141
422 1 4 . 1 1 4 4 CYS CA C 4 53.500 53.500 58.766 -5.266 18141
423 1 4 . 1 1 4 4 CYS H H 4 7.700 7.700 8.839 -1.139 18141
424 1 4 . 1 1 5 5 GLY N N 5 107.900 107.900 112.281 -4.381 18141
425 1 4 . 1 1 5 5 GLY CA C 5 43.700 43.700 45.174 -1.474 18141
426 1 4 . 1 1 5 5 GLY H H 5 5.930 5.930 8.042 -2.112 18141
427 1 4 . 1 1 6 6 GLN N N 6 114.200 114.200 118.472 -4.272 18141
428 1 4 . 1 1 6 6 GLN HA H 6 4.420 4.420 3.859 0.561 18141
429 1 4 . 1 1 6 6 GLN CA C 6 56.200 56.200 57.002 -0.801 18141
430 1 4 . 1 1 6 6 GLN H H 6 8.710 8.710 8.744 -0.034 18141
431 1 4 . 1 1 7 7 THR N N 7 106.600 106.600 107.437 -0.837 18141
432 1 4 . 1 1 7 7 THR HA H 7 4.780 4.780 4.623 0.157 18141
433 1 4 . 1 1 7 7 THR CA C 7 58.700 58.700 59.438 -0.738 18141
434 1 4 . 1 1 7 7 THR H H 7 7.300 7.300 7.517 -0.217 18141
435 1 4 . 1 1 8 8 GLY N N 8 110.400 110.400 110.846 -0.446 18141
436 1 4 . 1 1 8 8 GLY CA C 8 48.000 48.000 46.652 1.348 18141
437 1 4 . 1 1 8 8 GLY H H 8 9.260 9.260 8.993 0.267 18141
438 1 4 . 1 1 9 9 ALA N N 9 123.400 123.400 123.373 0.027 18141
439 1 4 . 1 1 9 9 ALA HA H 9 4.090 4.090 3.964 0.126 18141
440 1 4 . 1 1 9 9 ALA CA C 9 55.600 55.600 55.250 0.350 18141
441 1 4 . 1 1 9 9 ALA H H 9 8.490 8.490 7.612 0.878 18141
442 1 4 . 1 1 10 10 GLU N N 10 119.500 119.500 117.157 2.343 18141
443 1 4 . 1 1 10 10 GLU HA H 10 4.230 4.230 4.110 0.120 18141
444 1 4 . 1 1 10 10 GLU CA C 10 59.300 59.300 59.148 0.152 18141
445 1 4 . 1 1 10 10 GLU H H 10 7.790 7.790 8.464 -0.674 18141
446 1 4 . 1 1 11 11 CYS N N 11 118.300 118.300 119.000 -0.700 18141
447 1 4 . 1 1 11 11 CYS HA H 11 4.850 4.850 4.691 0.159 18141
448 1 4 . 1 1 11 11 CYS H H 11 8.460 8.460 7.665 0.795 18141
449 1 4 . 1 1 12 12 TYR N N 12 121.800 121.800 122.295 -0.495 18141
450 1 4 . 1 1 12 12 TYR HA H 12 4.020 4.020 4.208 -0.188 18141
451 1 4 . 1 1 12 12 TYR H H 12 8.860 8.860 8.987 -0.127 18141
452 1 4 . 1 1 13 13 SER N N 13 114.500 114.500 113.941 0.559 18141
453 1 4 . 1 1 13 13 SER HA H 13 4.130 4.130 3.819 0.311 18141
454 1 4 . 1 1 13 13 SER CA C 13 62.600 62.600 60.224 2.376 18141
455 1 4 . 1 1 13 13 SER H H 13 7.910 7.910 7.612 0.298 18141
456 1 4 . 1 1 14 14 TRP N N 14 122.400 122.400 123.602 -1.202 18141
457 1 4 . 1 1 14 14 TRP HA H 14 4.020 4.020 4.668 -0.648 18141
458 1 4 . 1 1 14 14 TRP H H 14 8.680 8.680 8.168 0.512 18141
459 1 4 . 1 1 15 15 CYS N N 15 120.500 120.500 118.296 2.204 18141
460 1 4 . 1 1 15 15 CYS HA H 15 3.530 3.530 3.519 0.011 18141
461 1 4 . 1 1 15 15 CYS CA C 15 60.500 60.500 61.488 -0.988 18141
462 1 4 . 1 1 15 15 CYS H H 15 8.120 8.120 8.364 -0.244 18141
463 1 4 . 1 1 16 16 ILE N N 16 120.300 120.300 121.492 -1.192 18141
464 1 4 . 1 1 16 16 ILE HA H 16 3.930 3.930 4.182 -0.252 18141
465 1 4 . 1 1 16 16 ILE CA C 16 61.700 61.700 62.545 -0.845 18141
466 1 4 . 1 1 16 16 ILE H H 16 8.250 8.250 7.587 0.663 18141
467 1 4 . 1 1 17 17 LYS N N 17 121.700 121.700 121.242 0.458 18141
468 1 4 . 1 1 17 17 LYS HA H 17 4.100 4.100 3.940 0.160 18141
469 1 4 . 1 1 17 17 LYS CA C 17 58.100 58.100 59.045 -0.945 18141
470 1 4 . 1 1 17 17 LYS H H 17 7.800 7.800 8.668 -0.868 18141
471 1 4 . 1 1 18 18 GLN N N 18 117.600 117.600 115.892 1.708 18141
472 1 4 . 1 1 18 18 GLN HA H 18 4.030 4.030 3.988 0.042 18141
473 1 4 . 1 1 18 18 GLN H H 18 7.240 7.240 7.432 -0.192 18141
474 1 4 . 1 1 19 19 ASP N N 19 121.800 121.800 116.655 5.145 18141
475 1 4 . 1 1 19 19 ASP HA H 19 4.320 4.320 4.330 -0.010 18141
476 1 4 . 1 1 19 19 ASP H H 19 8.050 8.050 8.098 -0.048 18141
477 1 4 . 1 1 20 20 LEU N N 20 119.400 119.400 117.263 2.137 18141
478 1 4 . 1 1 20 20 LEU HA H 20 4.300 4.300 4.198 0.102 18141
479 1 4 . 1 1 20 20 LEU H H 20 6.430 6.430 7.956 -1.526 18141
480 1 4 . 1 1 21 21 SER N N 21 115.500 115.500 109.476 6.024 18141
481 1 4 . 1 1 21 21 SER HA H 21 4.290 4.290 4.534 -0.244 18141
482 1 4 . 1 1 21 21 SER H H 21 8.260 8.260 7.564 0.696 18141
483 1 4 . 1 1 22 22 LYS N N 22 122.700 122.700 122.603 0.097 18141
484 1 4 . 1 1 22 22 LYS HA H 22 4.020 4.020 4.078 -0.058 18141
485 1 4 . 1 1 22 22 LYS H H 22 8.690 8.690 8.793 -0.103 18141
486 1 4 . 1 1 23 23 ASP N N 23 117.000 117.000 117.903 -0.903 18141
487 1 4 . 1 1 23 23 ASP HA H 23 4.370 4.370 4.579 -0.209 18141
488 1 4 . 1 1 23 23 ASP CA C 23 55.300 55.300 55.465 -0.166 18141
489 1 4 . 1 1 23 23 ASP H H 23 8.260 8.260 8.581 -0.321 18141
490 1 4 . 1 1 24 24 TRP N N 24 122.400 122.400 120.794 1.606 18141
491 1 4 . 1 1 24 24 TRP HA H 24 4.240 4.240 4.428 -0.188 18141
492 1 4 . 1 1 24 24 TRP CA C 24 59.300 59.300 60.295 -0.995 18141
493 1 4 . 1 1 24 24 TRP H H 24 7.910 7.910 7.919 -0.009 18141
494 1 4 . 1 1 25 25 CYS N N 25 117.800 117.800 118.053 -0.253 18141
495 1 4 . 1 1 25 25 CYS HA H 25 4.890 4.890 3.407 1.483 18141
496 1 4 . 1 1 25 25 CYS H H 25 9.110 9.110 7.374 1.736 18141
497 1 4 . 1 1 26 26 CYS N N 26 120.700 120.700 119.747 0.953 18141
498 1 4 . 1 1 26 26 CYS HA H 26 4.530 4.530 3.895 0.635 18141
499 1 4 . 1 1 26 26 CYS CA C 26 58.900 58.900 63.801 -4.901 18141
500 1 4 . 1 1 26 26 CYS H H 26 8.940 8.940 7.865 1.075 18141
501 1 4 . 1 1 27 27 ASP N N 27 120.700 120.700 118.307 2.393 18141
502 1 4 . 1 1 27 27 ASP HA H 27 4.330 4.330 4.537 -0.207 18141
503 1 4 . 1 1 27 27 ASP CA C 27 57.100 57.100 56.162 0.938 18141
504 1 4 . 1 1 27 27 ASP H H 27 7.400 7.400 7.637 -0.237 18141
505 1 4 . 1 1 28 28 PHE N N 28 123.100 123.100 121.215 1.885 18141
506 1 4 . 1 1 28 28 PHE HA H 28 4.070 4.070 4.074 -0.004 18141
507 1 4 . 1 1 28 28 PHE CA C 28 60.200 60.200 60.885 -0.685 18141
508 1 4 . 1 1 28 28 PHE H H 28 8.590 8.590 7.758 0.832 18141
509 1 4 . 1 1 29 29 VAL N N 29 116.200 116.200 115.352 0.848 18141
510 1 4 . 1 1 29 29 VAL HA H 29 3.120 3.120 3.384 -0.264 18141
511 1 4 . 1 1 29 29 VAL CA C 29 66.100 66.100 66.178 -0.078 18141
512 1 4 . 1 1 29 29 VAL H H 29 7.760 7.760 7.569 0.191 18141
513 1 4 . 1 1 30 30 LYS N N 30 117.300 117.300 119.983 -2.683 18141
514 1 4 . 1 1 30 30 LYS HA H 30 4.260 4.260 3.958 0.302 18141
515 1 4 . 1 1 30 30 LYS H H 30 7.280 7.280 7.383 -0.103 18141
516 1 4 . 1 1 31 31 ASP N N 31 122.600 122.600 120.278 2.322 18141
517 1 4 . 1 1 31 31 ASP HA H 31 4.410 4.410 4.516 -0.106 18141
518 1 4 . 1 1 31 31 ASP CA C 31 56.800 56.800 56.578 0.222 18141
519 1 4 . 1 1 31 31 ASP H H 31 8.510 8.510 7.708 0.802 18141
520 1 4 . 1 1 32 32 ILE N N 32 112.500 112.500 112.901 -0.401 18141
521 1 4 . 1 1 32 32 ILE HA H 32 4.310 4.310 4.194 0.116 18141
522 1 4 . 1 1 32 32 ILE CA C 32 62.800 62.800 61.025 1.776 18141
523 1 4 . 1 1 32 32 ILE H H 32 7.320 7.320 7.219 0.101 18141
524 1 4 . 1 1 33 33 ARG N N 33 114.200 114.200 117.439 -3.239 18141
525 1 4 . 1 1 33 33 ARG HA H 33 3.870 3.870 3.900 -0.030 18141
526 1 4 . 1 1 33 33 ARG CA C 33 56.600 56.600 57.200 -0.600 18141
527 1 4 . 1 1 33 33 ARG H H 33 7.880 7.880 7.426 0.454 18141
528 1 4 . 1 1 34 34 MET N N 34 117.100 117.100 117.784 -0.684 18141
529 1 4 . 1 1 34 34 MET HA H 34 4.640 4.640 4.481 0.159 18141
530 1 4 . 1 1 34 34 MET CA C 34 54.300 54.300 53.898 0.402 18141
531 1 4 . 1 1 34 34 MET H H 34 7.570 7.570 7.503 0.067 18141
532 1 4 . 1 1 35 35 ASN N N 35 118.000 118.000 120.110 -2.110 18141
533 1 4 . 1 1 35 35 ASN HA H 35 5.170 5.170 5.086 0.084 18141
534 1 4 . 1 1 35 35 ASN CA C 35 50.400 50.400 51.282 -0.882 18141
535 1 4 . 1 1 35 35 ASN H H 35 8.390 8.390 8.591 -0.201 18141
536 1 4 . 1 1 37 37 PRO HA H 37 4.320 4.320 4.470 -0.150 18141
537 1 4 . 1 1 37 37 PRO CA C 37 61.200 61.200 62.318 -1.117 18141
538 1 4 . 1 1 38 38 ALA N N 38 114.400 114.400 126.240 -11.840 18141
539 1 4 . 1 1 38 38 ALA HA H 38 3.990 3.990 4.095 -0.105 18141
540 1 4 . 1 1 38 38 ALA CA C 38 54.400 54.400 53.238 1.162 18141
541 1 4 . 1 1 38 38 ALA H H 38 8.770 8.770 8.434 0.336 18141
542 1 4 . 1 1 39 39 ASP N N 39 112.400 112.400 115.661 -3.261 18141
543 1 4 . 1 1 39 39 ASP HA H 39 4.310 4.310 4.735 -0.425 18141
544 1 4 . 1 1 39 39 ASP H H 39 8.710 8.710 7.930 0.780 18141
545 1 4 . 1 1 40 40 LYS N N 40 117.000 117.000 118.619 -1.619 18141
546 1 4 . 1 1 40 40 LYS HA H 40 4.370 4.370 4.377 -0.007 18141
547 1 4 . 1 1 40 40 LYS CA C 40 57.000 57.000 56.698 0.302 18141
548 1 4 . 1 1 40 40 LYS H H 40 6.990 6.990 7.725 -0.735 18141
549 1 4 . 1 1 41 41 CYS N N 41 121.600 121.600 121.119 0.481 18141
550 1 4 . 1 1 41 41 CYS HA H 41 5.180 5.180 4.875 0.305 18141
551 1 4 . 1 1 41 41 CYS CA C 41 50.900 50.900 56.911 -6.011 18141
552 1 4 . 1 1 41 41 CYS H H 41 7.520 7.520 8.101 -0.581 18141
553 1 5 . 1 1 2 2 PRO HA H 2 4.370 4.370 5.095 -0.725 18141
554 1 5 . 1 1 2 2 PRO CA C 2 62.800 62.800 62.546 0.254 18141
555 1 5 . 1 1 3 3 TYR N N 3 120.600 120.600 121.446 -0.846 18141
556 1 5 . 1 1 3 3 TYR HA H 3 4.310 4.310 4.778 -0.468 18141
557 1 5 . 1 1 3 3 TYR H H 3 8.160 8.160 8.203 -0.043 18141
558 1 5 . 1 1 4 4 CYS N N 4 119.100 119.100 118.236 0.864 18141
559 1 5 . 1 1 4 4 CYS HA H 4 3.330 3.330 4.104 -0.774 18141
560 1 5 . 1 1 4 4 CYS CA C 4 53.500 53.500 59.210 -5.710 18141
561 1 5 . 1 1 4 4 CYS H H 4 7.700 7.700 8.007 -0.307 18141
562 1 5 . 1 1 5 5 GLY N N 5 107.900 107.900 110.287 -2.387 18141
563 1 5 . 1 1 5 5 GLY CA C 5 43.700 43.700 45.866 -2.166 18141
564 1 5 . 1 1 5 5 GLY H H 5 5.930 5.930 8.261 -2.331 18141
565 1 5 . 1 1 6 6 GLN N N 6 114.200 114.200 120.047 -5.847 18141
566 1 5 . 1 1 6 6 GLN HA H 6 4.420 4.420 4.477 -0.057 18141
567 1 5 . 1 1 6 6 GLN CA C 6 56.200 56.200 55.640 0.560 18141
568 1 5 . 1 1 6 6 GLN H H 6 8.710 8.710 8.292 0.418 18141
569 1 5 . 1 1 7 7 THR N N 7 106.600 106.600 107.860 -1.260 18141
570 1 5 . 1 1 7 7 THR HA H 7 4.780 4.780 4.674 0.106 18141
571 1 5 . 1 1 7 7 THR CA C 7 58.700 58.700 60.097 -1.397 18141
572 1 5 . 1 1 7 7 THR H H 7 7.300 7.300 7.434 -0.134 18141
573 1 5 . 1 1 8 8 GLY N N 8 110.400 110.400 106.648 3.752 18141
574 1 5 . 1 1 8 8 GLY CA C 8 48.000 48.000 46.108 1.892 18141
575 1 5 . 1 1 8 8 GLY H H 8 9.260 9.260 8.389 0.871 18141
576 1 5 . 1 1 9 9 ALA N N 9 123.400 123.400 122.564 0.836 18141
577 1 5 . 1 1 9 9 ALA HA H 9 4.090 4.090 4.137 -0.047 18141
578 1 5 . 1 1 9 9 ALA CA C 9 55.600 55.600 54.487 1.113 18141
579 1 5 . 1 1 9 9 ALA H H 9 8.490 8.490 8.178 0.312 18141
580 1 5 . 1 1 10 10 GLU N N 10 119.500 119.500 118.110 1.390 18141
581 1 5 . 1 1 10 10 GLU HA H 10 4.230 4.230 4.111 0.119 18141
582 1 5 . 1 1 10 10 GLU CA C 10 59.300 59.300 59.063 0.237 18141
583 1 5 . 1 1 10 10 GLU H H 10 7.790 7.790 7.947 -0.157 18141
584 1 5 . 1 1 11 11 CYS N N 11 118.300 118.300 118.600 -0.300 18141
585 1 5 . 1 1 11 11 CYS HA H 11 4.850 4.850 4.503 0.347 18141
586 1 5 . 1 1 11 11 CYS H H 11 8.460 8.460 7.716 0.744 18141
587 1 5 . 1 1 12 12 TYR N N 12 121.800 121.800 120.850 0.950 18141
588 1 5 . 1 1 12 12 TYR HA H 12 4.020 4.020 4.174 -0.154 18141
589 1 5 . 1 1 12 12 TYR H H 12 8.860 8.860 8.345 0.515 18141
590 1 5 . 1 1 13 13 SER N N 13 114.500 114.500 114.513 -0.013 18141
591 1 5 . 1 1 13 13 SER HA H 13 4.130 4.130 3.786 0.344 18141
592 1 5 . 1 1 13 13 SER CA C 13 62.600 62.600 60.649 1.951 18141
593 1 5 . 1 1 13 13 SER H H 13 7.910 7.910 7.460 0.450 18141
594 1 5 . 1 1 14 14 TRP N N 14 122.400 122.400 124.118 -1.718 18141
595 1 5 . 1 1 14 14 TRP HA H 14 4.020 4.020 4.231 -0.211 18141
596 1 5 . 1 1 14 14 TRP H H 14 8.680 8.680 7.774 0.906 18141
597 1 5 . 1 1 15 15 CYS N N 15 120.500 120.500 116.032 4.468 18141
598 1 5 . 1 1 15 15 CYS HA H 15 3.530 3.530 3.303 0.227 18141
599 1 5 . 1 1 15 15 CYS CA C 15 60.500 60.500 61.796 -1.296 18141
600 1 5 . 1 1 15 15 CYS H H 15 8.120 8.120 8.549 -0.429 18141
601 1 5 . 1 1 16 16 ILE N N 16 120.300 120.300 122.267 -1.967 18141
602 1 5 . 1 1 16 16 ILE HA H 16 3.930 3.930 3.990 -0.060 18141
603 1 5 . 1 1 16 16 ILE CA C 16 61.700 61.700 63.395 -1.695 18141
604 1 5 . 1 1 16 16 ILE H H 16 8.250 8.250 7.981 0.269 18141
605 1 5 . 1 1 17 17 LYS N N 17 121.700 121.700 121.141 0.559 18141
606 1 5 . 1 1 17 17 LYS HA H 17 4.100 4.100 3.919 0.181 18141
607 1 5 . 1 1 17 17 LYS CA C 17 58.100 58.100 58.686 -0.586 18141
608 1 5 . 1 1 17 17 LYS H H 17 7.800 7.800 8.497 -0.697 18141
609 1 5 . 1 1 18 18 GLN N N 18 117.600 117.600 117.334 0.266 18141
610 1 5 . 1 1 18 18 GLN HA H 18 4.030 4.030 4.002 0.028 18141
611 1 5 . 1 1 18 18 GLN H H 18 7.240 7.240 7.563 -0.323 18141
612 1 5 . 1 1 19 19 ASP N N 19 121.800 121.800 115.984 5.816 18141
613 1 5 . 1 1 19 19 ASP HA H 19 4.320 4.320 4.278 0.042 18141
614 1 5 . 1 1 19 19 ASP H H 19 8.050 8.050 8.116 -0.066 18141
615 1 5 . 1 1 20 20 LEU N N 20 119.400 119.400 116.899 2.501 18141
616 1 5 . 1 1 20 20 LEU HA H 20 4.300 4.300 4.024 0.276 18141
617 1 5 . 1 1 20 20 LEU H H 20 6.430 6.430 8.016 -1.586 18141
618 1 5 . 1 1 21 21 SER N N 21 115.500 115.500 107.810 7.690 18141
619 1 5 . 1 1 21 21 SER HA H 21 4.290 4.290 4.649 -0.359 18141
620 1 5 . 1 1 21 21 SER H H 21 8.260 8.260 7.791 0.469 18141
621 1 5 . 1 1 22 22 LYS N N 22 122.700 122.700 119.296 3.404 18141
622 1 5 . 1 1 22 22 LYS HA H 22 4.020 4.020 4.228 -0.208 18141
623 1 5 . 1 1 22 22 LYS H H 22 8.690 8.690 8.782 -0.092 18141
624 1 5 . 1 1 23 23 ASP N N 23 117.000 117.000 120.703 -3.703 18141
625 1 5 . 1 1 23 23 ASP HA H 23 4.370 4.370 4.608 -0.238 18141
626 1 5 . 1 1 23 23 ASP CA C 23 55.300 55.300 56.312 -1.012 18141
627 1 5 . 1 1 23 23 ASP H H 23 8.260 8.260 8.718 -0.458 18141
628 1 5 . 1 1 24 24 TRP N N 24 122.400 122.400 121.734 0.666 18141
629 1 5 . 1 1 24 24 TRP HA H 24 4.240 4.240 4.361 -0.121 18141
630 1 5 . 1 1 24 24 TRP CA C 24 59.300 59.300 60.271 -0.971 18141
631 1 5 . 1 1 24 24 TRP H H 24 7.910 7.910 7.949 -0.039 18141
632 1 5 . 1 1 25 25 CYS N N 25 117.800 117.800 117.581 0.219 18141
633 1 5 . 1 1 25 25 CYS HA H 25 4.890 4.890 3.490 1.400 18141
634 1 5 . 1 1 25 25 CYS H H 25 9.110 9.110 7.761 1.349 18141
635 1 5 . 1 1 26 26 CYS N N 26 120.700 120.700 120.338 0.362 18141
636 1 5 . 1 1 26 26 CYS HA H 26 4.530 4.530 3.979 0.551 18141
637 1 5 . 1 1 26 26 CYS CA C 26 58.900 58.900 64.203 -5.303 18141
638 1 5 . 1 1 26 26 CYS H H 26 8.940 8.940 7.922 1.018 18141
639 1 5 . 1 1 27 27 ASP N N 27 120.700 120.700 118.469 2.231 18141
640 1 5 . 1 1 27 27 ASP HA H 27 4.330 4.330 4.654 -0.324 18141
641 1 5 . 1 1 27 27 ASP CA C 27 57.100 57.100 56.356 0.744 18141
642 1 5 . 1 1 27 27 ASP H H 27 7.400 7.400 7.806 -0.406 18141
643 1 5 . 1 1 28 28 PHE N N 28 123.100 123.100 122.221 0.879 18141
644 1 5 . 1 1 28 28 PHE HA H 28 4.070 4.070 4.384 -0.314 18141
645 1 5 . 1 1 28 28 PHE CA C 28 60.200 60.200 60.854 -0.654 18141
646 1 5 . 1 1 28 28 PHE H H 28 8.590 8.590 7.600 0.990 18141
647 1 5 . 1 1 29 29 VAL N N 29 116.200 116.200 115.738 0.462 18141
648 1 5 . 1 1 29 29 VAL HA H 29 3.120 3.120 3.546 -0.426 18141
649 1 5 . 1 1 29 29 VAL CA C 29 66.100 66.100 66.252 -0.152 18141
650 1 5 . 1 1 29 29 VAL H H 29 7.760 7.760 7.983 -0.223 18141
651 1 5 . 1 1 30 30 LYS N N 30 117.300 117.300 117.768 -0.468 18141
652 1 5 . 1 1 30 30 LYS HA H 30 4.260 4.260 4.009 0.251 18141
653 1 5 . 1 1 30 30 LYS H H 30 7.280 7.280 7.726 -0.446 18141
654 1 5 . 1 1 31 31 ASP N N 31 122.600 122.600 120.379 2.221 18141
655 1 5 . 1 1 31 31 ASP HA H 31 4.410 4.410 4.330 0.080 18141
656 1 5 . 1 1 31 31 ASP CA C 31 56.800 56.800 56.779 0.021 18141
657 1 5 . 1 1 31 31 ASP H H 31 8.510 8.510 7.942 0.568 18141
658 1 5 . 1 1 32 32 ILE N N 32 112.500 112.500 113.396 -0.896 18141
659 1 5 . 1 1 32 32 ILE HA H 32 4.310 4.310 4.187 0.123 18141
660 1 5 . 1 1 32 32 ILE CA C 32 62.800 62.800 60.023 2.777 18141
661 1 5 . 1 1 32 32 ILE H H 32 7.320 7.320 7.162 0.158 18141
662 1 5 . 1 1 33 33 ARG N N 33 114.200 114.200 120.417 -6.217 18141
663 1 5 . 1 1 33 33 ARG HA H 33 3.870 3.870 3.865 0.005 18141
664 1 5 . 1 1 33 33 ARG CA C 33 56.600 56.600 57.105 -0.505 18141
665 1 5 . 1 1 33 33 ARG H H 33 7.880 7.880 7.631 0.249 18141
666 1 5 . 1 1 34 34 MET N N 34 117.100 117.100 119.502 -2.402 18141
667 1 5 . 1 1 34 34 MET HA H 34 4.640 4.640 4.569 0.071 18141
668 1 5 . 1 1 34 34 MET CA C 34 54.300 54.300 53.292 1.008 18141
669 1 5 . 1 1 34 34 MET H H 34 7.570 7.570 7.850 -0.280 18141
670 1 5 . 1 1 35 35 ASN N N 35 118.000 118.000 119.773 -1.773 18141
671 1 5 . 1 1 35 35 ASN HA H 35 5.170 5.170 5.067 0.103 18141
672 1 5 . 1 1 35 35 ASN CA C 35 50.400 50.400 51.003 -0.603 18141
673 1 5 . 1 1 35 35 ASN H H 35 8.390 8.390 8.486 -0.096 18141
674 1 5 . 1 1 37 37 PRO HA H 37 4.320 4.320 4.489 -0.169 18141
675 1 5 . 1 1 37 37 PRO CA C 37 61.200 61.200 62.306 -1.106 18141
676 1 5 . 1 1 38 38 ALA N N 38 114.400 114.400 127.860 -13.460 18141
677 1 5 . 1 1 38 38 ALA HA H 38 3.990 3.990 4.175 -0.185 18141
678 1 5 . 1 1 38 38 ALA CA C 38 54.400 54.400 53.602 0.798 18141
679 1 5 . 1 1 38 38 ALA H H 38 8.770 8.770 8.455 0.315 18141
680 1 5 . 1 1 39 39 ASP N N 39 112.400 112.400 115.807 -3.407 18141
681 1 5 . 1 1 39 39 ASP HA H 39 4.310 4.310 4.541 -0.231 18141
682 1 5 . 1 1 39 39 ASP H H 39 8.710 8.710 8.374 0.336 18141
683 1 5 . 1 1 40 40 LYS N N 40 117.000 117.000 118.512 -1.512 18141
684 1 5 . 1 1 40 40 LYS HA H 40 4.370 4.370 4.371 -0.001 18141
685 1 5 . 1 1 40 40 LYS CA C 40 57.000 57.000 56.479 0.521 18141
686 1 5 . 1 1 40 40 LYS H H 40 6.990 6.990 7.544 -0.554 18141
687 1 5 . 1 1 41 41 CYS N N 41 121.600 121.600 121.814 -0.214 18141
688 1 5 . 1 1 41 41 CYS HA H 41 5.180 5.180 4.619 0.561 18141
689 1 5 . 1 1 41 41 CYS CA C 41 50.900 50.900 55.352 -4.452 18141
690 1 5 . 1 1 41 41 CYS H H 41 7.520 7.520 7.535 -0.015 18141
691 1 6 . 1 1 2 2 PRO HA H 2 4.370 4.370 4.702 -0.332 18141
692 1 6 . 1 1 2 2 PRO CA C 2 62.800 62.800 63.149 -0.349 18141
693 1 6 . 1 1 3 3 TYR N N 3 120.600 120.600 122.355 -1.755 18141
694 1 6 . 1 1 3 3 TYR HA H 3 4.310 4.310 4.426 -0.116 18141
695 1 6 . 1 1 3 3 TYR H H 3 8.160 8.160 8.204 -0.044 18141
696 1 6 . 1 1 4 4 CYS N N 4 119.100 119.100 120.884 -1.784 18141
697 1 6 . 1 1 4 4 CYS HA H 4 3.330 3.330 4.163 -0.833 18141
698 1 6 . 1 1 4 4 CYS CA C 4 53.500 53.500 58.989 -5.489 18141
699 1 6 . 1 1 4 4 CYS H H 4 7.700 7.700 8.308 -0.608 18141
700 1 6 . 1 1 5 5 GLY N N 5 107.900 107.900 107.304 0.596 18141
701 1 6 . 1 1 5 5 GLY CA C 5 43.700 43.700 45.467 -1.767 18141
702 1 6 . 1 1 5 5 GLY H H 5 5.930 5.930 8.073 -2.143 18141
703 1 6 . 1 1 6 6 GLN N N 6 114.200 114.200 118.357 -4.157 18141
704 1 6 . 1 1 6 6 GLN HA H 6 4.420 4.420 4.038 0.382 18141
705 1 6 . 1 1 6 6 GLN CA C 6 56.200 56.200 56.887 -0.687 18141
706 1 6 . 1 1 6 6 GLN H H 6 8.710 8.710 8.578 0.132 18141
707 1 6 . 1 1 7 7 THR N N 7 106.600 106.600 108.098 -1.498 18141
708 1 6 . 1 1 7 7 THR HA H 7 4.780 4.780 4.556 0.224 18141
709 1 6 . 1 1 7 7 THR CA C 7 58.700 58.700 60.192 -1.492 18141
710 1 6 . 1 1 7 7 THR H H 7 7.300 7.300 7.301 -0.001 18141
711 1 6 . 1 1 8 8 GLY N N 8 110.400 110.400 110.434 -0.034 18141
712 1 6 . 1 1 8 8 GLY CA C 8 48.000 48.000 47.356 0.644 18141
713 1 6 . 1 1 8 8 GLY H H 8 9.260 9.260 9.012 0.248 18141
714 1 6 . 1 1 9 9 ALA N N 9 123.400 123.400 123.140 0.260 18141
715 1 6 . 1 1 9 9 ALA HA H 9 4.090 4.090 4.075 0.015 18141
716 1 6 . 1 1 9 9 ALA CA C 9 55.600 55.600 54.454 1.146 18141
717 1 6 . 1 1 9 9 ALA H H 9 8.490 8.490 8.554 -0.064 18141
718 1 6 . 1 1 10 10 GLU N N 10 119.500 119.500 116.162 3.338 18141
719 1 6 . 1 1 10 10 GLU HA H 10 4.230 4.230 4.432 -0.202 18141
720 1 6 . 1 1 10 10 GLU CA C 10 59.300 59.300 58.472 0.828 18141
721 1 6 . 1 1 10 10 GLU H H 10 7.790 7.790 8.376 -0.586 18141
722 1 6 . 1 1 11 11 CYS N N 11 118.300 118.300 119.791 -1.491 18141
723 1 6 . 1 1 11 11 CYS HA H 11 4.850 4.850 4.595 0.255 18141
724 1 6 . 1 1 11 11 CYS H H 11 8.460 8.460 7.603 0.857 18141
725 1 6 . 1 1 12 12 TYR N N 12 121.800 121.800 121.092 0.708 18141
726 1 6 . 1 1 12 12 TYR HA H 12 4.020 4.020 4.215 -0.195 18141
727 1 6 . 1 1 12 12 TYR H H 12 8.860 8.860 9.033 -0.173 18141
728 1 6 . 1 1 13 13 SER N N 13 114.500 114.500 114.498 0.002 18141
729 1 6 . 1 1 13 13 SER HA H 13 4.130 4.130 3.700 0.430 18141
730 1 6 . 1 1 13 13 SER CA C 13 62.600 62.600 60.631 1.969 18141
731 1 6 . 1 1 13 13 SER H H 13 7.910 7.910 7.619 0.291 18141
732 1 6 . 1 1 14 14 TRP N N 14 122.400 122.400 123.767 -1.367 18141
733 1 6 . 1 1 14 14 TRP HA H 14 4.020 4.020 4.413 -0.393 18141
734 1 6 . 1 1 14 14 TRP H H 14 8.680 8.680 7.927 0.753 18141
735 1 6 . 1 1 15 15 CYS N N 15 120.500 120.500 117.427 3.073 18141
736 1 6 . 1 1 15 15 CYS HA H 15 3.530 3.530 3.298 0.232 18141
737 1 6 . 1 1 15 15 CYS CA C 15 60.500 60.500 61.419 -0.919 18141
738 1 6 . 1 1 15 15 CYS H H 15 8.120 8.120 8.164 -0.043 18141
739 1 6 . 1 1 16 16 ILE N N 16 120.300 120.300 121.457 -1.157 18141
740 1 6 . 1 1 16 16 ILE HA H 16 3.930 3.930 4.022 -0.092 18141
741 1 6 . 1 1 16 16 ILE CA C 16 61.700 61.700 64.501 -2.801 18141
742 1 6 . 1 1 16 16 ILE H H 16 8.250 8.250 7.625 0.625 18141
743 1 6 . 1 1 17 17 LYS N N 17 121.700 121.700 121.537 0.163 18141
744 1 6 . 1 1 17 17 LYS HA H 17 4.100 4.100 3.931 0.169 18141
745 1 6 . 1 1 17 17 LYS CA C 17 58.100 58.100 59.188 -1.089 18141
746 1 6 . 1 1 17 17 LYS H H 17 7.800 7.800 8.525 -0.725 18141
747 1 6 . 1 1 18 18 GLN N N 18 117.600 117.600 115.126 2.474 18141
748 1 6 . 1 1 18 18 GLN HA H 18 4.030 4.030 3.910 0.120 18141
749 1 6 . 1 1 18 18 GLN H H 18 7.240 7.240 7.538 -0.298 18141
750 1 6 . 1 1 19 19 ASP N N 19 121.800 121.800 116.224 5.576 18141
751 1 6 . 1 1 19 19 ASP HA H 19 4.320 4.320 4.332 -0.012 18141
752 1 6 . 1 1 19 19 ASP H H 19 8.050 8.050 7.930 0.120 18141
753 1 6 . 1 1 20 20 LEU N N 20 119.400 119.400 117.172 2.228 18141
754 1 6 . 1 1 20 20 LEU HA H 20 4.300 4.300 4.115 0.185 18141
755 1 6 . 1 1 20 20 LEU H H 20 6.430 6.430 8.035 -1.605 18141
756 1 6 . 1 1 21 21 SER N N 21 115.500 115.500 108.910 6.590 18141
757 1 6 . 1 1 21 21 SER HA H 21 4.290 4.290 4.554 -0.264 18141
758 1 6 . 1 1 21 21 SER H H 21 8.260 8.260 7.659 0.601 18141
759 1 6 . 1 1 22 22 LYS N N 22 122.700 122.700 124.244 -1.544 18141
760 1 6 . 1 1 22 22 LYS HA H 22 4.020 4.020 4.056 -0.036 18141
761 1 6 . 1 1 22 22 LYS H H 22 8.690 8.690 8.845 -0.155 18141
762 1 6 . 1 1 23 23 ASP N N 23 117.000 117.000 118.612 -1.612 18141
763 1 6 . 1 1 23 23 ASP HA H 23 4.370 4.370 4.632 -0.262 18141
764 1 6 . 1 1 23 23 ASP CA C 23 55.300 55.300 56.032 -0.732 18141
765 1 6 . 1 1 23 23 ASP H H 23 8.260 8.260 8.471 -0.211 18141
766 1 6 . 1 1 24 24 TRP N N 24 122.400 122.400 120.459 1.941 18141
767 1 6 . 1 1 24 24 TRP HA H 24 4.240 4.240 4.450 -0.210 18141
768 1 6 . 1 1 24 24 TRP CA C 24 59.300 59.300 60.358 -1.058 18141
769 1 6 . 1 1 24 24 TRP H H 24 7.910 7.910 8.389 -0.479 18141
770 1 6 . 1 1 25 25 CYS N N 25 117.800 117.800 118.468 -0.668 18141
771 1 6 . 1 1 25 25 CYS HA H 25 4.890 4.890 2.996 1.894 18141
772 1 6 . 1 1 25 25 CYS H H 25 9.110 9.110 7.296 1.814 18141
773 1 6 . 1 1 26 26 CYS N N 26 120.700 120.700 119.018 1.682 18141
774 1 6 . 1 1 26 26 CYS HA H 26 4.530 4.530 4.083 0.447 18141
775 1 6 . 1 1 26 26 CYS CA C 26 58.900 58.900 63.260 -4.360 18141
776 1 6 . 1 1 26 26 CYS H H 26 8.940 8.940 7.918 1.022 18141
777 1 6 . 1 1 27 27 ASP N N 27 120.700 120.700 118.252 2.448 18141
778 1 6 . 1 1 27 27 ASP HA H 27 4.330 4.330 4.558 -0.228 18141
779 1 6 . 1 1 27 27 ASP CA C 27 57.100 57.100 56.160 0.940 18141
780 1 6 . 1 1 27 27 ASP H H 27 7.400 7.400 7.663 -0.263 18141
781 1 6 . 1 1 28 28 PHE N N 28 123.100 123.100 121.694 1.406 18141
782 1 6 . 1 1 28 28 PHE HA H 28 4.070 4.070 4.173 -0.103 18141
783 1 6 . 1 1 28 28 PHE CA C 28 60.200 60.200 61.386 -1.186 18141
784 1 6 . 1 1 28 28 PHE H H 28 8.590 8.590 7.802 0.788 18141
785 1 6 . 1 1 29 29 VAL N N 29 116.200 116.200 119.922 -3.722 18141
786 1 6 . 1 1 29 29 VAL HA H 29 3.120 3.120 3.287 -0.167 18141
787 1 6 . 1 1 29 29 VAL CA C 29 66.100 66.100 66.047 0.053 18141
788 1 6 . 1 1 29 29 VAL H H 29 7.760 7.760 7.948 -0.188 18141
789 1 6 . 1 1 30 30 LYS N N 30 117.300 117.300 116.150 1.150 18141
790 1 6 . 1 1 30 30 LYS HA H 30 4.260 4.260 4.029 0.231 18141
791 1 6 . 1 1 30 30 LYS H H 30 7.280 7.280 7.686 -0.406 18141
792 1 6 . 1 1 31 31 ASP N N 31 122.600 122.600 118.533 4.067 18141
793 1 6 . 1 1 31 31 ASP HA H 31 4.410 4.410 4.571 -0.161 18141
794 1 6 . 1 1 31 31 ASP CA C 31 56.800 56.800 56.002 0.798 18141
795 1 6 . 1 1 31 31 ASP H H 31 8.510 8.510 8.152 0.358 18141
796 1 6 . 1 1 32 32 ILE N N 32 112.500 112.500 115.772 -3.272 18141
797 1 6 . 1 1 32 32 ILE HA H 32 4.310 4.310 4.039 0.271 18141
798 1 6 . 1 1 32 32 ILE CA C 32 62.800 62.800 60.603 2.197 18141
799 1 6 . 1 1 32 32 ILE H H 32 7.320 7.320 7.236 0.084 18141
800 1 6 . 1 1 33 33 ARG N N 33 114.200 114.200 116.856 -2.656 18141
801 1 6 . 1 1 33 33 ARG HA H 33 3.870 3.870 3.832 0.038 18141
802 1 6 . 1 1 33 33 ARG CA C 33 56.600 56.600 57.347 -0.747 18141
803 1 6 . 1 1 33 33 ARG H H 33 7.880 7.880 7.871 0.009 18141
804 1 6 . 1 1 34 34 MET N N 34 117.100 117.100 116.502 0.598 18141
805 1 6 . 1 1 34 34 MET HA H 34 4.640 4.640 4.640 0.000 18141
806 1 6 . 1 1 34 34 MET CA C 34 54.300 54.300 53.425 0.875 18141
807 1 6 . 1 1 34 34 MET H H 34 7.570 7.570 7.368 0.202 18141
808 1 6 . 1 1 35 35 ASN N N 35 118.000 118.000 119.385 -1.385 18141
809 1 6 . 1 1 35 35 ASN HA H 35 5.170 5.170 5.037 0.133 18141
810 1 6 . 1 1 35 35 ASN CA C 35 50.400 50.400 50.836 -0.436 18141
811 1 6 . 1 1 35 35 ASN H H 35 8.390 8.390 8.573 -0.183 18141
812 1 6 . 1 1 37 37 PRO HA H 37 4.320 4.320 4.484 -0.164 18141
813 1 6 . 1 1 37 37 PRO CA C 37 61.200 61.200 62.274 -1.074 18141
814 1 6 . 1 1 38 38 ALA N N 38 114.400 114.400 126.931 -12.531 18141
815 1 6 . 1 1 38 38 ALA HA H 38 3.990 3.990 4.190 -0.200 18141
816 1 6 . 1 1 38 38 ALA CA C 38 54.400 54.400 53.817 0.583 18141
817 1 6 . 1 1 38 38 ALA H H 38 8.770 8.770 8.616 0.154 18141
818 1 6 . 1 1 39 39 ASP N N 39 112.400 112.400 118.454 -6.054 18141
819 1 6 . 1 1 39 39 ASP HA H 39 4.310 4.310 4.491 -0.181 18141
820 1 6 . 1 1 39 39 ASP H H 39 8.710 8.710 8.229 0.481 18141
821 1 6 . 1 1 40 40 LYS N N 40 117.000 117.000 117.136 -0.136 18141
822 1 6 . 1 1 40 40 LYS HA H 40 4.370 4.370 4.295 0.075 18141
823 1 6 . 1 1 40 40 LYS CA C 40 57.000 57.000 54.963 2.037 18141
824 1 6 . 1 1 40 40 LYS H H 40 6.990 6.990 7.985 -0.995 18141
825 1 6 . 1 1 41 41 CYS N N 41 121.600 121.600 119.971 1.629 18141
826 1 6 . 1 1 41 41 CYS HA H 41 5.180 5.180 4.719 0.461 18141
827 1 6 . 1 1 41 41 CYS CA C 41 50.900 50.900 56.739 -5.839 18141
828 1 6 . 1 1 41 41 CYS H H 41 7.520 7.520 7.365 0.155 18141
829 1 7 . 1 1 2 2 PRO HA H 2 4.370 4.370 4.586 -0.216 18141
830 1 7 . 1 1 2 2 PRO CA C 2 62.800 62.800 62.817 -0.017 18141
831 1 7 . 1 1 3 3 TYR N N 3 120.600 120.600 122.828 -2.228 18141
832 1 7 . 1 1 3 3 TYR HA H 3 4.310 4.310 4.469 -0.159 18141
833 1 7 . 1 1 3 3 TYR H H 3 8.160 8.160 7.916 0.244 18141
834 1 7 . 1 1 4 4 CYS N N 4 119.100 119.100 116.669 2.431 18141
835 1 7 . 1 1 4 4 CYS HA H 4 3.330 3.330 4.099 -0.769 18141
836 1 7 . 1 1 4 4 CYS CA C 4 53.500 53.500 59.287 -5.787 18141
837 1 7 . 1 1 4 4 CYS H H 4 7.700 7.700 8.788 -1.088 18141
838 1 7 . 1 1 5 5 GLY N N 5 107.900 107.900 107.437 0.463 18141
839 1 7 . 1 1 5 5 GLY CA C 5 43.700 43.700 45.096 -1.396 18141
840 1 7 . 1 1 5 5 GLY H H 5 5.930 5.930 7.640 -1.710 18141
841 1 7 . 1 1 6 6 GLN N N 6 114.200 114.200 120.637 -6.437 18141
842 1 7 . 1 1 6 6 GLN HA H 6 4.420 4.420 4.469 -0.049 18141
843 1 7 . 1 1 6 6 GLN CA C 6 56.200 56.200 55.862 0.338 18141
844 1 7 . 1 1 6 6 GLN H H 6 8.710 8.710 8.457 0.253 18141
845 1 7 . 1 1 7 7 THR N N 7 106.600 106.600 109.819 -3.219 18141
846 1 7 . 1 1 7 7 THR HA H 7 4.780 4.780 4.760 0.020 18141
847 1 7 . 1 1 7 7 THR CA C 7 58.700 58.700 59.919 -1.218 18141
848 1 7 . 1 1 7 7 THR H H 7 7.300 7.300 7.578 -0.278 18141
849 1 7 . 1 1 8 8 GLY N N 8 110.400 110.400 107.353 3.047 18141
850 1 7 . 1 1 8 8 GLY CA C 8 48.000 48.000 46.522 1.478 18141
851 1 7 . 1 1 8 8 GLY H H 8 9.260 9.260 8.865 0.395 18141
852 1 7 . 1 1 9 9 ALA N N 9 123.400 123.400 124.509 -1.109 18141
853 1 7 . 1 1 9 9 ALA HA H 9 4.090 4.090 4.255 -0.165 18141
854 1 7 . 1 1 9 9 ALA CA C 9 55.600 55.600 54.562 1.038 18141
855 1 7 . 1 1 9 9 ALA H H 9 8.490 8.490 8.039 0.451 18141
856 1 7 . 1 1 10 10 GLU N N 10 119.500 119.500 116.985 2.515 18141
857 1 7 . 1 1 10 10 GLU HA H 10 4.230 4.230 4.232 -0.002 18141
858 1 7 . 1 1 10 10 GLU CA C 10 59.300 59.300 58.426 0.874 18141
859 1 7 . 1 1 10 10 GLU H H 10 7.790 7.790 7.715 0.075 18141
860 1 7 . 1 1 11 11 CYS N N 11 118.300 118.300 121.321 -3.021 18141
861 1 7 . 1 1 11 11 CYS HA H 11 4.850 4.850 4.558 0.292 18141
862 1 7 . 1 1 11 11 CYS H H 11 8.460 8.460 7.846 0.614 18141
863 1 7 . 1 1 12 12 TYR N N 12 121.800 121.800 119.758 2.042 18141
864 1 7 . 1 1 12 12 TYR HA H 12 4.020 4.020 4.386 -0.366 18141
865 1 7 . 1 1 12 12 TYR H H 12 8.860 8.860 7.969 0.891 18141
866 1 7 . 1 1 13 13 SER N N 13 114.500 114.500 114.882 -0.382 18141
867 1 7 . 1 1 13 13 SER HA H 13 4.130 4.130 4.465 -0.335 18141
868 1 7 . 1 1 13 13 SER CA C 13 62.600 62.600 61.428 1.171 18141
869 1 7 . 1 1 13 13 SER H H 13 7.910 7.910 7.766 0.144 18141
870 1 7 . 1 1 14 14 TRP N N 14 122.400 122.400 123.460 -1.060 18141
871 1 7 . 1 1 14 14 TRP HA H 14 4.020 4.020 4.694 -0.674 18141
872 1 7 . 1 1 14 14 TRP H H 14 8.680 8.680 7.969 0.711 18141
873 1 7 . 1 1 15 15 CYS N N 15 120.500 120.500 117.665 2.835 18141
874 1 7 . 1 1 15 15 CYS HA H 15 3.530 3.530 3.879 -0.349 18141
875 1 7 . 1 1 15 15 CYS CA C 15 60.500 60.500 61.709 -1.209 18141
876 1 7 . 1 1 15 15 CYS H H 15 8.120 8.120 8.206 -0.086 18141
877 1 7 . 1 1 16 16 ILE N N 16 120.300 120.300 121.359 -1.059 18141
878 1 7 . 1 1 16 16 ILE HA H 16 3.930 3.930 4.061 -0.131 18141
879 1 7 . 1 1 16 16 ILE CA C 16 61.700 61.700 63.821 -2.121 18141
880 1 7 . 1 1 16 16 ILE H H 16 8.250 8.250 7.710 0.540 18141
881 1 7 . 1 1 17 17 LYS N N 17 121.700 121.700 121.968 -0.268 18141
882 1 7 . 1 1 17 17 LYS HA H 17 4.100 4.100 3.934 0.166 18141
883 1 7 . 1 1 17 17 LYS CA C 17 58.100 58.100 58.764 -0.664 18141
884 1 7 . 1 1 17 17 LYS H H 17 7.800 7.800 8.480 -0.680 18141
885 1 7 . 1 1 18 18 GLN N N 18 117.600 117.600 115.625 1.975 18141
886 1 7 . 1 1 18 18 GLN HA H 18 4.030 4.030 4.149 -0.119 18141
887 1 7 . 1 1 18 18 GLN H H 18 7.240 7.240 7.349 -0.109 18141
888 1 7 . 1 1 19 19 ASP N N 19 121.800 121.800 117.043 4.757 18141
889 1 7 . 1 1 19 19 ASP HA H 19 4.320 4.320 4.247 0.073 18141
890 1 7 . 1 1 19 19 ASP H H 19 8.050 8.050 8.403 -0.353 18141
891 1 7 . 1 1 20 20 LEU N N 20 119.400 119.400 118.017 1.383 18141
892 1 7 . 1 1 20 20 LEU HA H 20 4.300 4.300 4.035 0.265 18141
893 1 7 . 1 1 20 20 LEU H H 20 6.430 6.430 8.208 -1.778 18141
894 1 7 . 1 1 21 21 SER N N 21 115.500 115.500 108.522 6.978 18141
895 1 7 . 1 1 21 21 SER HA H 21 4.290 4.290 4.672 -0.382 18141
896 1 7 . 1 1 21 21 SER H H 21 8.260 8.260 7.821 0.439 18141
897 1 7 . 1 1 22 22 LYS N N 22 122.700 122.700 121.719 0.981 18141
898 1 7 . 1 1 22 22 LYS HA H 22 4.020 4.020 4.043 -0.023 18141
899 1 7 . 1 1 22 22 LYS H H 22 8.690 8.690 8.833 -0.143 18141
900 1 7 . 1 1 23 23 ASP N N 23 117.000 117.000 116.139 0.861 18141
901 1 7 . 1 1 23 23 ASP HA H 23 4.370 4.370 4.571 -0.201 18141
902 1 7 . 1 1 23 23 ASP CA C 23 55.300 55.300 55.457 -0.157 18141
903 1 7 . 1 1 23 23 ASP H H 23 8.260 8.260 8.356 -0.096 18141
904 1 7 . 1 1 24 24 TRP N N 24 122.400 122.400 121.150 1.250 18141
905 1 7 . 1 1 24 24 TRP HA H 24 4.240 4.240 4.321 -0.081 18141
906 1 7 . 1 1 24 24 TRP CA C 24 59.300 59.300 60.995 -1.694 18141
907 1 7 . 1 1 24 24 TRP H H 24 7.910 7.910 8.342 -0.432 18141
908 1 7 . 1 1 25 25 CYS N N 25 117.800 117.800 118.247 -0.447 18141
909 1 7 . 1 1 25 25 CYS HA H 25 4.890 4.890 3.043 1.847 18141
910 1 7 . 1 1 25 25 CYS H H 25 9.110 9.110 7.444 1.666 18141
911 1 7 . 1 1 26 26 CYS N N 26 120.700 120.700 119.657 1.043 18141
912 1 7 . 1 1 26 26 CYS HA H 26 4.530 4.530 4.233 0.297 18141
913 1 7 . 1 1 26 26 CYS CA C 26 58.900 58.900 64.367 -5.467 18141
914 1 7 . 1 1 26 26 CYS H H 26 8.940 8.940 7.912 1.028 18141
915 1 7 . 1 1 27 27 ASP N N 27 120.700 120.700 118.139 2.561 18141
916 1 7 . 1 1 27 27 ASP HA H 27 4.330 4.330 4.567 -0.237 18141
917 1 7 . 1 1 27 27 ASP CA C 27 57.100 57.100 56.754 0.346 18141
918 1 7 . 1 1 27 27 ASP H H 27 7.400 7.400 7.636 -0.236 18141
919 1 7 . 1 1 28 28 PHE N N 28 123.100 123.100 121.440 1.660 18141
920 1 7 . 1 1 28 28 PHE HA H 28 4.070 4.070 4.117 -0.047 18141
921 1 7 . 1 1 28 28 PHE CA C 28 60.200 60.200 61.075 -0.875 18141
922 1 7 . 1 1 28 28 PHE H H 28 8.590 8.590 7.184 1.406 18141
923 1 7 . 1 1 29 29 VAL N N 29 116.200 116.200 117.823 -1.623 18141
924 1 7 . 1 1 29 29 VAL HA H 29 3.120 3.120 3.082 0.038 18141
925 1 7 . 1 1 29 29 VAL CA C 29 66.100 66.100 65.106 0.994 18141
926 1 7 . 1 1 29 29 VAL H H 29 7.760 7.760 7.457 0.303 18141
927 1 7 . 1 1 30 30 LYS N N 30 117.300 117.300 118.892 -1.592 18141
928 1 7 . 1 1 30 30 LYS HA H 30 4.260 4.260 4.011 0.249 18141
929 1 7 . 1 1 30 30 LYS H H 30 7.280 7.280 7.415 -0.135 18141
930 1 7 . 1 1 31 31 ASP N N 31 122.600 122.600 119.203 3.397 18141
931 1 7 . 1 1 31 31 ASP HA H 31 4.410 4.410 4.438 -0.028 18141
932 1 7 . 1 1 31 31 ASP CA C 31 56.800 56.800 56.322 0.478 18141
933 1 7 . 1 1 31 31 ASP H H 31 8.510 8.510 7.760 0.750 18141
934 1 7 . 1 1 32 32 ILE N N 32 112.500 112.500 113.283 -0.783 18141
935 1 7 . 1 1 32 32 ILE HA H 32 4.310 4.310 4.277 0.033 18141
936 1 7 . 1 1 32 32 ILE CA C 32 62.800 62.800 60.519 2.281 18141
937 1 7 . 1 1 32 32 ILE H H 32 7.320 7.320 6.937 0.383 18141
938 1 7 . 1 1 33 33 ARG N N 33 114.200 114.200 117.497 -3.297 18141
939 1 7 . 1 1 33 33 ARG HA H 33 3.870 3.870 3.891 -0.021 18141
940 1 7 . 1 1 33 33 ARG CA C 33 56.600 56.600 57.350 -0.750 18141
941 1 7 . 1 1 33 33 ARG H H 33 7.880 7.880 7.610 0.270 18141
942 1 7 . 1 1 34 34 MET N N 34 117.100 117.100 118.138 -1.038 18141
943 1 7 . 1 1 34 34 MET HA H 34 4.640 4.640 4.497 0.143 18141
944 1 7 . 1 1 34 34 MET CA C 34 54.300 54.300 53.935 0.365 18141
945 1 7 . 1 1 34 34 MET H H 34 7.570 7.570 7.533 0.037 18141
946 1 7 . 1 1 35 35 ASN N N 35 118.000 118.000 118.511 -0.511 18141
947 1 7 . 1 1 35 35 ASN HA H 35 5.170 5.170 5.070 0.100 18141
948 1 7 . 1 1 35 35 ASN CA C 35 50.400 50.400 50.492 -0.092 18141
949 1 7 . 1 1 35 35 ASN H H 35 8.390 8.390 8.388 0.002 18141
950 1 7 . 1 1 37 37 PRO HA H 37 4.320 4.320 4.484 -0.164 18141
951 1 7 . 1 1 37 37 PRO CA C 37 61.200 61.200 62.422 -1.222 18141
952 1 7 . 1 1 38 38 ALA N N 38 114.400 114.400 124.741 -10.341 18141
953 1 7 . 1 1 38 38 ALA HA H 38 3.990 3.990 4.425 -0.435 18141
954 1 7 . 1 1 38 38 ALA CA C 38 54.400 54.400 51.879 2.521 18141
955 1 7 . 1 1 38 38 ALA H H 38 8.770 8.770 8.405 0.365 18141
956 1 7 . 1 1 39 39 ASP N N 39 112.400 112.400 119.553 -7.153 18141
957 1 7 . 1 1 39 39 ASP HA H 39 4.310 4.310 4.529 -0.219 18141
958 1 7 . 1 1 39 39 ASP H H 39 8.710 8.710 8.258 0.452 18141
959 1 7 . 1 1 40 40 LYS N N 40 117.000 117.000 120.677 -3.677 18141
960 1 7 . 1 1 40 40 LYS HA H 40 4.370 4.370 4.222 0.148 18141
961 1 7 . 1 1 40 40 LYS CA C 40 57.000 57.000 57.060 -0.060 18141
962 1 7 . 1 1 40 40 LYS H H 40 6.990 6.990 8.034 -1.044 18141
963 1 7 . 1 1 41 41 CYS N N 41 121.600 121.600 119.151 2.449 18141
964 1 7 . 1 1 41 41 CYS HA H 41 5.180 5.180 4.770 0.410 18141
965 1 7 . 1 1 41 41 CYS CA C 41 50.900 50.900 56.340 -5.440 18141
966 1 7 . 1 1 41 41 CYS H H 41 7.520 7.520 8.196 -0.676 18141
967 1 8 . 1 1 2 2 PRO HA H 2 4.370 4.370 4.731 -0.361 18141
968 1 8 . 1 1 2 2 PRO CA C 2 62.800 62.800 62.664 0.136 18141
969 1 8 . 1 1 3 3 TYR N N 3 120.600 120.600 125.158 -4.558 18141
970 1 8 . 1 1 3 3 TYR HA H 3 4.310 4.310 4.367 -0.057 18141
971 1 8 . 1 1 3 3 TYR H H 3 8.160 8.160 8.589 -0.429 18141
972 1 8 . 1 1 4 4 CYS N N 4 119.100 119.100 120.103 -1.003 18141
973 1 8 . 1 1 4 4 CYS HA H 4 3.330 3.330 3.887 -0.557 18141
974 1 8 . 1 1 4 4 CYS CA C 4 53.500 53.500 58.721 -5.221 18141
975 1 8 . 1 1 4 4 CYS H H 4 7.700 7.700 8.281 -0.581 18141
976 1 8 . 1 1 5 5 GLY N N 5 107.900 107.900 111.185 -3.285 18141
977 1 8 . 1 1 5 5 GLY CA C 5 43.700 43.700 47.041 -3.341 18141
978 1 8 . 1 1 5 5 GLY H H 5 5.930 5.930 8.825 -2.895 18141
979 1 8 . 1 1 6 6 GLN N N 6 114.200 114.200 121.613 -7.413 18141
980 1 8 . 1 1 6 6 GLN HA H 6 4.420 4.420 4.538 -0.118 18141
981 1 8 . 1 1 6 6 GLN CA C 6 56.200 56.200 55.285 0.915 18141
982 1 8 . 1 1 6 6 GLN H H 6 8.710 8.710 9.175 -0.465 18141
983 1 8 . 1 1 7 7 THR N N 7 106.600 106.600 109.802 -3.202 18141
984 1 8 . 1 1 7 7 THR HA H 7 4.780 4.780 4.739 0.041 18141
985 1 8 . 1 1 7 7 THR CA C 7 58.700 58.700 60.144 -1.444 18141
986 1 8 . 1 1 7 7 THR H H 7 7.300 7.300 8.457 -1.157 18141
987 1 8 . 1 1 8 8 GLY N N 8 110.400 110.400 107.550 2.850 18141
988 1 8 . 1 1 8 8 GLY CA C 8 48.000 48.000 45.995 2.005 18141
989 1 8 . 1 1 8 8 GLY H H 8 9.260 9.260 8.312 0.948 18141
990 1 8 . 1 1 9 9 ALA N N 9 123.400 123.400 123.869 -0.469 18141
991 1 8 . 1 1 9 9 ALA HA H 9 4.090 4.090 4.365 -0.275 18141
992 1 8 . 1 1 9 9 ALA CA C 9 55.600 55.600 54.200 1.400 18141
993 1 8 . 1 1 9 9 ALA H H 9 8.490 8.490 7.591 0.899 18141
994 1 8 . 1 1 10 10 GLU N N 10 119.500 119.500 117.106 2.394 18141
995 1 8 . 1 1 10 10 GLU HA H 10 4.230 4.230 4.284 -0.054 18141
996 1 8 . 1 1 10 10 GLU CA C 10 59.300 59.300 58.356 0.944 18141
997 1 8 . 1 1 10 10 GLU H H 10 7.790 7.790 7.853 -0.063 18141
998 1 8 . 1 1 11 11 CYS N N 11 118.300 118.300 119.114 -0.814 18141
999 1 8 . 1 1 11 11 CYS HA H 11 4.850 4.850 4.530 0.320 18141
1000 1 8 . 1 1 11 11 CYS H H 11 8.460 8.460 7.984 0.476 18141
1001 1 8 . 1 1 12 12 TYR N N 12 121.800 121.800 122.064 -0.264 18141
1002 1 8 . 1 1 12 12 TYR HA H 12 4.020 4.020 4.243 -0.223 18141
1003 1 8 . 1 1 12 12 TYR H H 12 8.860 8.860 8.223 0.637 18141
1004 1 8 . 1 1 13 13 SER N N 13 114.500 114.500 114.330 0.170 18141
1005 1 8 . 1 1 13 13 SER HA H 13 4.130 4.130 3.953 0.177 18141
1006 1 8 . 1 1 13 13 SER CA C 13 62.600 62.600 60.956 1.645 18141
1007 1 8 . 1 1 13 13 SER H H 13 7.910 7.910 8.339 -0.429 18141
1008 1 8 . 1 1 14 14 TRP N N 14 122.400 122.400 122.953 -0.553 18141
1009 1 8 . 1 1 14 14 TRP HA H 14 4.020 4.020 4.380 -0.360 18141
1010 1 8 . 1 1 14 14 TRP H H 14 8.680 8.680 7.918 0.762 18141
1011 1 8 . 1 1 15 15 CYS N N 15 120.500 120.500 119.019 1.481 18141
1012 1 8 . 1 1 15 15 CYS HA H 15 3.530 3.530 2.968 0.562 18141
1013 1 8 . 1 1 15 15 CYS CA C 15 60.500 60.500 61.623 -1.123 18141
1014 1 8 . 1 1 15 15 CYS H H 15 8.120 8.120 7.844 0.276 18141
1015 1 8 . 1 1 16 16 ILE N N 16 120.300 120.300 118.902 1.398 18141
1016 1 8 . 1 1 16 16 ILE HA H 16 3.930 3.930 3.563 0.367 18141
1017 1 8 . 1 1 16 16 ILE CA C 16 61.700 61.700 62.106 -0.406 18141
1018 1 8 . 1 1 16 16 ILE H H 16 8.250 8.250 7.387 0.863 18141
1019 1 8 . 1 1 17 17 LYS N N 17 121.700 121.700 122.987 -1.287 18141
1020 1 8 . 1 1 17 17 LYS HA H 17 4.100 4.100 3.869 0.231 18141
1021 1 8 . 1 1 17 17 LYS CA C 17 58.100 58.100 58.944 -0.844 18141
1022 1 8 . 1 1 17 17 LYS H H 17 7.800 7.800 8.469 -0.669 18141
1023 1 8 . 1 1 18 18 GLN N N 18 117.600 117.600 115.299 2.301 18141
1024 1 8 . 1 1 18 18 GLN HA H 18 4.030 4.030 3.931 0.099 18141
1025 1 8 . 1 1 18 18 GLN H H 18 7.240 7.240 8.015 -0.775 18141
1026 1 8 . 1 1 19 19 ASP N N 19 121.800 121.800 117.779 4.021 18141
1027 1 8 . 1 1 19 19 ASP HA H 19 4.320 4.320 4.206 0.114 18141
1028 1 8 . 1 1 19 19 ASP H H 19 8.050 8.050 8.007 0.043 18141
1029 1 8 . 1 1 20 20 LEU N N 20 119.400 119.400 116.327 3.073 18141
1030 1 8 . 1 1 20 20 LEU HA H 20 4.300 4.300 4.120 0.180 18141
1031 1 8 . 1 1 20 20 LEU H H 20 6.430 6.430 8.204 -1.774 18141
1032 1 8 . 1 1 21 21 SER N N 21 115.500 115.500 108.546 6.954 18141
1033 1 8 . 1 1 21 21 SER HA H 21 4.290 4.290 4.545 -0.255 18141
1034 1 8 . 1 1 21 21 SER H H 21 8.260 8.260 7.430 0.830 18141
1035 1 8 . 1 1 22 22 LYS N N 22 122.700 122.700 126.096 -3.396 18141
1036 1 8 . 1 1 22 22 LYS HA H 22 4.020 4.020 4.152 -0.132 18141
1037 1 8 . 1 1 22 22 LYS H H 22 8.690 8.690 8.932 -0.242 18141
1038 1 8 . 1 1 23 23 ASP N N 23 117.000 117.000 120.294 -3.294 18141
1039 1 8 . 1 1 23 23 ASP HA H 23 4.370 4.370 4.675 -0.305 18141
1040 1 8 . 1 1 23 23 ASP CA C 23 55.300 55.300 54.746 0.554 18141
1041 1 8 . 1 1 23 23 ASP H H 23 8.260 8.260 7.928 0.332 18141
1042 1 8 . 1 1 24 24 TRP N N 24 122.400 122.400 122.144 0.256 18141
1043 1 8 . 1 1 24 24 TRP HA H 24 4.240 4.240 4.478 -0.238 18141
1044 1 8 . 1 1 24 24 TRP CA C 24 59.300 59.300 60.910 -1.610 18141
1045 1 8 . 1 1 24 24 TRP H H 24 7.910 7.910 8.361 -0.451 18141
1046 1 8 . 1 1 25 25 CYS N N 25 117.800 117.800 117.137 0.663 18141
1047 1 8 . 1 1 25 25 CYS HA H 25 4.890 4.890 4.901 -0.011 18141
1048 1 8 . 1 1 25 25 CYS H H 25 9.110 9.110 8.079 1.031 18141
1049 1 8 . 1 1 26 26 CYS N N 26 120.700 120.700 121.198 -0.498 18141
1050 1 8 . 1 1 26 26 CYS HA H 26 4.530 4.530 4.318 0.212 18141
1051 1 8 . 1 1 26 26 CYS CA C 26 58.900 58.900 63.732 -4.832 18141
1052 1 8 . 1 1 26 26 CYS H H 26 8.940 8.940 8.450 0.490 18141
1053 1 8 . 1 1 27 27 ASP N N 27 120.700 120.700 119.122 1.578 18141
1054 1 8 . 1 1 27 27 ASP HA H 27 4.330 4.330 4.621 -0.291 18141
1055 1 8 . 1 1 27 27 ASP CA C 27 57.100 57.100 56.824 0.276 18141
1056 1 8 . 1 1 27 27 ASP H H 27 7.400 7.400 8.421 -1.021 18141
1057 1 8 . 1 1 28 28 PHE N N 28 123.100 123.100 121.477 1.623 18141
1058 1 8 . 1 1 28 28 PHE HA H 28 4.070 4.070 4.304 -0.234 18141
1059 1 8 . 1 1 28 28 PHE CA C 28 60.200 60.200 61.147 -0.947 18141
1060 1 8 . 1 1 28 28 PHE H H 28 8.590 8.590 7.477 1.113 18141
1061 1 8 . 1 1 29 29 VAL N N 29 116.200 116.200 118.352 -2.152 18141
1062 1 8 . 1 1 29 29 VAL HA H 29 3.120 3.120 3.056 0.064 18141
1063 1 8 . 1 1 29 29 VAL CA C 29 66.100 66.100 65.677 0.423 18141
1064 1 8 . 1 1 29 29 VAL H H 29 7.760 7.760 7.735 0.025 18141
1065 1 8 . 1 1 30 30 LYS N N 30 117.300 117.300 117.652 -0.352 18141
1066 1 8 . 1 1 30 30 LYS HA H 30 4.260 4.260 4.024 0.236 18141
1067 1 8 . 1 1 30 30 LYS H H 30 7.280 7.280 7.467 -0.187 18141
1068 1 8 . 1 1 31 31 ASP N N 31 122.600 122.600 119.191 3.409 18141
1069 1 8 . 1 1 31 31 ASP HA H 31 4.410 4.410 4.534 -0.124 18141
1070 1 8 . 1 1 31 31 ASP CA C 31 56.800 56.800 56.733 0.067 18141
1071 1 8 . 1 1 31 31 ASP H H 31 8.510 8.510 7.786 0.724 18141
1072 1 8 . 1 1 32 32 ILE N N 32 112.500 112.500 113.714 -1.214 18141
1073 1 8 . 1 1 32 32 ILE HA H 32 4.310 4.310 4.234 0.076 18141
1074 1 8 . 1 1 32 32 ILE CA C 32 62.800 62.800 60.210 2.590 18141
1075 1 8 . 1 1 32 32 ILE H H 32 7.320 7.320 6.893 0.427 18141
1076 1 8 . 1 1 33 33 ARG N N 33 114.200 114.200 119.774 -5.574 18141
1077 1 8 . 1 1 33 33 ARG HA H 33 3.870 3.870 3.929 -0.059 18141
1078 1 8 . 1 1 33 33 ARG CA C 33 56.600 56.600 57.179 -0.579 18141
1079 1 8 . 1 1 33 33 ARG H H 33 7.880 7.880 7.888 -0.008 18141
1080 1 8 . 1 1 34 34 MET N N 34 117.100 117.100 117.836 -0.736 18141
1081 1 8 . 1 1 34 34 MET HA H 34 4.640 4.640 4.663 -0.023 18141
1082 1 8 . 1 1 34 34 MET CA C 34 54.300 54.300 52.844 1.456 18141
1083 1 8 . 1 1 34 34 MET H H 34 7.570 7.570 8.037 -0.467 18141
1084 1 8 . 1 1 35 35 ASN N N 35 118.000 118.000 119.957 -1.957 18141
1085 1 8 . 1 1 35 35 ASN HA H 35 5.170 5.170 5.194 -0.024 18141
1086 1 8 . 1 1 35 35 ASN CA C 35 50.400 50.400 51.039 -0.639 18141
1087 1 8 . 1 1 35 35 ASN H H 35 8.390 8.390 8.713 -0.323 18141
1088 1 8 . 1 1 37 37 PRO HA H 37 4.320 4.320 4.471 -0.151 18141
1089 1 8 . 1 1 37 37 PRO CA C 37 61.200 61.200 62.290 -1.090 18141
1090 1 8 . 1 1 38 38 ALA N N 38 114.400 114.400 123.554 -9.154 18141
1091 1 8 . 1 1 38 38 ALA HA H 38 3.990 3.990 4.385 -0.395 18141
1092 1 8 . 1 1 38 38 ALA CA C 38 54.400 54.400 52.885 1.515 18141
1093 1 8 . 1 1 38 38 ALA H H 38 8.770 8.770 8.304 0.466 18141
1094 1 8 . 1 1 39 39 ASP N N 39 112.400 112.400 117.776 -5.376 18141
1095 1 8 . 1 1 39 39 ASP HA H 39 4.310 4.310 4.752 -0.442 18141
1096 1 8 . 1 1 39 39 ASP H H 39 8.710 8.710 8.181 0.529 18141
1097 1 8 . 1 1 40 40 LYS N N 40 117.000 117.000 118.765 -1.765 18141
1098 1 8 . 1 1 40 40 LYS HA H 40 4.370 4.370 4.406 -0.036 18141
1099 1 8 . 1 1 40 40 LYS CA C 40 57.000 57.000 56.971 0.029 18141
1100 1 8 . 1 1 40 40 LYS H H 40 6.990 6.990 8.009 -1.019 18141
1101 1 8 . 1 1 41 41 CYS N N 41 121.600 121.600 121.390 0.210 18141
1102 1 8 . 1 1 41 41 CYS HA H 41 5.180 5.180 4.990 0.190 18141
1103 1 8 . 1 1 41 41 CYS CA C 41 50.900 50.900 55.898 -4.998 18141
1104 1 8 . 1 1 41 41 CYS H H 41 7.520 7.520 8.356 -0.836 18141
1105 1 9 . 1 1 2 2 PRO HA H 2 4.370 4.370 4.685 -0.315 18141
1106 1 9 . 1 1 2 2 PRO CA C 2 62.800 62.800 63.396 -0.596 18141
1107 1 9 . 1 1 3 3 TYR N N 3 120.600 120.600 121.319 -0.719 18141
1108 1 9 . 1 1 3 3 TYR HA H 3 4.310 4.310 4.583 -0.273 18141
1109 1 9 . 1 1 3 3 TYR H H 3 8.160 8.160 7.903 0.257 18141
1110 1 9 . 1 1 4 4 CYS N N 4 119.100 119.100 125.161 -6.061 18141
1111 1 9 . 1 1 4 4 CYS HA H 4 3.330 3.330 4.615 -1.285 18141
1112 1 9 . 1 1 4 4 CYS CA C 4 53.500 53.500 57.373 -3.873 18141
1113 1 9 . 1 1 4 4 CYS H H 4 7.700 7.700 8.108 -0.408 18141
1114 1 9 . 1 1 5 5 GLY N N 5 107.900 107.900 109.481 -1.581 18141
1115 1 9 . 1 1 5 5 GLY CA C 5 43.700 43.700 45.639 -1.939 18141
1116 1 9 . 1 1 5 5 GLY H H 5 5.930 5.930 8.149 -2.219 18141
1117 1 9 . 1 1 6 6 GLN N N 6 114.200 114.200 121.041 -6.841 18141
1118 1 9 . 1 1 6 6 GLN HA H 6 4.420 4.420 4.408 0.012 18141
1119 1 9 . 1 1 6 6 GLN CA C 6 56.200 56.200 55.837 0.362 18141
1120 1 9 . 1 1 6 6 GLN H H 6 8.710 8.710 8.512 0.198 18141
1121 1 9 . 1 1 7 7 THR N N 7 106.600 106.600 111.786 -5.186 18141
1122 1 9 . 1 1 7 7 THR HA H 7 4.780 4.780 4.792 -0.012 18141
1123 1 9 . 1 1 7 7 THR CA C 7 58.700 58.700 61.104 -2.404 18141
1124 1 9 . 1 1 7 7 THR H H 7 7.300 7.300 7.231 0.069 18141
1125 1 9 . 1 1 8 8 GLY N N 8 110.400 110.400 110.996 -0.596 18141
1126 1 9 . 1 1 8 8 GLY CA C 8 48.000 48.000 47.048 0.952 18141
1127 1 9 . 1 1 8 8 GLY H H 8 9.260 9.260 8.693 0.567 18141
1128 1 9 . 1 1 9 9 ALA N N 9 123.400 123.400 123.870 -0.470 18141
1129 1 9 . 1 1 9 9 ALA HA H 9 4.090 4.090 3.892 0.198 18141
1130 1 9 . 1 1 9 9 ALA CA C 9 55.600 55.600 55.536 0.064 18141
1131 1 9 . 1 1 9 9 ALA H H 9 8.490 8.490 7.722 0.768 18141
1132 1 9 . 1 1 10 10 GLU N N 10 119.500 119.500 116.923 2.577 18141
1133 1 9 . 1 1 10 10 GLU HA H 10 4.230 4.230 4.078 0.152 18141
1134 1 9 . 1 1 10 10 GLU CA C 10 59.300 59.300 59.246 0.054 18141
1135 1 9 . 1 1 10 10 GLU H H 10 7.790 7.790 8.604 -0.814 18141
1136 1 9 . 1 1 11 11 CYS N N 11 118.300 118.300 118.901 -0.601 18141
1137 1 9 . 1 1 11 11 CYS HA H 11 4.850 4.850 4.532 0.318 18141
1138 1 9 . 1 1 11 11 CYS H H 11 8.460 8.460 7.934 0.526 18141
1139 1 9 . 1 1 12 12 TYR N N 12 121.800 121.800 121.195 0.605 18141
1140 1 9 . 1 1 12 12 TYR HA H 12 4.020 4.020 4.263 -0.243 18141
1141 1 9 . 1 1 12 12 TYR H H 12 8.860 8.860 8.935 -0.075 18141
1142 1 9 . 1 1 13 13 SER N N 13 114.500 114.500 114.772 -0.272 18141
1143 1 9 . 1 1 13 13 SER HA H 13 4.130 4.130 4.417 -0.287 18141
1144 1 9 . 1 1 13 13 SER CA C 13 62.600 62.600 60.875 1.725 18141
1145 1 9 . 1 1 13 13 SER H H 13 7.910 7.910 7.731 0.179 18141
1146 1 9 . 1 1 14 14 TRP N N 14 122.400 122.400 123.731 -1.331 18141
1147 1 9 . 1 1 14 14 TRP HA H 14 4.020 4.020 4.716 -0.696 18141
1148 1 9 . 1 1 14 14 TRP H H 14 8.680 8.680 8.234 0.446 18141
1149 1 9 . 1 1 15 15 CYS N N 15 120.500 120.500 117.417 3.083 18141
1150 1 9 . 1 1 15 15 CYS HA H 15 3.530 3.530 3.585 -0.055 18141
1151 1 9 . 1 1 15 15 CYS CA C 15 60.500 60.500 60.638 -0.138 18141
1152 1 9 . 1 1 15 15 CYS H H 15 8.120 8.120 8.217 -0.097 18141
1153 1 9 . 1 1 16 16 ILE N N 16 120.300 120.300 121.738 -1.438 18141
1154 1 9 . 1 1 16 16 ILE HA H 16 3.930 3.930 3.922 0.008 18141
1155 1 9 . 1 1 16 16 ILE CA C 16 61.700 61.700 62.298 -0.598 18141
1156 1 9 . 1 1 16 16 ILE H H 16 8.250 8.250 7.654 0.596 18141
1157 1 9 . 1 1 17 17 LYS N N 17 121.700 121.700 120.855 0.845 18141
1158 1 9 . 1 1 17 17 LYS HA H 17 4.100 4.100 3.874 0.226 18141
1159 1 9 . 1 1 17 17 LYS CA C 17 58.100 58.100 59.314 -1.214 18141
1160 1 9 . 1 1 17 17 LYS H H 17 7.800 7.800 7.844 -0.044 18141
1161 1 9 . 1 1 18 18 GLN N N 18 117.600 117.600 117.063 0.537 18141
1162 1 9 . 1 1 18 18 GLN HA H 18 4.030 4.030 3.849 0.181 18141
1163 1 9 . 1 1 18 18 GLN H H 18 7.240 7.240 7.487 -0.247 18141
1164 1 9 . 1 1 19 19 ASP N N 19 121.800 121.800 114.963 6.837 18141
1165 1 9 . 1 1 19 19 ASP HA H 19 4.320 4.320 4.268 0.052 18141
1166 1 9 . 1 1 19 19 ASP H H 19 8.050 8.050 8.190 -0.140 18141
1167 1 9 . 1 1 20 20 LEU N N 20 119.400 119.400 117.520 1.880 18141
1168 1 9 . 1 1 20 20 LEU HA H 20 4.300 4.300 4.264 0.036 18141
1169 1 9 . 1 1 20 20 LEU H H 20 6.430 6.430 8.421 -1.991 18141
1170 1 9 . 1 1 21 21 SER N N 21 115.500 115.500 108.990 6.510 18141
1171 1 9 . 1 1 21 21 SER HA H 21 4.290 4.290 4.456 -0.166 18141
1172 1 9 . 1 1 21 21 SER H H 21 8.260 8.260 7.542 0.718 18141
1173 1 9 . 1 1 22 22 LYS N N 22 122.700 122.700 121.492 1.208 18141
1174 1 9 . 1 1 22 22 LYS HA H 22 4.020 4.020 4.323 -0.303 18141
1175 1 9 . 1 1 22 22 LYS H H 22 8.690 8.690 8.802 -0.112 18141
1176 1 9 . 1 1 23 23 ASP N N 23 117.000 117.000 118.658 -1.658 18141
1177 1 9 . 1 1 23 23 ASP HA H 23 4.370 4.370 4.589 -0.219 18141
1178 1 9 . 1 1 23 23 ASP CA C 23 55.300 55.300 56.126 -0.826 18141
1179 1 9 . 1 1 23 23 ASP H H 23 8.260 8.260 8.628 -0.368 18141
1180 1 9 . 1 1 24 24 TRP N N 24 122.400 122.400 120.667 1.733 18141
1181 1 9 . 1 1 24 24 TRP HA H 24 4.240 4.240 4.326 -0.086 18141
1182 1 9 . 1 1 24 24 TRP CA C 24 59.300 59.300 60.474 -1.174 18141
1183 1 9 . 1 1 24 24 TRP H H 24 7.910 7.910 7.583 0.327 18141
1184 1 9 . 1 1 25 25 CYS N N 25 117.800 117.800 118.170 -0.370 18141
1185 1 9 . 1 1 25 25 CYS HA H 25 4.890 4.890 2.906 1.984 18141
1186 1 9 . 1 1 25 25 CYS H H 25 9.110 9.110 7.460 1.650 18141
1187 1 9 . 1 1 26 26 CYS N N 26 120.700 120.700 119.329 1.371 18141
1188 1 9 . 1 1 26 26 CYS HA H 26 4.530 4.530 4.141 0.389 18141
1189 1 9 . 1 1 26 26 CYS CA C 26 58.900 58.900 63.947 -5.047 18141
1190 1 9 . 1 1 26 26 CYS H H 26 8.940 8.940 8.020 0.920 18141
1191 1 9 . 1 1 27 27 ASP N N 27 120.700 120.700 118.437 2.263 18141
1192 1 9 . 1 1 27 27 ASP HA H 27 4.330 4.330 4.634 -0.304 18141
1193 1 9 . 1 1 27 27 ASP CA C 27 57.100 57.100 56.343 0.756 18141
1194 1 9 . 1 1 27 27 ASP H H 27 7.400 7.400 7.770 -0.370 18141
1195 1 9 . 1 1 28 28 PHE N N 28 123.100 123.100 121.939 1.161 18141
1196 1 9 . 1 1 28 28 PHE HA H 28 4.070 4.070 3.962 0.108 18141
1197 1 9 . 1 1 28 28 PHE CA C 28 60.200 60.200 60.990 -0.790 18141
1198 1 9 . 1 1 28 28 PHE H H 28 8.590 8.590 7.175 1.415 18141
1199 1 9 . 1 1 29 29 VAL N N 29 116.200 116.200 114.727 1.473 18141
1200 1 9 . 1 1 29 29 VAL HA H 29 3.120 3.120 3.490 -0.370 18141
1201 1 9 . 1 1 29 29 VAL CA C 29 66.100 66.100 66.308 -0.208 18141
1202 1 9 . 1 1 29 29 VAL H H 29 7.760 7.760 7.998 -0.238 18141
1203 1 9 . 1 1 30 30 LYS N N 30 117.300 117.300 119.043 -1.743 18141
1204 1 9 . 1 1 30 30 LYS HA H 30 4.260 4.260 4.069 0.191 18141
1205 1 9 . 1 1 30 30 LYS H H 30 7.280 7.280 7.511 -0.231 18141
1206 1 9 . 1 1 31 31 ASP N N 31 122.600 122.600 120.121 2.479 18141
1207 1 9 . 1 1 31 31 ASP HA H 31 4.410 4.410 4.388 0.022 18141
1208 1 9 . 1 1 31 31 ASP CA C 31 56.800 56.800 56.393 0.407 18141
1209 1 9 . 1 1 31 31 ASP H H 31 8.510 8.510 7.971 0.539 18141
1210 1 9 . 1 1 32 32 ILE N N 32 112.500 112.500 112.711 -0.211 18141
1211 1 9 . 1 1 32 32 ILE HA H 32 4.310 4.310 4.289 0.021 18141
1212 1 9 . 1 1 32 32 ILE CA C 32 62.800 62.800 59.999 2.801 18141
1213 1 9 . 1 1 32 32 ILE H H 32 7.320 7.320 7.017 0.303 18141
1214 1 9 . 1 1 33 33 ARG N N 33 114.200 114.200 118.531 -4.331 18141
1215 1 9 . 1 1 33 33 ARG HA H 33 3.870 3.870 3.873 -0.003 18141
1216 1 9 . 1 1 33 33 ARG CA C 33 56.600 56.600 57.149 -0.549 18141
1217 1 9 . 1 1 33 33 ARG H H 33 7.880 7.880 7.654 0.226 18141
1218 1 9 . 1 1 34 34 MET N N 34 117.100 117.100 117.603 -0.503 18141
1219 1 9 . 1 1 34 34 MET HA H 34 4.640 4.640 4.563 0.077 18141
1220 1 9 . 1 1 34 34 MET CA C 34 54.300 54.300 53.656 0.644 18141
1221 1 9 . 1 1 34 34 MET H H 34 7.570 7.570 7.447 0.123 18141
1222 1 9 . 1 1 35 35 ASN N N 35 118.000 118.000 118.716 -0.716 18141
1223 1 9 . 1 1 35 35 ASN HA H 35 5.170 5.170 5.201 -0.031 18141
1224 1 9 . 1 1 35 35 ASN CA C 35 50.400 50.400 50.749 -0.349 18141
1225 1 9 . 1 1 35 35 ASN H H 35 8.390 8.390 8.631 -0.241 18141
1226 1 9 . 1 1 37 37 PRO HA H 37 4.320 4.320 4.415 -0.095 18141
1227 1 9 . 1 1 37 37 PRO CA C 37 61.200 61.200 62.338 -1.138 18141
1228 1 9 . 1 1 38 38 ALA N N 38 114.400 114.400 124.992 -10.592 18141
1229 1 9 . 1 1 38 38 ALA HA H 38 3.990 3.990 4.284 -0.294 18141
1230 1 9 . 1 1 38 38 ALA CA C 38 54.400 54.400 51.964 2.437 18141
1231 1 9 . 1 1 38 38 ALA H H 38 8.770 8.770 8.417 0.353 18141
1232 1 9 . 1 1 39 39 ASP N N 39 112.400 112.400 119.216 -6.816 18141
1233 1 9 . 1 1 39 39 ASP HA H 39 4.310 4.310 4.664 -0.354 18141
1234 1 9 . 1 1 39 39 ASP H H 39 8.710 8.710 8.073 0.637 18141
1235 1 9 . 1 1 40 40 LYS N N 40 117.000 117.000 118.420 -1.420 18141
1236 1 9 . 1 1 40 40 LYS HA H 40 4.370 4.370 4.465 -0.095 18141
1237 1 9 . 1 1 40 40 LYS CA C 40 57.000 57.000 55.917 1.083 18141
1238 1 9 . 1 1 40 40 LYS H H 40 6.990 6.990 7.853 -0.863 18141
1239 1 9 . 1 1 41 41 CYS N N 41 121.600 121.600 120.920 0.680 18141
1240 1 9 . 1 1 41 41 CYS HA H 41 5.180 5.180 4.994 0.186 18141
1241 1 9 . 1 1 41 41 CYS CA C 41 50.900 50.900 57.200 -6.300 18141
1242 1 9 . 1 1 41 41 CYS H H 41 7.520 7.520 8.342 -0.822 18141
1243 1 10 . 1 1 2 2 PRO HA H 2 4.370 4.370 4.705 -0.335 18141
1244 1 10 . 1 1 2 2 PRO CA C 2 62.800 62.800 63.208 -0.408 18141
1245 1 10 . 1 1 3 3 TYR N N 3 120.600 120.600 119.563 1.037 18141
1246 1 10 . 1 1 3 3 TYR HA H 3 4.310 4.310 4.505 -0.195 18141
1247 1 10 . 1 1 3 3 TYR H H 3 8.160 8.160 8.049 0.111 18141
1248 1 10 . 1 1 4 4 CYS N N 4 119.100 119.100 120.937 -1.837 18141
1249 1 10 . 1 1 4 4 CYS HA H 4 3.330 3.330 4.543 -1.213 18141
1250 1 10 . 1 1 4 4 CYS CA C 4 53.500 53.500 58.446 -4.946 18141
1251 1 10 . 1 1 4 4 CYS H H 4 7.700 7.700 7.693 0.007 18141
1252 1 10 . 1 1 5 5 GLY N N 5 107.900 107.900 106.552 1.348 18141
1253 1 10 . 1 1 5 5 GLY CA C 5 43.700 43.700 44.866 -1.166 18141
1254 1 10 . 1 1 5 5 GLY H H 5 5.930 5.930 7.136 -1.206 18141
1255 1 10 . 1 1 6 6 GLN N N 6 114.200 114.200 118.135 -3.935 18141
1256 1 10 . 1 1 6 6 GLN HA H 6 4.420 4.420 4.517 -0.097 18141
1257 1 10 . 1 1 6 6 GLN CA C 6 56.200 56.200 56.283 -0.083 18141
1258 1 10 . 1 1 6 6 GLN H H 6 8.710 8.710 8.549 0.161 18141
1259 1 10 . 1 1 7 7 THR N N 7 106.600 106.600 107.836 -1.236 18141
1260 1 10 . 1 1 7 7 THR HA H 7 4.780 4.780 4.590 0.190 18141
1261 1 10 . 1 1 7 7 THR CA C 7 58.700 58.700 59.972 -1.272 18141
1262 1 10 . 1 1 7 7 THR H H 7 7.300 7.300 7.303 -0.003 18141
1263 1 10 . 1 1 8 8 GLY N N 8 110.400 110.400 111.172 -0.772 18141
1264 1 10 . 1 1 8 8 GLY CA C 8 48.000 48.000 47.372 0.628 18141
1265 1 10 . 1 1 8 8 GLY H H 8 9.260 9.260 9.220 0.040 18141
1266 1 10 . 1 1 9 9 ALA N N 9 123.400 123.400 124.734 -1.334 18141
1267 1 10 . 1 1 9 9 ALA HA H 9 4.090 4.090 3.821 0.269 18141
1268 1 10 . 1 1 9 9 ALA CA C 9 55.600 55.600 55.297 0.303 18141
1269 1 10 . 1 1 9 9 ALA H H 9 8.490 8.490 8.575 -0.085 18141
1270 1 10 . 1 1 10 10 GLU N N 10 119.500 119.500 117.759 1.741 18141
1271 1 10 . 1 1 10 10 GLU HA H 10 4.230 4.230 4.048 0.182 18141
1272 1 10 . 1 1 10 10 GLU CA C 10 59.300 59.300 59.491 -0.191 18141
1273 1 10 . 1 1 10 10 GLU H H 10 7.790 7.790 8.185 -0.395 18141
1274 1 10 . 1 1 11 11 CYS N N 11 118.300 118.300 118.632 -0.332 18141
1275 1 10 . 1 1 11 11 CYS HA H 11 4.850 4.850 4.473 0.377 18141
1276 1 10 . 1 1 11 11 CYS H H 11 8.460 8.460 7.587 0.873 18141
1277 1 10 . 1 1 12 12 TYR N N 12 121.800 121.800 120.983 0.817 18141
1278 1 10 . 1 1 12 12 TYR HA H 12 4.020 4.020 4.281 -0.261 18141
1279 1 10 . 1 1 12 12 TYR H H 12 8.860 8.860 9.011 -0.151 18141
1280 1 10 . 1 1 13 13 SER N N 13 114.500 114.500 114.636 -0.136 18141
1281 1 10 . 1 1 13 13 SER HA H 13 4.130 4.130 4.451 -0.321 18141
1282 1 10 . 1 1 13 13 SER CA C 13 62.600 62.600 61.906 0.694 18141
1283 1 10 . 1 1 13 13 SER H H 13 7.910 7.910 7.845 0.065 18141
1284 1 10 . 1 1 14 14 TRP N N 14 122.400 122.400 122.867 -0.467 18141
1285 1 10 . 1 1 14 14 TRP HA H 14 4.020 4.020 4.702 -0.682 18141
1286 1 10 . 1 1 14 14 TRP H H 14 8.680 8.680 8.039 0.641 18141
1287 1 10 . 1 1 15 15 CYS N N 15 120.500 120.500 118.569 1.931 18141
1288 1 10 . 1 1 15 15 CYS HA H 15 3.530 3.530 3.693 -0.163 18141
1289 1 10 . 1 1 15 15 CYS CA C 15 60.500 60.500 61.168 -0.668 18141
1290 1 10 . 1 1 15 15 CYS H H 15 8.120 8.120 8.705 -0.585 18141
1291 1 10 . 1 1 16 16 ILE N N 16 120.300 120.300 121.666 -1.366 18141
1292 1 10 . 1 1 16 16 ILE HA H 16 3.930 3.930 4.148 -0.218 18141
1293 1 10 . 1 1 16 16 ILE CA C 16 61.700 61.700 64.010 -2.310 18141
1294 1 10 . 1 1 16 16 ILE H H 16 8.250 8.250 7.766 0.484 18141
1295 1 10 . 1 1 17 17 LYS N N 17 121.700 121.700 121.274 0.426 18141
1296 1 10 . 1 1 17 17 LYS HA H 17 4.100 4.100 3.957 0.143 18141
1297 1 10 . 1 1 17 17 LYS CA C 17 58.100 58.100 58.666 -0.566 18141
1298 1 10 . 1 1 17 17 LYS H H 17 7.800 7.800 7.375 0.425 18141
1299 1 10 . 1 1 18 18 GLN N N 18 117.600 117.600 117.307 0.293 18141
1300 1 10 . 1 1 18 18 GLN HA H 18 4.030 4.030 3.982 0.048 18141
1301 1 10 . 1 1 18 18 GLN H H 18 7.240 7.240 7.349 -0.109 18141
1302 1 10 . 1 1 19 19 ASP N N 19 121.800 121.800 116.861 4.939 18141
1303 1 10 . 1 1 19 19 ASP HA H 19 4.320 4.320 4.218 0.102 18141
1304 1 10 . 1 1 19 19 ASP H H 19 8.050 8.050 7.988 0.062 18141
1305 1 10 . 1 1 20 20 LEU N N 20 119.400 119.400 117.072 2.328 18141
1306 1 10 . 1 1 20 20 LEU HA H 20 4.300 4.300 4.253 0.047 18141
1307 1 10 . 1 1 20 20 LEU H H 20 6.430 6.430 8.305 -1.875 18141
1308 1 10 . 1 1 21 21 SER N N 21 115.500 115.500 109.417 6.083 18141
1309 1 10 . 1 1 21 21 SER HA H 21 4.290 4.290 4.531 -0.241 18141
1310 1 10 . 1 1 21 21 SER H H 21 8.260 8.260 7.607 0.653 18141
1311 1 10 . 1 1 22 22 LYS N N 22 122.700 122.700 121.372 1.328 18141
1312 1 10 . 1 1 22 22 LYS HA H 22 4.020 4.020 4.126 -0.106 18141
1313 1 10 . 1 1 22 22 LYS H H 22 8.690 8.690 8.555 0.135 18141
1314 1 10 . 1 1 23 23 ASP N N 23 117.000 117.000 118.463 -1.463 18141
1315 1 10 . 1 1 23 23 ASP HA H 23 4.370 4.370 4.424 -0.054 18141
1316 1 10 . 1 1 23 23 ASP CA C 23 55.300 55.300 57.060 -1.760 18141
1317 1 10 . 1 1 23 23 ASP H H 23 8.260 8.260 8.765 -0.505 18141
1318 1 10 . 1 1 24 24 TRP N N 24 122.400 122.400 121.021 1.379 18141
1319 1 10 . 1 1 24 24 TRP HA H 24 4.240 4.240 4.237 0.003 18141
1320 1 10 . 1 1 24 24 TRP CA C 24 59.300 59.300 59.796 -0.496 18141
1321 1 10 . 1 1 24 24 TRP H H 24 7.910 7.910 8.040 -0.130 18141
1322 1 10 . 1 1 25 25 CYS N N 25 117.800 117.800 118.023 -0.223 18141
1323 1 10 . 1 1 25 25 CYS HA H 25 4.890 4.890 3.129 1.761 18141
1324 1 10 . 1 1 25 25 CYS H H 25 9.110 9.110 7.167 1.943 18141
1325 1 10 . 1 1 26 26 CYS N N 26 120.700 120.700 120.001 0.699 18141
1326 1 10 . 1 1 26 26 CYS HA H 26 4.530 4.530 4.288 0.242 18141
1327 1 10 . 1 1 26 26 CYS CA C 26 58.900 58.900 63.319 -4.420 18141
1328 1 10 . 1 1 26 26 CYS H H 26 8.940 8.940 7.883 1.057 18141
1329 1 10 . 1 1 27 27 ASP N N 27 120.700 120.700 118.443 2.257 18141
1330 1 10 . 1 1 27 27 ASP HA H 27 4.330 4.330 4.569 -0.239 18141
1331 1 10 . 1 1 27 27 ASP CA C 27 57.100 57.100 55.923 1.177 18141
1332 1 10 . 1 1 27 27 ASP H H 27 7.400 7.400 7.891 -0.491 18141
1333 1 10 . 1 1 28 28 PHE N N 28 123.100 123.100 121.913 1.187 18141
1334 1 10 . 1 1 28 28 PHE HA H 28 4.070 4.070 4.237 -0.167 18141
1335 1 10 . 1 1 28 28 PHE CA C 28 60.200 60.200 61.017 -0.817 18141
1336 1 10 . 1 1 28 28 PHE H H 28 8.590 8.590 7.740 0.850 18141
1337 1 10 . 1 1 29 29 VAL N N 29 116.200 116.200 119.642 -3.442 18141
1338 1 10 . 1 1 29 29 VAL HA H 29 3.120 3.120 3.209 -0.089 18141
1339 1 10 . 1 1 29 29 VAL CA C 29 66.100 66.100 65.531 0.569 18141
1340 1 10 . 1 1 29 29 VAL H H 29 7.760 7.760 7.786 -0.026 18141
1341 1 10 . 1 1 30 30 LYS N N 30 117.300 117.300 118.941 -1.641 18141
1342 1 10 . 1 1 30 30 LYS HA H 30 4.260 4.260 3.950 0.310 18141
1343 1 10 . 1 1 30 30 LYS H H 30 7.280 7.280 7.513 -0.233 18141
1344 1 10 . 1 1 31 31 ASP N N 31 122.600 122.600 119.321 3.279 18141
1345 1 10 . 1 1 31 31 ASP HA H 31 4.410 4.410 4.354 0.056 18141
1346 1 10 . 1 1 31 31 ASP CA C 31 56.800 56.800 57.292 -0.492 18141
1347 1 10 . 1 1 31 31 ASP H H 31 8.510 8.510 7.424 1.086 18141
1348 1 10 . 1 1 32 32 ILE N N 32 112.500 112.500 115.397 -2.897 18141
1349 1 10 . 1 1 32 32 ILE HA H 32 4.310 4.310 4.212 0.098 18141
1350 1 10 . 1 1 32 32 ILE CA C 32 62.800 62.800 60.343 2.457 18141
1351 1 10 . 1 1 32 32 ILE H H 32 7.320 7.320 7.110 0.210 18141
1352 1 10 . 1 1 33 33 ARG N N 33 114.200 114.200 117.098 -2.898 18141
1353 1 10 . 1 1 33 33 ARG HA H 33 3.870 3.870 3.823 0.047 18141
1354 1 10 . 1 1 33 33 ARG CA C 33 56.600 56.600 57.061 -0.461 18141
1355 1 10 . 1 1 33 33 ARG H H 33 7.880 7.880 7.702 0.178 18141
1356 1 10 . 1 1 34 34 MET N N 34 117.100 117.100 118.291 -1.191 18141
1357 1 10 . 1 1 34 34 MET HA H 34 4.640 4.640 4.573 0.067 18141
1358 1 10 . 1 1 34 34 MET CA C 34 54.300 54.300 53.055 1.245 18141
1359 1 10 . 1 1 34 34 MET H H 34 7.570 7.570 7.677 -0.107 18141
1360 1 10 . 1 1 35 35 ASN N N 35 118.000 118.000 118.112 -0.112 18141
1361 1 10 . 1 1 35 35 ASN HA H 35 5.170 5.170 5.152 0.018 18141
1362 1 10 . 1 1 35 35 ASN CA C 35 50.400 50.400 51.068 -0.668 18141
1363 1 10 . 1 1 35 35 ASN H H 35 8.390 8.390 8.614 -0.224 18141
1364 1 10 . 1 1 37 37 PRO HA H 37 4.320 4.320 4.404 -0.084 18141
1365 1 10 . 1 1 37 37 PRO CA C 37 61.200 61.200 62.396 -1.196 18141
1366 1 10 . 1 1 38 38 ALA N N 38 114.400 114.400 126.598 -12.198 18141
1367 1 10 . 1 1 38 38 ALA HA H 38 3.990 3.990 4.192 -0.202 18141
1368 1 10 . 1 1 38 38 ALA CA C 38 54.400 54.400 53.450 0.950 18141
1369 1 10 . 1 1 38 38 ALA H H 38 8.770 8.770 8.482 0.289 18141
1370 1 10 . 1 1 39 39 ASP N N 39 112.400 112.400 118.308 -5.908 18141
1371 1 10 . 1 1 39 39 ASP HA H 39 4.310 4.310 4.524 -0.214 18141
1372 1 10 . 1 1 39 39 ASP H H 39 8.710 8.710 8.078 0.632 18141
1373 1 10 . 1 1 40 40 LYS N N 40 117.000 117.000 119.736 -2.736 18141
1374 1 10 . 1 1 40 40 LYS HA H 40 4.370 4.370 4.226 0.144 18141
1375 1 10 . 1 1 40 40 LYS CA C 40 57.000 57.000 56.652 0.348 18141
1376 1 10 . 1 1 40 40 LYS H H 40 6.990 6.990 8.104 -1.114 18141
1377 1 10 . 1 1 41 41 CYS N N 41 121.600 121.600 118.184 3.416 18141
1378 1 10 . 1 1 41 41 CYS HA H 41 5.180 5.180 5.101 0.079 18141
1379 1 10 . 1 1 41 41 CYS CA C 41 50.900 50.900 55.163 -4.263 18141
1380 1 10 . 1 1 41 41 CYS H H 41 7.520 7.520 7.736 -0.216 18141
1381 1 11 . 1 1 2 2 PRO HA H 2 4.370 4.370 4.557 -0.187 18141
1382 1 11 . 1 1 2 2 PRO CA C 2 62.800 62.800 62.137 0.663 18141
1383 1 11 . 1 1 3 3 TYR N N 3 120.600 120.600 120.984 -0.384 18141
1384 1 11 . 1 1 3 3 TYR HA H 3 4.310 4.310 4.154 0.156 18141
1385 1 11 . 1 1 3 3 TYR H H 3 8.160 8.160 7.158 1.002 18141
1386 1 11 . 1 1 4 4 CYS N N 4 119.100 119.100 122.933 -3.833 18141
1387 1 11 . 1 1 4 4 CYS HA H 4 3.330 3.330 4.537 -1.207 18141
1388 1 11 . 1 1 4 4 CYS CA C 4 53.500 53.500 58.445 -4.945 18141
1389 1 11 . 1 1 4 4 CYS H H 4 7.700 7.700 8.425 -0.725 18141
1390 1 11 . 1 1 5 5 GLY N N 5 107.900 107.900 112.638 -4.738 18141
1391 1 11 . 1 1 5 5 GLY CA C 5 43.700 43.700 46.393 -2.693 18141
1392 1 11 . 1 1 5 5 GLY H H 5 5.930 5.930 8.104 -2.174 18141
1393 1 11 . 1 1 6 6 GLN N N 6 114.200 114.200 122.561 -8.361 18141
1394 1 11 . 1 1 6 6 GLN HA H 6 4.420 4.420 4.650 -0.230 18141
1395 1 11 . 1 1 6 6 GLN CA C 6 56.200 56.200 55.342 0.859 18141
1396 1 11 . 1 1 6 6 GLN H H 6 8.710 8.710 8.749 -0.039 18141
1397 1 11 . 1 1 7 7 THR N N 7 106.600 106.600 108.714 -2.114 18141
1398 1 11 . 1 1 7 7 THR HA H 7 4.780 4.780 4.697 0.083 18141
1399 1 11 . 1 1 7 7 THR CA C 7 58.700 58.700 60.526 -1.826 18141
1400 1 11 . 1 1 7 7 THR H H 7 7.300 7.300 7.706 -0.406 18141
1401 1 11 . 1 1 8 8 GLY N N 8 110.400 110.400 107.312 3.088 18141
1402 1 11 . 1 1 8 8 GLY CA C 8 48.000 48.000 46.215 1.785 18141
1403 1 11 . 1 1 8 8 GLY H H 8 9.260 9.260 8.330 0.930 18141
1404 1 11 . 1 1 9 9 ALA N N 9 123.400 123.400 124.853 -1.453 18141
1405 1 11 . 1 1 9 9 ALA HA H 9 4.090 4.090 4.002 0.088 18141
1406 1 11 . 1 1 9 9 ALA CA C 9 55.600 55.600 55.890 -0.290 18141
1407 1 11 . 1 1 9 9 ALA H H 9 8.490 8.490 7.676 0.814 18141
1408 1 11 . 1 1 10 10 GLU N N 10 119.500 119.500 116.385 3.115 18141
1409 1 11 . 1 1 10 10 GLU HA H 10 4.230 4.230 4.033 0.197 18141
1410 1 11 . 1 1 10 10 GLU CA C 10 59.300 59.300 59.083 0.217 18141
1411 1 11 . 1 1 10 10 GLU H H 10 7.790 7.790 8.880 -1.090 18141
1412 1 11 . 1 1 11 11 CYS N N 11 118.300 118.300 118.514 -0.214 18141
1413 1 11 . 1 1 11 11 CYS HA H 11 4.850 4.850 4.733 0.117 18141
1414 1 11 . 1 1 11 11 CYS H H 11 8.460 8.460 7.763 0.697 18141
1415 1 11 . 1 1 12 12 TYR N N 12 121.800 121.800 122.524 -0.724 18141
1416 1 11 . 1 1 12 12 TYR HA H 12 4.020 4.020 4.145 -0.125 18141
1417 1 11 . 1 1 12 12 TYR H H 12 8.860 8.860 9.277 -0.417 18141
1418 1 11 . 1 1 13 13 SER N N 13 114.500 114.500 114.642 -0.142 18141
1419 1 11 . 1 1 13 13 SER HA H 13 4.130 4.130 3.881 0.249 18141
1420 1 11 . 1 1 13 13 SER CA C 13 62.600 62.600 62.333 0.267 18141
1421 1 11 . 1 1 13 13 SER H H 13 7.910 7.910 8.588 -0.678 18141
1422 1 11 . 1 1 14 14 TRP N N 14 122.400 122.400 121.456 0.944 18141
1423 1 11 . 1 1 14 14 TRP HA H 14 4.020 4.020 4.589 -0.569 18141
1424 1 11 . 1 1 14 14 TRP H H 14 8.680 8.680 7.839 0.841 18141
1425 1 11 . 1 1 15 15 CYS N N 15 120.500 120.500 120.859 -0.359 18141
1426 1 11 . 1 1 15 15 CYS HA H 15 3.530 3.530 4.048 -0.518 18141
1427 1 11 . 1 1 15 15 CYS CA C 15 60.500 60.500 61.396 -0.896 18141
1428 1 11 . 1 1 15 15 CYS H H 15 8.120 8.120 7.787 0.333 18141
1429 1 11 . 1 1 16 16 ILE N N 16 120.300 120.300 118.830 1.470 18141
1430 1 11 . 1 1 16 16 ILE HA H 16 3.930 3.930 3.988 -0.058 18141
1431 1 11 . 1 1 16 16 ILE CA C 16 61.700 61.700 64.490 -2.789 18141
1432 1 11 . 1 1 16 16 ILE H H 16 8.250 8.250 7.947 0.303 18141
1433 1 11 . 1 1 17 17 LYS N N 17 121.700 121.700 121.386 0.314 18141
1434 1 11 . 1 1 17 17 LYS HA H 17 4.100 4.100 3.893 0.207 18141
1435 1 11 . 1 1 17 17 LYS CA C 17 58.100 58.100 58.828 -0.728 18141
1436 1 11 . 1 1 17 17 LYS H H 17 7.800 7.800 7.592 0.208 18141
1437 1 11 . 1 1 18 18 GLN N N 18 117.600 117.600 117.479 0.121 18141
1438 1 11 . 1 1 18 18 GLN HA H 18 4.030 4.030 3.928 0.102 18141
1439 1 11 . 1 1 18 18 GLN H H 18 7.240 7.240 7.744 -0.504 18141
1440 1 11 . 1 1 19 19 ASP N N 19 121.800 121.800 115.002 6.798 18141
1441 1 11 . 1 1 19 19 ASP HA H 19 4.320 4.320 4.384 -0.064 18141
1442 1 11 . 1 1 19 19 ASP H H 19 8.050 8.050 8.016 0.034 18141
1443 1 11 . 1 1 20 20 LEU N N 20 119.400 119.400 118.375 1.025 18141
1444 1 11 . 1 1 20 20 LEU HA H 20 4.300 4.300 4.328 -0.028 18141
1445 1 11 . 1 1 20 20 LEU H H 20 6.430 6.430 8.737 -2.307 18141
1446 1 11 . 1 1 21 21 SER N N 21 115.500 115.500 110.187 5.313 18141
1447 1 11 . 1 1 21 21 SER HA H 21 4.290 4.290 4.535 -0.245 18141
1448 1 11 . 1 1 21 21 SER H H 21 8.260 8.260 7.760 0.500 18141
1449 1 11 . 1 1 22 22 LYS N N 22 122.700 122.700 120.362 2.338 18141
1450 1 11 . 1 1 22 22 LYS HA H 22 4.020 4.020 4.243 -0.223 18141
1451 1 11 . 1 1 22 22 LYS H H 22 8.690 8.690 8.677 0.013 18141
1452 1 11 . 1 1 23 23 ASP N N 23 117.000 117.000 118.786 -1.786 18141
1453 1 11 . 1 1 23 23 ASP HA H 23 4.370 4.370 4.513 -0.143 18141
1454 1 11 . 1 1 23 23 ASP CA C 23 55.300 55.300 56.087 -0.786 18141
1455 1 11 . 1 1 23 23 ASP H H 23 8.260 8.260 8.096 0.164 18141
1456 1 11 . 1 1 24 24 TRP N N 24 122.400 122.400 120.721 1.679 18141
1457 1 11 . 1 1 24 24 TRP HA H 24 4.240 4.240 4.363 -0.123 18141
1458 1 11 . 1 1 24 24 TRP CA C 24 59.300 59.300 60.507 -1.207 18141
1459 1 11 . 1 1 24 24 TRP H H 24 7.910 7.910 7.736 0.174 18141
1460 1 11 . 1 1 25 25 CYS N N 25 117.800 117.800 116.378 1.422 18141
1461 1 11 . 1 1 25 25 CYS HA H 25 4.890 4.890 4.033 0.857 18141
1462 1 11 . 1 1 25 25 CYS H H 25 9.110 9.110 7.701 1.409 18141
1463 1 11 . 1 1 26 26 CYS N N 26 120.700 120.700 120.378 0.322 18141
1464 1 11 . 1 1 26 26 CYS HA H 26 4.530 4.530 3.673 0.857 18141
1465 1 11 . 1 1 26 26 CYS CA C 26 58.900 58.900 63.790 -4.890 18141
1466 1 11 . 1 1 26 26 CYS H H 26 8.940 8.940 8.186 0.754 18141
1467 1 11 . 1 1 27 27 ASP N N 27 120.700 120.700 118.243 2.457 18141
1468 1 11 . 1 1 27 27 ASP HA H 27 4.330 4.330 4.567 -0.237 18141
1469 1 11 . 1 1 27 27 ASP CA C 27 57.100 57.100 56.863 0.237 18141
1470 1 11 . 1 1 27 27 ASP H H 27 7.400 7.400 7.507 -0.107 18141
1471 1 11 . 1 1 28 28 PHE N N 28 123.100 123.100 121.521 1.579 18141
1472 1 11 . 1 1 28 28 PHE HA H 28 4.070 4.070 3.959 0.111 18141
1473 1 11 . 1 1 28 28 PHE CA C 28 60.200 60.200 60.528 -0.328 18141
1474 1 11 . 1 1 28 28 PHE H H 28 8.590 8.590 7.379 1.211 18141
1475 1 11 . 1 1 29 29 VAL N N 29 116.200 116.200 114.380 1.820 18141
1476 1 11 . 1 1 29 29 VAL HA H 29 3.120 3.120 3.041 0.079 18141
1477 1 11 . 1 1 29 29 VAL CA C 29 66.100 66.100 65.770 0.330 18141
1478 1 11 . 1 1 29 29 VAL H H 29 7.760 7.760 7.490 0.270 18141
1479 1 11 . 1 1 30 30 LYS N N 30 117.300 117.300 120.296 -2.996 18141
1480 1 11 . 1 1 30 30 LYS HA H 30 4.260 4.260 3.980 0.280 18141
1481 1 11 . 1 1 30 30 LYS H H 30 7.280 7.280 7.112 0.168 18141
1482 1 11 . 1 1 31 31 ASP N N 31 122.600 122.600 120.619 1.981 18141
1483 1 11 . 1 1 31 31 ASP HA H 31 4.410 4.410 4.280 0.130 18141
1484 1 11 . 1 1 31 31 ASP CA C 31 56.800 56.800 57.538 -0.737 18141
1485 1 11 . 1 1 31 31 ASP H H 31 8.510 8.510 8.321 0.189 18141
1486 1 11 . 1 1 32 32 ILE N N 32 112.500 112.500 112.041 0.459 18141
1487 1 11 . 1 1 32 32 ILE HA H 32 4.310 4.310 4.106 0.204 18141
1488 1 11 . 1 1 32 32 ILE CA C 32 62.800 62.800 60.484 2.316 18141
1489 1 11 . 1 1 32 32 ILE H H 32 7.320 7.320 7.020 0.300 18141
1490 1 11 . 1 1 33 33 ARG N N 33 114.200 114.200 119.559 -5.359 18141
1491 1 11 . 1 1 33 33 ARG HA H 33 3.870 3.870 3.924 -0.054 18141
1492 1 11 . 1 1 33 33 ARG CA C 33 56.600 56.600 57.050 -0.450 18141
1493 1 11 . 1 1 33 33 ARG H H 33 7.880 7.880 8.200 -0.320 18141
1494 1 11 . 1 1 34 34 MET N N 34 117.100 117.100 119.856 -2.756 18141
1495 1 11 . 1 1 34 34 MET HA H 34 4.640 4.640 4.641 -0.001 18141
1496 1 11 . 1 1 34 34 MET CA C 34 54.300 54.300 54.167 0.133 18141
1497 1 11 . 1 1 34 34 MET H H 34 7.570 7.570 7.836 -0.266 18141
1498 1 11 . 1 1 35 35 ASN N N 35 118.000 118.000 119.857 -1.857 18141
1499 1 11 . 1 1 35 35 ASN HA H 35 5.170 5.170 5.162 0.008 18141
1500 1 11 . 1 1 35 35 ASN CA C 35 50.400 50.400 50.508 -0.108 18141
1501 1 11 . 1 1 35 35 ASN H H 35 8.390 8.390 8.520 -0.130 18141
1502 1 11 . 1 1 37 37 PRO HA H 37 4.320 4.320 4.567 -0.247 18141
1503 1 11 . 1 1 37 37 PRO CA C 37 61.200 61.200 61.763 -0.563 18141
1504 1 11 . 1 1 38 38 ALA N N 38 114.400 114.400 123.832 -9.432 18141
1505 1 11 . 1 1 38 38 ALA HA H 38 3.990 3.990 4.440 -0.450 18141
1506 1 11 . 1 1 38 38 ALA CA C 38 54.400 54.400 53.855 0.545 18141
1507 1 11 . 1 1 38 38 ALA H H 38 8.770 8.770 8.474 0.296 18141
1508 1 11 . 1 1 39 39 ASP N N 39 112.400 112.400 117.487 -5.087 18141
1509 1 11 . 1 1 39 39 ASP HA H 39 4.310 4.310 4.472 -0.162 18141
1510 1 11 . 1 1 39 39 ASP H H 39 8.710 8.710 8.420 0.290 18141
1511 1 11 . 1 1 40 40 LYS N N 40 117.000 117.000 116.475 0.525 18141
1512 1 11 . 1 1 40 40 LYS HA H 40 4.370 4.370 4.417 -0.047 18141
1513 1 11 . 1 1 40 40 LYS CA C 40 57.000 57.000 56.482 0.518 18141
1514 1 11 . 1 1 40 40 LYS H H 40 6.990 6.990 7.435 -0.445 18141
1515 1 11 . 1 1 41 41 CYS N N 41 121.600 121.600 120.156 1.444 18141
1516 1 11 . 1 1 41 41 CYS HA H 41 5.180 5.180 5.117 0.063 18141
1517 1 11 . 1 1 41 41 CYS CA C 41 50.900 50.900 56.342 -5.442 18141
1518 1 11 . 1 1 41 41 CYS H H 41 7.520 7.520 8.171 -0.651 18141
1519 1 12 . 1 1 2 2 PRO HA H 2 4.370 4.370 4.650 -0.280 18141
1520 1 12 . 1 1 2 2 PRO CA C 2 62.800 62.800 62.789 0.011 18141
1521 1 12 . 1 1 3 3 TYR N N 3 120.600 120.600 120.449 0.151 18141
1522 1 12 . 1 1 3 3 TYR HA H 3 4.310 4.310 4.671 -0.361 18141
1523 1 12 . 1 1 3 3 TYR H H 3 8.160 8.160 7.767 0.393 18141
1524 1 12 . 1 1 4 4 CYS N N 4 119.100 119.100 125.271 -6.171 18141
1525 1 12 . 1 1 4 4 CYS HA H 4 3.330 3.330 4.259 -0.929 18141
1526 1 12 . 1 1 4 4 CYS CA C 4 53.500 53.500 57.931 -4.431 18141
1527 1 12 . 1 1 4 4 CYS H H 4 7.700 7.700 8.564 -0.864 18141
1528 1 12 . 1 1 5 5 GLY N N 5 107.900 107.900 107.316 0.584 18141
1529 1 12 . 1 1 5 5 GLY CA C 5 43.700 43.700 45.229 -1.529 18141
1530 1 12 . 1 1 5 5 GLY H H 5 5.930 5.930 8.460 -2.530 18141
1531 1 12 . 1 1 6 6 GLN N N 6 114.200 114.200 121.721 -7.521 18141
1532 1 12 . 1 1 6 6 GLN HA H 6 4.420 4.420 4.077 0.343 18141
1533 1 12 . 1 1 6 6 GLN CA C 6 56.200 56.200 58.370 -2.170 18141
1534 1 12 . 1 1 6 6 GLN H H 6 8.710 8.710 8.477 0.233 18141
1535 1 12 . 1 1 7 7 THR N N 7 106.600 106.600 106.020 0.580 18141
1536 1 12 . 1 1 7 7 THR HA H 7 4.780 4.780 4.614 0.166 18141
1537 1 12 . 1 1 7 7 THR CA C 7 58.700 58.700 60.501 -1.801 18141
1538 1 12 . 1 1 7 7 THR H H 7 7.300 7.300 7.784 -0.484 18141
1539 1 12 . 1 1 8 8 GLY N N 8 110.400 110.400 107.198 3.202 18141
1540 1 12 . 1 1 8 8 GLY CA C 8 48.000 48.000 46.710 1.290 18141
1541 1 12 . 1 1 8 8 GLY H H 8 9.260 9.260 8.278 0.982 18141
1542 1 12 . 1 1 9 9 ALA N N 9 123.400 123.400 123.446 -0.046 18141
1543 1 12 . 1 1 9 9 ALA HA H 9 4.090 4.090 3.992 0.098 18141
1544 1 12 . 1 1 9 9 ALA CA C 9 55.600 55.600 54.991 0.609 18141
1545 1 12 . 1 1 9 9 ALA H H 9 8.490 8.490 8.629 -0.139 18141
1546 1 12 . 1 1 10 10 GLU N N 10 119.500 119.500 117.982 1.518 18141
1547 1 12 . 1 1 10 10 GLU HA H 10 4.230 4.230 4.048 0.182 18141
1548 1 12 . 1 1 10 10 GLU CA C 10 59.300 59.300 59.126 0.174 18141
1549 1 12 . 1 1 10 10 GLU H H 10 7.790 7.790 8.482 -0.692 18141
1550 1 12 . 1 1 11 11 CYS N N 11 118.300 118.300 118.725 -0.425 18141
1551 1 12 . 1 1 11 11 CYS HA H 11 4.850 4.850 4.702 0.148 18141
1552 1 12 . 1 1 11 11 CYS H H 11 8.460 8.460 7.698 0.762 18141
1553 1 12 . 1 1 12 12 TYR N N 12 121.800 121.800 122.864 -1.064 18141
1554 1 12 . 1 1 12 12 TYR HA H 12 4.020 4.020 4.245 -0.225 18141
1555 1 12 . 1 1 12 12 TYR H H 12 8.860 8.860 8.965 -0.105 18141
1556 1 12 . 1 1 13 13 SER N N 13 114.500 114.500 114.198 0.302 18141
1557 1 12 . 1 1 13 13 SER HA H 13 4.130 4.130 3.729 0.401 18141
1558 1 12 . 1 1 13 13 SER CA C 13 62.600 62.600 61.014 1.586 18141
1559 1 12 . 1 1 13 13 SER H H 13 7.910 7.910 8.071 -0.161 18141
1560 1 12 . 1 1 14 14 TRP N N 14 122.400 122.400 122.526 -0.126 18141
1561 1 12 . 1 1 14 14 TRP HA H 14 4.020 4.020 4.565 -0.545 18141
1562 1 12 . 1 1 14 14 TRP H H 14 8.680 8.680 7.588 1.092 18141
1563 1 12 . 1 1 15 15 CYS N N 15 120.500 120.500 116.744 3.756 18141
1564 1 12 . 1 1 15 15 CYS HA H 15 3.530 3.530 4.199 -0.669 18141
1565 1 12 . 1 1 15 15 CYS CA C 15 60.500 60.500 60.117 0.383 18141
1566 1 12 . 1 1 15 15 CYS H H 15 8.120 8.120 7.827 0.293 18141
1567 1 12 . 1 1 16 16 ILE N N 16 120.300 120.300 121.834 -1.534 18141
1568 1 12 . 1 1 16 16 ILE HA H 16 3.930 3.930 3.809 0.121 18141
1569 1 12 . 1 1 16 16 ILE CA C 16 61.700 61.700 64.421 -2.721 18141
1570 1 12 . 1 1 16 16 ILE H H 16 8.250 8.250 7.763 0.487 18141
1571 1 12 . 1 1 17 17 LYS N N 17 121.700 121.700 120.596 1.104 18141
1572 1 12 . 1 1 17 17 LYS HA H 17 4.100 4.100 3.954 0.146 18141
1573 1 12 . 1 1 17 17 LYS CA C 17 58.100 58.100 58.513 -0.413 18141
1574 1 12 . 1 1 17 17 LYS H H 17 7.800 7.800 7.698 0.102 18141
1575 1 12 . 1 1 18 18 GLN N N 18 117.600 117.600 115.552 2.048 18141
1576 1 12 . 1 1 18 18 GLN HA H 18 4.030 4.030 4.045 -0.015 18141
1577 1 12 . 1 1 18 18 GLN H H 18 7.240 7.240 7.881 -0.641 18141
1578 1 12 . 1 1 19 19 ASP N N 19 121.800 121.800 116.969 4.831 18141
1579 1 12 . 1 1 19 19 ASP HA H 19 4.320 4.320 4.326 -0.006 18141
1580 1 12 . 1 1 19 19 ASP H H 19 8.050 8.050 7.770 0.280 18141
1581 1 12 . 1 1 20 20 LEU N N 20 119.400 119.400 117.208 2.192 18141
1582 1 12 . 1 1 20 20 LEU HA H 20 4.300 4.300 4.171 0.129 18141
1583 1 12 . 1 1 20 20 LEU H H 20 6.430 6.430 8.017 -1.587 18141
1584 1 12 . 1 1 21 21 SER N N 21 115.500 115.500 111.005 4.495 18141
1585 1 12 . 1 1 21 21 SER HA H 21 4.290 4.290 4.640 -0.350 18141
1586 1 12 . 1 1 21 21 SER H H 21 8.260 8.260 7.748 0.512 18141
1587 1 12 . 1 1 22 22 LYS N N 22 122.700 122.700 126.280 -3.580 18141
1588 1 12 . 1 1 22 22 LYS HA H 22 4.020 4.020 4.123 -0.103 18141
1589 1 12 . 1 1 22 22 LYS H H 22 8.690 8.690 8.956 -0.266 18141
1590 1 12 . 1 1 23 23 ASP N N 23 117.000 117.000 119.729 -2.729 18141
1591 1 12 . 1 1 23 23 ASP HA H 23 4.370 4.370 4.698 -0.328 18141
1592 1 12 . 1 1 23 23 ASP CA C 23 55.300 55.300 54.979 0.321 18141
1593 1 12 . 1 1 23 23 ASP H H 23 8.260 8.260 7.926 0.334 18141
1594 1 12 . 1 1 24 24 TRP N N 24 122.400 122.400 121.047 1.353 18141
1595 1 12 . 1 1 24 24 TRP HA H 24 4.240 4.240 4.462 -0.222 18141
1596 1 12 . 1 1 24 24 TRP CA C 24 59.300 59.300 60.592 -1.292 18141
1597 1 12 . 1 1 24 24 TRP H H 24 7.910 7.910 8.397 -0.487 18141
1598 1 12 . 1 1 25 25 CYS N N 25 117.800 117.800 119.272 -1.472 18141
1599 1 12 . 1 1 25 25 CYS HA H 25 4.890 4.890 2.974 1.916 18141
1600 1 12 . 1 1 25 25 CYS H H 25 9.110 9.110 7.372 1.738 18141
1601 1 12 . 1 1 26 26 CYS N N 26 120.700 120.700 119.079 1.621 18141
1602 1 12 . 1 1 26 26 CYS HA H 26 4.530 4.530 4.226 0.304 18141
1603 1 12 . 1 1 26 26 CYS CA C 26 58.900 58.900 62.857 -3.957 18141
1604 1 12 . 1 1 26 26 CYS H H 26 8.940 8.940 8.155 0.785 18141
1605 1 12 . 1 1 27 27 ASP N N 27 120.700 120.700 119.747 0.953 18141
1606 1 12 . 1 1 27 27 ASP HA H 27 4.330 4.330 4.498 -0.168 18141
1607 1 12 . 1 1 27 27 ASP CA C 27 57.100 57.100 57.205 -0.105 18141
1608 1 12 . 1 1 27 27 ASP H H 27 7.400 7.400 7.387 0.013 18141
1609 1 12 . 1 1 28 28 PHE N N 28 123.100 123.100 121.310 1.790 18141
1610 1 12 . 1 1 28 28 PHE HA H 28 4.070 4.070 4.100 -0.030 18141
1611 1 12 . 1 1 28 28 PHE CA C 28 60.200 60.200 61.242 -1.042 18141
1612 1 12 . 1 1 28 28 PHE H H 28 8.590 8.590 8.106 0.484 18141
1613 1 12 . 1 1 29 29 VAL N N 29 116.200 116.200 119.203 -3.003 18141
1614 1 12 . 1 1 29 29 VAL HA H 29 3.120 3.120 3.197 -0.078 18141
1615 1 12 . 1 1 29 29 VAL CA C 29 66.100 66.100 65.156 0.944 18141
1616 1 12 . 1 1 29 29 VAL H H 29 7.760 7.760 8.220 -0.460 18141
1617 1 12 . 1 1 30 30 LYS N N 30 117.300 117.300 116.996 0.304 18141
1618 1 12 . 1 1 30 30 LYS HA H 30 4.260 4.260 4.248 0.012 18141
1619 1 12 . 1 1 30 30 LYS H H 30 7.280 7.280 7.277 0.003 18141
1620 1 12 . 1 1 31 31 ASP N N 31 122.600 122.600 118.732 3.868 18141
1621 1 12 . 1 1 31 31 ASP HA H 31 4.410 4.410 4.469 -0.059 18141
1622 1 12 . 1 1 31 31 ASP CA C 31 56.800 56.800 56.234 0.566 18141
1623 1 12 . 1 1 31 31 ASP H H 31 8.510 8.510 7.564 0.946 18141
1624 1 12 . 1 1 32 32 ILE N N 32 112.500 112.500 113.315 -0.815 18141
1625 1 12 . 1 1 32 32 ILE HA H 32 4.310 4.310 4.263 0.047 18141
1626 1 12 . 1 1 32 32 ILE CA C 32 62.800 62.800 60.562 2.238 18141
1627 1 12 . 1 1 32 32 ILE H H 32 7.320 7.320 6.880 0.440 18141
1628 1 12 . 1 1 33 33 ARG N N 33 114.200 114.200 118.684 -4.484 18141
1629 1 12 . 1 1 33 33 ARG HA H 33 3.870 3.870 3.885 -0.015 18141
1630 1 12 . 1 1 33 33 ARG CA C 33 56.600 56.600 57.395 -0.795 18141
1631 1 12 . 1 1 33 33 ARG H H 33 7.880 7.880 8.079 -0.199 18141
1632 1 12 . 1 1 34 34 MET N N 34 117.100 117.100 117.150 -0.050 18141
1633 1 12 . 1 1 34 34 MET HA H 34 4.640 4.640 4.600 0.040 18141
1634 1 12 . 1 1 34 34 MET CA C 34 54.300 54.300 53.181 1.119 18141
1635 1 12 . 1 1 34 34 MET H H 34 7.570 7.570 7.757 -0.187 18141
1636 1 12 . 1 1 35 35 ASN N N 35 118.000 118.000 124.011 -6.011 18141
1637 1 12 . 1 1 35 35 ASN HA H 35 5.170 5.170 4.897 0.273 18141
1638 1 12 . 1 1 35 35 ASN CA C 35 50.400 50.400 50.771 -0.371 18141
1639 1 12 . 1 1 35 35 ASN H H 35 8.390 8.390 8.830 -0.440 18141
1640 1 12 . 1 1 37 37 PRO HA H 37 4.320 4.320 4.490 -0.170 18141
1641 1 12 . 1 1 37 37 PRO CA C 37 61.200 61.200 62.196 -0.996 18141
1642 1 12 . 1 1 38 38 ALA N N 38 114.400 114.400 123.567 -9.167 18141
1643 1 12 . 1 1 38 38 ALA HA H 38 3.990 3.990 4.214 -0.224 18141
1644 1 12 . 1 1 38 38 ALA CA C 38 54.400 54.400 53.557 0.843 18141
1645 1 12 . 1 1 38 38 ALA H H 38 8.770 8.770 8.324 0.446 18141
1646 1 12 . 1 1 39 39 ASP N N 39 112.400 112.400 118.525 -6.125 18141
1647 1 12 . 1 1 39 39 ASP HA H 39 4.310 4.310 4.346 -0.036 18141
1648 1 12 . 1 1 39 39 ASP H H 39 8.710 8.710 8.350 0.360 18141
1649 1 12 . 1 1 40 40 LYS N N 40 117.000 117.000 118.375 -1.375 18141
1650 1 12 . 1 1 40 40 LYS HA H 40 4.370 4.370 4.122 0.248 18141
1651 1 12 . 1 1 40 40 LYS CA C 40 57.000 57.000 57.840 -0.840 18141
1652 1 12 . 1 1 40 40 LYS H H 40 6.990 6.990 7.817 -0.827 18141
1653 1 12 . 1 1 41 41 CYS N N 41 121.600 121.600 118.692 2.908 18141
1654 1 12 . 1 1 41 41 CYS HA H 41 5.180 5.180 4.989 0.191 18141
1655 1 12 . 1 1 41 41 CYS CA C 41 50.900 50.900 56.675 -5.774 18141
1656 1 12 . 1 1 41 41 CYS H H 41 7.520 7.520 7.358 0.162 18141
1657 1 13 . 1 1 2 2 PRO HA H 2 4.370 4.370 4.215 0.155 18141
1658 1 13 . 1 1 2 2 PRO CA C 2 62.800 62.800 62.573 0.227 18141
1659 1 13 . 1 1 3 3 TYR N N 3 120.600 120.600 114.314 6.286 18141
1660 1 13 . 1 1 3 3 TYR HA H 3 4.310 4.310 4.687 -0.377 18141
1661 1 13 . 1 1 3 3 TYR H H 3 8.160 8.160 6.860 1.300 18141
1662 1 13 . 1 1 4 4 CYS N N 4 119.100 119.100 119.974 -0.874 18141
1663 1 13 . 1 1 4 4 CYS HA H 4 3.330 3.330 4.137 -0.807 18141
1664 1 13 . 1 1 4 4 CYS CA C 4 53.500 53.500 59.509 -6.009 18141
1665 1 13 . 1 1 4 4 CYS H H 4 7.700 7.700 8.100 -0.400 18141
1666 1 13 . 1 1 5 5 GLY N N 5 107.900 107.900 109.546 -1.646 18141
1667 1 13 . 1 1 5 5 GLY CA C 5 43.700 43.700 47.534 -3.834 18141
1668 1 13 . 1 1 5 5 GLY H H 5 5.930 5.930 8.596 -2.666 18141
1669 1 13 . 1 1 6 6 GLN N N 6 114.200 114.200 120.254 -6.054 18141
1670 1 13 . 1 1 6 6 GLN HA H 6 4.420 4.420 4.322 0.098 18141
1671 1 13 . 1 1 6 6 GLN CA C 6 56.200 56.200 55.763 0.437 18141
1672 1 13 . 1 1 6 6 GLN H H 6 8.710 8.710 8.466 0.244 18141
1673 1 13 . 1 1 7 7 THR N N 7 106.600 106.600 111.317 -4.717 18141
1674 1 13 . 1 1 7 7 THR HA H 7 4.780 4.780 4.694 0.086 18141
1675 1 13 . 1 1 7 7 THR CA C 7 58.700 58.700 61.191 -2.491 18141
1676 1 13 . 1 1 7 7 THR H H 7 7.300 7.300 7.468 -0.168 18141
1677 1 13 . 1 1 8 8 GLY N N 8 110.400 110.400 109.404 0.996 18141
1678 1 13 . 1 1 8 8 GLY CA C 8 48.000 48.000 47.125 0.875 18141
1679 1 13 . 1 1 8 8 GLY H H 8 9.260 9.260 8.754 0.506 18141
1680 1 13 . 1 1 9 9 ALA N N 9 123.400 123.400 124.499 -1.099 18141
1681 1 13 . 1 1 9 9 ALA HA H 9 4.090 4.090 4.011 0.079 18141
1682 1 13 . 1 1 9 9 ALA CA C 9 55.600 55.600 55.012 0.588 18141
1683 1 13 . 1 1 9 9 ALA H H 9 8.490 8.490 7.992 0.498 18141
1684 1 13 . 1 1 10 10 GLU N N 10 119.500 119.500 117.339 2.161 18141
1685 1 13 . 1 1 10 10 GLU HA H 10 4.230 4.230 4.130 0.100 18141
1686 1 13 . 1 1 10 10 GLU CA C 10 59.300 59.300 58.875 0.425 18141
1687 1 13 . 1 1 10 10 GLU H H 10 7.790 7.790 7.788 0.002 18141
1688 1 13 . 1 1 11 11 CYS N N 11 118.300 118.300 118.895 -0.595 18141
1689 1 13 . 1 1 11 11 CYS HA H 11 4.850 4.850 4.639 0.211 18141
1690 1 13 . 1 1 11 11 CYS H H 11 8.460 8.460 7.574 0.886 18141
1691 1 13 . 1 1 12 12 TYR N N 12 121.800 121.800 120.805 0.995 18141
1692 1 13 . 1 1 12 12 TYR HA H 12 4.020 4.020 4.148 -0.128 18141
1693 1 13 . 1 1 12 12 TYR H H 12 8.860 8.860 8.585 0.275 18141
1694 1 13 . 1 1 13 13 SER N N 13 114.500 114.500 114.791 -0.291 18141
1695 1 13 . 1 1 13 13 SER HA H 13 4.130 4.130 4.002 0.128 18141
1696 1 13 . 1 1 13 13 SER CA C 13 62.600 62.600 61.528 1.072 18141
1697 1 13 . 1 1 13 13 SER H H 13 7.910 7.910 7.988 -0.078 18141
1698 1 13 . 1 1 14 14 TRP N N 14 122.400 122.400 122.874 -0.474 18141
1699 1 13 . 1 1 14 14 TRP HA H 14 4.020 4.020 4.306 -0.286 18141
1700 1 13 . 1 1 14 14 TRP H H 14 8.680 8.680 8.015 0.665 18141
1701 1 13 . 1 1 15 15 CYS N N 15 120.500 120.500 117.615 2.885 18141
1702 1 13 . 1 1 15 15 CYS HA H 15 3.530 3.530 3.229 0.301 18141
1703 1 13 . 1 1 15 15 CYS CA C 15 60.500 60.500 61.252 -0.751 18141
1704 1 13 . 1 1 15 15 CYS H H 15 8.120 8.120 8.270 -0.150 18141
1705 1 13 . 1 1 16 16 ILE N N 16 120.300 120.300 121.256 -0.956 18141
1706 1 13 . 1 1 16 16 ILE HA H 16 3.930 3.930 3.943 -0.013 18141
1707 1 13 . 1 1 16 16 ILE CA C 16 61.700 61.700 62.658 -0.958 18141
1708 1 13 . 1 1 16 16 ILE H H 16 8.250 8.250 7.329 0.921 18141
1709 1 13 . 1 1 17 17 LYS N N 17 121.700 121.700 121.390 0.310 18141
1710 1 13 . 1 1 17 17 LYS HA H 17 4.100 4.100 3.853 0.247 18141
1711 1 13 . 1 1 17 17 LYS CA C 17 58.100 58.100 58.917 -0.817 18141
1712 1 13 . 1 1 17 17 LYS H H 17 7.800 7.800 8.386 -0.586 18141
1713 1 13 . 1 1 18 18 GLN N N 18 117.600 117.600 115.650 1.950 18141
1714 1 13 . 1 1 18 18 GLN HA H 18 4.030 4.030 3.980 0.050 18141
1715 1 13 . 1 1 18 18 GLN H H 18 7.240 7.240 7.410 -0.170 18141
1716 1 13 . 1 1 19 19 ASP N N 19 121.800 121.800 117.648 4.152 18141
1717 1 13 . 1 1 19 19 ASP HA H 19 4.320 4.320 4.327 -0.007 18141
1718 1 13 . 1 1 19 19 ASP H H 19 8.050 8.050 8.417 -0.367 18141
1719 1 13 . 1 1 20 20 LEU N N 20 119.400 119.400 117.288 2.112 18141
1720 1 13 . 1 1 20 20 LEU HA H 20 4.300 4.300 4.110 0.190 18141
1721 1 13 . 1 1 20 20 LEU H H 20 6.430 6.430 8.067 -1.637 18141
1722 1 13 . 1 1 21 21 SER N N 21 115.500 115.500 108.251 7.249 18141
1723 1 13 . 1 1 21 21 SER HA H 21 4.290 4.290 4.516 -0.226 18141
1724 1 13 . 1 1 21 21 SER H H 21 8.260 8.260 7.610 0.650 18141
1725 1 13 . 1 1 22 22 LYS N N 22 122.700 122.700 120.973 1.727 18141
1726 1 13 . 1 1 22 22 LYS HA H 22 4.020 4.020 4.287 -0.267 18141
1727 1 13 . 1 1 22 22 LYS H H 22 8.690 8.690 8.551 0.139 18141
1728 1 13 . 1 1 23 23 ASP N N 23 117.000 117.000 118.305 -1.305 18141
1729 1 13 . 1 1 23 23 ASP HA H 23 4.370 4.370 4.536 -0.166 18141
1730 1 13 . 1 1 23 23 ASP CA C 23 55.300 55.300 56.155 -0.855 18141
1731 1 13 . 1 1 23 23 ASP H H 23 8.260 8.260 8.721 -0.461 18141
1732 1 13 . 1 1 24 24 TRP N N 24 122.400 122.400 121.162 1.238 18141
1733 1 13 . 1 1 24 24 TRP HA H 24 4.240 4.240 4.331 -0.091 18141
1734 1 13 . 1 1 24 24 TRP CA C 24 59.300 59.300 60.096 -0.796 18141
1735 1 13 . 1 1 24 24 TRP H H 24 7.910 7.910 7.966 -0.056 18141
1736 1 13 . 1 1 25 25 CYS N N 25 117.800 117.800 117.589 0.211 18141
1737 1 13 . 1 1 25 25 CYS HA H 25 4.890 4.890 3.759 1.131 18141
1738 1 13 . 1 1 25 25 CYS H H 25 9.110 9.110 7.584 1.526 18141
1739 1 13 . 1 1 26 26 CYS N N 26 120.700 120.700 120.996 -0.296 18141
1740 1 13 . 1 1 26 26 CYS HA H 26 4.530 4.530 4.122 0.408 18141
1741 1 13 . 1 1 26 26 CYS CA C 26 58.900 58.900 63.210 -4.310 18141
1742 1 13 . 1 1 26 26 CYS H H 26 8.940 8.940 7.881 1.059 18141
1743 1 13 . 1 1 27 27 ASP N N 27 120.700 120.700 118.694 2.006 18141
1744 1 13 . 1 1 27 27 ASP HA H 27 4.330 4.330 4.680 -0.350 18141
1745 1 13 . 1 1 27 27 ASP CA C 27 57.100 57.100 56.595 0.505 18141
1746 1 13 . 1 1 27 27 ASP H H 27 7.400 7.400 7.739 -0.339 18141
1747 1 13 . 1 1 28 28 PHE N N 28 123.100 123.100 122.336 0.764 18141
1748 1 13 . 1 1 28 28 PHE HA H 28 4.070 4.070 4.120 -0.050 18141
1749 1 13 . 1 1 28 28 PHE CA C 28 60.200 60.200 61.061 -0.861 18141
1750 1 13 . 1 1 28 28 PHE H H 28 8.590 8.590 7.251 1.339 18141
1751 1 13 . 1 1 29 29 VAL N N 29 116.200 116.200 115.825 0.375 18141
1752 1 13 . 1 1 29 29 VAL HA H 29 3.120 3.120 3.265 -0.145 18141
1753 1 13 . 1 1 29 29 VAL CA C 29 66.100 66.100 66.266 -0.166 18141
1754 1 13 . 1 1 29 29 VAL H H 29 7.760 7.760 7.890 -0.130 18141
1755 1 13 . 1 1 30 30 LYS N N 30 117.300 117.300 118.469 -1.169 18141
1756 1 13 . 1 1 30 30 LYS HA H 30 4.260 4.260 4.091 0.169 18141
1757 1 13 . 1 1 30 30 LYS H H 30 7.280 7.280 7.911 -0.631 18141
1758 1 13 . 1 1 31 31 ASP N N 31 122.600 122.600 120.687 1.913 18141
1759 1 13 . 1 1 31 31 ASP HA H 31 4.410 4.410 4.497 -0.087 18141
1760 1 13 . 1 1 31 31 ASP CA C 31 56.800 56.800 56.058 0.742 18141
1761 1 13 . 1 1 31 31 ASP H H 31 8.510 8.510 7.804 0.706 18141
1762 1 13 . 1 1 32 32 ILE N N 32 112.500 112.500 114.284 -1.784 18141
1763 1 13 . 1 1 32 32 ILE HA H 32 4.310 4.310 4.276 0.034 18141
1764 1 13 . 1 1 32 32 ILE CA C 32 62.800 62.800 60.399 2.401 18141
1765 1 13 . 1 1 32 32 ILE H H 32 7.320 7.320 7.481 -0.161 18141
1766 1 13 . 1 1 33 33 ARG N N 33 114.200 114.200 118.367 -4.167 18141
1767 1 13 . 1 1 33 33 ARG HA H 33 3.870 3.870 3.950 -0.080 18141
1768 1 13 . 1 1 33 33 ARG CA C 33 56.600 56.600 57.148 -0.548 18141
1769 1 13 . 1 1 33 33 ARG H H 33 7.880 7.880 7.644 0.236 18141
1770 1 13 . 1 1 34 34 MET N N 34 117.100 117.100 116.465 0.635 18141
1771 1 13 . 1 1 34 34 MET HA H 34 4.640 4.640 4.603 0.037 18141
1772 1 13 . 1 1 34 34 MET CA C 34 54.300 54.300 53.733 0.568 18141
1773 1 13 . 1 1 34 34 MET H H 34 7.570 7.570 7.922 -0.352 18141
1774 1 13 . 1 1 35 35 ASN N N 35 118.000 118.000 119.529 -1.529 18141
1775 1 13 . 1 1 35 35 ASN HA H 35 5.170 5.170 5.147 0.023 18141
1776 1 13 . 1 1 35 35 ASN CA C 35 50.400 50.400 49.753 0.647 18141
1777 1 13 . 1 1 35 35 ASN H H 35 8.390 8.390 8.531 -0.141 18141
1778 1 13 . 1 1 37 37 PRO HA H 37 4.320 4.320 4.431 -0.111 18141
1779 1 13 . 1 1 37 37 PRO CA C 37 61.200 61.200 62.024 -0.824 18141
1780 1 13 . 1 1 38 38 ALA N N 38 114.400 114.400 123.542 -9.142 18141
1781 1 13 . 1 1 38 38 ALA HA H 38 3.990 3.990 4.456 -0.466 18141
1782 1 13 . 1 1 38 38 ALA CA C 38 54.400 54.400 52.854 1.546 18141
1783 1 13 . 1 1 38 38 ALA H H 38 8.770 8.770 8.483 0.287 18141
1784 1 13 . 1 1 39 39 ASP N N 39 112.400 112.400 117.528 -5.128 18141
1785 1 13 . 1 1 39 39 ASP HA H 39 4.310 4.310 4.702 -0.393 18141
1786 1 13 . 1 1 39 39 ASP H H 39 8.710 8.710 8.171 0.539 18141
1787 1 13 . 1 1 40 40 LYS N N 40 117.000 117.000 118.103 -1.103 18141
1788 1 13 . 1 1 40 40 LYS HA H 40 4.370 4.370 4.463 -0.093 18141
1789 1 13 . 1 1 40 40 LYS CA C 40 57.000 57.000 55.556 1.444 18141
1790 1 13 . 1 1 40 40 LYS H H 40 6.990 6.990 7.577 -0.587 18141
1791 1 13 . 1 1 41 41 CYS N N 41 121.600 121.600 118.897 2.703 18141
1792 1 13 . 1 1 41 41 CYS HA H 41 5.180 5.180 4.895 0.285 18141
1793 1 13 . 1 1 41 41 CYS CA C 41 50.900 50.900 57.134 -6.234 18141
1794 1 13 . 1 1 41 41 CYS H H 41 7.520 7.520 7.620 -0.100 18141
1795 1 14 . 1 1 2 2 PRO HA H 2 4.370 4.370 4.810 -0.440 18141
1796 1 14 . 1 1 2 2 PRO CA C 2 62.800 62.800 63.077 -0.277 18141
1797 1 14 . 1 1 3 3 TYR N N 3 120.600 120.600 122.054 -1.454 18141
1798 1 14 . 1 1 3 3 TYR HA H 3 4.310 4.310 4.869 -0.559 18141
1799 1 14 . 1 1 3 3 TYR H H 3 8.160 8.160 7.949 0.211 18141
1800 1 14 . 1 1 4 4 CYS N N 4 119.100 119.100 126.903 -7.803 18141
1801 1 14 . 1 1 4 4 CYS HA H 4 3.330 3.330 4.461 -1.131 18141
1802 1 14 . 1 1 4 4 CYS CA C 4 53.500 53.500 57.748 -4.248 18141
1803 1 14 . 1 1 4 4 CYS H H 4 7.700 7.700 8.814 -1.114 18141
1804 1 14 . 1 1 5 5 GLY N N 5 107.900 107.900 113.159 -5.259 18141
1805 1 14 . 1 1 5 5 GLY CA C 5 43.700 43.700 46.967 -3.267 18141
1806 1 14 . 1 1 5 5 GLY H H 5 5.930 5.930 8.120 -2.190 18141
1807 1 14 . 1 1 6 6 GLN N N 6 114.200 114.200 117.833 -3.633 18141
1808 1 14 . 1 1 6 6 GLN HA H 6 4.420 4.420 4.388 0.032 18141
1809 1 14 . 1 1 6 6 GLN CA C 6 56.200 56.200 55.437 0.763 18141
1810 1 14 . 1 1 6 6 GLN H H 6 8.710 8.710 8.373 0.337 18141
1811 1 14 . 1 1 7 7 THR N N 7 106.600 106.600 108.270 -1.670 18141
1812 1 14 . 1 1 7 7 THR HA H 7 4.780 4.780 4.925 -0.145 18141
1813 1 14 . 1 1 7 7 THR CA C 7 58.700 58.700 60.357 -1.657 18141
1814 1 14 . 1 1 7 7 THR H H 7 7.300 7.300 7.252 0.048 18141
1815 1 14 . 1 1 8 8 GLY N N 8 110.400 110.400 106.960 3.440 18141
1816 1 14 . 1 1 8 8 GLY CA C 8 48.000 48.000 46.204 1.796 18141
1817 1 14 . 1 1 8 8 GLY H H 8 9.260 9.260 8.780 0.480 18141
1818 1 14 . 1 1 9 9 ALA N N 9 123.400 123.400 123.570 -0.170 18141
1819 1 14 . 1 1 9 9 ALA HA H 9 4.090 4.090 4.216 -0.126 18141
1820 1 14 . 1 1 9 9 ALA CA C 9 55.600 55.600 54.756 0.844 18141
1821 1 14 . 1 1 9 9 ALA H H 9 8.490 8.490 7.618 0.872 18141
1822 1 14 . 1 1 10 10 GLU N N 10 119.500 119.500 116.799 2.701 18141
1823 1 14 . 1 1 10 10 GLU HA H 10 4.230 4.230 4.126 0.104 18141
1824 1 14 . 1 1 10 10 GLU CA C 10 59.300 59.300 58.214 1.086 18141
1825 1 14 . 1 1 10 10 GLU H H 10 7.790 7.790 8.050 -0.260 18141
1826 1 14 . 1 1 11 11 CYS N N 11 118.300 118.300 119.634 -1.334 18141
1827 1 14 . 1 1 11 11 CYS HA H 11 4.850 4.850 4.353 0.497 18141
1828 1 14 . 1 1 11 11 CYS H H 11 8.460 8.460 7.775 0.685 18141
1829 1 14 . 1 1 12 12 TYR N N 12 121.800 121.800 121.130 0.670 18141
1830 1 14 . 1 1 12 12 TYR HA H 12 4.020 4.020 4.389 -0.369 18141
1831 1 14 . 1 1 12 12 TYR H H 12 8.860 8.860 8.471 0.389 18141
1832 1 14 . 1 1 13 13 SER N N 13 114.500 114.500 114.420 0.080 18141
1833 1 14 . 1 1 13 13 SER HA H 13 4.130 4.130 4.285 -0.155 18141
1834 1 14 . 1 1 13 13 SER CA C 13 62.600 62.600 60.759 1.841 18141
1835 1 14 . 1 1 13 13 SER H H 13 7.910 7.910 7.805 0.105 18141
1836 1 14 . 1 1 14 14 TRP N N 14 122.400 122.400 123.125 -0.725 18141
1837 1 14 . 1 1 14 14 TRP HA H 14 4.020 4.020 4.614 -0.594 18141
1838 1 14 . 1 1 14 14 TRP H H 14 8.680 8.680 8.069 0.611 18141
1839 1 14 . 1 1 15 15 CYS N N 15 120.500 120.500 117.076 3.424 18141
1840 1 14 . 1 1 15 15 CYS HA H 15 3.530 3.530 3.305 0.225 18141
1841 1 14 . 1 1 15 15 CYS CA C 15 60.500 60.500 60.834 -0.334 18141
1842 1 14 . 1 1 15 15 CYS H H 15 8.120 8.120 8.173 -0.053 18141
1843 1 14 . 1 1 16 16 ILE N N 16 120.300 120.300 119.370 0.930 18141
1844 1 14 . 1 1 16 16 ILE HA H 16 3.930 3.930 3.823 0.107 18141
1845 1 14 . 1 1 16 16 ILE CA C 16 61.700 61.700 61.260 0.441 18141
1846 1 14 . 1 1 16 16 ILE H H 16 8.250 8.250 7.375 0.875 18141
1847 1 14 . 1 1 17 17 LYS N N 17 121.700 121.700 121.252 0.448 18141
1848 1 14 . 1 1 17 17 LYS HA H 17 4.100 4.100 3.901 0.199 18141
1849 1 14 . 1 1 17 17 LYS CA C 17 58.100 58.100 58.427 -0.327 18141
1850 1 14 . 1 1 17 17 LYS H H 17 7.800 7.800 8.113 -0.313 18141
1851 1 14 . 1 1 18 18 GLN N N 18 117.600 117.600 115.962 1.638 18141
1852 1 14 . 1 1 18 18 GLN HA H 18 4.030 4.030 3.887 0.143 18141
1853 1 14 . 1 1 18 18 GLN H H 18 7.240 7.240 7.283 -0.043 18141
1854 1 14 . 1 1 19 19 ASP N N 19 121.800 121.800 117.051 4.749 18141
1855 1 14 . 1 1 19 19 ASP HA H 19 4.320 4.320 4.234 0.086 18141
1856 1 14 . 1 1 19 19 ASP H H 19 8.050 8.050 7.638 0.412 18141
1857 1 14 . 1 1 20 20 LEU N N 20 119.400 119.400 117.462 1.938 18141
1858 1 14 . 1 1 20 20 LEU HA H 20 4.300 4.300 4.212 0.088 18141
1859 1 14 . 1 1 20 20 LEU H H 20 6.430 6.430 7.655 -1.225 18141
1860 1 14 . 1 1 21 21 SER N N 21 115.500 115.500 109.441 6.059 18141
1861 1 14 . 1 1 21 21 SER HA H 21 4.290 4.290 4.547 -0.257 18141
1862 1 14 . 1 1 21 21 SER H H 21 8.260 8.260 7.323 0.937 18141
1863 1 14 . 1 1 22 22 LYS N N 22 122.700 122.700 125.775 -3.075 18141
1864 1 14 . 1 1 22 22 LYS HA H 22 4.020 4.020 4.018 0.002 18141
1865 1 14 . 1 1 22 22 LYS H H 22 8.690 8.690 8.865 -0.175 18141
1866 1 14 . 1 1 23 23 ASP N N 23 117.000 117.000 120.154 -3.154 18141
1867 1 14 . 1 1 23 23 ASP HA H 23 4.370 4.370 4.655 -0.285 18141
1868 1 14 . 1 1 23 23 ASP CA C 23 55.300 55.300 54.841 0.459 18141
1869 1 14 . 1 1 23 23 ASP H H 23 8.260 8.260 8.081 0.179 18141
1870 1 14 . 1 1 24 24 TRP N N 24 122.400 122.400 121.208 1.192 18141
1871 1 14 . 1 1 24 24 TRP HA H 24 4.240 4.240 4.378 -0.138 18141
1872 1 14 . 1 1 24 24 TRP CA C 24 59.300 59.300 61.729 -2.429 18141
1873 1 14 . 1 1 24 24 TRP H H 24 7.910 7.910 8.549 -0.639 18141
1874 1 14 . 1 1 25 25 CYS N N 25 117.800 117.800 118.152 -0.352 18141
1875 1 14 . 1 1 25 25 CYS HA H 25 4.890 4.890 4.795 0.095 18141
1876 1 14 . 1 1 25 25 CYS H H 25 9.110 9.110 7.972 1.138 18141
1877 1 14 . 1 1 26 26 CYS N N 26 120.700 120.700 121.162 -0.462 18141
1878 1 14 . 1 1 26 26 CYS HA H 26 4.530 4.530 4.316 0.214 18141
1879 1 14 . 1 1 26 26 CYS CA C 26 58.900 58.900 64.128 -5.228 18141
1880 1 14 . 1 1 26 26 CYS H H 26 8.940 8.940 8.099 0.841 18141
1881 1 14 . 1 1 27 27 ASP N N 27 120.700 120.700 118.050 2.650 18141
1882 1 14 . 1 1 27 27 ASP HA H 27 4.330 4.330 4.623 -0.293 18141
1883 1 14 . 1 1 27 27 ASP CA C 27 57.100 57.100 56.306 0.794 18141
1884 1 14 . 1 1 27 27 ASP H H 27 7.400 7.400 7.750 -0.350 18141
1885 1 14 . 1 1 28 28 PHE N N 28 123.100 123.100 122.059 1.041 18141
1886 1 14 . 1 1 28 28 PHE HA H 28 4.070 4.070 4.126 -0.056 18141
1887 1 14 . 1 1 28 28 PHE CA C 28 60.200 60.200 60.475 -0.275 18141
1888 1 14 . 1 1 28 28 PHE H H 28 8.590 8.590 7.514 1.076 18141
1889 1 14 . 1 1 29 29 VAL N N 29 116.200 116.200 116.637 -0.437 18141
1890 1 14 . 1 1 29 29 VAL HA H 29 3.120 3.120 3.288 -0.168 18141
1891 1 14 . 1 1 29 29 VAL CA C 29 66.100 66.100 66.250 -0.150 18141
1892 1 14 . 1 1 29 29 VAL H H 29 7.760 7.760 7.919 -0.159 18141
1893 1 14 . 1 1 30 30 LYS N N 30 117.300 117.300 119.257 -1.957 18141
1894 1 14 . 1 1 30 30 LYS HA H 30 4.260 4.260 3.948 0.312 18141
1895 1 14 . 1 1 30 30 LYS H H 30 7.280 7.280 7.522 -0.242 18141
1896 1 14 . 1 1 31 31 ASP N N 31 122.600 122.600 118.675 3.925 18141
1897 1 14 . 1 1 31 31 ASP HA H 31 4.410 4.410 4.527 -0.117 18141
1898 1 14 . 1 1 31 31 ASP CA C 31 56.800 56.800 56.699 0.101 18141
1899 1 14 . 1 1 31 31 ASP H H 31 8.510 8.510 7.686 0.824 18141
1900 1 14 . 1 1 32 32 ILE N N 32 112.500 112.500 116.579 -4.079 18141
1901 1 14 . 1 1 32 32 ILE HA H 32 4.310 4.310 4.109 0.201 18141
1902 1 14 . 1 1 32 32 ILE CA C 32 62.800 62.800 60.837 1.963 18141
1903 1 14 . 1 1 32 32 ILE H H 32 7.320 7.320 7.338 -0.018 18141
1904 1 14 . 1 1 33 33 ARG N N 33 114.200 114.200 117.775 -3.575 18141
1905 1 14 . 1 1 33 33 ARG HA H 33 3.870 3.870 3.857 0.013 18141
1906 1 14 . 1 1 33 33 ARG CA C 33 56.600 56.600 57.191 -0.591 18141
1907 1 14 . 1 1 33 33 ARG H H 33 7.880 7.880 8.120 -0.240 18141
1908 1 14 . 1 1 34 34 MET N N 34 117.100 117.100 117.443 -0.343 18141
1909 1 14 . 1 1 34 34 MET HA H 34 4.640 4.640 4.663 -0.023 18141
1910 1 14 . 1 1 34 34 MET CA C 34 54.300 54.300 53.934 0.366 18141
1911 1 14 . 1 1 34 34 MET H H 34 7.570 7.570 7.776 -0.206 18141
1912 1 14 . 1 1 35 35 ASN N N 35 118.000 118.000 118.681 -0.681 18141
1913 1 14 . 1 1 35 35 ASN HA H 35 5.170 5.170 5.071 0.099 18141
1914 1 14 . 1 1 35 35 ASN CA C 35 50.400 50.400 50.847 -0.447 18141
1915 1 14 . 1 1 35 35 ASN H H 35 8.390 8.390 8.406 -0.016 18141
1916 1 14 . 1 1 37 37 PRO HA H 37 4.320 4.320 4.443 -0.123 18141
1917 1 14 . 1 1 37 37 PRO CA C 37 61.200 61.200 62.083 -0.883 18141
1918 1 14 . 1 1 38 38 ALA N N 38 114.400 114.400 123.469 -9.069 18141
1919 1 14 . 1 1 38 38 ALA HA H 38 3.990 3.990 4.355 -0.365 18141
1920 1 14 . 1 1 38 38 ALA CA C 38 54.400 54.400 52.376 2.024 18141
1921 1 14 . 1 1 38 38 ALA H H 38 8.770 8.770 8.313 0.457 18141
1922 1 14 . 1 1 39 39 ASP N N 39 112.400 112.400 117.657 -5.257 18141
1923 1 14 . 1 1 39 39 ASP HA H 39 4.310 4.310 4.505 -0.195 18141
1924 1 14 . 1 1 39 39 ASP H H 39 8.710 8.710 7.919 0.791 18141
1925 1 14 . 1 1 40 40 LYS N N 40 117.000 117.000 117.043 -0.043 18141
1926 1 14 . 1 1 40 40 LYS HA H 40 4.370 4.370 4.622 -0.252 18141
1927 1 14 . 1 1 40 40 LYS CA C 40 57.000 57.000 56.590 0.409 18141
1928 1 14 . 1 1 40 40 LYS H H 40 6.990 6.990 8.048 -1.058 18141
1929 1 14 . 1 1 41 41 CYS N N 41 121.600 121.600 118.284 3.316 18141
1930 1 14 . 1 1 41 41 CYS HA H 41 5.180 5.180 4.986 0.194 18141
1931 1 14 . 1 1 41 41 CYS CA C 41 50.900 50.900 56.142 -5.242 18141
1932 1 14 . 1 1 41 41 CYS H H 41 7.520 7.520 7.958 -0.438 18141
1933 1 15 . 1 1 2 2 PRO HA H 2 4.370 4.370 4.735 -0.365 18141
1934 1 15 . 1 1 2 2 PRO CA C 2 62.800 62.800 62.846 -0.047 18141
1935 1 15 . 1 1 3 3 TYR N N 3 120.600 120.600 118.472 2.128 18141
1936 1 15 . 1 1 3 3 TYR HA H 3 4.310 4.310 4.932 -0.622 18141
1937 1 15 . 1 1 3 3 TYR H H 3 8.160 8.160 7.955 0.205 18141
1938 1 15 . 1 1 4 4 CYS N N 4 119.100 119.100 128.015 -8.915 18141
1939 1 15 . 1 1 4 4 CYS HA H 4 3.330 3.330 4.327 -0.997 18141
1940 1 15 . 1 1 4 4 CYS CA C 4 53.500 53.500 59.263 -5.763 18141
1941 1 15 . 1 1 4 4 CYS H H 4 7.700 7.700 8.964 -1.264 18141
1942 1 15 . 1 1 5 5 GLY N N 5 107.900 107.900 112.240 -4.340 18141
1943 1 15 . 1 1 5 5 GLY CA C 5 43.700 43.700 44.738 -1.038 18141
1944 1 15 . 1 1 5 5 GLY H H 5 5.930 5.930 7.367 -1.437 18141
1945 1 15 . 1 1 6 6 GLN N N 6 114.200 114.200 119.974 -5.774 18141
1946 1 15 . 1 1 6 6 GLN HA H 6 4.420 4.420 4.211 0.209 18141
1947 1 15 . 1 1 6 6 GLN CA C 6 56.200 56.200 58.183 -1.983 18141
1948 1 15 . 1 1 6 6 GLN H H 6 8.710 8.710 9.110 -0.400 18141
1949 1 15 . 1 1 7 7 THR N N 7 106.600 106.600 105.191 1.409 18141
1950 1 15 . 1 1 7 7 THR HA H 7 4.780 4.780 4.653 0.127 18141
1951 1 15 . 1 1 7 7 THR CA C 7 58.700 58.700 59.920 -1.220 18141
1952 1 15 . 1 1 7 7 THR H H 7 7.300 7.300 7.213 0.087 18141
1953 1 15 . 1 1 8 8 GLY N N 8 110.400 110.400 106.952 3.448 18141
1954 1 15 . 1 1 8 8 GLY CA C 8 48.000 48.000 46.547 1.453 18141
1955 1 15 . 1 1 8 8 GLY H H 8 9.260 9.260 8.714 0.546 18141
1956 1 15 . 1 1 9 9 ALA N N 9 123.400 123.400 122.886 0.514 18141
1957 1 15 . 1 1 9 9 ALA HA H 9 4.090 4.090 4.112 -0.022 18141
1958 1 15 . 1 1 9 9 ALA CA C 9 55.600 55.600 54.650 0.950 18141
1959 1 15 . 1 1 9 9 ALA H H 9 8.490 8.490 8.699 -0.209 18141
1960 1 15 . 1 1 10 10 GLU N N 10 119.500 119.500 116.245 3.255 18141
1961 1 15 . 1 1 10 10 GLU HA H 10 4.230 4.230 4.259 -0.029 18141
1962 1 15 . 1 1 10 10 GLU CA C 10 59.300 59.300 59.100 0.200 18141
1963 1 15 . 1 1 10 10 GLU H H 10 7.790 7.790 7.848 -0.058 18141
1964 1 15 . 1 1 11 11 CYS N N 11 118.300 118.300 119.376 -1.076 18141
1965 1 15 . 1 1 11 11 CYS HA H 11 4.850 4.850 4.728 0.122 18141
1966 1 15 . 1 1 11 11 CYS H H 11 8.460 8.460 7.734 0.726 18141
1967 1 15 . 1 1 12 12 TYR N N 12 121.800 121.800 122.514 -0.714 18141
1968 1 15 . 1 1 12 12 TYR HA H 12 4.020 4.020 4.157 -0.137 18141
1969 1 15 . 1 1 12 12 TYR H H 12 8.860 8.860 8.903 -0.043 18141
1970 1 15 . 1 1 13 13 SER N N 13 114.500 114.500 114.450 0.050 18141
1971 1 15 . 1 1 13 13 SER HA H 13 4.130 4.130 3.351 0.779 18141
1972 1 15 . 1 1 13 13 SER CA C 13 62.600 62.600 60.406 2.194 18141
1973 1 15 . 1 1 13 13 SER H H 13 7.910 7.910 7.713 0.197 18141
1974 1 15 . 1 1 14 14 TRP N N 14 122.400 122.400 124.658 -2.258 18141
1975 1 15 . 1 1 14 14 TRP HA H 14 4.020 4.020 4.388 -0.368 18141
1976 1 15 . 1 1 14 14 TRP H H 14 8.680 8.680 7.934 0.746 18141
1977 1 15 . 1 1 15 15 CYS N N 15 120.500 120.500 118.714 1.786 18141
1978 1 15 . 1 1 15 15 CYS HA H 15 3.530 3.530 3.391 0.139 18141
1979 1 15 . 1 1 15 15 CYS CA C 15 60.500 60.500 60.727 -0.227 18141
1980 1 15 . 1 1 15 15 CYS H H 15 8.120 8.120 8.841 -0.721 18141
1981 1 15 . 1 1 16 16 ILE N N 16 120.300 120.300 119.571 0.729 18141
1982 1 15 . 1 1 16 16 ILE HA H 16 3.930 3.930 4.103 -0.173 18141
1983 1 15 . 1 1 16 16 ILE CA C 16 61.700 61.700 61.978 -0.279 18141
1984 1 15 . 1 1 16 16 ILE H H 16 8.250 8.250 7.442 0.808 18141
1985 1 15 . 1 1 17 17 LYS N N 17 121.700 121.700 121.631 0.069 18141
1986 1 15 . 1 1 17 17 LYS HA H 17 4.100 4.100 3.884 0.216 18141
1987 1 15 . 1 1 17 17 LYS CA C 17 58.100 58.100 59.017 -0.917 18141
1988 1 15 . 1 1 17 17 LYS H H 17 7.800 7.800 8.200 -0.400 18141
1989 1 15 . 1 1 18 18 GLN N N 18 117.600 117.600 115.835 1.765 18141
1990 1 15 . 1 1 18 18 GLN HA H 18 4.030 4.030 4.040 -0.010 18141
1991 1 15 . 1 1 18 18 GLN H H 18 7.240 7.240 7.774 -0.534 18141
1992 1 15 . 1 1 19 19 ASP N N 19 121.800 121.800 117.886 3.914 18141
1993 1 15 . 1 1 19 19 ASP HA H 19 4.320 4.320 4.392 -0.072 18141
1994 1 15 . 1 1 19 19 ASP H H 19 8.050 8.050 8.443 -0.393 18141
1995 1 15 . 1 1 20 20 LEU N N 20 119.400 119.400 117.111 2.289 18141
1996 1 15 . 1 1 20 20 LEU HA H 20 4.300 4.300 4.047 0.253 18141
1997 1 15 . 1 1 20 20 LEU H H 20 6.430 6.430 8.023 -1.593 18141
1998 1 15 . 1 1 21 21 SER N N 21 115.500 115.500 109.201 6.299 18141
1999 1 15 . 1 1 21 21 SER HA H 21 4.290 4.290 4.519 -0.229 18141
2000 1 15 . 1 1 21 21 SER H H 21 8.260 8.260 7.677 0.583 18141
2001 1 15 . 1 1 22 22 LYS N N 22 122.700 122.700 125.495 -2.795 18141
2002 1 15 . 1 1 22 22 LYS HA H 22 4.020 4.020 4.072 -0.052 18141
2003 1 15 . 1 1 22 22 LYS H H 22 8.690 8.690 8.862 -0.172 18141
2004 1 15 . 1 1 23 23 ASP N N 23 117.000 117.000 119.021 -2.021 18141
2005 1 15 . 1 1 23 23 ASP HA H 23 4.370 4.370 4.636 -0.266 18141
2006 1 15 . 1 1 23 23 ASP CA C 23 55.300 55.300 55.812 -0.512 18141
2007 1 15 . 1 1 23 23 ASP H H 23 8.260 8.260 7.946 0.314 18141
2008 1 15 . 1 1 24 24 TRP N N 24 122.400 122.400 120.306 2.094 18141
2009 1 15 . 1 1 24 24 TRP HA H 24 4.240 4.240 4.570 -0.330 18141
2010 1 15 . 1 1 24 24 TRP CA C 24 59.300 59.300 60.281 -0.981 18141
2011 1 15 . 1 1 24 24 TRP H H 24 7.910 7.910 8.305 -0.395 18141
2012 1 15 . 1 1 25 25 CYS N N 25 117.800 117.800 120.058 -2.258 18141
2013 1 15 . 1 1 25 25 CYS HA H 25 4.890 4.890 3.031 1.859 18141
2014 1 15 . 1 1 25 25 CYS H H 25 9.110 9.110 7.299 1.811 18141
2015 1 15 . 1 1 26 26 CYS N N 26 120.700 120.700 118.147 2.553 18141
2016 1 15 . 1 1 26 26 CYS HA H 26 4.530 4.530 4.043 0.487 18141
2017 1 15 . 1 1 26 26 CYS CA C 26 58.900 58.900 63.150 -4.250 18141
2018 1 15 . 1 1 26 26 CYS H H 26 8.940 8.940 8.070 0.870 18141
2019 1 15 . 1 1 27 27 ASP N N 27 120.700 120.700 119.194 1.506 18141
2020 1 15 . 1 1 27 27 ASP HA H 27 4.330 4.330 4.512 -0.182 18141
2021 1 15 . 1 1 27 27 ASP CA C 27 57.100 57.100 56.479 0.621 18141
2022 1 15 . 1 1 27 27 ASP H H 27 7.400 7.400 7.556 -0.156 18141
2023 1 15 . 1 1 28 28 PHE N N 28 123.100 123.100 121.758 1.342 18141
2024 1 15 . 1 1 28 28 PHE HA H 28 4.070 4.070 4.147 -0.077 18141
2025 1 15 . 1 1 28 28 PHE CA C 28 60.200 60.200 60.591 -0.391 18141
2026 1 15 . 1 1 28 28 PHE H H 28 8.590 8.590 7.518 1.072 18141
2027 1 15 . 1 1 29 29 VAL N N 29 116.200 116.200 117.826 -1.626 18141
2028 1 15 . 1 1 29 29 VAL HA H 29 3.120 3.120 3.659 -0.539 18141
2029 1 15 . 1 1 29 29 VAL CA C 29 66.100 66.100 65.732 0.368 18141
2030 1 15 . 1 1 29 29 VAL H H 29 7.760 7.760 7.799 -0.039 18141
2031 1 15 . 1 1 30 30 LYS N N 30 117.300 117.300 116.688 0.612 18141
2032 1 15 . 1 1 30 30 LYS HA H 30 4.260 4.260 4.261 -0.001 18141
2033 1 15 . 1 1 30 30 LYS H H 30 7.280 7.280 7.398 -0.118 18141
2034 1 15 . 1 1 31 31 ASP N N 31 122.600 122.600 121.489 1.111 18141
2035 1 15 . 1 1 31 31 ASP HA H 31 4.410 4.410 4.392 0.018 18141
2036 1 15 . 1 1 31 31 ASP CA C 31 56.800 56.800 56.869 -0.069 18141
2037 1 15 . 1 1 31 31 ASP H H 31 8.510 8.510 7.705 0.805 18141
2038 1 15 . 1 1 32 32 ILE N N 32 112.500 112.500 114.193 -1.693 18141
2039 1 15 . 1 1 32 32 ILE HA H 32 4.310 4.310 4.187 0.123 18141
2040 1 15 . 1 1 32 32 ILE CA C 32 62.800 62.800 60.308 2.492 18141
2041 1 15 . 1 1 32 32 ILE H H 32 7.320 7.320 7.130 0.190 18141
2042 1 15 . 1 1 33 33 ARG N N 33 114.200 114.200 119.963 -5.763 18141
2043 1 15 . 1 1 33 33 ARG HA H 33 3.870 3.870 3.988 -0.118 18141
2044 1 15 . 1 1 33 33 ARG CA C 33 56.600 56.600 56.947 -0.347 18141
2045 1 15 . 1 1 33 33 ARG H H 33 7.880 7.880 7.636 0.244 18141
2046 1 15 . 1 1 34 34 MET N N 34 117.100 117.100 117.566 -0.466 18141
2047 1 15 . 1 1 34 34 MET HA H 34 4.640 4.640 4.649 -0.009 18141
2048 1 15 . 1 1 34 34 MET CA C 34 54.300 54.300 53.552 0.748 18141
2049 1 15 . 1 1 34 34 MET H H 34 7.570 7.570 7.478 0.092 18141
2050 1 15 . 1 1 35 35 ASN N N 35 118.000 118.000 121.046 -3.046 18141
2051 1 15 . 1 1 35 35 ASN HA H 35 5.170 5.170 5.143 0.027 18141
2052 1 15 . 1 1 35 35 ASN CA C 35 50.400 50.400 50.666 -0.266 18141
2053 1 15 . 1 1 35 35 ASN H H 35 8.390 8.390 8.610 -0.220 18141
2054 1 15 . 1 1 37 37 PRO HA H 37 4.320 4.320 4.506 -0.186 18141
2055 1 15 . 1 1 37 37 PRO CA C 37 61.200 61.200 62.081 -0.881 18141
2056 1 15 . 1 1 38 38 ALA N N 38 114.400 114.400 125.726 -11.326 18141
2057 1 15 . 1 1 38 38 ALA HA H 38 3.990 3.990 4.217 -0.227 18141
2058 1 15 . 1 1 38 38 ALA CA C 38 54.400 54.400 52.580 1.820 18141
2059 1 15 . 1 1 38 38 ALA H H 38 8.770 8.770 8.446 0.324 18141
2060 1 15 . 1 1 39 39 ASP N N 39 112.400 112.400 117.982 -5.582 18141
2061 1 15 . 1 1 39 39 ASP HA H 39 4.310 4.310 4.660 -0.350 18141
2062 1 15 . 1 1 39 39 ASP H H 39 8.710 8.710 7.983 0.727 18141
2063 1 15 . 1 1 40 40 LYS N N 40 117.000 117.000 119.393 -2.393 18141
2064 1 15 . 1 1 40 40 LYS HA H 40 4.370 4.370 4.505 -0.135 18141
2065 1 15 . 1 1 40 40 LYS CA C 40 57.000 57.000 54.866 2.134 18141
2066 1 15 . 1 1 40 40 LYS H H 40 6.990 6.990 7.894 -0.904 18141
2067 1 15 . 1 1 41 41 CYS N N 41 121.600 121.600 120.141 1.459 18141
2068 1 15 . 1 1 41 41 CYS HA H 41 5.180 5.180 4.693 0.487 18141
2069 1 15 . 1 1 41 41 CYS CA C 41 50.900 50.900 56.443 -5.543 18141
2070 1 15 . 1 1 41 41 CYS H H 41 7.520 7.520 7.646 -0.126 18141
2071 1 16 . 1 1 2 2 PRO HA H 2 4.370 4.370 3.885 0.485 18141
2072 1 16 . 1 1 2 2 PRO CA C 2 62.800 62.800 62.626 0.174 18141
2073 1 16 . 1 1 3 3 TYR N N 3 120.600 120.600 115.474 5.126 18141
2074 1 16 . 1 1 3 3 TYR HA H 3 4.310 4.310 4.746 -0.436 18141
2075 1 16 . 1 1 3 3 TYR H H 3 8.160 8.160 8.069 0.091 18141
2076 1 16 . 1 1 4 4 CYS N N 4 119.100 119.100 115.206 3.894 18141
2077 1 16 . 1 1 4 4 CYS HA H 4 3.330 3.330 5.069 -1.739 18141
2078 1 16 . 1 1 4 4 CYS CA C 4 53.500 53.500 58.224 -4.724 18141
2079 1 16 . 1 1 4 4 CYS H H 4 7.700 7.700 9.548 -1.848 18141
2080 1 16 . 1 1 5 5 GLY N N 5 107.900 107.900 108.040 -0.140 18141
2081 1 16 . 1 1 5 5 GLY CA C 5 43.700 43.700 45.367 -1.667 18141
2082 1 16 . 1 1 5 5 GLY H H 5 5.930 5.930 8.002 -2.072 18141
2083 1 16 . 1 1 6 6 GLN N N 6 114.200 114.200 116.497 -2.297 18141
2084 1 16 . 1 1 6 6 GLN HA H 6 4.420 4.420 4.032 0.388 18141
2085 1 16 . 1 1 6 6 GLN CA C 6 56.200 56.200 57.669 -1.469 18141
2086 1 16 . 1 1 6 6 GLN H H 6 8.710 8.710 9.165 -0.455 18141
2087 1 16 . 1 1 7 7 THR N N 7 106.600 106.600 105.772 0.828 18141
2088 1 16 . 1 1 7 7 THR HA H 7 4.780 4.780 4.648 0.132 18141
2089 1 16 . 1 1 7 7 THR CA C 7 58.700 58.700 59.755 -1.055 18141
2090 1 16 . 1 1 7 7 THR H H 7 7.300 7.300 7.417 -0.117 18141
2091 1 16 . 1 1 8 8 GLY N N 8 110.400 110.400 112.875 -2.475 18141
2092 1 16 . 1 1 8 8 GLY CA C 8 48.000 48.000 47.610 0.390 18141
2093 1 16 . 1 1 8 8 GLY H H 8 9.260 9.260 8.676 0.584 18141
2094 1 16 . 1 1 9 9 ALA N N 9 123.400 123.400 123.152 0.248 18141
2095 1 16 . 1 1 9 9 ALA HA H 9 4.090 4.090 4.232 -0.142 18141
2096 1 16 . 1 1 9 9 ALA CA C 9 55.600 55.600 54.004 1.596 18141
2097 1 16 . 1 1 9 9 ALA H H 9 8.490 8.490 8.473 0.017 18141
2098 1 16 . 1 1 10 10 GLU N N 10 119.500 119.500 118.128 1.372 18141
2099 1 16 . 1 1 10 10 GLU HA H 10 4.230 4.230 4.058 0.172 18141
2100 1 16 . 1 1 10 10 GLU CA C 10 59.300 59.300 59.338 -0.038 18141
2101 1 16 . 1 1 10 10 GLU H H 10 7.790 7.790 8.732 -0.942 18141
2102 1 16 . 1 1 11 11 CYS N N 11 118.300 118.300 118.198 0.102 18141
2103 1 16 . 1 1 11 11 CYS HA H 11 4.850 4.850 4.661 0.189 18141
2104 1 16 . 1 1 11 11 CYS H H 11 8.460 8.460 7.866 0.594 18141
2105 1 16 . 1 1 12 12 TYR N N 12 121.800 121.800 122.930 -1.130 18141
2106 1 16 . 1 1 12 12 TYR HA H 12 4.020 4.020 3.993 0.027 18141
2107 1 16 . 1 1 12 12 TYR H H 12 8.860 8.860 7.931 0.929 18141
2108 1 16 . 1 1 13 13 SER N N 13 114.500 114.500 115.173 -0.673 18141
2109 1 16 . 1 1 13 13 SER HA H 13 4.130 4.130 3.621 0.509 18141
2110 1 16 . 1 1 13 13 SER CA C 13 62.600 62.600 61.552 1.048 18141
2111 1 16 . 1 1 13 13 SER H H 13 7.910 7.910 7.737 0.173 18141
2112 1 16 . 1 1 14 14 TRP N N 14 122.400 122.400 123.165 -0.765 18141
2113 1 16 . 1 1 14 14 TRP HA H 14 4.020 4.020 4.375 -0.355 18141
2114 1 16 . 1 1 14 14 TRP H H 14 8.680 8.680 7.647 1.033 18141
2115 1 16 . 1 1 15 15 CYS N N 15 120.500 120.500 121.040 -0.540 18141
2116 1 16 . 1 1 15 15 CYS HA H 15 3.530 3.530 2.935 0.595 18141
2117 1 16 . 1 1 15 15 CYS CA C 15 60.500 60.500 62.706 -2.206 18141
2118 1 16 . 1 1 15 15 CYS H H 15 8.120 8.120 8.838 -0.718 18141
2119 1 16 . 1 1 16 16 ILE N N 16 120.300 120.300 119.616 0.684 18141
2120 1 16 . 1 1 16 16 ILE HA H 16 3.930 3.930 3.791 0.139 18141
2121 1 16 . 1 1 16 16 ILE CA C 16 61.700 61.700 64.283 -2.583 18141
2122 1 16 . 1 1 16 16 ILE H H 16 8.250 8.250 7.884 0.366 18141
2123 1 16 . 1 1 17 17 LYS N N 17 121.700 121.700 121.520 0.180 18141
2124 1 16 . 1 1 17 17 LYS HA H 17 4.100 4.100 3.825 0.275 18141
2125 1 16 . 1 1 17 17 LYS CA C 17 58.100 58.100 58.897 -0.797 18141
2126 1 16 . 1 1 17 17 LYS H H 17 7.800 7.800 8.462 -0.662 18141
2127 1 16 . 1 1 18 18 GLN N N 18 117.600 117.600 115.913 1.687 18141
2128 1 16 . 1 1 18 18 GLN HA H 18 4.030 4.030 3.990 0.040 18141
2129 1 16 . 1 1 18 18 GLN H H 18 7.240 7.240 7.604 -0.364 18141
2130 1 16 . 1 1 19 19 ASP N N 19 121.800 121.800 115.367 6.433 18141
2131 1 16 . 1 1 19 19 ASP HA H 19 4.320 4.320 4.318 0.002 18141
2132 1 16 . 1 1 19 19 ASP H H 19 8.050 8.050 8.322 -0.272 18141
2133 1 16 . 1 1 20 20 LEU N N 20 119.400 119.400 116.689 2.711 18141
2134 1 16 . 1 1 20 20 LEU HA H 20 4.300 4.300 4.128 0.172 18141
2135 1 16 . 1 1 20 20 LEU H H 20 6.430 6.430 7.961 -1.531 18141
2136 1 16 . 1 1 21 21 SER N N 21 115.500 115.500 110.343 5.157 18141
2137 1 16 . 1 1 21 21 SER HA H 21 4.290 4.290 4.600 -0.310 18141
2138 1 16 . 1 1 21 21 SER H H 21 8.260 8.260 7.741 0.519 18141
2139 1 16 . 1 1 22 22 LYS N N 22 122.700 122.700 121.456 1.244 18141
2140 1 16 . 1 1 22 22 LYS HA H 22 4.020 4.020 4.486 -0.466 18141
2141 1 16 . 1 1 22 22 LYS H H 22 8.690 8.690 8.767 -0.077 18141
2142 1 16 . 1 1 23 23 ASP N N 23 117.000 117.000 118.948 -1.948 18141
2143 1 16 . 1 1 23 23 ASP HA H 23 4.370 4.370 4.475 -0.105 18141
2144 1 16 . 1 1 23 23 ASP CA C 23 55.300 55.300 55.660 -0.360 18141
2145 1 16 . 1 1 23 23 ASP H H 23 8.260 8.260 7.870 0.390 18141
2146 1 16 . 1 1 24 24 TRP N N 24 122.400 122.400 121.507 0.893 18141
2147 1 16 . 1 1 24 24 TRP HA H 24 4.240 4.240 4.449 -0.209 18141
2148 1 16 . 1 1 24 24 TRP CA C 24 59.300 59.300 59.376 -0.076 18141
2149 1 16 . 1 1 24 24 TRP H H 24 7.910 7.910 7.603 0.307 18141
2150 1 16 . 1 1 25 25 CYS N N 25 117.800 117.800 117.454 0.346 18141
2151 1 16 . 1 1 25 25 CYS HA H 25 4.890 4.890 3.398 1.492 18141
2152 1 16 . 1 1 25 25 CYS H H 25 9.110 9.110 7.579 1.531 18141
2153 1 16 . 1 1 26 26 CYS N N 26 120.700 120.700 118.769 1.931 18141
2154 1 16 . 1 1 26 26 CYS HA H 26 4.530 4.530 3.562 0.968 18141
2155 1 16 . 1 1 26 26 CYS CA C 26 58.900 58.900 62.797 -3.897 18141
2156 1 16 . 1 1 26 26 CYS H H 26 8.940 8.940 7.701 1.239 18141
2157 1 16 . 1 1 27 27 ASP N N 27 120.700 120.700 118.333 2.367 18141
2158 1 16 . 1 1 27 27 ASP HA H 27 4.330 4.330 4.421 -0.091 18141
2159 1 16 . 1 1 27 27 ASP CA C 27 57.100 57.100 56.829 0.271 18141
2160 1 16 . 1 1 27 27 ASP H H 27 7.400 7.400 7.651 -0.251 18141
2161 1 16 . 1 1 28 28 PHE N N 28 123.100 123.100 121.797 1.303 18141
2162 1 16 . 1 1 28 28 PHE HA H 28 4.070 4.070 3.930 0.140 18141
2163 1 16 . 1 1 28 28 PHE CA C 28 60.200 60.200 60.759 -0.559 18141
2164 1 16 . 1 1 28 28 PHE H H 28 8.590 8.590 7.067 1.523 18141
2165 1 16 . 1 1 29 29 VAL N N 29 116.200 116.200 120.033 -3.833 18141
2166 1 16 . 1 1 29 29 VAL HA H 29 3.120 3.120 3.370 -0.250 18141
2167 1 16 . 1 1 29 29 VAL CA C 29 66.100 66.100 65.905 0.195 18141
2168 1 16 . 1 1 29 29 VAL H H 29 7.760 7.760 8.112 -0.352 18141
2169 1 16 . 1 1 30 30 LYS N N 30 117.300 117.300 118.065 -0.765 18141
2170 1 16 . 1 1 30 30 LYS HA H 30 4.260 4.260 4.163 0.097 18141
2171 1 16 . 1 1 30 30 LYS H H 30 7.280 7.280 7.678 -0.398 18141
2172 1 16 . 1 1 31 31 ASP N N 31 122.600 122.600 118.440 4.160 18141
2173 1 16 . 1 1 31 31 ASP HA H 31 4.410 4.410 4.411 -0.001 18141
2174 1 16 . 1 1 31 31 ASP CA C 31 56.800 56.800 55.854 0.946 18141
2175 1 16 . 1 1 31 31 ASP H H 31 8.510 8.510 8.116 0.394 18141
2176 1 16 . 1 1 32 32 ILE N N 32 112.500 112.500 113.800 -1.300 18141
2177 1 16 . 1 1 32 32 ILE HA H 32 4.310 4.310 4.123 0.187 18141
2178 1 16 . 1 1 32 32 ILE CA C 32 62.800 62.800 60.069 2.731 18141
2179 1 16 . 1 1 32 32 ILE H H 32 7.320 7.320 7.003 0.317 18141
2180 1 16 . 1 1 33 33 ARG N N 33 114.200 114.200 117.606 -3.406 18141
2181 1 16 . 1 1 33 33 ARG HA H 33 3.870 3.870 3.859 0.011 18141
2182 1 16 . 1 1 33 33 ARG CA C 33 56.600 56.600 56.889 -0.289 18141
2183 1 16 . 1 1 33 33 ARG H H 33 7.880 7.880 7.670 0.210 18141
2184 1 16 . 1 1 34 34 MET N N 34 117.100 117.100 116.110 0.990 18141
2185 1 16 . 1 1 34 34 MET HA H 34 4.640 4.640 4.679 -0.039 18141
2186 1 16 . 1 1 34 34 MET CA C 34 54.300 54.300 53.468 0.832 18141
2187 1 16 . 1 1 34 34 MET H H 34 7.570 7.570 7.472 0.098 18141
2188 1 16 . 1 1 35 35 ASN N N 35 118.000 118.000 120.910 -2.910 18141
2189 1 16 . 1 1 35 35 ASN HA H 35 5.170 5.170 5.166 0.004 18141
2190 1 16 . 1 1 35 35 ASN CA C 35 50.400 50.400 49.909 0.491 18141
2191 1 16 . 1 1 35 35 ASN H H 35 8.390 8.390 8.809 -0.419 18141
2192 1 16 . 1 1 37 37 PRO HA H 37 4.320 4.320 4.525 -0.205 18141
2193 1 16 . 1 1 37 37 PRO CA C 37 61.200 61.200 62.384 -1.184 18141
2194 1 16 . 1 1 38 38 ALA N N 38 114.400 114.400 126.244 -11.844 18141
2195 1 16 . 1 1 38 38 ALA HA H 38 3.990 3.990 4.177 -0.187 18141
2196 1 16 . 1 1 38 38 ALA CA C 38 54.400 54.400 53.686 0.714 18141
2197 1 16 . 1 1 38 38 ALA H H 38 8.770 8.770 8.613 0.157 18141
2198 1 16 . 1 1 39 39 ASP N N 39 112.400 112.400 115.636 -3.236 18141
2199 1 16 . 1 1 39 39 ASP HA H 39 4.310 4.310 4.762 -0.452 18141
2200 1 16 . 1 1 39 39 ASP H H 39 8.710 8.710 8.315 0.395 18141
2201 1 16 . 1 1 40 40 LYS N N 40 117.000 117.000 118.232 -1.232 18141
2202 1 16 . 1 1 40 40 LYS HA H 40 4.370 4.370 4.527 -0.157 18141
2203 1 16 . 1 1 40 40 LYS CA C 40 57.000 57.000 57.090 -0.090 18141
2204 1 16 . 1 1 40 40 LYS H H 40 6.990 6.990 7.526 -0.536 18141
2205 1 16 . 1 1 41 41 CYS N N 41 121.600 121.600 119.285 2.315 18141
2206 1 16 . 1 1 41 41 CYS HA H 41 5.180 5.180 5.021 0.159 18141
2207 1 16 . 1 1 41 41 CYS CA C 41 50.900 50.900 56.687 -5.787 18141
2208 1 16 . 1 1 41 41 CYS H H 41 7.520 7.520 7.639 -0.119 18141
2209 1 17 . 1 1 2 2 PRO HA H 2 4.370 4.370 4.546 -0.176 18141
2210 1 17 . 1 1 2 2 PRO CA C 2 62.800 62.800 62.669 0.132 18141
2211 1 17 . 1 1 3 3 TYR N N 3 120.600 120.600 124.139 -3.539 18141
2212 1 17 . 1 1 3 3 TYR HA H 3 4.310 4.310 4.435 -0.125 18141
2213 1 17 . 1 1 3 3 TYR H H 3 8.160 8.160 7.962 0.198 18141
2214 1 17 . 1 1 4 4 CYS N N 4 119.100 119.100 118.796 0.304 18141
2215 1 17 . 1 1 4 4 CYS HA H 4 3.330 3.330 4.514 -1.184 18141
2216 1 17 . 1 1 4 4 CYS CA C 4 53.500 53.500 57.268 -3.768 18141
2217 1 17 . 1 1 4 4 CYS H H 4 7.700 7.700 8.271 -0.571 18141
2218 1 17 . 1 1 5 5 GLY N N 5 107.900 107.900 110.907 -3.007 18141
2219 1 17 . 1 1 5 5 GLY CA C 5 43.700 43.700 45.672 -1.972 18141
2220 1 17 . 1 1 5 5 GLY H H 5 5.930 5.930 7.524 -1.594 18141
2221 1 17 . 1 1 6 6 GLN N N 6 114.200 114.200 120.165 -5.965 18141
2222 1 17 . 1 1 6 6 GLN HA H 6 4.420 4.420 4.461 -0.041 18141
2223 1 17 . 1 1 6 6 GLN CA C 6 56.200 56.200 55.866 0.334 18141
2224 1 17 . 1 1 6 6 GLN H H 6 8.710 8.710 8.586 0.124 18141
2225 1 17 . 1 1 7 7 THR N N 7 106.600 106.600 111.171 -4.571 18141
2226 1 17 . 1 1 7 7 THR HA H 7 4.780 4.780 4.712 0.068 18141
2227 1 17 . 1 1 7 7 THR CA C 7 58.700 58.700 60.209 -1.509 18141
2228 1 17 . 1 1 7 7 THR H H 7 7.300 7.300 7.207 0.093 18141
2229 1 17 . 1 1 8 8 GLY N N 8 110.400 110.400 111.857 -1.457 18141
2230 1 17 . 1 1 8 8 GLY CA C 8 48.000 48.000 47.239 0.761 18141
2231 1 17 . 1 1 8 8 GLY H H 8 9.260 9.260 9.117 0.143 18141
2232 1 17 . 1 1 9 9 ALA N N 9 123.400 123.400 124.217 -0.817 18141
2233 1 17 . 1 1 9 9 ALA HA H 9 4.090 4.090 4.286 -0.196 18141
2234 1 17 . 1 1 9 9 ALA CA C 9 55.600 55.600 54.526 1.074 18141
2235 1 17 . 1 1 9 9 ALA H H 9 8.490 8.490 8.068 0.422 18141
2236 1 17 . 1 1 10 10 GLU N N 10 119.500 119.500 117.814 1.686 18141
2237 1 17 . 1 1 10 10 GLU HA H 10 4.230 4.230 4.236 -0.006 18141
2238 1 17 . 1 1 10 10 GLU CA C 10 59.300 59.300 58.686 0.614 18141
2239 1 17 . 1 1 10 10 GLU H H 10 7.790 7.790 7.819 -0.029 18141
2240 1 17 . 1 1 11 11 CYS N N 11 118.300 118.300 120.918 -2.618 18141
2241 1 17 . 1 1 11 11 CYS HA H 11 4.850 4.850 4.337 0.513 18141
2242 1 17 . 1 1 11 11 CYS H H 11 8.460 8.460 8.474 -0.014 18141
2243 1 17 . 1 1 12 12 TYR N N 12 121.800 121.800 121.058 0.742 18141
2244 1 17 . 1 1 12 12 TYR HA H 12 4.020 4.020 4.290 -0.270 18141
2245 1 17 . 1 1 12 12 TYR H H 12 8.860 8.860 8.099 0.761 18141
2246 1 17 . 1 1 13 13 SER N N 13 114.500 114.500 114.616 -0.116 18141
2247 1 17 . 1 1 13 13 SER HA H 13 4.130 4.130 3.683 0.447 18141
2248 1 17 . 1 1 13 13 SER CA C 13 62.600 62.600 60.630 1.970 18141
2249 1 17 . 1 1 13 13 SER H H 13 7.910 7.910 7.955 -0.045 18141
2250 1 17 . 1 1 14 14 TRP N N 14 122.400 122.400 124.524 -2.124 18141
2251 1 17 . 1 1 14 14 TRP HA H 14 4.020 4.020 4.471 -0.451 18141
2252 1 17 . 1 1 14 14 TRP H H 14 8.680 8.680 8.243 0.437 18141
2253 1 17 . 1 1 15 15 CYS N N 15 120.500 120.500 117.740 2.760 18141
2254 1 17 . 1 1 15 15 CYS HA H 15 3.530 3.530 3.165 0.365 18141
2255 1 17 . 1 1 15 15 CYS CA C 15 60.500 60.500 60.746 -0.246 18141
2256 1 17 . 1 1 15 15 CYS H H 15 8.120 8.120 7.781 0.339 18141
2257 1 17 . 1 1 16 16 ILE N N 16 120.300 120.300 118.985 1.315 18141
2258 1 17 . 1 1 16 16 ILE HA H 16 3.930 3.930 3.851 0.079 18141
2259 1 17 . 1 1 16 16 ILE CA C 16 61.700 61.700 62.004 -0.304 18141
2260 1 17 . 1 1 16 16 ILE H H 16 8.250 8.250 7.208 1.042 18141
2261 1 17 . 1 1 17 17 LYS N N 17 121.700 121.700 120.745 0.955 18141
2262 1 17 . 1 1 17 17 LYS HA H 17 4.100 4.100 3.941 0.159 18141
2263 1 17 . 1 1 17 17 LYS CA C 17 58.100 58.100 58.301 -0.201 18141
2264 1 17 . 1 1 17 17 LYS H H 17 7.800 7.800 8.255 -0.455 18141
2265 1 17 . 1 1 18 18 GLN N N 18 117.600 117.600 116.966 0.634 18141
2266 1 17 . 1 1 18 18 GLN HA H 18 4.030 4.030 3.848 0.182 18141
2267 1 17 . 1 1 18 18 GLN H H 18 7.240 7.240 7.251 -0.011 18141
2268 1 17 . 1 1 19 19 ASP N N 19 121.800 121.800 115.533 6.267 18141
2269 1 17 . 1 1 19 19 ASP HA H 19 4.320 4.320 4.213 0.107 18141
2270 1 17 . 1 1 19 19 ASP H H 19 8.050 8.050 7.643 0.407 18141
2271 1 17 . 1 1 20 20 LEU N N 20 119.400 119.400 116.092 3.308 18141
2272 1 17 . 1 1 20 20 LEU HA H 20 4.300 4.300 4.345 -0.045 18141
2273 1 17 . 1 1 20 20 LEU H H 20 6.430 6.430 7.909 -1.479 18141
2274 1 17 . 1 1 21 21 SER N N 21 115.500 115.500 109.643 5.857 18141
2275 1 17 . 1 1 21 21 SER HA H 21 4.290 4.290 4.503 -0.213 18141
2276 1 17 . 1 1 21 21 SER H H 21 8.260 8.260 7.525 0.735 18141
2277 1 17 . 1 1 22 22 LYS N N 22 122.700 122.700 123.159 -0.459 18141
2278 1 17 . 1 1 22 22 LYS HA H 22 4.020 4.020 3.961 0.059 18141
2279 1 17 . 1 1 22 22 LYS H H 22 8.690 8.690 8.716 -0.026 18141
2280 1 17 . 1 1 23 23 ASP N N 23 117.000 117.000 115.582 1.418 18141
2281 1 17 . 1 1 23 23 ASP HA H 23 4.370 4.370 4.486 -0.116 18141
2282 1 17 . 1 1 23 23 ASP CA C 23 55.300 55.300 56.390 -1.090 18141
2283 1 17 . 1 1 23 23 ASP H H 23 8.260 8.260 8.614 -0.354 18141
2284 1 17 . 1 1 24 24 TRP N N 24 122.400 122.400 120.563 1.837 18141
2285 1 17 . 1 1 24 24 TRP HA H 24 4.240 4.240 4.393 -0.153 18141
2286 1 17 . 1 1 24 24 TRP CA C 24 59.300 59.300 60.560 -1.260 18141
2287 1 17 . 1 1 24 24 TRP H H 24 7.910 7.910 8.158 -0.247 18141
2288 1 17 . 1 1 25 25 CYS N N 25 117.800 117.800 118.610 -0.810 18141
2289 1 17 . 1 1 25 25 CYS HA H 25 4.890 4.890 4.695 0.195 18141
2290 1 17 . 1 1 25 25 CYS H H 25 9.110 9.110 7.885 1.225 18141
2291 1 17 . 1 1 26 26 CYS N N 26 120.700 120.700 121.725 -1.025 18141
2292 1 17 . 1 1 26 26 CYS HA H 26 4.530 4.530 4.176 0.354 18141
2293 1 17 . 1 1 26 26 CYS CA C 26 58.900 58.900 63.400 -4.500 18141
2294 1 17 . 1 1 26 26 CYS H H 26 8.940 8.940 8.027 0.913 18141
2295 1 17 . 1 1 27 27 ASP N N 27 120.700 120.700 119.033 1.667 18141
2296 1 17 . 1 1 27 27 ASP HA H 27 4.330 4.330 4.634 -0.304 18141
2297 1 17 . 1 1 27 27 ASP CA C 27 57.100 57.100 56.978 0.122 18141
2298 1 17 . 1 1 27 27 ASP H H 27 7.400 7.400 7.819 -0.419 18141
2299 1 17 . 1 1 28 28 PHE N N 28 123.100 123.100 122.146 0.954 18141
2300 1 17 . 1 1 28 28 PHE HA H 28 4.070 4.070 4.254 -0.184 18141
2301 1 17 . 1 1 28 28 PHE CA C 28 60.200 60.200 61.522 -1.322 18141
2302 1 17 . 1 1 28 28 PHE H H 28 8.590 8.590 7.535 1.055 18141
2303 1 17 . 1 1 29 29 VAL N N 29 116.200 116.200 119.159 -2.959 18141
2304 1 17 . 1 1 29 29 VAL HA H 29 3.120 3.120 3.552 -0.432 18141
2305 1 17 . 1 1 29 29 VAL CA C 29 66.100 66.100 65.359 0.742 18141
2306 1 17 . 1 1 29 29 VAL H H 29 7.760 7.760 8.241 -0.481 18141
2307 1 17 . 1 1 30 30 LYS N N 30 117.300 117.300 118.433 -1.133 18141
2308 1 17 . 1 1 30 30 LYS HA H 30 4.260 4.260 4.081 0.179 18141
2309 1 17 . 1 1 30 30 LYS H H 30 7.280 7.280 7.634 -0.354 18141
2310 1 17 . 1 1 31 31 ASP N N 31 122.600 122.600 119.502 3.098 18141
2311 1 17 . 1 1 31 31 ASP HA H 31 4.410 4.410 4.507 -0.097 18141
2312 1 17 . 1 1 31 31 ASP CA C 31 56.800 56.800 56.093 0.707 18141
2313 1 17 . 1 1 31 31 ASP H H 31 8.510 8.510 7.996 0.514 18141
2314 1 17 . 1 1 32 32 ILE N N 32 112.500 112.500 113.627 -1.127 18141
2315 1 17 . 1 1 32 32 ILE HA H 32 4.310 4.310 4.309 0.001 18141
2316 1 17 . 1 1 32 32 ILE CA C 32 62.800 62.800 60.282 2.518 18141
2317 1 17 . 1 1 32 32 ILE H H 32 7.320 7.320 7.119 0.201 18141
2318 1 17 . 1 1 33 33 ARG N N 33 114.200 114.200 118.814 -4.614 18141
2319 1 17 . 1 1 33 33 ARG HA H 33 3.870 3.870 3.923 -0.053 18141
2320 1 17 . 1 1 33 33 ARG CA C 33 56.600 56.600 57.392 -0.793 18141
2321 1 17 . 1 1 33 33 ARG H H 33 7.880 7.880 7.741 0.139 18141
2322 1 17 . 1 1 34 34 MET N N 34 117.100 117.100 117.631 -0.531 18141
2323 1 17 . 1 1 34 34 MET HA H 34 4.640 4.640 4.643 -0.003 18141
2324 1 17 . 1 1 34 34 MET CA C 34 54.300 54.300 53.423 0.877 18141
2325 1 17 . 1 1 34 34 MET H H 34 7.570 7.570 7.609 -0.039 18141
2326 1 17 . 1 1 35 35 ASN N N 35 118.000 118.000 119.237 -1.237 18141
2327 1 17 . 1 1 35 35 ASN HA H 35 5.170 5.170 5.079 0.091 18141
2328 1 17 . 1 1 35 35 ASN CA C 35 50.400 50.400 50.143 0.257 18141
2329 1 17 . 1 1 35 35 ASN H H 35 8.390 8.390 8.458 -0.068 18141
2330 1 17 . 1 1 37 37 PRO HA H 37 4.320 4.320 4.454 -0.134 18141
2331 1 17 . 1 1 37 37 PRO CA C 37 61.200 61.200 62.399 -1.199 18141
2332 1 17 . 1 1 38 38 ALA N N 38 114.400 114.400 124.063 -9.663 18141
2333 1 17 . 1 1 38 38 ALA HA H 38 3.990 3.990 4.366 -0.376 18141
2334 1 17 . 1 1 38 38 ALA CA C 38 54.400 54.400 52.542 1.858 18141
2335 1 17 . 1 1 38 38 ALA H H 38 8.770 8.770 8.449 0.321 18141
2336 1 17 . 1 1 39 39 ASP N N 39 112.400 112.400 117.906 -5.506 18141
2337 1 17 . 1 1 39 39 ASP HA H 39 4.310 4.310 4.626 -0.316 18141
2338 1 17 . 1 1 39 39 ASP H H 39 8.710 8.710 8.063 0.647 18141
2339 1 17 . 1 1 40 40 LYS N N 40 117.000 117.000 120.103 -3.103 18141
2340 1 17 . 1 1 40 40 LYS HA H 40 4.370 4.370 4.378 -0.008 18141
2341 1 17 . 1 1 40 40 LYS CA C 40 57.000 57.000 56.306 0.694 18141
2342 1 17 . 1 1 40 40 LYS H H 40 6.990 6.990 7.673 -0.683 18141
2343 1 17 . 1 1 41 41 CYS N N 41 121.600 121.600 121.572 0.028 18141
2344 1 17 . 1 1 41 41 CYS HA H 41 5.180 5.180 4.723 0.457 18141
2345 1 17 . 1 1 41 41 CYS CA C 41 50.900 50.900 57.424 -6.524 18141
2346 1 17 . 1 1 41 41 CYS H H 41 7.520 7.520 8.291 -0.771 18141
2347 1 18 . 1 1 2 2 PRO HA H 2 4.370 4.370 4.485 -0.115 18141
2348 1 18 . 1 1 2 2 PRO CA C 2 62.800 62.800 63.168 -0.368 18141
2349 1 18 . 1 1 3 3 TYR N N 3 120.600 120.600 116.657 3.943 18141
2350 1 18 . 1 1 3 3 TYR HA H 3 4.310 4.310 4.651 -0.341 18141
2351 1 18 . 1 1 3 3 TYR H H 3 8.160 8.160 6.933 1.227 18141
2352 1 18 . 1 1 4 4 CYS N N 4 119.100 119.100 121.652 -2.552 18141
2353 1 18 . 1 1 4 4 CYS HA H 4 3.330 3.330 4.586 -1.256 18141
2354 1 18 . 1 1 4 4 CYS CA C 4 53.500 53.500 58.662 -5.162 18141
2355 1 18 . 1 1 4 4 CYS H H 4 7.700 7.700 8.261 -0.561 18141
2356 1 18 . 1 1 5 5 GLY N N 5 107.900 107.900 109.330 -1.430 18141
2357 1 18 . 1 1 5 5 GLY CA C 5 43.700 43.700 46.231 -2.531 18141
2358 1 18 . 1 1 5 5 GLY H H 5 5.930 5.930 7.778 -1.848 18141
2359 1 18 . 1 1 6 6 GLN N N 6 114.200 114.200 119.964 -5.764 18141
2360 1 18 . 1 1 6 6 GLN HA H 6 4.420 4.420 4.380 0.040 18141
2361 1 18 . 1 1 6 6 GLN CA C 6 56.200 56.200 55.866 0.334 18141
2362 1 18 . 1 1 6 6 GLN H H 6 8.710 8.710 8.438 0.272 18141
2363 1 18 . 1 1 7 7 THR N N 7 106.600 106.600 111.000 -4.400 18141
2364 1 18 . 1 1 7 7 THR HA H 7 4.780 4.780 4.644 0.136 18141
2365 1 18 . 1 1 7 7 THR CA C 7 58.700 58.700 59.899 -1.199 18141
2366 1 18 . 1 1 7 7 THR H H 7 7.300 7.300 7.337 -0.037 18141
2367 1 18 . 1 1 8 8 GLY N N 8 110.400 110.400 109.679 0.721 18141
2368 1 18 . 1 1 8 8 GLY CA C 8 48.000 48.000 47.455 0.545 18141
2369 1 18 . 1 1 8 8 GLY H H 8 9.260 9.260 8.899 0.361 18141
2370 1 18 . 1 1 9 9 ALA N N 9 123.400 123.400 123.955 -0.555 18141
2371 1 18 . 1 1 9 9 ALA HA H 9 4.090 4.090 4.100 -0.010 18141
2372 1 18 . 1 1 9 9 ALA CA C 9 55.600 55.600 54.783 0.817 18141
2373 1 18 . 1 1 9 9 ALA H H 9 8.490 8.490 8.387 0.103 18141
2374 1 18 . 1 1 10 10 GLU N N 10 119.500 119.500 117.834 1.666 18141
2375 1 18 . 1 1 10 10 GLU HA H 10 4.230 4.230 4.216 0.014 18141
2376 1 18 . 1 1 10 10 GLU CA C 10 59.300 59.300 59.275 0.025 18141
2377 1 18 . 1 1 10 10 GLU H H 10 7.790 7.790 8.600 -0.810 18141
2378 1 18 . 1 1 11 11 CYS N N 11 118.300 118.300 119.705 -1.405 18141
2379 1 18 . 1 1 11 11 CYS HA H 11 4.850 4.850 4.430 0.420 18141
2380 1 18 . 1 1 11 11 CYS H H 11 8.460 8.460 7.666 0.794 18141
2381 1 18 . 1 1 12 12 TYR N N 12 121.800 121.800 120.744 1.056 18141
2382 1 18 . 1 1 12 12 TYR HA H 12 4.020 4.020 4.105 -0.085 18141
2383 1 18 . 1 1 12 12 TYR H H 12 8.860 8.860 8.286 0.574 18141
2384 1 18 . 1 1 13 13 SER N N 13 114.500 114.500 114.365 0.135 18141
2385 1 18 . 1 1 13 13 SER HA H 13 4.130 4.130 3.809 0.321 18141
2386 1 18 . 1 1 13 13 SER CA C 13 62.600 62.600 61.184 1.416 18141
2387 1 18 . 1 1 13 13 SER H H 13 7.910 7.910 7.577 0.333 18141
2388 1 18 . 1 1 14 14 TRP N N 14 122.400 122.400 123.478 -1.078 18141
2389 1 18 . 1 1 14 14 TRP HA H 14 4.020 4.020 4.378 -0.358 18141
2390 1 18 . 1 1 14 14 TRP H H 14 8.680 8.680 8.145 0.535 18141
2391 1 18 . 1 1 15 15 CYS N N 15 120.500 120.500 117.411 3.089 18141
2392 1 18 . 1 1 15 15 CYS HA H 15 3.530 3.530 3.482 0.048 18141
2393 1 18 . 1 1 15 15 CYS CA C 15 60.500 60.500 61.406 -0.906 18141
2394 1 18 . 1 1 15 15 CYS H H 15 8.120 8.120 8.064 0.056 18141
2395 1 18 . 1 1 16 16 ILE N N 16 120.300 120.300 120.548 -0.248 18141
2396 1 18 . 1 1 16 16 ILE HA H 16 3.930 3.930 4.076 -0.146 18141
2397 1 18 . 1 1 16 16 ILE CA C 16 61.700 61.700 62.539 -0.839 18141
2398 1 18 . 1 1 16 16 ILE H H 16 8.250 8.250 7.495 0.755 18141
2399 1 18 . 1 1 17 17 LYS N N 17 121.700 121.700 120.538 1.162 18141
2400 1 18 . 1 1 17 17 LYS HA H 17 4.100 4.100 3.972 0.128 18141
2401 1 18 . 1 1 17 17 LYS CA C 17 58.100 58.100 58.522 -0.422 18141
2402 1 18 . 1 1 17 17 LYS H H 17 7.800 7.800 8.304 -0.504 18141
2403 1 18 . 1 1 18 18 GLN N N 18 117.600 117.600 116.207 1.393 18141
2404 1 18 . 1 1 18 18 GLN HA H 18 4.030 4.030 4.037 -0.007 18141
2405 1 18 . 1 1 18 18 GLN H H 18 7.240 7.240 7.363 -0.123 18141
2406 1 18 . 1 1 19 19 ASP N N 19 121.800 121.800 116.627 5.173 18141
2407 1 18 . 1 1 19 19 ASP HA H 19 4.320 4.320 4.300 0.020 18141
2408 1 18 . 1 1 19 19 ASP H H 19 8.050 8.050 7.960 0.090 18141
2409 1 18 . 1 1 20 20 LEU N N 20 119.400 119.400 117.111 2.289 18141
2410 1 18 . 1 1 20 20 LEU HA H 20 4.300 4.300 4.114 0.186 18141
2411 1 18 . 1 1 20 20 LEU H H 20 6.430 6.430 8.112 -1.682 18141
2412 1 18 . 1 1 21 21 SER N N 21 115.500 115.500 109.511 5.989 18141
2413 1 18 . 1 1 21 21 SER HA H 21 4.290 4.290 4.517 -0.227 18141
2414 1 18 . 1 1 21 21 SER H H 21 8.260 8.260 7.526 0.734 18141
2415 1 18 . 1 1 22 22 LYS N N 22 122.700 122.700 123.960 -1.260 18141
2416 1 18 . 1 1 22 22 LYS HA H 22 4.020 4.020 4.069 -0.049 18141
2417 1 18 . 1 1 22 22 LYS H H 22 8.690 8.690 8.822 -0.132 18141
2418 1 18 . 1 1 23 23 ASP N N 23 117.000 117.000 116.651 0.349 18141
2419 1 18 . 1 1 23 23 ASP HA H 23 4.370 4.370 4.618 -0.248 18141
2420 1 18 . 1 1 23 23 ASP CA C 23 55.300 55.300 55.301 -0.001 18141
2421 1 18 . 1 1 23 23 ASP H H 23 8.260 8.260 8.367 -0.107 18141
2422 1 18 . 1 1 24 24 TRP N N 24 122.400 122.400 121.147 1.253 18141
2423 1 18 . 1 1 24 24 TRP HA H 24 4.240 4.240 4.528 -0.288 18141
2424 1 18 . 1 1 24 24 TRP CA C 24 59.300 59.300 60.384 -1.084 18141
2425 1 18 . 1 1 24 24 TRP H H 24 7.910 7.910 8.461 -0.551 18141
2426 1 18 . 1 1 25 25 CYS N N 25 117.800 117.800 118.779 -0.979 18141
2427 1 18 . 1 1 25 25 CYS HA H 25 4.890 4.890 2.991 1.899 18141
2428 1 18 . 1 1 25 25 CYS H H 25 9.110 9.110 7.322 1.788 18141
2429 1 18 . 1 1 26 26 CYS N N 26 120.700 120.700 118.727 1.973 18141
2430 1 18 . 1 1 26 26 CYS HA H 26 4.530 4.530 4.126 0.404 18141
2431 1 18 . 1 1 26 26 CYS CA C 26 58.900 58.900 62.902 -4.002 18141
2432 1 18 . 1 1 26 26 CYS H H 26 8.940 8.940 8.044 0.896 18141
2433 1 18 . 1 1 27 27 ASP N N 27 120.700 120.700 118.676 2.024 18141
2434 1 18 . 1 1 27 27 ASP HA H 27 4.330 4.330 4.626 -0.296 18141
2435 1 18 . 1 1 27 27 ASP CA C 27 57.100 57.100 56.208 0.892 18141
2436 1 18 . 1 1 27 27 ASP H H 27 7.400 7.400 7.515 -0.115 18141
2437 1 18 . 1 1 28 28 PHE N N 28 123.100 123.100 121.914 1.186 18141
2438 1 18 . 1 1 28 28 PHE HA H 28 4.070 4.070 4.227 -0.157 18141
2439 1 18 . 1 1 28 28 PHE CA C 28 60.200 60.200 61.299 -1.099 18141
2440 1 18 . 1 1 28 28 PHE H H 28 8.590 8.590 7.868 0.722 18141
2441 1 18 . 1 1 29 29 VAL N N 29 116.200 116.200 116.362 -0.162 18141
2442 1 18 . 1 1 29 29 VAL HA H 29 3.120 3.120 3.716 -0.596 18141
2443 1 18 . 1 1 29 29 VAL CA C 29 66.100 66.100 66.767 -0.667 18141
2444 1 18 . 1 1 29 29 VAL H H 29 7.760 7.760 8.058 -0.298 18141
2445 1 18 . 1 1 30 30 LYS N N 30 117.300 117.300 116.431 0.869 18141
2446 1 18 . 1 1 30 30 LYS HA H 30 4.260 4.260 4.118 0.142 18141
2447 1 18 . 1 1 30 30 LYS H H 30 7.280 7.280 7.685 -0.405 18141
2448 1 18 . 1 1 31 31 ASP N N 31 122.600 122.600 120.377 2.223 18141
2449 1 18 . 1 1 31 31 ASP HA H 31 4.410 4.410 4.364 0.046 18141
2450 1 18 . 1 1 31 31 ASP CA C 31 56.800 56.800 56.728 0.072 18141
2451 1 18 . 1 1 31 31 ASP H H 31 8.510 8.510 7.408 1.102 18141
2452 1 18 . 1 1 32 32 ILE N N 32 112.500 112.500 112.623 -0.123 18141
2453 1 18 . 1 1 32 32 ILE HA H 32 4.310 4.310 4.131 0.179 18141
2454 1 18 . 1 1 32 32 ILE CA C 32 62.800 62.800 60.396 2.404 18141
2455 1 18 . 1 1 32 32 ILE H H 32 7.320 7.320 7.211 0.109 18141
2456 1 18 . 1 1 33 33 ARG N N 33 114.200 114.200 117.672 -3.472 18141
2457 1 18 . 1 1 33 33 ARG HA H 33 3.870 3.870 3.913 -0.043 18141
2458 1 18 . 1 1 33 33 ARG CA C 33 56.600 56.600 57.014 -0.414 18141
2459 1 18 . 1 1 33 33 ARG H H 33 7.880 7.880 7.902 -0.022 18141
2460 1 18 . 1 1 34 34 MET N N 34 117.100 117.100 117.075 0.025 18141
2461 1 18 . 1 1 34 34 MET HA H 34 4.640 4.640 4.707 -0.067 18141
2462 1 18 . 1 1 34 34 MET CA C 34 54.300 54.300 53.042 1.258 18141
2463 1 18 . 1 1 34 34 MET H H 34 7.570 7.570 7.561 0.009 18141
2464 1 18 . 1 1 35 35 ASN N N 35 118.000 118.000 119.925 -1.925 18141
2465 1 18 . 1 1 35 35 ASN HA H 35 5.170 5.170 5.040 0.130 18141
2466 1 18 . 1 1 35 35 ASN CA C 35 50.400 50.400 50.003 0.397 18141
2467 1 18 . 1 1 35 35 ASN H H 35 8.390 8.390 8.504 -0.114 18141
2468 1 18 . 1 1 37 37 PRO HA H 37 4.320 4.320 4.509 -0.189 18141
2469 1 18 . 1 1 37 37 PRO CA C 37 61.200 61.200 62.368 -1.168 18141
2470 1 18 . 1 1 38 38 ALA N N 38 114.400 114.400 125.316 -10.916 18141
2471 1 18 . 1 1 38 38 ALA HA H 38 3.990 3.990 4.227 -0.237 18141
2472 1 18 . 1 1 38 38 ALA CA C 38 54.400 54.400 53.571 0.829 18141
2473 1 18 . 1 1 38 38 ALA H H 38 8.770 8.770 8.321 0.449 18141
2474 1 18 . 1 1 39 39 ASP N N 39 112.400 112.400 117.306 -4.906 18141
2475 1 18 . 1 1 39 39 ASP HA H 39 4.310 4.310 4.649 -0.339 18141
2476 1 18 . 1 1 39 39 ASP H H 39 8.710 8.710 8.291 0.419 18141
2477 1 18 . 1 1 40 40 LYS N N 40 117.000 117.000 117.752 -0.752 18141
2478 1 18 . 1 1 40 40 LYS HA H 40 4.370 4.370 4.354 0.016 18141
2479 1 18 . 1 1 40 40 LYS CA C 40 57.000 57.000 56.556 0.444 18141
2480 1 18 . 1 1 40 40 LYS H H 40 6.990 6.990 7.798 -0.808 18141
2481 1 18 . 1 1 41 41 CYS N N 41 121.600 121.600 118.734 2.866 18141
2482 1 18 . 1 1 41 41 CYS HA H 41 5.180 5.180 4.780 0.400 18141
2483 1 18 . 1 1 41 41 CYS CA C 41 50.900 50.900 56.258 -5.358 18141
2484 1 18 . 1 1 41 41 CYS H H 41 7.520 7.520 7.696 -0.176 18141
2485 1 19 . 1 1 2 2 PRO HA H 2 4.370 4.370 4.731 -0.361 18141
2486 1 19 . 1 1 2 2 PRO CA C 2 62.800 62.800 62.837 -0.037 18141
2487 1 19 . 1 1 3 3 TYR N N 3 120.600 120.600 124.483 -3.883 18141
2488 1 19 . 1 1 3 3 TYR HA H 3 4.310 4.310 4.171 0.139 18141
2489 1 19 . 1 1 3 3 TYR H H 3 8.160 8.160 8.329 -0.169 18141
2490 1 19 . 1 1 4 4 CYS N N 4 119.100 119.100 115.220 3.880 18141
2491 1 19 . 1 1 4 4 CYS HA H 4 3.330 3.330 4.274 -0.944 18141
2492 1 19 . 1 1 4 4 CYS CA C 4 53.500 53.500 59.597 -6.097 18141
2493 1 19 . 1 1 4 4 CYS H H 4 7.700 7.700 8.212 -0.512 18141
2494 1 19 . 1 1 5 5 GLY N N 5 107.900 107.900 108.150 -0.250 18141
2495 1 19 . 1 1 5 5 GLY CA C 5 43.700 43.700 45.016 -1.316 18141
2496 1 19 . 1 1 5 5 GLY H H 5 5.930 5.930 7.859 -1.929 18141
2497 1 19 . 1 1 6 6 GLN N N 6 114.200 114.200 120.854 -6.654 18141
2498 1 19 . 1 1 6 6 GLN HA H 6 4.420 4.420 4.572 -0.152 18141
2499 1 19 . 1 1 6 6 GLN CA C 6 56.200 56.200 55.864 0.336 18141
2500 1 19 . 1 1 6 6 GLN H H 6 8.710 8.710 8.734 -0.024 18141
2501 1 19 . 1 1 7 7 THR N N 7 106.600 106.600 108.245 -1.645 18141
2502 1 19 . 1 1 7 7 THR HA H 7 4.780 4.780 4.824 -0.044 18141
2503 1 19 . 1 1 7 7 THR CA C 7 58.700 58.700 60.315 -1.615 18141
2504 1 19 . 1 1 7 7 THR H H 7 7.300 7.300 7.334 -0.034 18141
2505 1 19 . 1 1 8 8 GLY N N 8 110.400 110.400 107.588 2.812 18141
2506 1 19 . 1 1 8 8 GLY CA C 8 48.000 48.000 46.391 1.609 18141
2507 1 19 . 1 1 8 8 GLY H H 8 9.260 9.260 8.933 0.327 18141
2508 1 19 . 1 1 9 9 ALA N N 9 123.400 123.400 124.808 -1.408 18141
2509 1 19 . 1 1 9 9 ALA HA H 9 4.090 4.090 4.196 -0.106 18141
2510 1 19 . 1 1 9 9 ALA CA C 9 55.600 55.600 55.260 0.340 18141
2511 1 19 . 1 1 9 9 ALA H H 9 8.490 8.490 8.328 0.162 18141
2512 1 19 . 1 1 10 10 GLU N N 10 119.500 119.500 117.404 2.096 18141
2513 1 19 . 1 1 10 10 GLU HA H 10 4.230 4.230 4.127 0.103 18141
2514 1 19 . 1 1 10 10 GLU CA C 10 59.300 59.300 59.028 0.272 18141
2515 1 19 . 1 1 10 10 GLU H H 10 7.790 7.790 8.006 -0.216 18141
2516 1 19 . 1 1 11 11 CYS N N 11 118.300 118.300 119.472 -1.172 18141
2517 1 19 . 1 1 11 11 CYS HA H 11 4.850 4.850 4.301 0.548 18141
2518 1 19 . 1 1 11 11 CYS H H 11 8.460 8.460 7.687 0.773 18141
2519 1 19 . 1 1 12 12 TYR N N 12 121.800 121.800 120.161 1.639 18141
2520 1 19 . 1 1 12 12 TYR HA H 12 4.020 4.020 4.435 -0.415 18141
2521 1 19 . 1 1 12 12 TYR H H 12 8.860 8.860 8.716 0.144 18141
2522 1 19 . 1 1 13 13 SER N N 13 114.500 114.500 115.861 -1.361 18141
2523 1 19 . 1 1 13 13 SER HA H 13 4.130 4.130 4.296 -0.166 18141
2524 1 19 . 1 1 13 13 SER CA C 13 62.600 62.600 62.082 0.518 18141
2525 1 19 . 1 1 13 13 SER H H 13 7.910 7.910 7.804 0.106 18141
2526 1 19 . 1 1 14 14 TRP N N 14 122.400 122.400 124.318 -1.918 18141
2527 1 19 . 1 1 14 14 TRP HA H 14 4.020 4.020 4.248 -0.228 18141
2528 1 19 . 1 1 14 14 TRP H H 14 8.680 8.680 7.741 0.939 18141
2529 1 19 . 1 1 15 15 CYS N N 15 120.500 120.500 114.955 5.545 18141
2530 1 19 . 1 1 15 15 CYS HA H 15 3.530 3.530 3.772 -0.242 18141
2531 1 19 . 1 1 15 15 CYS CA C 15 60.500 60.500 61.967 -1.467 18141
2532 1 19 . 1 1 15 15 CYS H H 15 8.120 8.120 8.266 -0.146 18141
2533 1 19 . 1 1 16 16 ILE N N 16 120.300 120.300 120.806 -0.506 18141
2534 1 19 . 1 1 16 16 ILE HA H 16 3.930 3.930 3.925 0.005 18141
2535 1 19 . 1 1 16 16 ILE CA C 16 61.700 61.700 62.059 -0.359 18141
2536 1 19 . 1 1 16 16 ILE H H 16 8.250 8.250 7.566 0.684 18141
2537 1 19 . 1 1 17 17 LYS N N 17 121.700 121.700 121.221 0.479 18141
2538 1 19 . 1 1 17 17 LYS HA H 17 4.100 4.100 3.833 0.267 18141
2539 1 19 . 1 1 17 17 LYS CA C 17 58.100 58.100 59.271 -1.171 18141
2540 1 19 . 1 1 17 17 LYS H H 17 7.800 7.800 8.548 -0.748 18141
2541 1 19 . 1 1 18 18 GLN N N 18 117.600 117.600 116.533 1.067 18141
2542 1 19 . 1 1 18 18 GLN HA H 18 4.030 4.030 3.753 0.277 18141
2543 1 19 . 1 1 18 18 GLN H H 18 7.240 7.240 7.559 -0.319 18141
2544 1 19 . 1 1 19 19 ASP N N 19 121.800 121.800 117.004 4.796 18141
2545 1 19 . 1 1 19 19 ASP HA H 19 4.320 4.320 4.301 0.019 18141
2546 1 19 . 1 1 19 19 ASP H H 19 8.050 8.050 8.219 -0.169 18141
2547 1 19 . 1 1 20 20 LEU N N 20 119.400 119.400 119.087 0.313 18141
2548 1 19 . 1 1 20 20 LEU HA H 20 4.300 4.300 4.192 0.108 18141
2549 1 19 . 1 1 20 20 LEU H H 20 6.430 6.430 8.065 -1.635 18141
2550 1 19 . 1 1 21 21 SER N N 21 115.500 115.500 109.952 5.548 18141
2551 1 19 . 1 1 21 21 SER HA H 21 4.290 4.290 4.519 -0.229 18141
2552 1 19 . 1 1 21 21 SER H H 21 8.260 8.260 7.602 0.658 18141
2553 1 19 . 1 1 22 22 LYS N N 22 122.700 122.700 124.242 -1.542 18141
2554 1 19 . 1 1 22 22 LYS HA H 22 4.020 4.020 3.976 0.044 18141
2555 1 19 . 1 1 22 22 LYS H H 22 8.690 8.690 8.591 0.099 18141
2556 1 19 . 1 1 23 23 ASP N N 23 117.000 117.000 119.570 -2.570 18141
2557 1 19 . 1 1 23 23 ASP HA H 23 4.370 4.370 4.566 -0.197 18141
2558 1 19 . 1 1 23 23 ASP CA C 23 55.300 55.300 56.669 -1.369 18141
2559 1 19 . 1 1 23 23 ASP H H 23 8.260 8.260 8.302 -0.042 18141
2560 1 19 . 1 1 24 24 TRP N N 24 122.400 122.400 121.019 1.381 18141
2561 1 19 . 1 1 24 24 TRP HA H 24 4.240 4.240 4.250 -0.010 18141
2562 1 19 . 1 1 24 24 TRP CA C 24 59.300 59.300 60.707 -1.407 18141
2563 1 19 . 1 1 24 24 TRP H H 24 7.910 7.910 7.925 -0.015 18141
2564 1 19 . 1 1 25 25 CYS N N 25 117.800 117.800 117.502 0.298 18141
2565 1 19 . 1 1 25 25 CYS HA H 25 4.890 4.890 4.536 0.354 18141
2566 1 19 . 1 1 25 25 CYS H H 25 9.110 9.110 7.898 1.212 18141
2567 1 19 . 1 1 26 26 CYS N N 26 120.700 120.700 121.281 -0.581 18141
2568 1 19 . 1 1 26 26 CYS HA H 26 4.530 4.530 4.234 0.296 18141
2569 1 19 . 1 1 26 26 CYS CA C 26 58.900 58.900 63.476 -4.576 18141
2570 1 19 . 1 1 26 26 CYS H H 26 8.940 8.940 8.158 0.782 18141
2571 1 19 . 1 1 27 27 ASP N N 27 120.700 120.700 117.935 2.765 18141
2572 1 19 . 1 1 27 27 ASP HA H 27 4.330 4.330 4.539 -0.209 18141
2573 1 19 . 1 1 27 27 ASP CA C 27 57.100 57.100 56.346 0.754 18141
2574 1 19 . 1 1 27 27 ASP H H 27 7.400 7.400 8.136 -0.736 18141
2575 1 19 . 1 1 28 28 PHE N N 28 123.100 123.100 121.921 1.179 18141
2576 1 19 . 1 1 28 28 PHE HA H 28 4.070 4.070 4.136 -0.066 18141
2577 1 19 . 1 1 28 28 PHE CA C 28 60.200 60.200 60.496 -0.296 18141
2578 1 19 . 1 1 28 28 PHE H H 28 8.590 8.590 7.806 0.784 18141
2579 1 19 . 1 1 29 29 VAL N N 29 116.200 116.200 119.512 -3.312 18141
2580 1 19 . 1 1 29 29 VAL HA H 29 3.120 3.120 2.938 0.182 18141
2581 1 19 . 1 1 29 29 VAL CA C 29 66.100 66.100 66.172 -0.072 18141
2582 1 19 . 1 1 29 29 VAL H H 29 7.760 7.760 7.657 0.103 18141
2583 1 19 . 1 1 30 30 LYS N N 30 117.300 117.300 118.069 -0.769 18141
2584 1 19 . 1 1 30 30 LYS HA H 30 4.260 4.260 3.914 0.346 18141
2585 1 19 . 1 1 30 30 LYS H H 30 7.280 7.280 7.628 -0.348 18141
2586 1 19 . 1 1 31 31 ASP N N 31 122.600 122.600 118.403 4.197 18141
2587 1 19 . 1 1 31 31 ASP HA H 31 4.410 4.410 4.484 -0.074 18141
2588 1 19 . 1 1 31 31 ASP CA C 31 56.800 56.800 55.999 0.801 18141
2589 1 19 . 1 1 31 31 ASP H H 31 8.510 8.510 7.532 0.978 18141
2590 1 19 . 1 1 32 32 ILE N N 32 112.500 112.500 115.379 -2.879 18141
2591 1 19 . 1 1 32 32 ILE HA H 32 4.310 4.310 4.138 0.172 18141
2592 1 19 . 1 1 32 32 ILE CA C 32 62.800 62.800 60.086 2.714 18141
2593 1 19 . 1 1 32 32 ILE H H 32 7.320 7.320 7.487 -0.167 18141
2594 1 19 . 1 1 33 33 ARG N N 33 114.200 114.200 120.451 -6.251 18141
2595 1 19 . 1 1 33 33 ARG HA H 33 3.870 3.870 3.930 -0.060 18141
2596 1 19 . 1 1 33 33 ARG CA C 33 56.600 56.600 57.159 -0.559 18141
2597 1 19 . 1 1 33 33 ARG H H 33 7.880 7.880 7.424 0.456 18141
2598 1 19 . 1 1 34 34 MET N N 34 117.100 117.100 120.847 -3.747 18141
2599 1 19 . 1 1 34 34 MET HA H 34 4.640 4.640 4.619 0.021 18141
2600 1 19 . 1 1 34 34 MET CA C 34 54.300 54.300 54.280 0.020 18141
2601 1 19 . 1 1 34 34 MET H H 34 7.570 7.570 8.151 -0.581 18141
2602 1 19 . 1 1 35 35 ASN N N 35 118.000 118.000 120.722 -2.722 18141
2603 1 19 . 1 1 35 35 ASN HA H 35 5.170 5.170 5.157 0.013 18141
2604 1 19 . 1 1 35 35 ASN CA C 35 50.400 50.400 50.941 -0.541 18141
2605 1 19 . 1 1 35 35 ASN H H 35 8.390 8.390 8.397 -0.007 18141
2606 1 19 . 1 1 37 37 PRO HA H 37 4.320 4.320 4.524 -0.204 18141
2607 1 19 . 1 1 37 37 PRO CA C 37 61.200 61.200 61.775 -0.575 18141
2608 1 19 . 1 1 38 38 ALA N N 38 114.400 114.400 122.283 -7.883 18141
2609 1 19 . 1 1 38 38 ALA HA H 38 3.990 3.990 4.283 -0.293 18141
2610 1 19 . 1 1 38 38 ALA CA C 38 54.400 54.400 52.406 1.994 18141
2611 1 19 . 1 1 38 38 ALA H H 38 8.770 8.770 8.320 0.450 18141
2612 1 19 . 1 1 39 39 ASP N N 39 112.400 112.400 116.896 -4.496 18141
2613 1 19 . 1 1 39 39 ASP HA H 39 4.310 4.310 4.570 -0.260 18141
2614 1 19 . 1 1 39 39 ASP H H 39 8.710 8.710 7.954 0.756 18141
2615 1 19 . 1 1 40 40 LYS N N 40 117.000 117.000 119.416 -2.416 18141
2616 1 19 . 1 1 40 40 LYS HA H 40 4.370 4.370 4.292 0.078 18141
2617 1 19 . 1 1 40 40 LYS CA C 40 57.000 57.000 55.914 1.086 18141
2618 1 19 . 1 1 40 40 LYS H H 40 6.990 6.990 7.477 -0.487 18141
2619 1 19 . 1 1 41 41 CYS N N 41 121.600 121.600 120.237 1.363 18141
2620 1 19 . 1 1 41 41 CYS HA H 41 5.180 5.180 4.888 0.292 18141
2621 1 19 . 1 1 41 41 CYS CA C 41 50.900 50.900 56.519 -5.619 18141
2622 1 19 . 1 1 41 41 CYS H H 41 7.520 7.520 8.050 -0.530 18141
2623 1 20 . 1 1 2 2 PRO HA H 2 4.370 4.370 4.696 -0.326 18141
2624 1 20 . 1 1 2 2 PRO CA C 2 62.800 62.800 63.105 -0.305 18141
2625 1 20 . 1 1 3 3 TYR N N 3 120.600 120.600 119.990 0.610 18141
2626 1 20 . 1 1 3 3 TYR HA H 3 4.310 4.310 4.486 -0.176 18141
2627 1 20 . 1 1 3 3 TYR H H 3 8.160 8.160 7.911 0.249 18141
2628 1 20 . 1 1 4 4 CYS N N 4 119.100 119.100 126.099 -6.999 18141
2629 1 20 . 1 1 4 4 CYS HA H 4 3.330 3.330 4.800 -1.470 18141
2630 1 20 . 1 1 4 4 CYS CA C 4 53.500 53.500 57.835 -4.335 18141
2631 1 20 . 1 1 4 4 CYS H H 4 7.700 7.700 8.625 -0.925 18141
2632 1 20 . 1 1 5 5 GLY N N 5 107.900 107.900 108.342 -0.442 18141
2633 1 20 . 1 1 5 5 GLY CA C 5 43.700 43.700 46.273 -2.574 18141
2634 1 20 . 1 1 5 5 GLY H H 5 5.930 5.930 8.287 -2.357 18141
2635 1 20 . 1 1 6 6 GLN N N 6 114.200 114.200 115.792 -1.592 18141
2636 1 20 . 1 1 6 6 GLN HA H 6 4.420 4.420 3.829 0.591 18141
2637 1 20 . 1 1 6 6 GLN CA C 6 56.200 56.200 57.293 -1.093 18141
2638 1 20 . 1 1 6 6 GLN H H 6 8.710 8.710 8.541 0.169 18141
2639 1 20 . 1 1 7 7 THR N N 7 106.600 106.600 107.003 -0.403 18141
2640 1 20 . 1 1 7 7 THR HA H 7 4.780 4.780 4.728 0.052 18141
2641 1 20 . 1 1 7 7 THR CA C 7 58.700 58.700 59.690 -0.990 18141
2642 1 20 . 1 1 7 7 THR H H 7 7.300 7.300 7.948 -0.648 18141
2643 1 20 . 1 1 8 8 GLY N N 8 110.400 110.400 108.980 1.420 18141
2644 1 20 . 1 1 8 8 GLY CA C 8 48.000 48.000 46.654 1.346 18141
2645 1 20 . 1 1 8 8 GLY H H 8 9.260 9.260 8.690 0.570 18141
2646 1 20 . 1 1 9 9 ALA N N 9 123.400 123.400 123.358 0.042 18141
2647 1 20 . 1 1 9 9 ALA HA H 9 4.090 4.090 4.214 -0.124 18141
2648 1 20 . 1 1 9 9 ALA CA C 9 55.600 55.600 54.779 0.821 18141
2649 1 20 . 1 1 9 9 ALA H H 9 8.490 8.490 8.453 0.037 18141
2650 1 20 . 1 1 10 10 GLU N N 10 119.500 119.500 116.216 3.284 18141
2651 1 20 . 1 1 10 10 GLU HA H 10 4.230 4.230 4.378 -0.148 18141
2652 1 20 . 1 1 10 10 GLU CA C 10 59.300 59.300 58.268 1.032 18141
2653 1 20 . 1 1 10 10 GLU H H 10 7.790 7.790 7.851 -0.061 18141
2654 1 20 . 1 1 11 11 CYS N N 11 118.300 118.300 119.339 -1.039 18141
2655 1 20 . 1 1 11 11 CYS HA H 11 4.850 4.850 4.642 0.208 18141
2656 1 20 . 1 1 11 11 CYS H H 11 8.460 8.460 7.565 0.895 18141
2657 1 20 . 1 1 12 12 TYR N N 12 121.800 121.800 121.532 0.268 18141
2658 1 20 . 1 1 12 12 TYR HA H 12 4.020 4.020 4.210 -0.190 18141
2659 1 20 . 1 1 12 12 TYR H H 12 8.860 8.860 8.920 -0.060 18141
2660 1 20 . 1 1 13 13 SER N N 13 114.500 114.500 114.696 -0.196 18141
2661 1 20 . 1 1 13 13 SER HA H 13 4.130 4.130 3.579 0.551 18141
2662 1 20 . 1 1 13 13 SER CA C 13 62.600 62.600 60.958 1.642 18141
2663 1 20 . 1 1 13 13 SER H H 13 7.910 7.910 7.564 0.346 18141
2664 1 20 . 1 1 14 14 TRP N N 14 122.400 122.400 123.274 -0.874 18141
2665 1 20 . 1 1 14 14 TRP HA H 14 4.020 4.020 4.501 -0.481 18141
2666 1 20 . 1 1 14 14 TRP H H 14 8.680 8.680 8.295 0.385 18141
2667 1 20 . 1 1 15 15 CYS N N 15 120.500 120.500 117.736 2.764 18141
2668 1 20 . 1 1 15 15 CYS HA H 15 3.530 3.530 3.350 0.180 18141
2669 1 20 . 1 1 15 15 CYS CA C 15 60.500 60.500 60.347 0.153 18141
2670 1 20 . 1 1 15 15 CYS H H 15 8.120 8.120 8.209 -0.089 18141
2671 1 20 . 1 1 16 16 ILE N N 16 120.300 120.300 122.527 -2.227 18141
2672 1 20 . 1 1 16 16 ILE HA H 16 3.930 3.930 3.950 -0.020 18141
2673 1 20 . 1 1 16 16 ILE CA C 16 61.700 61.700 62.676 -0.976 18141
2674 1 20 . 1 1 16 16 ILE H H 16 8.250 8.250 7.526 0.724 18141
2675 1 20 . 1 1 17 17 LYS N N 17 121.700 121.700 120.558 1.142 18141
2676 1 20 . 1 1 17 17 LYS HA H 17 4.100 4.100 4.001 0.099 18141
2677 1 20 . 1 1 17 17 LYS CA C 17 58.100 58.100 58.512 -0.412 18141
2678 1 20 . 1 1 17 17 LYS H H 17 7.800 7.800 8.494 -0.694 18141
2679 1 20 . 1 1 18 18 GLN N N 18 117.600 117.600 118.984 -1.384 18141
2680 1 20 . 1 1 18 18 GLN HA H 18 4.030 4.030 3.997 0.033 18141
2681 1 20 . 1 1 18 18 GLN H H 18 7.240 7.240 7.502 -0.262 18141
2682 1 20 . 1 1 19 19 ASP N N 19 121.800 121.800 114.085 7.715 18141
2683 1 20 . 1 1 19 19 ASP HA H 19 4.320 4.320 4.258 0.062 18141
2684 1 20 . 1 1 19 19 ASP H H 19 8.050 8.050 8.089 -0.039 18141
2685 1 20 . 1 1 20 20 LEU N N 20 119.400 119.400 118.578 0.822 18141
2686 1 20 . 1 1 20 20 LEU HA H 20 4.300 4.300 4.242 0.058 18141
2687 1 20 . 1 1 20 20 LEU H H 20 6.430 6.430 8.565 -2.135 18141
2688 1 20 . 1 1 21 21 SER N N 21 115.500 115.500 109.148 6.352 18141
2689 1 20 . 1 1 21 21 SER HA H 21 4.290 4.290 4.508 -0.218 18141
2690 1 20 . 1 1 21 21 SER H H 21 8.260 8.260 7.700 0.560 18141
2691 1 20 . 1 1 22 22 LYS N N 22 122.700 122.700 121.678 1.022 18141
2692 1 20 . 1 1 22 22 LYS HA H 22 4.020 4.020 4.005 0.015 18141
2693 1 20 . 1 1 22 22 LYS H H 22 8.690 8.690 8.778 -0.088 18141
2694 1 20 . 1 1 23 23 ASP N N 23 117.000 117.000 118.968 -1.968 18141
2695 1 20 . 1 1 23 23 ASP HA H 23 4.370 4.370 4.523 -0.153 18141
2696 1 20 . 1 1 23 23 ASP CA C 23 55.300 55.300 56.805 -1.505 18141
2697 1 20 . 1 1 23 23 ASP H H 23 8.260 8.260 8.456 -0.196 18141
2698 1 20 . 1 1 24 24 TRP N N 24 122.400 122.400 121.922 0.478 18141
2699 1 20 . 1 1 24 24 TRP HA H 24 4.240 4.240 4.288 -0.048 18141
2700 1 20 . 1 1 24 24 TRP CA C 24 59.300 59.300 60.272 -0.972 18141
2701 1 20 . 1 1 24 24 TRP H H 24 7.910 7.910 8.303 -0.393 18141
2702 1 20 . 1 1 25 25 CYS N N 25 117.800 117.800 117.822 -0.022 18141
2703 1 20 . 1 1 25 25 CYS HA H 25 4.890 4.890 3.697 1.193 18141
2704 1 20 . 1 1 25 25 CYS H H 25 9.110 9.110 7.748 1.362 18141
2705 1 20 . 1 1 26 26 CYS N N 26 120.700 120.700 120.677 0.023 18141
2706 1 20 . 1 1 26 26 CYS HA H 26 4.530 4.530 3.936 0.594 18141
2707 1 20 . 1 1 26 26 CYS CA C 26 58.900 58.900 62.749 -3.849 18141
2708 1 20 . 1 1 26 26 CYS H H 26 8.940 8.940 8.073 0.867 18141
2709 1 20 . 1 1 27 27 ASP N N 27 120.700 120.700 119.538 1.162 18141
2710 1 20 . 1 1 27 27 ASP HA H 27 4.330 4.330 4.534 -0.204 18141
2711 1 20 . 1 1 27 27 ASP CA C 27 57.100 57.100 56.679 0.421 18141
2712 1 20 . 1 1 27 27 ASP H H 27 7.400 7.400 7.680 -0.280 18141
2713 1 20 . 1 1 28 28 PHE N N 28 123.100 123.100 121.572 1.528 18141
2714 1 20 . 1 1 28 28 PHE HA H 28 4.070 4.070 4.126 -0.056 18141
2715 1 20 . 1 1 28 28 PHE CA C 28 60.200 60.200 60.751 -0.551 18141
2716 1 20 . 1 1 28 28 PHE H H 28 8.590 8.590 7.209 1.381 18141
2717 1 20 . 1 1 29 29 VAL N N 29 116.200 116.200 119.838 -3.638 18141
2718 1 20 . 1 1 29 29 VAL HA H 29 3.120 3.120 2.946 0.174 18141
2719 1 20 . 1 1 29 29 VAL CA C 29 66.100 66.100 65.332 0.769 18141
2720 1 20 . 1 1 29 29 VAL H H 29 7.760 7.760 7.633 0.127 18141
2721 1 20 . 1 1 30 30 LYS N N 30 117.300 117.300 117.626 -0.326 18141
2722 1 20 . 1 1 30 30 LYS HA H 30 4.260 4.260 3.952 0.308 18141
2723 1 20 . 1 1 30 30 LYS H H 30 7.280 7.280 7.548 -0.268 18141
2724 1 20 . 1 1 31 31 ASP N N 31 122.600 122.600 118.850 3.750 18141
2725 1 20 . 1 1 31 31 ASP HA H 31 4.410 4.410 4.552 -0.142 18141
2726 1 20 . 1 1 31 31 ASP CA C 31 56.800 56.800 56.016 0.784 18141
2727 1 20 . 1 1 31 31 ASP H H 31 8.510 8.510 8.054 0.456 18141
2728 1 20 . 1 1 32 32 ILE N N 32 112.500 112.500 116.755 -4.255 18141
2729 1 20 . 1 1 32 32 ILE HA H 32 4.310 4.310 4.198 0.112 18141
2730 1 20 . 1 1 32 32 ILE CA C 32 62.800 62.800 60.493 2.307 18141
2731 1 20 . 1 1 32 32 ILE H H 32 7.320 7.320 7.092 0.228 18141
2732 1 20 . 1 1 33 33 ARG N N 33 114.200 114.200 116.435 -2.235 18141
2733 1 20 . 1 1 33 33 ARG HA H 33 3.870 3.870 3.860 0.010 18141
2734 1 20 . 1 1 33 33 ARG CA C 33 56.600 56.600 57.252 -0.652 18141
2735 1 20 . 1 1 33 33 ARG H H 33 7.880 7.880 7.504 0.376 18141
2736 1 20 . 1 1 34 34 MET N N 34 117.100 117.100 117.084 0.016 18141
2737 1 20 . 1 1 34 34 MET HA H 34 4.640 4.640 4.357 0.283 18141
2738 1 20 . 1 1 34 34 MET CA C 34 54.300 54.300 55.519 -1.219 18141
2739 1 20 . 1 1 34 34 MET H H 34 7.570 7.570 7.507 0.063 18141
2740 1 20 . 1 1 35 35 ASN N N 35 118.000 118.000 119.451 -1.451 18141
2741 1 20 . 1 1 35 35 ASN HA H 35 5.170 5.170 4.986 0.184 18141
2742 1 20 . 1 1 35 35 ASN CA C 35 50.400 50.400 50.978 -0.578 18141
2743 1 20 . 1 1 35 35 ASN H H 35 8.390 8.390 8.403 -0.013 18141
2744 1 20 . 1 1 37 37 PRO HA H 37 4.320 4.320 4.503 -0.183 18141
2745 1 20 . 1 1 37 37 PRO CA C 37 61.200 61.200 62.218 -1.018 18141
2746 1 20 . 1 1 38 38 ALA N N 38 114.400 114.400 128.140 -13.740 18141
2747 1 20 . 1 1 38 38 ALA HA H 38 3.990 3.990 4.038 -0.048 18141
2748 1 20 . 1 1 38 38 ALA CA C 38 54.400 54.400 53.919 0.481 18141
2749 1 20 . 1 1 38 38 ALA H H 38 8.770 8.770 8.636 0.134 18141
2750 1 20 . 1 1 39 39 ASP N N 39 112.400 112.400 117.093 -4.693 18141
2751 1 20 . 1 1 39 39 ASP HA H 39 4.310 4.310 4.572 -0.262 18141
2752 1 20 . 1 1 39 39 ASP H H 39 8.710 8.710 8.313 0.397 18141
2753 1 20 . 1 1 40 40 LYS N N 40 117.000 117.000 117.937 -0.937 18141
2754 1 20 . 1 1 40 40 LYS HA H 40 4.370 4.370 4.418 -0.048 18141
2755 1 20 . 1 1 40 40 LYS CA C 40 57.000 57.000 57.019 -0.019 18141
2756 1 20 . 1 1 40 40 LYS H H 40 6.990 6.990 7.519 -0.529 18141
2757 1 20 . 1 1 41 41 CYS N N 41 121.600 121.600 120.745 0.855 18141
2758 1 20 . 1 1 41 41 CYS HA H 41 5.180 5.180 4.951 0.229 18141
2759 1 20 . 1 1 41 41 CYS CA C 41 50.900 50.900 56.963 -6.063 18141
2760 1 20 . 1 1 41 41 CYS H H 41 7.520 7.520 7.881 -0.361 18141
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 37 3.058 0.189 3.094 18141
2 1 1 "Average Difference" HA 41 0.415 0.014 0.420 18141
3 1 1 "Average Difference" C 0 0.000 0.000 0.000 18141
4 1 1 "Average Difference" CA 27 2.091 0.483 2.073 18141
5 1 1 "Average Difference" CB 0 0.000 0.000 0.000 18141
6 1 1 "Average Difference" HN 37 0.712 -0.099 0.715 18141
7 1 2 "Average Difference" N 37 2.997 0.231 3.029 18141
8 1 2 "Average Difference" HA 41 0.364 -0.022 0.368 18141
9 1 2 "Average Difference" C 0 0.000 0.000 0.000 18141
10 1 2 "Average Difference" CA 27 2.023 0.592 1.971 18141
11 1 2 "Average Difference" CB 0 0.000 0.000 0.000 18141
12 1 2 "Average Difference" HN 37 0.735 -0.028 0.744 18141
13 1 3 "Average Difference" N 37 3.070 0.101 3.110 18141
14 1 3 "Average Difference" HA 41 0.362 0.038 0.364 18141
15 1 3 "Average Difference" C 0 0.000 0.000 0.000 18141
16 1 3 "Average Difference" CA 27 2.187 0.556 2.155 18141
17 1 3 "Average Difference" CB 0 0.000 0.000 0.000 18141
18 1 3 "Average Difference" HN 37 0.680 -0.066 0.686 18141
19 1 4 "Average Difference" N 37 2.993 0.311 3.017 18141
20 1 4 "Average Difference" HA 41 0.400 -0.016 0.405 18141
21 1 4 "Average Difference" C 0 0.000 0.000 0.000 18141
22 1 4 "Average Difference" CA 27 2.028 0.652 1.957 18141
23 1 4 "Average Difference" CB 0 0.000 0.000 0.000 18141
24 1 4 "Average Difference" HN 37 0.731 -0.030 0.741 18141
25 1 5 "Average Difference" N 37 3.555 0.239 3.596 18141
26 1 5 "Average Difference" HA 41 0.382 0.003 0.387 18141
27 1 5 "Average Difference" C 0 0.000 0.000 0.000 18141
28 1 5 "Average Difference" CA 27 2.069 0.583 2.023 18141
29 1 5 "Average Difference" CB 0 0.000 0.000 0.000 18141
30 1 5 "Average Difference" HN 37 0.688 -0.034 0.697 18141
31 1 6 "Average Difference" N 37 3.314 0.186 3.355 18141
32 1 6 "Average Difference" HA 41 0.412 -0.060 0.412 18141
33 1 6 "Average Difference" C 0 0.000 0.000 0.000 18141
34 1 6 "Average Difference" CA 27 2.125 0.665 2.057 18141
35 1 6 "Average Difference" CB 0 0.000 0.000 0.000 18141
36 1 6 "Average Difference" HN 37 0.693 0.013 0.702 18141
37 1 7 "Average Difference" N 37 3.295 0.179 3.335 18141
38 1 7 "Average Difference" HA 41 0.403 0.017 0.407 18141
39 1 7 "Average Difference" C 0 0.000 0.000 0.000 18141
40 1 7 "Average Difference" CA 27 2.169 0.603 2.124 18141
41 1 7 "Average Difference" CB 0 0.000 0.000 0.000 18141
42 1 7 "Average Difference" HN 37 0.726 -0.069 0.732 18141
43 1 8 "Average Difference" N 37 3.269 0.701 3.237 18141
44 1 8 "Average Difference" HA 41 0.270 0.049 0.269 18141
45 1 8 "Average Difference" C 0 0.000 0.000 0.000 18141
46 1 8 "Average Difference" CA 27 2.095 0.486 2.077 18141
47 1 8 "Average Difference" CB 0 0.000 0.000 0.000 18141
48 1 8 "Average Difference" HN 37 0.847 0.079 0.855 18141
49 1 9 "Average Difference" N 37 3.434 0.492 3.445 18141
50 1 9 "Average Difference" HA 41 0.450 0.009 0.455 18141
51 1 9 "Average Difference" C 0 0.000 0.000 0.000 18141
52 1 9 "Average Difference" CA 27 2.077 0.587 2.030 18141
53 1 9 "Average Difference" CB 0 0.000 0.000 0.000 18141
54 1 9 "Average Difference" HN 37 0.749 -0.042 0.758 18141
55 1 10 "Average Difference" N 37 3.126 0.314 3.153 18141
56 1 10 "Average Difference" HA 41 0.407 0.010 0.412 18141
57 1 10 "Average Difference" C 0 0.000 0.000 0.000 18141
58 1 10 "Average Difference" CA 27 1.816 0.660 1.725 18141
59 1 10 "Average Difference" CB 0 0.000 0.000 0.000 18141
60 1 10 "Average Difference" HN 37 0.675 -0.066 0.681 18141
61 1 11 "Average Difference" N 37 3.320 0.362 3.346 18141
62 1 11 "Average Difference" HA 41 0.356 0.027 0.360 18141
63 1 11 "Average Difference" C 0 0.000 0.000 0.000 18141
64 1 11 "Average Difference" CA 27 2.033 0.771 1.917 18141
65 1 11 "Average Difference" CB 0 0.000 0.000 0.000 18141
66 1 11 "Average Difference" HN 37 0.777 -0.017 0.788 18141
67 1 12 "Average Difference" N 37 3.383 0.490 3.393 18141
68 1 12 "Average Difference" HA 41 0.425 -0.015 0.430 18141
69 1 12 "Average Difference" C 0 0.000 0.000 0.000 18141
70 1 12 "Average Difference" CA 27 1.970 0.672 1.887 18141
71 1 12 "Average Difference" CB 0 0.000 0.000 0.000 18141
72 1 12 "Average Difference" HN 37 0.760 -0.021 0.770 18141
73 1 13 "Average Difference" N 37 3.100 0.045 3.143 18141
74 1 13 "Average Difference" HA 41 0.314 -0.001 0.318 18141
75 1 13 "Average Difference" C 0 0.000 0.000 0.000 18141
76 1 13 "Average Difference" CA 27 2.229 0.666 2.168 18141
77 1 13 "Average Difference" CB 0 0.000 0.000 0.000 18141
78 1 13 "Average Difference" HN 37 0.785 -0.070 0.793 18141
79 1 14 "Average Difference" N 37 3.315 0.441 3.331 18141
80 1 14 "Average Difference" HA 41 0.320 0.078 0.314 18141
81 1 14 "Average Difference" C 0 0.000 0.000 0.000 18141
82 1 14 "Average Difference" CA 27 2.039 0.462 2.024 18141
83 1 14 "Average Difference" CB 0 0.000 0.000 0.000 18141
84 1 14 "Average Difference" HN 37 0.706 -0.068 0.712 18141
85 1 15 "Average Difference" N 37 3.616 0.641 3.608 18141
86 1 15 "Average Difference" HA 41 0.439 0.009 0.444 18141
87 1 15 "Average Difference" C 0 0.000 0.000 0.000 18141
88 1 15 "Average Difference" CA 27 2.062 0.435 2.055 18141
89 1 15 "Average Difference" CB 0 0.000 0.000 0.000 18141
90 1 15 "Average Difference" HN 37 0.693 -0.031 0.702 18141
91 1 16 "Average Difference" N 37 3.150 -0.148 3.189 18141
92 1 16 "Average Difference" HA 41 0.474 -0.039 0.478 18141
93 1 16 "Average Difference" C 0 0.000 0.000 0.000 18141
94 1 16 "Average Difference" CA 27 1.971 0.644 1.898 18141
95 1 16 "Average Difference" CB 0 0.000 0.000 0.000 18141
96 1 16 "Average Difference" HN 37 0.791 0.007 0.802 18141
97 1 17 "Average Difference" N 37 3.201 0.637 3.181 18141
98 1 17 "Average Difference" HA 41 0.315 0.036 0.317 18141
99 1 17 "Average Difference" C 0 0.000 0.000 0.000 18141
100 1 17 "Average Difference" CA 27 2.002 0.445 1.989 18141
101 1 17 "Average Difference" CB 0 0.000 0.000 0.000 18141
102 1 17 "Average Difference" HN 37 0.621 -0.056 0.627 18141
103 1 18 "Average Difference" N 37 3.086 0.069 3.128 18141
104 1 18 "Average Difference" HA 41 0.435 -0.004 0.440 18141
105 1 18 "Average Difference" C 0 0.000 0.000 0.000 18141
106 1 18 "Average Difference" CA 27 1.902 0.585 1.845 18141
107 1 18 "Average Difference" CB 0 0.000 0.000 0.000 18141
108 1 18 "Average Difference" HN 37 0.719 -0.082 0.724 18141
109 1 19 "Average Difference" N 37 3.270 0.503 3.276 18141
110 1 19 "Average Difference" HA 41 0.280 0.022 0.283 18141
111 1 19 "Average Difference" C 0 0.000 0.000 0.000 18141
112 1 19 "Average Difference" CA 27 2.103 0.616 2.050 18141
113 1 19 "Average Difference" CB 0 0.000 0.000 0.000 18141
114 1 19 "Average Difference" HN 37 0.661 -0.016 0.670 18141
115 1 20 "Average Difference" N 37 3.515 0.410 3.540 18141
116 1 20 "Average Difference" HA 41 0.391 -0.030 0.394 18141
117 1 20 "Average Difference" C 0 0.000 0.000 0.000 18141
118 1 20 "Average Difference" CA 27 1.928 0.643 1.852 18141
119 1 20 "Average Difference" CB 0 0.000 0.000 0.000 18141
120 1 20 "Average Difference" HN 37 0.738 0.002 0.748 18141
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 18141
_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 4.370 4.370 4.610 -0.240 18141
2 1 . 1 1 2 2 PRO CA C 2 62.800 62.800 62.831 -0.031 18141
3 1 . 1 1 3 3 TYR N N 3 120.600 120.600 120.627 -0.027 18141
4 1 . 1 1 3 3 TYR HA H 3 4.310 4.310 4.553 -0.243 18141
5 1 . 1 1 3 3 TYR H H 3 8.160 8.160 7.901 0.259 18141
6 1 . 1 1 4 4 CYS N N 4 119.100 119.100 121.294 -2.194 18141
7 1 . 1 1 4 4 CYS HA H 4 3.330 3.330 4.369 -1.039 18141
8 1 . 1 1 4 4 CYS CA C 4 53.500 53.500 58.710 -5.210 18141
9 1 . 1 1 4 4 CYS H H 4 7.700 7.700 8.469 -0.769 18141
10 1 . 1 1 5 5 GLY N N 5 107.900 107.900 109.157 -1.258 18141
11 1 . 1 1 5 5 GLY CA C 5 43.700 43.700 45.726 -2.026 18141
12 1 . 1 1 5 5 GLY H H 5 5.930 5.930 7.965 -2.035 18141
13 1 . 1 1 6 6 GLN N N 6 114.200 114.200 119.568 -5.368 18141
14 1 . 1 1 6 6 GLN HA H 6 4.420 4.420 4.251 0.169 18141
15 1 . 1 1 6 6 GLN CA C 6 56.200 56.200 56.489 -0.289 18141
16 1 . 1 1 6 6 GLN H H 6 8.710 8.710 8.605 0.105 18141
17 1 . 1 1 7 7 THR N N 7 106.600 106.600 108.307 -1.707 18141
18 1 . 1 1 7 7 THR HA H 7 4.780 4.780 4.687 0.093 18141
19 1 . 1 1 7 7 THR CA C 7 58.700 58.700 60.135 -1.435 18141
20 1 . 1 1 7 7 THR H H 7 7.300 7.300 7.463 -0.163 18141
21 1 . 1 1 8 8 GLY N N 8 110.400 110.400 108.854 1.546 18141
22 1 . 1 1 8 8 GLY CA C 8 48.000 48.000 46.739 1.261 18141
23 1 . 1 1 8 8 GLY H H 8 9.260 9.260 8.726 0.534 18141
24 1 . 1 1 9 9 ALA N N 9 123.400 123.400 123.678 -0.278 18141
25 1 . 1 1 9 9 ALA HA H 9 4.090 4.090 4.099 -0.009 18141
26 1 . 1 1 9 9 ALA CA C 9 55.600 55.600 54.791 0.809 18141
27 1 . 1 1 9 9 ALA H H 9 8.490 8.490 8.186 0.304 18141
28 1 . 1 1 10 10 GLU N N 10 119.500 119.500 117.245 2.255 18141
29 1 . 1 1 10 10 GLU HA H 10 4.230 4.230 4.185 0.045 18141
30 1 . 1 1 10 10 GLU CA C 10 59.300 59.300 58.914 0.386 18141
31 1 . 1 1 10 10 GLU H H 10 7.790 7.790 8.142 -0.352 18141
32 1 . 1 1 11 11 CYS N N 11 118.300 118.300 119.309 -1.009 18141
33 1 . 1 1 11 11 CYS HA H 11 4.850 4.850 4.536 0.314 18141
34 1 . 1 1 11 11 CYS H H 11 8.460 8.460 7.770 0.690 18141
35 1 . 1 1 12 12 TYR N N 12 121.800 121.800 121.456 0.344 18141
36 1 . 1 1 12 12 TYR HA H 12 4.020 4.020 4.224 -0.204 18141
37 1 . 1 1 12 12 TYR H H 12 8.860 8.860 8.586 0.274 18141
38 1 . 1 1 13 13 SER N N 13 114.500 114.500 114.647 -0.147 18141
39 1 . 1 1 13 13 SER HA H 13 4.130 4.130 3.910 0.220 18141
40 1 . 1 1 13 13 SER CA C 13 62.600 62.600 61.040 1.560 18141
41 1 . 1 1 13 13 SER H H 13 7.910 7.910 7.817 0.093 18141
42 1 . 1 1 14 14 TRP N N 14 122.400 122.400 123.374 -0.974 18141
43 1 . 1 1 14 14 TRP HA H 14 4.020 4.020 4.473 -0.453 18141
44 1 . 1 1 14 14 TRP H H 14 8.680 8.680 8.001 0.679 18141
45 1 . 1 1 15 15 CYS N N 15 120.500 120.500 117.877 2.623 18141
46 1 . 1 1 15 15 CYS HA H 15 3.530 3.530 3.475 0.055 18141
47 1 . 1 1 15 15 CYS CA C 15 60.500 60.500 61.261 -0.761 18141
48 1 . 1 1 15 15 CYS H H 15 8.120 8.120 8.213 -0.093 18141
49 1 . 1 1 16 16 ILE N N 16 120.300 120.300 120.696 -0.396 18141
50 1 . 1 1 16 16 ILE HA H 16 3.930 3.930 3.962 -0.032 18141
51 1 . 1 1 16 16 ILE CA C 16 61.700 61.700 63.035 -1.334 18141
52 1 . 1 1 16 16 ILE H H 16 8.250 8.250 7.593 0.657 18141
53 1 . 1 1 17 17 LYS N N 17 121.700 121.700 121.192 0.508 18141
54 1 . 1 1 17 17 LYS HA H 17 4.100 4.100 3.915 0.185 18141
55 1 . 1 1 17 17 LYS CA C 17 58.100 58.100 58.763 -0.663 18141
56 1 . 1 1 17 17 LYS H H 17 7.800 7.800 8.211 -0.411 18141
57 1 . 1 1 18 18 GLN N N 18 117.600 117.600 116.504 1.096 18141
58 1 . 1 1 18 18 GLN HA H 18 4.030 4.030 3.969 0.061 18141
59 1 . 1 1 18 18 GLN H H 18 7.240 7.240 7.514 -0.274 18141
60 1 . 1 1 19 19 ASP N N 19 121.800 121.800 116.550 5.250 18141
61 1 . 1 1 19 19 ASP HA H 19 4.320 4.320 4.285 0.035 18141
62 1 . 1 1 19 19 ASP H H 19 8.050 8.050 8.064 -0.014 18141
63 1 . 1 1 20 20 LEU N N 20 119.400 119.400 117.211 2.189 18141
64 1 . 1 1 20 20 LEU HA H 20 4.300 4.300 4.205 0.095 18141
65 1 . 1 1 20 20 LEU H H 20 6.430 6.430 8.132 -1.702 18141
66 1 . 1 1 21 21 SER N N 21 115.500 115.500 109.657 5.843 18141
67 1 . 1 1 21 21 SER HA H 21 4.290 4.290 4.541 -0.251 18141
68 1 . 1 1 21 21 SER H H 21 8.260 8.260 7.612 0.648 18141
69 1 . 1 1 22 22 LYS N N 22 122.700 122.700 122.941 -0.241 18141
70 1 . 1 1 22 22 LYS HA H 22 4.020 4.020 4.143 -0.123 18141
71 1 . 1 1 22 22 LYS H H 22 8.690 8.690 8.762 -0.072 18141
72 1 . 1 1 23 23 ASP N N 23 117.000 117.000 118.756 -1.756 18141
73 1 . 1 1 23 23 ASP HA H 23 4.370 4.370 4.579 -0.209 18141
74 1 . 1 1 23 23 ASP CA C 23 55.300 55.300 55.932 -0.632 18141
75 1 . 1 1 23 23 ASP H H 23 8.260 8.260 8.316 -0.056 18141
76 1 . 1 1 24 24 TRP N N 24 122.400 122.400 121.155 1.245 18141
77 1 . 1 1 24 24 TRP HA H 24 4.240 4.240 4.373 -0.133 18141
78 1 . 1 1 24 24 TRP CA C 24 59.300 59.300 60.483 -1.183 18141
79 1 . 1 1 24 24 TRP H H 24 7.910 7.910 8.107 -0.197 18141
80 1 . 1 1 25 25 CYS N N 25 117.800 117.800 118.063 -0.263 18141
81 1 . 1 1 25 25 CYS HA H 25 4.890 4.890 3.647 1.243 18141
82 1 . 1 1 25 25 CYS H H 25 9.110 9.110 7.600 1.510 18141
83 1 . 1 1 26 26 CYS N N 26 120.700 120.700 120.108 0.593 18141
84 1 . 1 1 26 26 CYS HA H 26 4.530 4.530 4.077 0.453 18141
85 1 . 1 1 26 26 CYS CA C 26 58.900 58.900 63.507 -4.607 18141
86 1 . 1 1 26 26 CYS H H 26 8.940 8.940 8.017 0.923 18141
87 1 . 1 1 27 27 ASP N N 27 120.700 120.700 118.654 2.046 18141
88 1 . 1 1 27 27 ASP HA H 27 4.330 4.330 4.577 -0.247 18141
89 1 . 1 1 27 27 ASP CA C 27 57.100 57.100 56.527 0.573 18141
90 1 . 1 1 27 27 ASP H H 27 7.400 7.400 7.771 -0.371 18141
91 1 . 1 1 28 28 PHE N N 28 123.100 123.100 121.720 1.380 18141
92 1 . 1 1 28 28 PHE HA H 28 4.070 4.070 4.156 -0.086 18141
93 1 . 1 1 28 28 PHE CA C 28 60.200 60.200 60.956 -0.756 18141
94 1 . 1 1 28 28 PHE H H 28 8.590 8.590 7.530 1.060 18141
95 1 . 1 1 29 29 VAL N N 29 116.200 116.200 117.462 -1.262 18141
96 1 . 1 1 29 29 VAL HA H 29 3.120 3.120 3.319 -0.199 18141
97 1 . 1 1 29 29 VAL CA C 29 66.100 66.100 65.875 0.225 18141
98 1 . 1 1 29 29 VAL H H 29 7.760 7.760 7.890 -0.130 18141
99 1 . 1 1 30 30 LYS N N 30 117.300 117.300 118.231 -0.931 18141
100 1 . 1 1 30 30 LYS HA H 30 4.260 4.260 4.068 0.192 18141
101 1 . 1 1 30 30 LYS H H 30 7.280 7.280 7.532 -0.252 18141
102 1 . 1 1 31 31 ASP N N 31 122.600 122.600 119.540 3.060 18141
103 1 . 1 1 31 31 ASP HA H 31 4.410 4.410 4.454 -0.044 18141
104 1 . 1 1 31 31 ASP CA C 31 56.800 56.800 56.420 0.380 18141
105 1 . 1 1 31 31 ASP H H 31 8.510 8.510 7.792 0.718 18141
106 1 . 1 1 32 32 ILE N N 32 112.500 112.500 114.352 -1.852 18141
107 1 . 1 1 32 32 ILE HA H 32 4.310 4.310 4.189 0.121 18141
108 1 . 1 1 32 32 ILE CA C 32 62.800 62.800 60.369 2.431 18141
109 1 . 1 1 32 32 ILE H H 32 7.320 7.320 7.140 0.180 18141
110 1 . 1 1 33 33 ARG N N 33 114.200 114.200 118.254 -4.055 18141
111 1 . 1 1 33 33 ARG HA H 33 3.870 3.870 3.896 -0.026 18141
112 1 . 1 1 33 33 ARG CA C 33 56.600 56.600 57.190 -0.590 18141
113 1 . 1 1 33 33 ARG H H 33 7.880 7.880 7.749 0.131 18141
114 1 . 1 1 34 34 MET N N 34 117.100 117.100 117.670 -0.570 18141
115 1 . 1 1 34 34 MET HA H 34 4.640 4.640 4.603 0.037 18141
116 1 . 1 1 34 34 MET CA C 34 54.300 54.300 53.648 0.652 18141
117 1 . 1 1 34 34 MET H H 34 7.570 7.570 7.679 -0.109 18141
118 1 . 1 1 35 35 ASN N N 35 118.000 118.000 119.878 -1.877 18141
119 1 . 1 1 35 35 ASN HA H 35 5.170 5.170 5.104 0.066 18141
120 1 . 1 1 35 35 ASN CA C 35 50.400 50.400 50.615 -0.215 18141
121 1 . 1 1 35 35 ASN H H 35 8.390 8.390 8.561 -0.171 18141
122 1 . 1 1 37 37 PRO HA H 37 4.320 4.320 4.487 -0.167 18141
123 1 . 1 1 37 37 PRO CA C 37 61.200 61.200 62.207 -1.007 18141
124 1 . 1 1 38 38 ALA N N 38 114.400 114.400 124.911 -10.511 18141
125 1 . 1 1 38 38 ALA HA H 38 3.990 3.990 4.262 -0.272 18141
126 1 . 1 1 38 38 ALA CA C 38 54.400 54.400 53.061 1.339 18141
127 1 . 1 1 38 38 ALA H H 38 8.770 8.770 8.435 0.335 18141
128 1 . 1 1 39 39 ASP N N 39 112.400 112.400 117.526 -5.126 18141
129 1 . 1 1 39 39 ASP HA H 39 4.310 4.310 4.595 -0.285 18141
130 1 . 1 1 39 39 ASP H H 39 8.710 8.710 8.169 0.541 18141
131 1 . 1 1 40 40 LYS N N 40 117.000 117.000 118.535 -1.535 18141
132 1 . 1 1 40 40 LYS HA H 40 4.370 4.370 4.378 -0.008 18141
133 1 . 1 1 40 40 LYS CA C 40 57.000 57.000 56.373 0.627 18141
134 1 . 1 1 40 40 LYS H H 40 6.990 6.990 7.810 -0.820 18141
135 1 . 1 1 41 41 CYS N N 41 121.600 121.600 120.066 1.534 18141
136 1 . 1 1 41 41 CYS HA H 41 5.180 5.180 4.882 0.298 18141
137 1 . 1 1 41 41 CYS CA C 41 50.900 50.900 56.340 -5.440 18141
138 1 . 1 1 41 41 CYS H H 41 7.520 7.520 7.881 -0.361 18141
stop_
save_