data_19694
save_entry_information
_Entry.Sf_category entry_information
_Entry.NMR_STAR_version 3.0.9.13
_Entry.Entry_ID 19694
_Entry.PDB_ID 2MIU
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 19694
_Entity_delta_chem_shifts.ID 1
loop_
_Delta_CS.Atom_chem_shift_ID
_Delta_CS.Entity_delta_chem_shifts_ID
_Delta_CS.Conformer_ID
_Delta_CS.Assembly_atom_ID
_Delta_CS.Entity_assembly_ID
_Delta_CS.Entity_ID
_Delta_CS.Comp_index_ID
_Delta_CS.Seq_ID
_Delta_CS.Comp_ID
_Delta_CS.Atom_ID
_Delta_CS.Atom_type
_Delta_CS.Auth_seq_ID
_Delta_CS.Original_CS_value
_Delta_CS.Corrected_CS_value
_Delta_CS.Sparta_CS_value
_Delta_CS.Delta_CS_value
_Delta_CS.Entry_ID
1 1 1 . 1 1 2 2 THR N N 2 113.570 113.570 116.279 -2.709 19694
2 1 1 . 1 1 2 2 THR HA H 2 4.240 4.240 4.199 0.041 19694
3 1 1 . 1 1 2 2 THR CA C 2 62.130 62.130 64.088 -1.958 19694
4 1 1 . 1 1 2 2 THR CB C 2 69.250 69.250 69.175 0.075 19694
5 1 1 . 1 1 2 2 THR H H 2 8.090 8.090 8.255 -0.165 19694
6 1 1 . 1 1 3 3 GLU N N 3 122.880 122.880 119.638 3.242 19694
7 1 1 . 1 1 3 3 GLU HA H 3 4.280 4.280 4.504 -0.224 19694
8 1 1 . 1 1 3 3 GLU CA C 3 56.860 56.860 55.417 1.443 19694
9 1 1 . 1 1 3 3 GLU CB C 3 30.570 30.570 30.506 0.064 19694
10 1 1 . 1 1 3 3 GLU H H 3 8.280 8.280 7.978 0.302 19694
11 1 1 . 1 1 4 4 ARG N N 4 121.330 121.330 119.640 1.690 19694
12 1 1 . 1 1 4 4 ARG HA H 4 4.300 4.300 4.591 -0.291 19694
13 1 1 . 1 1 4 4 ARG CA C 4 55.870 55.870 55.243 0.627 19694
14 1 1 . 1 1 4 4 ARG CB C 4 31.640 31.640 30.849 0.791 19694
15 1 1 . 1 1 4 4 ARG H H 4 8.280 8.280 8.594 -0.314 19694
16 1 1 . 1 1 5 5 PHE N N 5 125.490 125.490 124.984 0.506 19694
17 1 1 . 1 1 5 5 PHE HA H 5 4.610 4.610 4.612 -0.002 19694
18 1 1 . 1 1 5 5 PHE CA C 5 56.380 56.380 56.715 -0.334 19694
19 1 1 . 1 1 5 5 PHE CB C 5 39.560 39.560 40.019 -0.459 19694
20 1 1 . 1 1 5 5 PHE H H 5 8.290 8.290 8.716 -0.426 19694
21 1 1 . 1 1 6 6 ASP N N 6 123.260 123.260 121.272 1.988 19694
22 1 1 . 1 1 6 6 ASP HA H 6 5.045 5.045 4.770 0.275 19694
23 1 1 . 1 1 6 6 ASP CA C 6 52.180 52.180 53.195 -1.015 19694
24 1 1 . 1 1 6 6 ASP CB C 6 44.210 44.210 44.320 -0.110 19694
25 1 1 . 1 1 6 6 ASP H H 6 7.940 7.940 7.608 0.332 19694
26 1 1 . 1 1 7 7 CYS N N 7 121.440 121.440 123.039 -1.599 19694
27 1 1 . 1 1 7 7 CYS HA H 7 3.960 3.960 4.451 -0.491 19694
28 1 1 . 1 1 7 7 CYS CA C 7 59.820 59.820 59.738 0.082 19694
29 1 1 . 1 1 7 7 CYS CB C 7 30.950 30.950 26.132 4.818 19694
30 1 1 . 1 1 7 7 CYS H H 7 8.700 8.700 8.550 0.150 19694
31 1 1 . 1 1 8 8 HIS N N 8 129.390 129.390 129.379 0.011 19694
32 1 1 . 1 1 8 8 HIS HA H 8 4.200 4.200 4.206 -0.006 19694
33 1 1 . 1 1 8 8 HIS CA C 8 58.240 58.240 59.621 -1.381 19694
34 1 1 . 1 1 8 8 HIS CB C 8 29.480 29.480 30.154 -0.674 19694
35 1 1 . 1 1 8 8 HIS H H 8 9.160 9.160 9.592 -0.432 19694
36 1 1 . 1 1 9 9 HIS N N 9 118.740 118.740 116.913 1.827 19694
37 1 1 . 1 1 9 9 HIS HA H 9 4.880 4.880 4.487 0.393 19694
38 1 1 . 1 1 9 9 HIS CA C 9 58.680 58.680 57.202 1.478 19694
39 1 1 . 1 1 9 9 HIS CB C 9 31.040 31.040 30.008 1.032 19694
40 1 1 . 1 1 9 9 HIS H H 9 9.270 9.270 7.988 1.282 19694
41 1 1 . 1 1 10 10 CYS N N 10 118.600 118.600 116.977 1.623 19694
42 1 1 . 1 1 10 10 CYS HA H 10 4.600 4.600 4.506 0.094 19694
43 1 1 . 1 1 10 10 CYS CA C 10 59.600 59.600 58.995 0.605 19694
44 1 1 . 1 1 10 10 CYS CB C 10 32.330 32.330 28.052 4.278 19694
45 1 1 . 1 1 10 10 CYS H H 10 8.550 8.550 7.821 0.729 19694
46 1 1 . 1 1 11 11 ASN N N 11 116.220 116.220 118.452 -2.232 19694
47 1 1 . 1 1 11 11 ASN HA H 11 4.410 4.410 4.353 0.057 19694
48 1 1 . 1 1 11 11 ASN CA C 11 55.640 55.640 54.539 1.101 19694
49 1 1 . 1 1 11 11 ASN CB C 11 38.200 38.200 37.833 0.367 19694
50 1 1 . 1 1 11 11 ASN H H 11 7.690 7.690 8.641 -0.951 19694
51 1 1 . 1 1 12 12 GLU N N 12 120.330 120.330 117.641 2.689 19694
52 1 1 . 1 1 12 12 GLU HA H 12 4.220 4.220 4.517 -0.297 19694
53 1 1 . 1 1 12 12 GLU CA C 12 56.700 56.700 55.151 1.549 19694
54 1 1 . 1 1 12 12 GLU CB C 12 30.910 30.910 30.695 0.215 19694
55 1 1 . 1 1 12 12 GLU H H 12 8.210 8.210 7.648 0.562 19694
56 1 1 . 1 1 13 13 SER N N 13 116.190 116.190 120.253 -4.063 19694
57 1 1 . 1 1 13 13 SER HA H 13 4.060 4.060 4.319 -0.259 19694
58 1 1 . 1 1 13 13 SER CA C 13 59.350 59.350 58.398 0.952 19694
59 1 1 . 1 1 13 13 SER CB C 13 63.820 63.820 63.596 0.224 19694
60 1 1 . 1 1 13 13 SER H H 13 8.520 8.520 8.692 -0.172 19694
61 1 1 . 1 1 14 14 LEU N N 14 126.060 126.060 126.448 -0.388 19694
62 1 1 . 1 1 14 14 LEU HA H 14 4.310 4.310 4.351 -0.041 19694
63 1 1 . 1 1 14 14 LEU CA C 14 54.100 54.100 55.911 -1.811 19694
64 1 1 . 1 1 14 14 LEU CB C 14 42.200 42.200 41.658 0.542 19694
65 1 1 . 1 1 14 14 LEU H H 14 8.910 8.910 7.792 1.118 19694
66 1 1 . 1 1 15 15 PHE N N 15 120.660 120.660 121.379 -0.719 19694
67 1 1 . 1 1 15 15 PHE HA H 15 4.480 4.480 4.583 -0.103 19694
68 1 1 . 1 1 15 15 PHE CA C 15 60.400 60.400 56.216 4.184 19694
69 1 1 . 1 1 15 15 PHE CB C 15 38.130 38.130 37.555 0.575 19694
70 1 1 . 1 1 15 15 PHE H H 15 7.820 7.820 8.619 -0.799 19694
71 1 1 . 1 1 16 16 GLY N N 16 114.730 114.730 110.681 4.049 19694
72 1 1 . 1 1 16 16 GLY CA C 16 45.900 45.900 45.858 0.042 19694
73 1 1 . 1 1 16 16 GLY H H 16 8.860 8.860 8.534 0.326 19694
74 1 1 . 1 1 17 17 LYS N N 17 119.580 119.580 119.760 -0.180 19694
75 1 1 . 1 1 17 17 LYS HA H 17 4.480 4.480 4.467 0.013 19694
76 1 1 . 1 1 17 17 LYS CA C 17 54.460 54.460 54.609 -0.150 19694
77 1 1 . 1 1 17 17 LYS CB C 17 35.800 35.800 33.961 1.839 19694
78 1 1 . 1 1 17 17 LYS H H 17 8.030 8.030 7.254 0.776 19694
79 1 1 . 1 1 18 18 LYS N N 18 120.330 120.330 121.978 -1.648 19694
80 1 1 . 1 1 18 18 LYS HA H 18 4.280 4.280 4.329 -0.049 19694
81 1 1 . 1 1 18 18 LYS CA C 18 56.800 56.800 57.661 -0.861 19694
82 1 1 . 1 1 18 18 LYS CB C 18 33.010 33.010 32.863 0.147 19694
83 1 1 . 1 1 18 18 LYS H H 18 8.190 8.190 8.511 -0.321 19694
84 1 1 . 1 1 19 19 TYR N N 19 117.500 117.500 114.245 3.255 19694
85 1 1 . 1 1 19 19 TYR HA H 19 5.240 5.240 4.769 0.471 19694
86 1 1 . 1 1 19 19 TYR CA C 19 55.340 55.340 56.416 -1.076 19694
87 1 1 . 1 1 19 19 TYR CB C 19 42.850 42.850 40.390 2.460 19694
88 1 1 . 1 1 19 19 TYR H H 19 7.610 7.610 7.816 -0.206 19694
89 1 1 . 1 1 20 20 ILE N N 20 121.430 121.430 121.978 -0.548 19694
90 1 1 . 1 1 20 20 ILE HA H 20 4.137 4.137 4.250 -0.113 19694
91 1 1 . 1 1 20 20 ILE CA C 20 60.010 60.010 60.116 -0.106 19694
92 1 1 . 1 1 20 20 ILE CB C 20 41.570 41.570 40.587 0.983 19694
93 1 1 . 1 1 20 20 ILE H H 20 9.350 9.350 8.229 1.121 19694
94 1 1 . 1 1 21 21 LEU N N 21 126.720 126.720 127.143 -0.423 19694
95 1 1 . 1 1 21 21 LEU HA H 21 5.090 5.090 4.532 0.558 19694
96 1 1 . 1 1 21 21 LEU CA C 21 54.020 54.020 54.278 -0.258 19694
97 1 1 . 1 1 21 21 LEU CB C 21 43.720 43.720 40.436 3.284 19694
98 1 1 . 1 1 21 21 LEU H H 21 8.530 8.530 8.531 -0.001 19694
99 1 1 . 1 1 22 22 ARG N N 22 123.930 123.930 125.157 -1.227 19694
100 1 1 . 1 1 22 22 ARG HA H 22 4.440 4.440 4.427 0.013 19694
101 1 1 . 1 1 22 22 ARG CA C 22 55.600 55.600 53.871 1.729 19694
102 1 1 . 1 1 22 22 ARG CB C 22 32.280 32.280 32.035 0.245 19694
103 1 1 . 1 1 22 22 ARG H H 22 9.080 9.080 9.012 0.068 19694
104 1 1 . 1 1 23 23 GLU N N 23 128.500 128.500 124.710 3.790 19694
105 1 1 . 1 1 23 23 GLU HA H 23 3.840 3.840 3.886 -0.046 19694
106 1 1 . 1 1 23 23 GLU CA C 23 58.030 58.030 57.420 0.610 19694
107 1 1 . 1 1 23 23 GLU CB C 23 27.200 27.200 27.706 -0.506 19694
108 1 1 . 1 1 23 23 GLU H H 23 9.610 9.610 8.962 0.648 19694
109 1 1 . 1 1 24 24 GLU N N 24 110.300 110.300 112.424 -2.124 19694
110 1 1 . 1 1 24 24 GLU HA H 24 3.780 3.780 3.901 -0.121 19694
111 1 1 . 1 1 24 24 GLU CA C 24 58.320 58.320 57.442 0.878 19694
112 1 1 . 1 1 24 24 GLU CB C 24 28.220 28.220 28.194 0.026 19694
113 1 1 . 1 1 24 24 GLU H H 24 8.660 8.660 8.569 0.091 19694
114 1 1 . 1 1 25 25 SER N N 25 117.700 117.700 113.445 4.255 19694
115 1 1 . 1 1 25 25 SER HA H 25 4.890 4.890 4.879 0.011 19694
116 1 1 . 1 1 25 25 SER CA C 25 56.540 56.540 55.159 1.381 19694
117 1 1 . 1 1 25 25 SER CB C 25 64.720 64.720 65.067 -0.347 19694
118 1 1 . 1 1 25 25 SER H H 25 7.900 7.900 7.826 0.074 19694
119 1 1 . 1 1 26 26 PRO HA H 26 4.995 4.995 4.848 0.147 19694
120 1 1 . 1 1 26 26 PRO CA C 26 61.750 61.750 63.090 -1.340 19694
121 1 1 . 1 1 26 26 PRO CB C 26 32.660 32.660 31.863 0.797 19694
122 1 1 . 1 1 27 27 TYR N N 27 118.100 118.100 123.686 -5.586 19694
123 1 1 . 1 1 27 27 TYR HA H 27 5.910 5.910 4.975 0.935 19694
124 1 1 . 1 1 27 27 TYR CA C 27 56.830 56.830 55.265 1.565 19694
125 1 1 . 1 1 27 27 TYR CB C 27 42.810 42.810 42.677 0.133 19694
126 1 1 . 1 1 27 27 TYR H H 27 9.040 9.040 8.945 0.095 19694
127 1 1 . 1 1 28 28 CYS N N 28 122.230 122.230 119.511 2.719 19694
128 1 1 . 1 1 28 28 CYS HA H 28 4.850 4.850 4.688 0.162 19694
129 1 1 . 1 1 28 28 CYS CA C 28 58.110 58.110 58.380 -0.270 19694
130 1 1 . 1 1 28 28 CYS CB C 28 30.530 30.530 29.193 1.337 19694
131 1 1 . 1 1 28 28 CYS H H 28 9.850 9.850 8.359 1.491 19694
132 1 1 . 1 1 29 29 VAL N N 29 118.200 118.200 122.746 -4.546 19694
133 1 1 . 1 1 29 29 VAL HA H 29 3.650 3.650 3.693 -0.043 19694
134 1 1 . 1 1 29 29 VAL CA C 29 67.400 67.400 66.647 0.753 19694
135 1 1 . 1 1 29 29 VAL CB C 29 31.860 31.860 31.053 0.807 19694
136 1 1 . 1 1 29 29 VAL H H 29 8.430 8.430 9.044 -0.614 19694
137 1 1 . 1 1 30 30 VAL N N 30 119.570 119.570 118.862 0.708 19694
138 1 1 . 1 1 30 30 VAL HA H 30 3.860 3.860 3.543 0.317 19694
139 1 1 . 1 1 30 30 VAL CA C 30 66.450 66.450 66.302 0.148 19694
140 1 1 . 1 1 30 30 VAL CB C 30 31.540 31.540 31.123 0.417 19694
141 1 1 . 1 1 30 30 VAL H H 30 7.700 7.700 8.244 -0.544 19694
142 1 1 . 1 1 31 31 CYS N N 31 125.890 125.890 119.183 6.707 19694
143 1 1 . 1 1 31 31 CYS HA H 31 3.830 3.830 3.907 -0.077 19694
144 1 1 . 1 1 31 31 CYS CA C 31 65.850 65.850 64.231 1.619 19694
145 1 1 . 1 1 31 31 CYS CB C 31 29.510 29.510 25.501 4.009 19694
146 1 1 . 1 1 31 31 CYS H H 31 9.050 9.050 7.638 1.412 19694
147 1 1 . 1 1 32 32 PHE N N 32 119.000 119.000 119.273 -0.273 19694
148 1 1 . 1 1 32 32 PHE HA H 32 3.780 3.780 3.709 0.071 19694
149 1 1 . 1 1 32 32 PHE CA C 32 62.610 62.610 61.871 0.739 19694
150 1 1 . 1 1 32 32 PHE CB C 32 39.920 39.920 39.055 0.865 19694
151 1 1 . 1 1 32 32 PHE H H 32 9.080 9.080 7.895 1.185 19694
152 1 1 . 1 1 33 33 GLU N N 33 117.470 117.470 118.334 -0.864 19694
153 1 1 . 1 1 33 33 GLU HA H 33 3.760 3.760 4.015 -0.255 19694
154 1 1 . 1 1 33 33 GLU CA C 33 59.210 59.210 59.418 -0.208 19694
155 1 1 . 1 1 33 33 GLU CB C 33 29.480 29.480 29.437 0.043 19694
156 1 1 . 1 1 33 33 GLU H H 33 8.510 8.510 8.067 0.443 19694
157 1 1 . 1 1 34 34 THR N N 34 114.140 114.140 115.295 -1.155 19694
158 1 1 . 1 1 34 34 THR HA H 34 3.730 3.730 3.909 -0.179 19694
159 1 1 . 1 1 34 34 THR CA C 34 65.890 65.890 66.033 -0.143 19694
160 1 1 . 1 1 34 34 THR CB C 34 69.210 69.210 68.773 0.437 19694
161 1 1 . 1 1 34 34 THR H H 34 7.880 7.880 8.195 -0.315 19694
162 1 1 . 1 1 35 35 LEU N N 35 117.980 117.980 118.936 -0.956 19694
163 1 1 . 1 1 35 35 LEU HA H 35 3.650 3.650 3.973 -0.323 19694
164 1 1 . 1 1 35 35 LEU CA C 35 56.860 56.860 57.214 -0.354 19694
165 1 1 . 1 1 35 35 LEU CB C 35 41.870 41.870 41.829 0.041 19694
166 1 1 . 1 1 35 35 LEU H H 35 7.660 7.660 7.742 -0.082 19694
167 1 1 . 1 1 36 36 PHE N N 36 113.900 113.900 113.117 0.783 19694
168 1 1 . 1 1 36 36 PHE HA H 36 4.597 4.597 4.516 0.081 19694
169 1 1 . 1 1 36 36 PHE CA C 36 56.860 56.860 56.122 0.738 19694
170 1 1 . 1 1 36 36 PHE CB C 36 40.570 40.570 38.394 2.176 19694
171 1 1 . 1 1 36 36 PHE H H 36 7.730 7.730 6.697 1.033 19694
172 1 1 . 1 1 37 37 ALA N N 37 121.920 121.920 123.098 -1.178 19694
173 1 1 . 1 1 37 37 ALA HA H 37 4.070 4.070 4.101 -0.031 19694
174 1 1 . 1 1 37 37 ALA CA C 37 52.900 52.900 52.163 0.737 19694
175 1 1 . 1 1 37 37 ALA CB C 37 19.770 19.770 19.620 0.150 19694
176 1 1 . 1 1 37 37 ALA H H 37 7.090 7.090 7.920 -0.830 19694
177 1 1 . 1 1 38 38 ASN N N 38 119.230 119.230 120.230 -1.000 19694
178 1 1 . 1 1 38 38 ASN HA H 38 4.450 4.450 4.640 -0.190 19694
179 1 1 . 1 1 38 38 ASN CA C 38 52.850 52.850 52.547 0.303 19694
180 1 1 . 1 1 38 38 ASN CB C 38 38.950 38.950 40.415 -1.465 19694
181 1 1 . 1 1 38 38 ASN H H 38 8.790 8.790 8.265 0.525 19694
182 1 1 . 1 1 39 39 THR N N 39 116.330 116.330 115.645 0.685 19694
183 1 1 . 1 1 39 39 THR HA H 39 3.990 3.990 4.275 -0.285 19694
184 1 1 . 1 1 39 39 THR CA C 39 62.130 62.130 62.450 -0.320 19694
185 1 1 . 1 1 39 39 THR CB C 39 69.920 69.920 69.864 0.056 19694
186 1 1 . 1 1 39 39 THR H H 39 8.540 8.540 8.197 0.343 19694
187 1 1 . 1 1 40 40 CYS N N 40 126.950 126.950 127.802 -0.852 19694
188 1 1 . 1 1 40 40 CYS HA H 40 4.300 4.300 4.485 -0.185 19694
189 1 1 . 1 1 40 40 CYS CA C 40 58.350 58.350 57.070 1.280 19694
190 1 1 . 1 1 40 40 CYS CB C 40 31.600 31.600 26.717 4.883 19694
191 1 1 . 1 1 40 40 CYS H H 40 7.940 7.940 8.548 -0.608 19694
192 1 1 . 1 1 41 41 GLU N N 41 130.560 130.560 127.572 2.988 19694
193 1 1 . 1 1 41 41 GLU HA H 41 3.690 3.690 3.845 -0.155 19694
194 1 1 . 1 1 41 41 GLU CA C 41 58.600 58.600 59.121 -0.521 19694
195 1 1 . 1 1 41 41 GLU CB C 41 30.460 30.460 29.428 1.032 19694
196 1 1 . 1 1 41 41 GLU H H 41 8.810 8.810 8.692 0.118 19694
197 1 1 . 1 1 42 42 GLU N N 42 119.680 119.680 118.092 1.588 19694
198 1 1 . 1 1 42 42 GLU HA H 42 4.570 4.570 4.333 0.237 19694
199 1 1 . 1 1 42 42 GLU CA C 42 58.000 58.000 58.149 -0.149 19694
200 1 1 . 1 1 42 42 GLU CB C 42 31.680 31.680 30.634 1.046 19694
201 1 1 . 1 1 42 42 GLU H H 42 8.500 8.500 8.145 0.355 19694
202 1 1 . 1 1 43 43 CYS N N 43 115.600 115.600 116.245 -0.645 19694
203 1 1 . 1 1 43 43 CYS HA H 43 5.010 5.010 4.647 0.363 19694
204 1 1 . 1 1 43 43 CYS CA C 43 58.810 58.810 60.048 -1.238 19694
205 1 1 . 1 1 43 43 CYS CB C 43 31.580 31.580 29.589 1.991 19694
206 1 1 . 1 1 43 43 CYS H H 43 8.120 8.120 7.957 0.163 19694
207 1 1 . 1 1 44 44 GLY N N 44 112.100 112.100 107.758 4.342 19694
208 1 1 . 1 1 44 44 GLY CA C 44 46.420 46.420 45.203 1.217 19694
209 1 1 . 1 1 44 44 GLY H H 44 7.900 7.900 8.616 -0.716 19694
210 1 1 . 1 1 45 45 LYS N N 45 121.210 121.210 121.642 -0.432 19694
211 1 1 . 1 1 45 45 LYS HA H 45 4.840 4.840 4.685 0.155 19694
212 1 1 . 1 1 45 45 LYS CA C 45 54.360 54.360 52.802 1.558 19694
213 1 1 . 1 1 45 45 LYS CB C 45 32.430 32.430 32.807 -0.377 19694
214 1 1 . 1 1 45 45 LYS H H 45 8.180 8.180 7.855 0.325 19694
215 1 1 . 1 1 46 46 PRO HA H 46 4.477 4.477 4.531 -0.054 19694
216 1 1 . 1 1 46 46 PRO CA C 46 62.700 62.700 63.037 -0.337 19694
217 1 1 . 1 1 46 46 PRO CB C 46 32.490 32.490 32.041 0.449 19694
218 1 1 . 1 1 47 47 ILE N N 47 125.280 125.280 123.117 2.163 19694
219 1 1 . 1 1 47 47 ILE HA H 47 3.830 3.830 4.324 -0.494 19694
220 1 1 . 1 1 47 47 ILE CA C 47 61.040 61.040 60.791 0.249 19694
221 1 1 . 1 1 47 47 ILE CB C 47 37.440 37.440 37.790 -0.350 19694
222 1 1 . 1 1 47 47 ILE H H 47 8.540 8.540 8.898 -0.358 19694
223 1 1 . 1 1 48 48 GLY N N 48 114.120 114.120 113.595 0.525 19694
224 1 1 . 1 1 48 48 GLY CA C 48 45.240 45.240 44.599 0.641 19694
225 1 1 . 1 1 48 48 GLY H H 48 8.660 8.660 8.594 0.066 19694
226 1 1 . 1 1 49 49 CYS N N 49 117.140 117.140 120.303 -3.163 19694
227 1 1 . 1 1 49 49 CYS HA H 49 4.280 4.280 4.302 -0.022 19694
228 1 1 . 1 1 49 49 CYS CA C 49 60.880 60.880 60.182 0.698 19694
229 1 1 . 1 1 49 49 CYS CB C 49 27.650 27.650 27.325 0.325 19694
230 1 1 . 1 1 49 49 CYS H H 49 9.210 9.210 8.856 0.354 19694
231 1 1 . 1 1 50 50 ASP N N 50 119.300 119.300 120.997 -1.697 19694
232 1 1 . 1 1 50 50 ASP HA H 50 4.620 4.620 4.652 -0.032 19694
233 1 1 . 1 1 50 50 ASP CA C 50 54.160 54.160 55.267 -1.107 19694
234 1 1 . 1 1 50 50 ASP CB C 50 40.380 40.380 40.522 -0.142 19694
235 1 1 . 1 1 50 50 ASP H H 50 8.800 8.800 8.505 0.295 19694
236 1 1 . 1 1 51 51 CYS N N 51 118.150 118.150 116.972 1.178 19694
237 1 1 . 1 1 51 51 CYS HA H 51 4.620 4.620 4.678 -0.058 19694
238 1 1 . 1 1 51 51 CYS CA C 51 58.030 58.030 57.154 0.876 19694
239 1 1 . 1 1 51 51 CYS CB C 51 30.090 30.090 31.542 -1.452 19694
240 1 1 . 1 1 51 51 CYS H H 51 7.590 7.590 7.405 0.185 19694
241 1 1 . 1 1 52 52 LYS N N 52 123.800 123.800 122.829 0.971 19694
242 1 1 . 1 1 52 52 LYS HA H 52 4.180 4.180 4.388 -0.208 19694
243 1 1 . 1 1 52 52 LYS CA C 52 57.240 57.240 55.789 1.450 19694
244 1 1 . 1 1 52 52 LYS CB C 52 33.030 33.030 30.782 2.248 19694
245 1 1 . 1 1 52 52 LYS H H 52 8.600 8.600 8.562 0.038 19694
246 1 1 . 1 1 53 53 ASP N N 53 124.900 124.900 123.728 1.172 19694
247 1 1 . 1 1 53 53 ASP HA H 53 4.230 4.230 4.727 -0.497 19694
248 1 1 . 1 1 53 53 ASP CA C 53 53.130 53.130 53.028 0.102 19694
249 1 1 . 1 1 53 53 ASP CB C 53 42.230 42.230 40.510 1.720 19694
250 1 1 . 1 1 53 53 ASP H H 53 8.250 8.250 8.324 -0.074 19694
251 1 1 . 1 1 54 54 LEU N N 54 130.160 130.160 125.065 5.095 19694
252 1 1 . 1 1 54 54 LEU HA H 54 4.440 4.440 4.569 -0.129 19694
253 1 1 . 1 1 54 54 LEU CA C 54 53.340 53.340 55.450 -2.110 19694
254 1 1 . 1 1 54 54 LEU CB C 54 41.170 41.170 43.111 -1.940 19694
255 1 1 . 1 1 54 54 LEU H H 54 8.670 8.670 9.019 -0.349 19694
256 1 1 . 1 1 55 55 SER N N 55 113.820 113.820 121.370 -7.550 19694
257 1 1 . 1 1 55 55 SER HA H 55 5.580 5.580 4.942 0.638 19694
258 1 1 . 1 1 55 55 SER CA C 55 55.850 55.850 56.392 -0.542 19694
259 1 1 . 1 1 55 55 SER CB C 55 67.300 67.300 64.240 3.061 19694
260 1 1 . 1 1 55 55 SER H H 55 8.160 8.160 8.451 -0.291 19694
261 1 1 . 1 1 56 56 TYR N N 56 122.610 122.610 126.381 -3.771 19694
262 1 1 . 1 1 56 56 TYR HA H 56 4.620 4.620 4.612 0.008 19694
263 1 1 . 1 1 56 56 TYR CA C 56 58.810 58.810 58.760 0.050 19694
264 1 1 . 1 1 56 56 TYR CB C 56 41.000 41.000 41.856 -0.856 19694
265 1 1 . 1 1 56 56 TYR H H 56 8.450 8.450 8.643 -0.193 19694
266 1 1 . 1 1 57 57 LYS N N 57 126.020 126.020 129.380 -3.360 19694
267 1 1 . 1 1 57 57 LYS HA H 57 3.470 3.470 3.906 -0.436 19694
268 1 1 . 1 1 57 57 LYS CA C 57 58.100 58.100 57.294 0.806 19694
269 1 1 . 1 1 57 57 LYS CB C 57 29.480 29.480 32.045 -2.565 19694
270 1 1 . 1 1 57 57 LYS H H 57 8.920 8.920 8.704 0.216 19694
271 1 1 . 1 1 58 58 ASP HA H 58 3.830 3.830 4.225 -0.395 19694
272 1 1 . 1 1 58 58 ASP CA C 58 54.900 54.900 55.386 -0.486 19694
273 1 1 . 1 1 58 58 ASP CB C 58 40.080 40.080 40.884 -0.804 19694
274 1 1 . 1 1 58 58 ASP H H 58 8.400 8.400 8.585 -0.185 19694
275 1 1 . 1 1 59 59 ARG N N 59 121.190 121.190 115.903 5.287 19694
276 1 1 . 1 1 59 59 ARG HA H 59 4.250 4.250 4.640 -0.390 19694
277 1 1 . 1 1 59 59 ARG CA C 59 55.580 55.580 54.277 1.303 19694
278 1 1 . 1 1 59 59 ARG CB C 59 33.460 33.460 33.551 -0.091 19694
279 1 1 . 1 1 59 59 ARG H H 59 7.980 7.980 7.265 0.715 19694
280 1 1 . 1 1 60 60 HIS N N 60 118.420 118.420 117.580 0.840 19694
281 1 1 . 1 1 60 60 HIS HA H 60 5.270 5.270 5.657 -0.387 19694
282 1 1 . 1 1 60 60 HIS CA C 60 55.010 55.010 55.202 -0.192 19694
283 1 1 . 1 1 60 60 HIS CB C 60 32.380 32.380 33.482 -1.102 19694
284 1 1 . 1 1 60 60 HIS H H 60 8.350 8.350 8.154 0.196 19694
285 1 1 . 1 1 61 61 TRP N N 61 119.990 119.990 118.185 1.805 19694
286 1 1 . 1 1 61 61 TRP HA H 61 5.930 5.930 4.802 1.128 19694
287 1 1 . 1 1 61 61 TRP CA C 61 57.400 57.400 57.150 0.251 19694
288 1 1 . 1 1 61 61 TRP CB C 61 35.380 35.380 34.193 1.187 19694
289 1 1 . 1 1 61 61 TRP H H 61 9.310 9.310 9.262 0.048 19694
290 1 1 . 1 1 62 62 HIS N N 62 117.270 117.270 122.053 -4.783 19694
291 1 1 . 1 1 62 62 HIS HA H 62 4.600 4.600 4.852 -0.252 19694
292 1 1 . 1 1 62 62 HIS CA C 62 59.210 59.210 57.676 1.534 19694
293 1 1 . 1 1 62 62 HIS CB C 62 31.200 31.200 30.550 0.649 19694
294 1 1 . 1 1 62 62 HIS H H 62 8.430 8.430 9.133 -0.703 19694
295 1 1 . 1 1 63 63 GLU N N 63 124.640 124.640 128.595 -3.955 19694
296 1 1 . 1 1 63 63 GLU HA H 63 3.827 3.827 4.028 -0.201 19694
297 1 1 . 1 1 63 63 GLU CA C 63 61.020 61.020 59.211 1.809 19694
298 1 1 . 1 1 63 63 GLU CB C 63 30.310 30.310 29.823 0.486 19694
299 1 1 . 1 1 63 63 GLU H H 63 9.040 9.040 8.215 0.825 19694
300 1 1 . 1 1 64 64 ALA N N 64 117.050 117.050 118.093 -1.043 19694
301 1 1 . 1 1 64 64 ALA HA H 64 4.230 4.230 4.398 -0.168 19694
302 1 1 . 1 1 64 64 ALA CA C 64 54.000 54.000 53.139 0.861 19694
303 1 1 . 1 1 64 64 ALA CB C 64 18.880 18.880 18.993 -0.113 19694
304 1 1 . 1 1 64 64 ALA H H 64 8.680 8.680 8.328 0.352 19694
305 1 1 . 1 1 65 65 CYS N N 65 115.380 115.380 117.274 -1.894 19694
306 1 1 . 1 1 65 65 CYS HA H 65 4.295 4.295 4.692 -0.397 19694
307 1 1 . 1 1 65 65 CYS CA C 65 59.850 59.850 60.747 -0.897 19694
308 1 1 . 1 1 65 65 CYS CB C 65 32.840 32.840 27.605 5.235 19694
309 1 1 . 1 1 65 65 CYS H H 65 7.490 7.490 8.269 -0.779 19694
310 1 1 . 1 1 66 66 PHE N N 66 122.020 122.020 122.996 -0.976 19694
311 1 1 . 1 1 66 66 PHE HA H 66 3.890 3.890 3.906 -0.016 19694
312 1 1 . 1 1 66 66 PHE CA C 66 57.010 57.010 58.669 -1.659 19694
313 1 1 . 1 1 66 66 PHE CB C 66 38.070 38.070 38.083 -0.013 19694
314 1 1 . 1 1 66 66 PHE H H 66 7.110 7.110 7.769 -0.659 19694
315 1 1 . 1 1 67 67 HIS N N 67 121.280 121.280 120.952 0.328 19694
316 1 1 . 1 1 67 67 HIS HA H 67 4.720 4.720 5.286 -0.566 19694
317 1 1 . 1 1 67 67 HIS CA C 67 52.730 52.730 53.820 -1.090 19694
318 1 1 . 1 1 67 67 HIS CB C 67 32.230 32.230 31.991 0.239 19694
319 1 1 . 1 1 67 67 HIS H H 67 7.380 7.380 7.115 0.265 19694
320 1 1 . 1 1 68 68 CYS N N 68 121.590 121.590 119.445 2.145 19694
321 1 1 . 1 1 68 68 CYS HA H 68 3.960 3.960 4.808 -0.848 19694
322 1 1 . 1 1 68 68 CYS CA C 68 59.790 59.790 58.087 1.703 19694
323 1 1 . 1 1 68 68 CYS CB C 68 31.200 31.200 29.585 1.615 19694
324 1 1 . 1 1 68 68 CYS H H 68 8.530 8.530 8.600 -0.070 19694
325 1 1 . 1 1 69 69 SER N N 69 126.530 126.530 120.034 6.496 19694
326 1 1 . 1 1 69 69 SER HA H 69 4.310 4.310 4.419 -0.109 19694
327 1 1 . 1 1 69 69 SER CA C 69 61.760 61.760 60.597 1.163 19694
328 1 1 . 1 1 69 69 SER CB C 69 64.040 64.040 63.398 0.642 19694
329 1 1 . 1 1 69 69 SER H H 69 9.460 9.460 8.672 0.788 19694
330 1 1 . 1 1 70 70 GLN N N 70 122.370 122.370 118.509 3.861 19694
331 1 1 . 1 1 70 70 GLN HA H 70 4.510 4.510 4.547 -0.037 19694
332 1 1 . 1 1 70 70 GLN CA C 70 57.840 57.840 57.520 0.320 19694
333 1 1 . 1 1 70 70 GLN CB C 70 30.430 30.430 29.710 0.720 19694
334 1 1 . 1 1 70 70 GLN H H 70 8.980 8.980 7.975 1.005 19694
335 1 1 . 1 1 71 71 CYS N N 71 118.860 118.860 115.460 3.400 19694
336 1 1 . 1 1 71 71 CYS HA H 71 4.720 4.720 4.652 0.068 19694
337 1 1 . 1 1 71 71 CYS CA C 71 59.770 59.770 58.427 1.343 19694
338 1 1 . 1 1 71 71 CYS CB C 71 31.910 31.910 27.447 4.463 19694
339 1 1 . 1 1 71 71 CYS H H 71 8.220 8.220 7.757 0.463 19694
340 1 1 . 1 1 72 72 ARG N N 72 114.380 114.380 115.739 -1.359 19694
341 1 1 . 1 1 72 72 ARG HA H 72 3.965 3.965 3.984 -0.019 19694
342 1 1 . 1 1 72 72 ARG CA C 72 58.030 58.030 57.274 0.756 19694
343 1 1 . 1 1 72 72 ARG CB C 72 27.720 27.720 27.016 0.704 19694
344 1 1 . 1 1 72 72 ARG H H 72 7.380 7.380 7.883 -0.503 19694
345 1 1 . 1 1 73 73 ASN N N 73 121.480 121.480 116.431 5.049 19694
346 1 1 . 1 1 73 73 ASN HA H 73 4.630 4.630 4.657 -0.027 19694
347 1 1 . 1 1 73 73 ASN CA C 73 54.110 54.110 53.925 0.185 19694
348 1 1 . 1 1 73 73 ASN CB C 73 38.870 38.870 39.706 -0.836 19694
349 1 1 . 1 1 73 73 ASN H H 73 8.722 8.722 8.177 0.545 19694
350 1 1 . 1 1 74 74 SER N N 74 114.710 114.710 117.521 -2.811 19694
351 1 1 . 1 1 74 74 SER HA H 74 4.060 4.060 4.870 -0.810 19694
352 1 1 . 1 1 74 74 SER CA C 74 59.357 59.357 58.288 1.069 19694
353 1 1 . 1 1 74 74 SER CB C 74 63.300 63.300 62.970 0.330 19694
354 1 1 . 1 1 74 74 SER H H 74 8.690 8.690 8.501 0.189 19694
355 1 1 . 1 1 75 75 LEU N N 75 125.757 125.757 127.073 -1.316 19694
356 1 1 . 1 1 75 75 LEU HA H 75 4.280 4.280 4.282 -0.002 19694
357 1 1 . 1 1 75 75 LEU CA C 75 53.510 53.510 54.833 -1.323 19694
358 1 1 . 1 1 75 75 LEU CB C 75 42.200 42.200 41.693 0.507 19694
359 1 1 . 1 1 75 75 LEU H H 75 7.970 7.970 8.030 -0.061 19694
360 1 1 . 1 1 76 76 VAL N N 76 120.860 120.860 124.975 -4.115 19694
361 1 1 . 1 1 76 76 VAL HA H 76 3.570 3.570 3.865 -0.295 19694
362 1 1 . 1 1 76 76 VAL CA C 76 65.420 65.420 60.881 4.539 19694
363 1 1 . 1 1 76 76 VAL CB C 76 31.540 31.540 34.741 -3.201 19694
364 1 1 . 1 1 76 76 VAL H H 76 7.830 7.830 8.011 -0.181 19694
365 1 1 . 1 1 77 77 ASP N N 77 122.360 122.360 122.288 0.072 19694
366 1 1 . 1 1 77 77 ASP HA H 77 4.230 4.230 4.451 -0.221 19694
367 1 1 . 1 1 77 77 ASP CA C 77 56.200 56.200 55.849 0.351 19694
368 1 1 . 1 1 77 77 ASP CB C 77 39.380 39.380 40.863 -1.483 19694
369 1 1 . 1 1 77 77 ASP H H 77 8.910 8.910 8.592 0.318 19694
370 1 1 . 1 1 78 78 LYS N N 78 118.100 118.100 118.429 -0.329 19694
371 1 1 . 1 1 78 78 LYS HA H 78 4.870 4.870 4.638 0.232 19694
372 1 1 . 1 1 78 78 LYS CA C 78 56.960 56.960 53.672 3.288 19694
373 1 1 . 1 1 78 78 LYS CB C 78 34.680 34.680 33.744 0.936 19694
374 1 1 . 1 1 78 78 LYS H H 78 7.660 7.660 7.620 0.040 19694
375 1 1 . 1 1 79 79 PRO HA H 79 4.460 4.460 4.209 0.251 19694
376 1 1 . 1 1 79 79 PRO CA C 79 62.520 62.520 62.932 -0.412 19694
377 1 1 . 1 1 79 79 PRO CB C 79 32.160 32.160 31.860 0.299 19694
378 1 1 . 1 1 80 80 PHE N N 80 114.050 114.050 117.112 -3.062 19694
379 1 1 . 1 1 80 80 PHE HA H 80 4.910 4.910 5.051 -0.141 19694
380 1 1 . 1 1 80 80 PHE CA C 80 56.060 56.060 55.130 0.930 19694
381 1 1 . 1 1 80 80 PHE CB C 80 42.410 42.410 41.900 0.510 19694
382 1 1 . 1 1 80 80 PHE H H 80 7.510 7.510 7.216 0.294 19694
383 1 1 . 1 1 81 81 ALA N N 81 123.290 123.290 123.719 -0.429 19694
384 1 1 . 1 1 81 81 ALA HA H 81 4.310 4.310 4.338 -0.028 19694
385 1 1 . 1 1 81 81 ALA CA C 81 50.450 50.450 50.358 0.093 19694
386 1 1 . 1 1 81 81 ALA CB C 81 21.920 21.920 18.962 2.958 19694
387 1 1 . 1 1 81 81 ALA H H 81 9.030 9.030 8.945 0.085 19694
388 1 1 . 1 1 82 82 ALA N N 82 122.490 122.490 129.146 -6.656 19694
389 1 1 . 1 1 82 82 ALA HA H 82 5.110 5.110 4.364 0.746 19694
390 1 1 . 1 1 82 82 ALA CA C 82 51.100 51.100 51.669 -0.569 19694
391 1 1 . 1 1 82 82 ALA CB C 82 21.130 21.130 18.817 2.313 19694
392 1 1 . 1 1 82 82 ALA H H 82 8.240 8.240 8.617 -0.377 19694
393 1 1 . 1 1 83 83 LYS N N 83 123.580 123.580 125.935 -2.355 19694
394 1 1 . 1 1 83 83 LYS HA H 83 4.490 4.490 4.526 -0.036 19694
395 1 1 . 1 1 83 83 LYS CA C 83 55.800 55.800 55.365 0.435 19694
396 1 1 . 1 1 83 83 LYS CB C 83 34.720 34.720 34.110 0.610 19694
397 1 1 . 1 1 83 83 LYS H H 83 8.400 8.400 8.247 0.153 19694
398 1 1 . 1 1 84 84 GLU N N 84 125.470 125.470 120.349 5.121 19694
399 1 1 . 1 1 84 84 GLU HA H 84 3.820 3.820 4.115 -0.295 19694
400 1 1 . 1 1 84 84 GLU CA C 84 58.620 58.620 58.981 -0.361 19694
401 1 1 . 1 1 84 84 GLU CB C 84 27.210 27.210 29.719 -2.509 19694
402 1 1 . 1 1 84 84 GLU H H 84 9.320 9.320 8.792 0.528 19694
403 1 1 . 1 1 85 85 ASP N N 85 118.550 118.550 114.440 4.110 19694
404 1 1 . 1 1 85 85 ASP HA H 85 4.600 4.600 4.771 -0.171 19694
405 1 1 . 1 1 85 85 ASP CA C 85 55.400 55.400 53.841 1.559 19694
406 1 1 . 1 1 85 85 ASP CB C 85 40.400 40.400 42.128 -1.728 19694
407 1 1 . 1 1 85 85 ASP H H 85 8.730 8.730 8.365 0.365 19694
408 1 1 . 1 1 86 86 GLN N N 86 119.050 119.050 117.294 1.756 19694
409 1 1 . 1 1 86 86 GLN HA H 86 4.540 4.540 4.637 -0.097 19694
410 1 1 . 1 1 86 86 GLN CA C 86 55.100 55.100 54.003 1.097 19694
411 1 1 . 1 1 86 86 GLN CB C 86 31.110 31.110 32.041 -0.931 19694
412 1 1 . 1 1 86 86 GLN H H 86 8.170 8.170 7.562 0.608 19694
413 1 1 . 1 1 87 87 LEU N N 87 123.110 123.110 121.259 1.851 19694
414 1 1 . 1 1 87 87 LEU HA H 87 4.620 4.620 5.133 -0.513 19694
415 1 1 . 1 1 87 87 LEU CA C 87 54.520 54.520 53.952 0.568 19694
416 1 1 . 1 1 87 87 LEU CB C 87 42.700 42.700 44.468 -1.768 19694
417 1 1 . 1 1 87 87 LEU H H 87 8.490 8.490 8.445 0.045 19694
418 1 1 . 1 1 88 88 LEU N N 88 123.690 123.690 120.161 3.529 19694
419 1 1 . 1 1 88 88 LEU HA H 88 5.880 5.880 4.963 0.917 19694
420 1 1 . 1 1 88 88 LEU CA C 88 53.340 53.340 52.788 0.552 19694
421 1 1 . 1 1 88 88 LEU CB C 88 47.190 47.190 47.788 -0.598 19694
422 1 1 . 1 1 88 88 LEU H H 88 8.930 8.930 8.336 0.594 19694
423 1 1 . 1 1 89 89 CYS N N 89 122.270 122.270 118.521 3.749 19694
424 1 1 . 1 1 89 89 CYS HA H 89 4.780 4.780 4.774 0.006 19694
425 1 1 . 1 1 89 89 CYS CA C 89 57.640 57.640 59.039 -1.399 19694
426 1 1 . 1 1 89 89 CYS CB C 89 30.940 30.940 27.691 3.249 19694
427 1 1 . 1 1 89 89 CYS H H 89 9.430 9.430 9.099 0.331 19694
428 1 1 . 1 1 90 90 THR N N 90 110.620 110.620 116.537 -5.917 19694
429 1 1 . 1 1 90 90 THR HA H 90 3.900 3.900 4.009 -0.109 19694
430 1 1 . 1 1 90 90 THR CA C 90 65.460 65.460 65.923 -0.463 19694
431 1 1 . 1 1 90 90 THR CB C 90 68.670 68.670 69.070 -0.400 19694
432 1 1 . 1 1 90 90 THR H H 90 8.410 8.410 9.031 -0.621 19694
433 1 1 . 1 1 91 91 ASP N N 91 123.470 123.470 121.337 2.133 19694
434 1 1 . 1 1 91 91 ASP HA H 91 4.490 4.490 4.674 -0.184 19694
435 1 1 . 1 1 91 91 ASP CA C 91 57.810 57.810 57.541 0.269 19694
436 1 1 . 1 1 91 91 ASP CB C 91 41.160 41.160 40.654 0.506 19694
437 1 1 . 1 1 91 91 ASP H H 91 8.150 8.150 8.356 -0.206 19694
438 1 1 . 1 1 92 92 CYS N N 92 123.800 123.800 119.642 4.158 19694
439 1 1 . 1 1 92 92 CYS HA H 92 3.970 3.970 4.406 -0.436 19694
440 1 1 . 1 1 92 92 CYS CA C 92 64.100 64.100 61.335 2.765 19694
441 1 1 . 1 1 92 92 CYS CB C 92 30.090 30.090 26.207 3.883 19694
442 1 1 . 1 1 92 92 CYS H H 92 8.580 8.580 7.839 0.741 19694
443 1 1 . 1 1 93 93 TYR N N 93 120.730 120.730 120.946 -0.216 19694
444 1 1 . 1 1 93 93 TYR HA H 93 4.140 4.140 4.078 0.062 19694
445 1 1 . 1 1 93 93 TYR CA C 93 60.380 60.380 61.940 -1.560 19694
446 1 1 . 1 1 93 93 TYR CB C 93 39.300 39.300 38.418 0.882 19694
447 1 1 . 1 1 93 93 TYR H H 93 8.540 8.540 9.170 -0.630 19694
448 1 1 . 1 1 94 94 SER N N 94 115.010 115.010 112.584 2.426 19694
449 1 1 . 1 1 94 94 SER HA H 94 4.220 4.220 4.284 -0.064 19694
450 1 1 . 1 1 94 94 SER CA C 94 59.300 59.300 61.233 -1.933 19694
451 1 1 . 1 1 94 94 SER CB C 94 63.660 63.660 62.488 1.172 19694
452 1 1 . 1 1 94 94 SER H H 94 7.750 7.750 8.121 -0.371 19694
453 1 1 . 1 1 95 95 ASN N N 95 119.820 119.820 118.705 1.115 19694
454 1 1 . 1 1 95 95 ASN HA H 95 4.510 4.510 4.588 -0.078 19694
455 1 1 . 1 1 95 95 ASN CA C 95 53.880 53.880 55.518 -1.638 19694
456 1 1 . 1 1 95 95 ASN CB C 95 39.300 39.300 38.955 0.345 19694
457 1 1 . 1 1 95 95 ASN H H 95 7.780 7.780 7.997 -0.217 19694
458 1 1 . 1 1 96 96 GLU N N 96 119.820 119.820 117.303 2.517 19694
459 1 1 . 1 1 96 96 GLU HA H 96 4.096 4.096 4.167 -0.071 19694
460 1 1 . 1 1 96 96 GLU CA C 96 56.910 56.910 56.839 0.071 19694
461 1 1 . 1 1 96 96 GLU CB C 96 30.220 30.220 29.644 0.576 19694
462 1 1 . 1 1 96 96 GLU H H 96 7.950 7.950 7.748 0.202 19694
463 1 1 . 1 1 97 97 TYR N N 97 120.370 120.370 121.583 -1.213 19694
464 1 1 . 1 1 97 97 TYR HA H 97 4.620 4.620 3.954 0.666 19694
465 1 1 . 1 1 97 97 TYR CA C 97 57.700 57.700 60.224 -2.524 19694
466 1 1 . 1 1 97 97 TYR CB C 97 38.710 38.710 38.339 0.371 19694
467 1 1 . 1 1 97 97 TYR H H 97 8.070 8.070 8.511 -0.441 19694
468 1 2 . 1 1 2 2 THR N N 2 113.570 113.570 114.879 -1.309 19694
469 1 2 . 1 1 2 2 THR HA H 2 4.240 4.240 4.390 -0.150 19694
470 1 2 . 1 1 2 2 THR CA C 2 62.130 62.130 62.405 -0.275 19694
471 1 2 . 1 1 2 2 THR CB C 2 69.250 69.250 68.860 0.390 19694
472 1 2 . 1 1 2 2 THR H H 2 8.090 8.090 8.196 -0.106 19694
473 1 2 . 1 1 3 3 GLU N N 3 122.880 122.880 121.270 1.610 19694
474 1 2 . 1 1 3 3 GLU HA H 3 4.280 4.280 4.334 -0.054 19694
475 1 2 . 1 1 3 3 GLU CA C 3 56.860 56.860 56.075 0.785 19694
476 1 2 . 1 1 3 3 GLU CB C 3 30.570 30.570 30.469 0.101 19694
477 1 2 . 1 1 3 3 GLU H H 3 8.280 8.280 8.344 -0.064 19694
478 1 2 . 1 1 4 4 ARG N N 4 121.330 121.330 119.629 1.701 19694
479 1 2 . 1 1 4 4 ARG HA H 4 4.300 4.300 4.549 -0.249 19694
480 1 2 . 1 1 4 4 ARG CA C 4 55.870 55.870 55.379 0.491 19694
481 1 2 . 1 1 4 4 ARG CB C 4 31.640 31.640 30.680 0.960 19694
482 1 2 . 1 1 4 4 ARG H H 4 8.280 8.280 8.554 -0.274 19694
483 1 2 . 1 1 5 5 PHE N N 5 125.490 125.490 124.942 0.548 19694
484 1 2 . 1 1 5 5 PHE HA H 5 4.610 4.610 4.582 0.028 19694
485 1 2 . 1 1 5 5 PHE CA C 5 56.380 56.380 56.678 -0.298 19694
486 1 2 . 1 1 5 5 PHE CB C 5 39.560 39.560 39.761 -0.201 19694
487 1 2 . 1 1 5 5 PHE H H 5 8.290 8.290 8.720 -0.430 19694
488 1 2 . 1 1 6 6 ASP N N 6 123.260 123.260 121.527 1.733 19694
489 1 2 . 1 1 6 6 ASP HA H 6 5.045 5.045 4.759 0.286 19694
490 1 2 . 1 1 6 6 ASP CA C 6 52.180 52.180 53.067 -0.887 19694
491 1 2 . 1 1 6 6 ASP CB C 6 44.210 44.210 44.760 -0.550 19694
492 1 2 . 1 1 6 6 ASP H H 6 7.940 7.940 7.577 0.363 19694
493 1 2 . 1 1 7 7 CYS N N 7 121.440 121.440 122.460 -1.020 19694
494 1 2 . 1 1 7 7 CYS HA H 7 3.960 3.960 4.412 -0.452 19694
495 1 2 . 1 1 7 7 CYS CA C 7 59.820 59.820 59.423 0.397 19694
496 1 2 . 1 1 7 7 CYS CB C 7 30.950 30.950 26.292 4.658 19694
497 1 2 . 1 1 7 7 CYS H H 7 8.700 8.700 8.664 0.036 19694
498 1 2 . 1 1 8 8 HIS N N 8 129.390 129.390 129.987 -0.597 19694
499 1 2 . 1 1 8 8 HIS HA H 8 4.200 4.200 4.229 -0.029 19694
500 1 2 . 1 1 8 8 HIS CA C 8 58.240 58.240 59.786 -1.546 19694
501 1 2 . 1 1 8 8 HIS CB C 8 29.480 29.480 30.077 -0.597 19694
502 1 2 . 1 1 8 8 HIS H H 8 9.160 9.160 9.631 -0.471 19694
503 1 2 . 1 1 9 9 HIS N N 9 118.740 118.740 117.593 1.147 19694
504 1 2 . 1 1 9 9 HIS HA H 9 4.880 4.880 4.489 0.391 19694
505 1 2 . 1 1 9 9 HIS CA C 9 58.680 58.680 57.172 1.508 19694
506 1 2 . 1 1 9 9 HIS CB C 9 31.040 31.040 30.203 0.837 19694
507 1 2 . 1 1 9 9 HIS H H 9 9.270 9.270 7.985 1.285 19694
508 1 2 . 1 1 10 10 CYS N N 10 118.600 118.600 117.424 1.176 19694
509 1 2 . 1 1 10 10 CYS HA H 10 4.600 4.600 4.394 0.206 19694
510 1 2 . 1 1 10 10 CYS CA C 10 59.600 59.600 59.214 0.386 19694
511 1 2 . 1 1 10 10 CYS CB C 10 32.330 32.330 27.889 4.441 19694
512 1 2 . 1 1 10 10 CYS H H 10 8.550 8.550 7.854 0.696 19694
513 1 2 . 1 1 11 11 ASN N N 11 116.220 116.220 117.064 -0.844 19694
514 1 2 . 1 1 11 11 ASN HA H 11 4.410 4.410 4.346 0.064 19694
515 1 2 . 1 1 11 11 ASN CA C 11 55.640 55.640 54.459 1.181 19694
516 1 2 . 1 1 11 11 ASN CB C 11 38.200 38.200 36.464 1.736 19694
517 1 2 . 1 1 11 11 ASN H H 11 7.690 7.690 8.668 -0.978 19694
518 1 2 . 1 1 12 12 GLU N N 12 120.330 120.330 117.931 2.399 19694
519 1 2 . 1 1 12 12 GLU HA H 12 4.220 4.220 4.505 -0.285 19694
520 1 2 . 1 1 12 12 GLU CA C 12 56.700 56.700 54.981 1.719 19694
521 1 2 . 1 1 12 12 GLU CB C 12 30.910 30.910 31.058 -0.148 19694
522 1 2 . 1 1 12 12 GLU H H 12 8.210 8.210 7.666 0.544 19694
523 1 2 . 1 1 13 13 SER N N 13 116.190 116.190 119.586 -3.396 19694
524 1 2 . 1 1 13 13 SER HA H 13 4.060 4.060 4.525 -0.465 19694
525 1 2 . 1 1 13 13 SER CA C 13 59.350 59.350 59.241 0.109 19694
526 1 2 . 1 1 13 13 SER CB C 13 63.820 63.820 63.426 0.394 19694
527 1 2 . 1 1 13 13 SER H H 13 8.520 8.520 8.660 -0.140 19694
528 1 2 . 1 1 14 14 LEU N N 14 126.060 126.060 124.884 1.176 19694
529 1 2 . 1 1 14 14 LEU HA H 14 4.310 4.310 4.327 -0.017 19694
530 1 2 . 1 1 14 14 LEU CA C 14 54.100 54.100 55.573 -1.473 19694
531 1 2 . 1 1 14 14 LEU CB C 14 42.200 42.200 41.694 0.506 19694
532 1 2 . 1 1 14 14 LEU H H 14 8.910 8.910 7.767 1.143 19694
533 1 2 . 1 1 15 15 PHE N N 15 120.660 120.660 121.011 -0.351 19694
534 1 2 . 1 1 15 15 PHE HA H 15 4.480 4.480 4.604 -0.124 19694
535 1 2 . 1 1 15 15 PHE CA C 15 60.400 60.400 56.417 3.983 19694
536 1 2 . 1 1 15 15 PHE CB C 15 38.130 38.130 37.882 0.248 19694
537 1 2 . 1 1 15 15 PHE H H 15 7.820 7.820 8.501 -0.681 19694
538 1 2 . 1 1 16 16 GLY N N 16 114.730 114.730 110.959 3.771 19694
539 1 2 . 1 1 16 16 GLY CA C 16 45.900 45.900 45.799 0.101 19694
540 1 2 . 1 1 16 16 GLY H H 16 8.860 8.860 8.814 0.046 19694
541 1 2 . 1 1 17 17 LYS N N 17 119.580 119.580 120.206 -0.626 19694
542 1 2 . 1 1 17 17 LYS HA H 17 4.480 4.480 4.522 -0.042 19694
543 1 2 . 1 1 17 17 LYS CA C 17 54.460 54.460 54.454 0.006 19694
544 1 2 . 1 1 17 17 LYS CB C 17 35.800 35.800 34.323 1.477 19694
545 1 2 . 1 1 17 17 LYS H H 17 8.030 8.030 7.236 0.794 19694
546 1 2 . 1 1 18 18 LYS N N 18 120.330 120.330 122.288 -1.958 19694
547 1 2 . 1 1 18 18 LYS HA H 18 4.280 4.280 4.311 -0.031 19694
548 1 2 . 1 1 18 18 LYS CA C 18 56.800 56.800 57.487 -0.687 19694
549 1 2 . 1 1 18 18 LYS CB C 18 33.010 33.010 32.797 0.213 19694
550 1 2 . 1 1 18 18 LYS H H 18 8.190 8.190 8.463 -0.273 19694
551 1 2 . 1 1 19 19 TYR N N 19 117.500 117.500 115.366 2.134 19694
552 1 2 . 1 1 19 19 TYR HA H 19 5.240 5.240 4.825 0.415 19694
553 1 2 . 1 1 19 19 TYR CA C 19 55.340 55.340 56.309 -0.970 19694
554 1 2 . 1 1 19 19 TYR CB C 19 42.850 42.850 40.261 2.589 19694
555 1 2 . 1 1 19 19 TYR H H 19 7.610 7.610 7.874 -0.264 19694
556 1 2 . 1 1 20 20 ILE N N 20 121.430 121.430 121.934 -0.504 19694
557 1 2 . 1 1 20 20 ILE HA H 20 4.137 4.137 4.215 -0.078 19694
558 1 2 . 1 1 20 20 ILE CA C 20 60.010 60.010 60.053 -0.043 19694
559 1 2 . 1 1 20 20 ILE CB C 20 41.570 41.570 40.547 1.023 19694
560 1 2 . 1 1 20 20 ILE H H 20 9.350 9.350 8.276 1.074 19694
561 1 2 . 1 1 21 21 LEU N N 21 126.720 126.720 126.816 -0.096 19694
562 1 2 . 1 1 21 21 LEU HA H 21 5.090 5.090 4.511 0.579 19694
563 1 2 . 1 1 21 21 LEU CA C 21 54.020 54.020 54.311 -0.291 19694
564 1 2 . 1 1 21 21 LEU CB C 21 43.720 43.720 40.563 3.157 19694
565 1 2 . 1 1 21 21 LEU H H 21 8.530 8.530 8.498 0.032 19694
566 1 2 . 1 1 22 22 ARG N N 22 123.930 123.930 125.772 -1.842 19694
567 1 2 . 1 1 22 22 ARG HA H 22 4.440 4.440 4.542 -0.102 19694
568 1 2 . 1 1 22 22 ARG CA C 22 55.600 55.600 53.704 1.896 19694
569 1 2 . 1 1 22 22 ARG CB C 22 32.280 32.280 31.907 0.373 19694
570 1 2 . 1 1 22 22 ARG H H 22 9.080 9.080 9.118 -0.038 19694
571 1 2 . 1 1 23 23 GLU N N 23 128.500 128.500 125.041 3.459 19694
572 1 2 . 1 1 23 23 GLU HA H 23 3.840 3.840 3.908 -0.068 19694
573 1 2 . 1 1 23 23 GLU CA C 23 58.030 58.030 57.632 0.398 19694
574 1 2 . 1 1 23 23 GLU CB C 23 27.200 27.200 28.217 -1.017 19694
575 1 2 . 1 1 23 23 GLU H H 23 9.610 9.610 9.092 0.518 19694
576 1 2 . 1 1 24 24 GLU N N 24 110.300 110.300 113.309 -3.009 19694
577 1 2 . 1 1 24 24 GLU HA H 24 3.780 3.780 3.979 -0.199 19694
578 1 2 . 1 1 24 24 GLU CA C 24 58.320 58.320 57.369 0.951 19694
579 1 2 . 1 1 24 24 GLU CB C 24 28.220 28.220 27.759 0.461 19694
580 1 2 . 1 1 24 24 GLU H H 24 8.660 8.660 8.716 -0.056 19694
581 1 2 . 1 1 25 25 SER N N 25 117.700 117.700 112.937 4.763 19694
582 1 2 . 1 1 25 25 SER HA H 25 4.890 4.890 4.765 0.125 19694
583 1 2 . 1 1 25 25 SER CA C 25 56.540 56.540 55.484 1.056 19694
584 1 2 . 1 1 25 25 SER CB C 25 64.720 64.720 65.406 -0.686 19694
585 1 2 . 1 1 25 25 SER H H 25 7.900 7.900 7.812 0.088 19694
586 1 2 . 1 1 26 26 PRO HA H 26 4.995 4.995 4.816 0.179 19694
587 1 2 . 1 1 26 26 PRO CA C 26 61.750 61.750 63.136 -1.386 19694
588 1 2 . 1 1 26 26 PRO CB C 26 32.660 32.660 31.763 0.897 19694
589 1 2 . 1 1 27 27 TYR N N 27 118.100 118.100 124.059 -5.959 19694
590 1 2 . 1 1 27 27 TYR HA H 27 5.910 5.910 4.982 0.928 19694
591 1 2 . 1 1 27 27 TYR CA C 27 56.830 56.830 55.165 1.665 19694
592 1 2 . 1 1 27 27 TYR CB C 27 42.810 42.810 42.539 0.271 19694
593 1 2 . 1 1 27 27 TYR H H 27 9.040 9.040 8.772 0.268 19694
594 1 2 . 1 1 28 28 CYS N N 28 122.230 122.230 119.274 2.956 19694
595 1 2 . 1 1 28 28 CYS HA H 28 4.850 4.850 4.647 0.203 19694
596 1 2 . 1 1 28 28 CYS CA C 28 58.110 58.110 58.500 -0.390 19694
597 1 2 . 1 1 28 28 CYS CB C 28 30.530 30.530 29.026 1.504 19694
598 1 2 . 1 1 28 28 CYS H H 28 9.850 9.850 8.313 1.537 19694
599 1 2 . 1 1 29 29 VAL N N 29 118.200 118.200 123.100 -4.900 19694
600 1 2 . 1 1 29 29 VAL HA H 29 3.650 3.650 3.681 -0.031 19694
601 1 2 . 1 1 29 29 VAL CA C 29 67.400 67.400 67.268 0.132 19694
602 1 2 . 1 1 29 29 VAL CB C 29 31.860 31.860 31.248 0.612 19694
603 1 2 . 1 1 29 29 VAL H H 29 8.430 8.430 9.040 -0.610 19694
604 1 2 . 1 1 30 30 VAL N N 30 119.570 119.570 118.469 1.101 19694
605 1 2 . 1 1 30 30 VAL HA H 30 3.860 3.860 3.615 0.245 19694
606 1 2 . 1 1 30 30 VAL CA C 30 66.450 66.450 66.055 0.395 19694
607 1 2 . 1 1 30 30 VAL CB C 30 31.540 31.540 30.505 1.035 19694
608 1 2 . 1 1 30 30 VAL H H 30 7.700 7.700 8.255 -0.555 19694
609 1 2 . 1 1 31 31 CYS N N 31 125.890 125.890 119.645 6.245 19694
610 1 2 . 1 1 31 31 CYS HA H 31 3.830 3.830 3.927 -0.097 19694
611 1 2 . 1 1 31 31 CYS CA C 31 65.850 65.850 64.358 1.492 19694
612 1 2 . 1 1 31 31 CYS CB C 31 29.510 29.510 25.582 3.928 19694
613 1 2 . 1 1 31 31 CYS H H 31 9.050 9.050 7.624 1.426 19694
614 1 2 . 1 1 32 32 PHE N N 32 119.000 119.000 119.395 -0.395 19694
615 1 2 . 1 1 32 32 PHE HA H 32 3.780 3.780 3.775 0.005 19694
616 1 2 . 1 1 32 32 PHE CA C 32 62.610 62.610 61.803 0.807 19694
617 1 2 . 1 1 32 32 PHE CB C 32 39.920 39.920 39.099 0.821 19694
618 1 2 . 1 1 32 32 PHE H H 32 9.080 9.080 7.913 1.167 19694
619 1 2 . 1 1 33 33 GLU N N 33 117.470 117.470 118.054 -0.584 19694
620 1 2 . 1 1 33 33 GLU HA H 33 3.760 3.760 4.071 -0.311 19694
621 1 2 . 1 1 33 33 GLU CA C 33 59.210 59.210 59.400 -0.190 19694
622 1 2 . 1 1 33 33 GLU CB C 33 29.480 29.480 29.207 0.273 19694
623 1 2 . 1 1 33 33 GLU H H 33 8.510 8.510 8.357 0.153 19694
624 1 2 . 1 1 34 34 THR N N 34 114.140 114.140 114.941 -0.801 19694
625 1 2 . 1 1 34 34 THR HA H 34 3.730 3.730 4.019 -0.289 19694
626 1 2 . 1 1 34 34 THR CA C 34 65.890 65.890 65.519 0.370 19694
627 1 2 . 1 1 34 34 THR CB C 34 69.210 69.210 68.687 0.523 19694
628 1 2 . 1 1 34 34 THR H H 34 7.880 7.880 8.342 -0.462 19694
629 1 2 . 1 1 35 35 LEU N N 35 117.980 117.980 120.189 -2.209 19694
630 1 2 . 1 1 35 35 LEU HA H 35 3.650 3.650 3.880 -0.230 19694
631 1 2 . 1 1 35 35 LEU CA C 35 56.860 56.860 57.339 -0.479 19694
632 1 2 . 1 1 35 35 LEU CB C 35 41.870 41.870 41.727 0.142 19694
633 1 2 . 1 1 35 35 LEU H H 35 7.660 7.660 8.018 -0.358 19694
634 1 2 . 1 1 36 36 PHE N N 36 113.900 113.900 113.749 0.151 19694
635 1 2 . 1 1 36 36 PHE HA H 36 4.597 4.597 4.569 0.028 19694
636 1 2 . 1 1 36 36 PHE CA C 36 56.860 56.860 55.902 0.958 19694
637 1 2 . 1 1 36 36 PHE CB C 36 40.570 40.570 37.622 2.948 19694
638 1 2 . 1 1 36 36 PHE H H 36 7.730 7.730 6.680 1.050 19694
639 1 2 . 1 1 37 37 ALA N N 37 121.920 121.920 123.026 -1.106 19694
640 1 2 . 1 1 37 37 ALA HA H 37 4.070 4.070 4.052 0.018 19694
641 1 2 . 1 1 37 37 ALA CA C 37 52.900 52.900 52.523 0.377 19694
642 1 2 . 1 1 37 37 ALA CB C 37 19.770 19.770 19.386 0.384 19694
643 1 2 . 1 1 37 37 ALA H H 37 7.090 7.090 7.815 -0.725 19694
644 1 2 . 1 1 38 38 ASN N N 38 119.230 119.230 119.158 0.072 19694
645 1 2 . 1 1 38 38 ASN HA H 38 4.450 4.450 4.676 -0.226 19694
646 1 2 . 1 1 38 38 ASN CA C 38 52.850 52.850 52.832 0.018 19694
647 1 2 . 1 1 38 38 ASN CB C 38 38.950 38.950 39.806 -0.856 19694
648 1 2 . 1 1 38 38 ASN H H 38 8.790 8.790 8.365 0.425 19694
649 1 2 . 1 1 39 39 THR N N 39 116.330 116.330 115.721 0.609 19694
650 1 2 . 1 1 39 39 THR HA H 39 3.990 3.990 4.332 -0.342 19694
651 1 2 . 1 1 39 39 THR CA C 39 62.130 62.130 62.633 -0.503 19694
652 1 2 . 1 1 39 39 THR CB C 39 69.920 69.920 70.006 -0.086 19694
653 1 2 . 1 1 39 39 THR H H 39 8.540 8.540 8.376 0.164 19694
654 1 2 . 1 1 40 40 CYS N N 40 126.950 126.950 128.060 -1.110 19694
655 1 2 . 1 1 40 40 CYS HA H 40 4.300 4.300 4.468 -0.168 19694
656 1 2 . 1 1 40 40 CYS CA C 40 58.350 58.350 57.021 1.329 19694
657 1 2 . 1 1 40 40 CYS CB C 40 31.600 31.600 26.691 4.909 19694
658 1 2 . 1 1 40 40 CYS H H 40 7.940 7.940 8.549 -0.609 19694
659 1 2 . 1 1 41 41 GLU N N 41 130.560 130.560 127.584 2.976 19694
660 1 2 . 1 1 41 41 GLU HA H 41 3.690 3.690 3.845 -0.155 19694
661 1 2 . 1 1 41 41 GLU CA C 41 58.600 58.600 59.138 -0.538 19694
662 1 2 . 1 1 41 41 GLU CB C 41 30.460 30.460 29.443 1.017 19694
663 1 2 . 1 1 41 41 GLU H H 41 8.810 8.810 8.641 0.169 19694
664 1 2 . 1 1 42 42 GLU N N 42 119.680 119.680 118.438 1.242 19694
665 1 2 . 1 1 42 42 GLU HA H 42 4.570 4.570 4.332 0.238 19694
666 1 2 . 1 1 42 42 GLU CA C 42 58.000 58.000 58.166 -0.166 19694
667 1 2 . 1 1 42 42 GLU CB C 42 31.680 31.680 30.454 1.226 19694
668 1 2 . 1 1 42 42 GLU H H 42 8.500 8.500 8.115 0.385 19694
669 1 2 . 1 1 43 43 CYS N N 43 115.600 115.600 116.407 -0.807 19694
670 1 2 . 1 1 43 43 CYS HA H 43 5.010 5.010 4.531 0.479 19694
671 1 2 . 1 1 43 43 CYS CA C 43 58.810 58.810 60.174 -1.364 19694
672 1 2 . 1 1 43 43 CYS CB C 43 31.580 31.580 29.160 2.420 19694
673 1 2 . 1 1 43 43 CYS H H 43 8.120 8.120 7.969 0.151 19694
674 1 2 . 1 1 44 44 GLY N N 44 112.100 112.100 106.860 5.240 19694
675 1 2 . 1 1 44 44 GLY CA C 44 46.420 46.420 45.397 1.023 19694
676 1 2 . 1 1 44 44 GLY H H 44 7.900 7.900 8.617 -0.717 19694
677 1 2 . 1 1 45 45 LYS N N 45 121.210 121.210 121.744 -0.534 19694
678 1 2 . 1 1 45 45 LYS HA H 45 4.840 4.840 4.847 -0.007 19694
679 1 2 . 1 1 45 45 LYS CA C 45 54.360 54.360 52.686 1.674 19694
680 1 2 . 1 1 45 45 LYS CB C 45 32.430 32.430 32.352 0.078 19694
681 1 2 . 1 1 45 45 LYS H H 45 8.180 8.180 8.087 0.093 19694
682 1 2 . 1 1 46 46 PRO HA H 46 4.477 4.477 4.618 -0.141 19694
683 1 2 . 1 1 46 46 PRO CA C 46 62.700 62.700 62.981 -0.281 19694
684 1 2 . 1 1 46 46 PRO CB C 46 32.490 32.490 32.124 0.366 19694
685 1 2 . 1 1 47 47 ILE N N 47 125.280 125.280 122.604 2.676 19694
686 1 2 . 1 1 47 47 ILE HA H 47 3.830 3.830 4.332 -0.502 19694
687 1 2 . 1 1 47 47 ILE CA C 47 61.040 61.040 60.554 0.486 19694
688 1 2 . 1 1 47 47 ILE CB C 47 37.440 37.440 37.905 -0.465 19694
689 1 2 . 1 1 47 47 ILE H H 47 8.540 8.540 8.867 -0.327 19694
690 1 2 . 1 1 48 48 GLY N N 48 114.120 114.120 113.526 0.594 19694
691 1 2 . 1 1 48 48 GLY CA C 48 45.240 45.240 44.903 0.337 19694
692 1 2 . 1 1 48 48 GLY H H 48 8.660 8.660 8.488 0.172 19694
693 1 2 . 1 1 49 49 CYS N N 49 117.140 117.140 121.826 -4.686 19694
694 1 2 . 1 1 49 49 CYS HA H 49 4.280 4.280 4.238 0.042 19694
695 1 2 . 1 1 49 49 CYS CA C 49 60.880 60.880 60.692 0.188 19694
696 1 2 . 1 1 49 49 CYS CB C 49 27.650 27.650 26.853 0.797 19694
697 1 2 . 1 1 49 49 CYS H H 49 9.210 9.210 9.141 0.069 19694
698 1 2 . 1 1 50 50 ASP N N 50 119.300 119.300 118.954 0.346 19694
699 1 2 . 1 1 50 50 ASP HA H 50 4.620 4.620 4.581 0.039 19694
700 1 2 . 1 1 50 50 ASP CA C 50 54.160 54.160 56.117 -1.958 19694
701 1 2 . 1 1 50 50 ASP CB C 50 40.380 40.380 40.796 -0.416 19694
702 1 2 . 1 1 50 50 ASP H H 50 8.800 8.800 8.560 0.240 19694
703 1 2 . 1 1 51 51 CYS N N 51 118.150 118.150 117.713 0.437 19694
704 1 2 . 1 1 51 51 CYS HA H 51 4.620 4.620 4.650 -0.030 19694
705 1 2 . 1 1 51 51 CYS CA C 51 58.030 58.030 57.361 0.669 19694
706 1 2 . 1 1 51 51 CYS CB C 51 30.090 30.090 30.196 -0.106 19694
707 1 2 . 1 1 51 51 CYS H H 51 7.590 7.590 7.574 0.016 19694
708 1 2 . 1 1 52 52 LYS N N 52 123.800 123.800 123.899 -0.099 19694
709 1 2 . 1 1 52 52 LYS HA H 52 4.180 4.180 4.201 -0.021 19694
710 1 2 . 1 1 52 52 LYS CA C 52 57.240 57.240 57.122 0.118 19694
711 1 2 . 1 1 52 52 LYS CB C 52 33.030 33.030 31.535 1.495 19694
712 1 2 . 1 1 52 52 LYS H H 52 8.600 8.600 8.545 0.055 19694
713 1 2 . 1 1 53 53 ASP N N 53 124.900 124.900 123.717 1.183 19694
714 1 2 . 1 1 53 53 ASP HA H 53 4.230 4.230 4.691 -0.461 19694
715 1 2 . 1 1 53 53 ASP CA C 53 53.130 53.130 53.043 0.087 19694
716 1 2 . 1 1 53 53 ASP CB C 53 42.230 42.230 41.112 1.118 19694
717 1 2 . 1 1 53 53 ASP H H 53 8.250 8.250 8.264 -0.014 19694
718 1 2 . 1 1 54 54 LEU N N 54 130.160 130.160 126.085 4.075 19694
719 1 2 . 1 1 54 54 LEU HA H 54 4.440 4.440 4.642 -0.202 19694
720 1 2 . 1 1 54 54 LEU CA C 54 53.340 53.340 54.956 -1.615 19694
721 1 2 . 1 1 54 54 LEU CB C 54 41.170 41.170 43.163 -1.993 19694
722 1 2 . 1 1 54 54 LEU H H 54 8.670 8.670 9.078 -0.408 19694
723 1 2 . 1 1 55 55 SER N N 55 113.820 113.820 122.361 -8.541 19694
724 1 2 . 1 1 55 55 SER HA H 55 5.580 5.580 5.109 0.471 19694
725 1 2 . 1 1 55 55 SER CA C 55 55.850 55.850 56.316 -0.466 19694
726 1 2 . 1 1 55 55 SER CB C 55 67.300 67.300 64.279 3.021 19694
727 1 2 . 1 1 55 55 SER H H 55 8.160 8.160 8.550 -0.390 19694
728 1 2 . 1 1 56 56 TYR N N 56 122.610 122.610 126.613 -4.003 19694
729 1 2 . 1 1 56 56 TYR HA H 56 4.620 4.620 4.616 0.004 19694
730 1 2 . 1 1 56 56 TYR CA C 56 58.810 58.810 58.603 0.207 19694
731 1 2 . 1 1 56 56 TYR CB C 56 41.000 41.000 41.927 -0.927 19694
732 1 2 . 1 1 56 56 TYR H H 56 8.450 8.450 8.654 -0.204 19694
733 1 2 . 1 1 57 57 LYS N N 57 126.020 126.020 129.487 -3.467 19694
734 1 2 . 1 1 57 57 LYS HA H 57 3.470 3.470 3.893 -0.423 19694
735 1 2 . 1 1 57 57 LYS CA C 57 58.100 58.100 57.316 0.784 19694
736 1 2 . 1 1 57 57 LYS CB C 57 29.480 29.480 32.065 -2.585 19694
737 1 2 . 1 1 57 57 LYS H H 57 8.920 8.920 8.697 0.223 19694
738 1 2 . 1 1 58 58 ASP HA H 58 3.830 3.830 4.192 -0.362 19694
739 1 2 . 1 1 58 58 ASP CA C 58 54.900 54.900 55.281 -0.381 19694
740 1 2 . 1 1 58 58 ASP CB C 58 40.080 40.080 40.769 -0.689 19694
741 1 2 . 1 1 58 58 ASP H H 58 8.400 8.400 8.561 -0.161 19694
742 1 2 . 1 1 59 59 ARG N N 59 121.190 121.190 116.010 5.180 19694
743 1 2 . 1 1 59 59 ARG HA H 59 4.250 4.250 4.503 -0.253 19694
744 1 2 . 1 1 59 59 ARG CA C 59 55.580 55.580 54.233 1.347 19694
745 1 2 . 1 1 59 59 ARG CB C 59 33.460 33.460 33.641 -0.181 19694
746 1 2 . 1 1 59 59 ARG H H 59 7.980 7.980 7.278 0.702 19694
747 1 2 . 1 1 60 60 HIS N N 60 118.420 118.420 117.534 0.886 19694
748 1 2 . 1 1 60 60 HIS HA H 60 5.270 5.270 5.586 -0.316 19694
749 1 2 . 1 1 60 60 HIS CA C 60 55.010 55.010 55.012 -0.002 19694
750 1 2 . 1 1 60 60 HIS CB C 60 32.380 32.380 33.483 -1.103 19694
751 1 2 . 1 1 60 60 HIS H H 60 8.350 8.350 8.118 0.232 19694
752 1 2 . 1 1 61 61 TRP N N 61 119.990 119.990 118.201 1.789 19694
753 1 2 . 1 1 61 61 TRP HA H 61 5.930 5.930 4.788 1.142 19694
754 1 2 . 1 1 61 61 TRP CA C 61 57.400 57.400 57.085 0.315 19694
755 1 2 . 1 1 61 61 TRP CB C 61 35.380 35.380 34.193 1.187 19694
756 1 2 . 1 1 61 61 TRP H H 61 9.310 9.310 9.223 0.087 19694
757 1 2 . 1 1 62 62 HIS N N 62 117.270 117.270 121.420 -4.150 19694
758 1 2 . 1 1 62 62 HIS HA H 62 4.600 4.600 5.068 -0.468 19694
759 1 2 . 1 1 62 62 HIS CA C 62 59.210 59.210 56.857 2.353 19694
760 1 2 . 1 1 62 62 HIS CB C 62 31.200 31.200 30.187 1.013 19694
761 1 2 . 1 1 62 62 HIS H H 62 8.430 8.430 9.122 -0.692 19694
762 1 2 . 1 1 63 63 GLU N N 63 124.640 124.640 128.609 -3.969 19694
763 1 2 . 1 1 63 63 GLU HA H 63 3.827 3.827 3.950 -0.123 19694
764 1 2 . 1 1 63 63 GLU CA C 63 61.020 61.020 59.833 1.187 19694
765 1 2 . 1 1 63 63 GLU CB C 63 30.310 30.310 29.504 0.806 19694
766 1 2 . 1 1 63 63 GLU H H 63 9.040 9.040 8.577 0.463 19694
767 1 2 . 1 1 64 64 ALA N N 64 117.050 117.050 118.240 -1.190 19694
768 1 2 . 1 1 64 64 ALA HA H 64 4.230 4.230 4.307 -0.077 19694
769 1 2 . 1 1 64 64 ALA CA C 64 54.000 54.000 53.101 0.899 19694
770 1 2 . 1 1 64 64 ALA CB C 64 18.880 18.880 18.971 -0.091 19694
771 1 2 . 1 1 64 64 ALA H H 64 8.680 8.680 8.303 0.377 19694
772 1 2 . 1 1 65 65 CYS N N 65 115.380 115.380 117.130 -1.750 19694
773 1 2 . 1 1 65 65 CYS HA H 65 4.295 4.295 4.106 0.189 19694
774 1 2 . 1 1 65 65 CYS CA C 65 59.850 59.850 60.270 -0.420 19694
775 1 2 . 1 1 65 65 CYS CB C 65 32.840 32.840 26.969 5.871 19694
776 1 2 . 1 1 65 65 CYS H H 65 7.490 7.490 8.162 -0.672 19694
777 1 2 . 1 1 66 66 PHE N N 66 122.020 122.020 122.986 -0.966 19694
778 1 2 . 1 1 66 66 PHE HA H 66 3.890 3.890 3.806 0.084 19694
779 1 2 . 1 1 66 66 PHE CA C 66 57.010 57.010 58.480 -1.470 19694
780 1 2 . 1 1 66 66 PHE CB C 66 38.070 38.070 38.104 -0.034 19694
781 1 2 . 1 1 66 66 PHE H H 66 7.110 7.110 7.560 -0.450 19694
782 1 2 . 1 1 67 67 HIS N N 67 121.280 121.280 121.815 -0.535 19694
783 1 2 . 1 1 67 67 HIS HA H 67 4.720 4.720 5.205 -0.485 19694
784 1 2 . 1 1 67 67 HIS CA C 67 52.730 52.730 53.040 -0.310 19694
785 1 2 . 1 1 67 67 HIS CB C 67 32.230 32.230 30.769 1.461 19694
786 1 2 . 1 1 67 67 HIS H H 67 7.380 7.380 7.588 -0.208 19694
787 1 2 . 1 1 68 68 CYS N N 68 121.590 121.590 118.883 2.707 19694
788 1 2 . 1 1 68 68 CYS HA H 68 3.960 3.960 4.967 -1.007 19694
789 1 2 . 1 1 68 68 CYS CA C 68 59.790 59.790 57.969 1.821 19694
790 1 2 . 1 1 68 68 CYS CB C 68 31.200 31.200 29.279 1.921 19694
791 1 2 . 1 1 68 68 CYS H H 68 8.530 8.530 8.346 0.184 19694
792 1 2 . 1 1 69 69 SER N N 69 126.530 126.530 120.489 6.041 19694
793 1 2 . 1 1 69 69 SER HA H 69 4.310 4.310 4.098 0.212 19694
794 1 2 . 1 1 69 69 SER CA C 69 61.760 61.760 60.710 1.050 19694
795 1 2 . 1 1 69 69 SER CB C 69 64.040 64.040 63.186 0.854 19694
796 1 2 . 1 1 69 69 SER H H 69 9.460 9.460 8.821 0.639 19694
797 1 2 . 1 1 70 70 GLN N N 70 122.370 122.370 118.557 3.813 19694
798 1 2 . 1 1 70 70 GLN HA H 70 4.510 4.510 4.417 0.093 19694
799 1 2 . 1 1 70 70 GLN CA C 70 57.840 57.840 57.258 0.582 19694
800 1 2 . 1 1 70 70 GLN CB C 70 30.430 30.430 29.892 0.537 19694
801 1 2 . 1 1 70 70 GLN H H 70 8.980 8.980 7.819 1.161 19694
802 1 2 . 1 1 71 71 CYS N N 71 118.860 118.860 116.800 2.060 19694
803 1 2 . 1 1 71 71 CYS HA H 71 4.720 4.720 4.694 0.026 19694
804 1 2 . 1 1 71 71 CYS CA C 71 59.770 59.770 58.245 1.525 19694
805 1 2 . 1 1 71 71 CYS CB C 71 31.910 31.910 28.152 3.758 19694
806 1 2 . 1 1 71 71 CYS H H 71 8.220 8.220 7.724 0.496 19694
807 1 2 . 1 1 72 72 ARG N N 72 114.380 114.380 115.708 -1.328 19694
808 1 2 . 1 1 72 72 ARG HA H 72 3.965 3.965 3.730 0.235 19694
809 1 2 . 1 1 72 72 ARG CA C 72 58.030 58.030 57.200 0.830 19694
810 1 2 . 1 1 72 72 ARG CB C 72 27.720 27.720 27.006 0.714 19694
811 1 2 . 1 1 72 72 ARG H H 72 7.380 7.380 7.765 -0.385 19694
812 1 2 . 1 1 73 73 ASN N N 73 121.480 121.480 116.384 5.096 19694
813 1 2 . 1 1 73 73 ASN HA H 73 4.630 4.630 4.654 -0.024 19694
814 1 2 . 1 1 73 73 ASN CA C 73 54.110 54.110 53.982 0.128 19694
815 1 2 . 1 1 73 73 ASN CB C 73 38.870 38.870 39.669 -0.799 19694
816 1 2 . 1 1 73 73 ASN H H 73 8.722 8.722 8.162 0.560 19694
817 1 2 . 1 1 74 74 SER N N 74 114.710 114.710 117.648 -2.938 19694
818 1 2 . 1 1 74 74 SER HA H 74 4.060 4.060 4.821 -0.761 19694
819 1 2 . 1 1 74 74 SER CA C 74 59.357 59.357 58.130 1.228 19694
820 1 2 . 1 1 74 74 SER CB C 74 63.300 63.300 62.717 0.583 19694
821 1 2 . 1 1 74 74 SER H H 74 8.690 8.690 8.508 0.182 19694
822 1 2 . 1 1 75 75 LEU N N 75 125.757 125.757 127.777 -2.020 19694
823 1 2 . 1 1 75 75 LEU HA H 75 4.280 4.280 4.305 -0.025 19694
824 1 2 . 1 1 75 75 LEU CA C 75 53.510 53.510 54.881 -1.371 19694
825 1 2 . 1 1 75 75 LEU CB C 75 42.200 42.200 41.818 0.382 19694
826 1 2 . 1 1 75 75 LEU H H 75 7.970 7.970 8.026 -0.056 19694
827 1 2 . 1 1 76 76 VAL N N 76 120.860 120.860 124.521 -3.661 19694
828 1 2 . 1 1 76 76 VAL HA H 76 3.570 3.570 3.885 -0.315 19694
829 1 2 . 1 1 76 76 VAL CA C 76 65.420 65.420 60.816 4.604 19694
830 1 2 . 1 1 76 76 VAL CB C 76 31.540 31.540 35.151 -3.611 19694
831 1 2 . 1 1 76 76 VAL H H 76 7.830 7.830 7.894 -0.064 19694
832 1 2 . 1 1 77 77 ASP N N 77 122.360 122.360 121.329 1.031 19694
833 1 2 . 1 1 77 77 ASP HA H 77 4.230 4.230 4.502 -0.272 19694
834 1 2 . 1 1 77 77 ASP CA C 77 56.200 56.200 55.809 0.391 19694
835 1 2 . 1 1 77 77 ASP CB C 77 39.380 39.380 40.556 -1.175 19694
836 1 2 . 1 1 77 77 ASP H H 77 8.910 8.910 8.362 0.548 19694
837 1 2 . 1 1 78 78 LYS N N 78 118.100 118.100 118.978 -0.878 19694
838 1 2 . 1 1 78 78 LYS HA H 78 4.870 4.870 4.619 0.251 19694
839 1 2 . 1 1 78 78 LYS CA C 78 56.960 56.960 53.486 3.474 19694
840 1 2 . 1 1 78 78 LYS CB C 78 34.680 34.680 33.924 0.756 19694
841 1 2 . 1 1 78 78 LYS H H 78 7.660 7.660 7.616 0.044 19694
842 1 2 . 1 1 79 79 PRO HA H 79 4.460 4.460 4.224 0.236 19694
843 1 2 . 1 1 79 79 PRO CA C 79 62.520 62.520 63.004 -0.484 19694
844 1 2 . 1 1 79 79 PRO CB C 79 32.160 32.160 31.857 0.303 19694
845 1 2 . 1 1 80 80 PHE N N 80 114.050 114.050 117.091 -3.041 19694
846 1 2 . 1 1 80 80 PHE HA H 80 4.910 4.910 5.035 -0.125 19694
847 1 2 . 1 1 80 80 PHE CA C 80 56.060 56.060 55.138 0.922 19694
848 1 2 . 1 1 80 80 PHE CB C 80 42.410 42.410 41.813 0.597 19694
849 1 2 . 1 1 80 80 PHE H H 80 7.510 7.510 7.233 0.277 19694
850 1 2 . 1 1 81 81 ALA N N 81 123.290 123.290 123.602 -0.312 19694
851 1 2 . 1 1 81 81 ALA HA H 81 4.310 4.310 4.354 -0.044 19694
852 1 2 . 1 1 81 81 ALA CA C 81 50.450 50.450 50.400 0.050 19694
853 1 2 . 1 1 81 81 ALA CB C 81 21.920 21.920 18.971 2.950 19694
854 1 2 . 1 1 81 81 ALA H H 81 9.030 9.030 8.965 0.065 19694
855 1 2 . 1 1 82 82 ALA N N 82 122.490 122.490 129.152 -6.662 19694
856 1 2 . 1 1 82 82 ALA HA H 82 5.110 5.110 4.379 0.731 19694
857 1 2 . 1 1 82 82 ALA CA C 82 51.100 51.100 51.664 -0.564 19694
858 1 2 . 1 1 82 82 ALA CB C 82 21.130 21.130 18.772 2.358 19694
859 1 2 . 1 1 82 82 ALA H H 82 8.240 8.240 8.622 -0.382 19694
860 1 2 . 1 1 83 83 LYS N N 83 123.580 123.580 125.775 -2.195 19694
861 1 2 . 1 1 83 83 LYS HA H 83 4.490 4.490 4.527 -0.038 19694
862 1 2 . 1 1 83 83 LYS CA C 83 55.800 55.800 55.275 0.525 19694
863 1 2 . 1 1 83 83 LYS CB C 83 34.720 34.720 34.215 0.505 19694
864 1 2 . 1 1 83 83 LYS H H 83 8.400 8.400 8.168 0.232 19694
865 1 2 . 1 1 84 84 GLU N N 84 125.470 125.470 120.033 5.437 19694
866 1 2 . 1 1 84 84 GLU HA H 84 3.820 3.820 4.123 -0.303 19694
867 1 2 . 1 1 84 84 GLU CA C 84 58.620 58.620 58.922 -0.302 19694
868 1 2 . 1 1 84 84 GLU CB C 84 27.210 27.210 29.726 -2.516 19694
869 1 2 . 1 1 84 84 GLU H H 84 9.320 9.320 8.684 0.636 19694
870 1 2 . 1 1 85 85 ASP N N 85 118.550 118.550 114.280 4.270 19694
871 1 2 . 1 1 85 85 ASP HA H 85 4.600 4.600 4.796 -0.196 19694
872 1 2 . 1 1 85 85 ASP CA C 85 55.400 55.400 54.074 1.326 19694
873 1 2 . 1 1 85 85 ASP CB C 85 40.400 40.400 41.825 -1.425 19694
874 1 2 . 1 1 85 85 ASP H H 85 8.730 8.730 8.243 0.487 19694
875 1 2 . 1 1 86 86 GLN N N 86 119.050 119.050 116.240 2.810 19694
876 1 2 . 1 1 86 86 GLN HA H 86 4.540 4.540 4.513 0.027 19694
877 1 2 . 1 1 86 86 GLN CA C 86 55.100 55.100 53.887 1.213 19694
878 1 2 . 1 1 86 86 GLN CB C 86 31.110 31.110 31.774 -0.664 19694
879 1 2 . 1 1 86 86 GLN H H 86 8.170 8.170 7.604 0.566 19694
880 1 2 . 1 1 87 87 LEU N N 87 123.110 123.110 121.245 1.865 19694
881 1 2 . 1 1 87 87 LEU HA H 87 4.620 4.620 5.205 -0.585 19694
882 1 2 . 1 1 87 87 LEU CA C 87 54.520 54.520 54.020 0.500 19694
883 1 2 . 1 1 87 87 LEU CB C 87 42.700 42.700 44.645 -1.944 19694
884 1 2 . 1 1 87 87 LEU H H 87 8.490 8.490 8.526 -0.036 19694
885 1 2 . 1 1 88 88 LEU N N 88 123.690 123.690 120.124 3.566 19694
886 1 2 . 1 1 88 88 LEU HA H 88 5.880 5.880 4.959 0.921 19694
887 1 2 . 1 1 88 88 LEU CA C 88 53.340 53.340 52.797 0.543 19694
888 1 2 . 1 1 88 88 LEU CB C 88 47.190 47.190 47.819 -0.629 19694
889 1 2 . 1 1 88 88 LEU H H 88 8.930 8.930 8.308 0.622 19694
890 1 2 . 1 1 89 89 CYS N N 89 122.270 122.270 119.136 3.134 19694
891 1 2 . 1 1 89 89 CYS HA H 89 4.780 4.780 4.841 -0.061 19694
892 1 2 . 1 1 89 89 CYS CA C 89 57.640 57.640 59.414 -1.774 19694
893 1 2 . 1 1 89 89 CYS CB C 89 30.940 30.940 27.873 3.067 19694
894 1 2 . 1 1 89 89 CYS H H 89 9.430 9.430 9.057 0.373 19694
895 1 2 . 1 1 90 90 THR N N 90 110.620 110.620 116.917 -6.297 19694
896 1 2 . 1 1 90 90 THR HA H 90 3.900 3.900 3.985 -0.085 19694
897 1 2 . 1 1 90 90 THR CA C 90 65.460 65.460 65.793 -0.333 19694
898 1 2 . 1 1 90 90 THR CB C 90 68.670 68.670 68.915 -0.245 19694
899 1 2 . 1 1 90 90 THR H H 90 8.410 8.410 8.880 -0.470 19694
900 1 2 . 1 1 91 91 ASP N N 91 123.470 123.470 121.310 2.160 19694
901 1 2 . 1 1 91 91 ASP HA H 91 4.490 4.490 4.660 -0.170 19694
902 1 2 . 1 1 91 91 ASP CA C 91 57.810 57.810 57.863 -0.053 19694
903 1 2 . 1 1 91 91 ASP CB C 91 41.160 41.160 40.702 0.458 19694
904 1 2 . 1 1 91 91 ASP H H 91 8.150 8.150 8.341 -0.191 19694
905 1 2 . 1 1 92 92 CYS N N 92 123.800 123.800 119.682 4.118 19694
906 1 2 . 1 1 92 92 CYS HA H 92 3.970 3.970 4.403 -0.433 19694
907 1 2 . 1 1 92 92 CYS CA C 92 64.100 64.100 61.397 2.703 19694
908 1 2 . 1 1 92 92 CYS CB C 92 30.090 30.090 26.109 3.981 19694
909 1 2 . 1 1 92 92 CYS H H 92 8.580 8.580 7.864 0.716 19694
910 1 2 . 1 1 93 93 TYR N N 93 120.730 120.730 120.917 -0.187 19694
911 1 2 . 1 1 93 93 TYR HA H 93 4.140 4.140 4.085 0.055 19694
912 1 2 . 1 1 93 93 TYR CA C 93 60.380 60.380 61.392 -1.012 19694
913 1 2 . 1 1 93 93 TYR CB C 93 39.300 39.300 38.325 0.974 19694
914 1 2 . 1 1 93 93 TYR H H 93 8.540 8.540 9.139 -0.599 19694
915 1 2 . 1 1 94 94 SER N N 94 115.010 115.010 113.069 1.941 19694
916 1 2 . 1 1 94 94 SER HA H 94 4.220 4.220 4.212 0.008 19694
917 1 2 . 1 1 94 94 SER CA C 94 59.300 59.300 61.344 -2.044 19694
918 1 2 . 1 1 94 94 SER CB C 94 63.660 63.660 62.686 0.974 19694
919 1 2 . 1 1 94 94 SER H H 94 7.750 7.750 8.043 -0.293 19694
920 1 2 . 1 1 95 95 ASN N N 95 119.820 119.820 119.014 0.806 19694
921 1 2 . 1 1 95 95 ASN HA H 95 4.510 4.510 4.566 -0.056 19694
922 1 2 . 1 1 95 95 ASN CA C 95 53.880 53.880 55.538 -1.658 19694
923 1 2 . 1 1 95 95 ASN CB C 95 39.300 39.300 38.894 0.406 19694
924 1 2 . 1 1 95 95 ASN H H 95 7.780 7.780 8.010 -0.230 19694
925 1 2 . 1 1 96 96 GLU N N 96 119.820 119.820 117.394 2.426 19694
926 1 2 . 1 1 96 96 GLU HA H 96 4.096 4.096 4.190 -0.094 19694
927 1 2 . 1 1 96 96 GLU CA C 96 56.910 56.910 57.256 -0.346 19694
928 1 2 . 1 1 96 96 GLU CB C 96 30.220 30.220 29.871 0.349 19694
929 1 2 . 1 1 96 96 GLU H H 96 7.950 7.950 7.514 0.436 19694
930 1 2 . 1 1 97 97 TYR N N 97 120.370 120.370 121.112 -0.742 19694
931 1 2 . 1 1 97 97 TYR HA H 97 4.620 4.620 3.983 0.637 19694
932 1 2 . 1 1 97 97 TYR CA C 97 57.700 57.700 59.684 -1.984 19694
933 1 2 . 1 1 97 97 TYR CB C 97 38.710 38.710 38.287 0.423 19694
934 1 2 . 1 1 97 97 TYR H H 97 8.070 8.070 8.287 -0.217 19694
935 1 3 . 1 1 2 2 THR N N 2 113.570 113.570 115.734 -2.164 19694
936 1 3 . 1 1 2 2 THR HA H 2 4.240 4.240 4.276 -0.036 19694
937 1 3 . 1 1 2 2 THR CA C 2 62.130 62.130 62.849 -0.719 19694
938 1 3 . 1 1 2 2 THR CB C 2 69.250 69.250 69.290 -0.040 19694
939 1 3 . 1 1 2 2 THR H H 2 8.090 8.090 8.061 0.029 19694
940 1 3 . 1 1 3 3 GLU N N 3 122.880 122.880 120.720 2.160 19694
941 1 3 . 1 1 3 3 GLU HA H 3 4.280 4.280 4.254 0.026 19694
942 1 3 . 1 1 3 3 GLU CA C 3 56.860 56.860 56.276 0.584 19694
943 1 3 . 1 1 3 3 GLU CB C 3 30.570 30.570 30.240 0.330 19694
944 1 3 . 1 1 3 3 GLU H H 3 8.280 8.280 8.043 0.237 19694
945 1 3 . 1 1 4 4 ARG N N 4 121.330 121.330 119.506 1.824 19694
946 1 3 . 1 1 4 4 ARG HA H 4 4.300 4.300 4.533 -0.233 19694
947 1 3 . 1 1 4 4 ARG CA C 4 55.870 55.870 55.342 0.528 19694
948 1 3 . 1 1 4 4 ARG CB C 4 31.640 31.640 30.736 0.904 19694
949 1 3 . 1 1 4 4 ARG H H 4 8.280 8.280 8.537 -0.257 19694
950 1 3 . 1 1 5 5 PHE N N 5 125.490 125.490 124.717 0.773 19694
951 1 3 . 1 1 5 5 PHE HA H 5 4.610 4.610 4.591 0.019 19694
952 1 3 . 1 1 5 5 PHE CA C 5 56.380 56.380 56.439 -0.059 19694
953 1 3 . 1 1 5 5 PHE CB C 5 39.560 39.560 39.720 -0.160 19694
954 1 3 . 1 1 5 5 PHE H H 5 8.290 8.290 8.688 -0.398 19694
955 1 3 . 1 1 6 6 ASP N N 6 123.260 123.260 121.706 1.554 19694
956 1 3 . 1 1 6 6 ASP HA H 6 5.045 5.045 4.761 0.284 19694
957 1 3 . 1 1 6 6 ASP CA C 6 52.180 52.180 52.835 -0.655 19694
958 1 3 . 1 1 6 6 ASP CB C 6 44.210 44.210 44.444 -0.234 19694
959 1 3 . 1 1 6 6 ASP H H 6 7.940 7.940 7.602 0.338 19694
960 1 3 . 1 1 7 7 CYS N N 7 121.440 121.440 122.768 -1.328 19694
961 1 3 . 1 1 7 7 CYS HA H 7 3.960 3.960 4.414 -0.454 19694
962 1 3 . 1 1 7 7 CYS CA C 7 59.820 59.820 59.513 0.307 19694
963 1 3 . 1 1 7 7 CYS CB C 7 30.950 30.950 26.093 4.857 19694
964 1 3 . 1 1 7 7 CYS H H 7 8.700 8.700 8.554 0.146 19694
965 1 3 . 1 1 8 8 HIS N N 8 129.390 129.390 129.444 -0.054 19694
966 1 3 . 1 1 8 8 HIS HA H 8 4.200 4.200 4.205 -0.005 19694
967 1 3 . 1 1 8 8 HIS CA C 8 58.240 58.240 59.699 -1.459 19694
968 1 3 . 1 1 8 8 HIS CB C 8 29.480 29.480 30.136 -0.656 19694
969 1 3 . 1 1 8 8 HIS H H 8 9.160 9.160 9.586 -0.426 19694
970 1 3 . 1 1 9 9 HIS N N 9 118.740 118.740 116.768 1.972 19694
971 1 3 . 1 1 9 9 HIS HA H 9 4.880 4.880 4.469 0.411 19694
972 1 3 . 1 1 9 9 HIS CA C 9 58.680 58.680 57.484 1.196 19694
973 1 3 . 1 1 9 9 HIS CB C 9 31.040 31.040 30.015 1.025 19694
974 1 3 . 1 1 9 9 HIS H H 9 9.270 9.270 7.928 1.342 19694
975 1 3 . 1 1 10 10 CYS N N 10 118.600 118.600 117.058 1.542 19694
976 1 3 . 1 1 10 10 CYS HA H 10 4.600 4.600 4.507 0.093 19694
977 1 3 . 1 1 10 10 CYS CA C 10 59.600 59.600 58.976 0.624 19694
978 1 3 . 1 1 10 10 CYS CB C 10 32.330 32.330 28.027 4.303 19694
979 1 3 . 1 1 10 10 CYS H H 10 8.550 8.550 7.816 0.734 19694
980 1 3 . 1 1 11 11 ASN N N 11 116.220 116.220 118.498 -2.278 19694
981 1 3 . 1 1 11 11 ASN HA H 11 4.410 4.410 4.351 0.059 19694
982 1 3 . 1 1 11 11 ASN CA C 11 55.640 55.640 54.583 1.057 19694
983 1 3 . 1 1 11 11 ASN CB C 11 38.200 38.200 37.712 0.488 19694
984 1 3 . 1 1 11 11 ASN H H 11 7.690 7.690 8.640 -0.950 19694
985 1 3 . 1 1 12 12 GLU N N 12 120.330 120.330 117.799 2.531 19694
986 1 3 . 1 1 12 12 GLU HA H 12 4.220 4.220 4.496 -0.276 19694
987 1 3 . 1 1 12 12 GLU CA C 12 56.700 56.700 55.201 1.499 19694
988 1 3 . 1 1 12 12 GLU CB C 12 30.910 30.910 30.807 0.103 19694
989 1 3 . 1 1 12 12 GLU H H 12 8.210 8.210 7.718 0.492 19694
990 1 3 . 1 1 13 13 SER N N 13 116.190 116.190 120.403 -4.213 19694
991 1 3 . 1 1 13 13 SER HA H 13 4.060 4.060 4.478 -0.418 19694
992 1 3 . 1 1 13 13 SER CA C 13 59.350 59.350 59.080 0.270 19694
993 1 3 . 1 1 13 13 SER CB C 13 63.820 63.820 63.592 0.228 19694
994 1 3 . 1 1 13 13 SER H H 13 8.520 8.520 8.695 -0.175 19694
995 1 3 . 1 1 14 14 LEU N N 14 126.060 126.060 124.487 1.573 19694
996 1 3 . 1 1 14 14 LEU HA H 14 4.310 4.310 4.334 -0.024 19694
997 1 3 . 1 1 14 14 LEU CA C 14 54.100 54.100 55.927 -1.827 19694
998 1 3 . 1 1 14 14 LEU CB C 14 42.200 42.200 41.557 0.643 19694
999 1 3 . 1 1 14 14 LEU H H 14 8.910 8.910 7.703 1.207 19694
1000 1 3 . 1 1 15 15 PHE N N 15 120.660 120.660 120.940 -0.280 19694
1001 1 3 . 1 1 15 15 PHE HA H 15 4.480 4.480 4.613 -0.133 19694
1002 1 3 . 1 1 15 15 PHE CA C 15 60.400 60.400 56.039 4.361 19694
1003 1 3 . 1 1 15 15 PHE CB C 15 38.130 38.130 37.925 0.205 19694
1004 1 3 . 1 1 15 15 PHE H H 15 7.820 7.820 8.466 -0.646 19694
1005 1 3 . 1 1 16 16 GLY N N 16 114.730 114.730 110.921 3.809 19694
1006 1 3 . 1 1 16 16 GLY CA C 16 45.900 45.900 45.815 0.085 19694
1007 1 3 . 1 1 16 16 GLY H H 16 8.860 8.860 8.807 0.053 19694
1008 1 3 . 1 1 17 17 LYS N N 17 119.580 119.580 119.775 -0.195 19694
1009 1 3 . 1 1 17 17 LYS HA H 17 4.480 4.480 4.468 0.012 19694
1010 1 3 . 1 1 17 17 LYS CA C 17 54.460 54.460 54.522 -0.062 19694
1011 1 3 . 1 1 17 17 LYS CB C 17 35.800 35.800 33.958 1.842 19694
1012 1 3 . 1 1 17 17 LYS H H 17 8.030 8.030 7.242 0.788 19694
1013 1 3 . 1 1 18 18 LYS N N 18 120.330 120.330 121.503 -1.173 19694
1014 1 3 . 1 1 18 18 LYS HA H 18 4.280 4.280 4.342 -0.062 19694
1015 1 3 . 1 1 18 18 LYS CA C 18 56.800 56.800 57.400 -0.600 19694
1016 1 3 . 1 1 18 18 LYS CB C 18 33.010 33.010 33.033 -0.023 19694
1017 1 3 . 1 1 18 18 LYS H H 18 8.190 8.190 8.570 -0.380 19694
1018 1 3 . 1 1 19 19 TYR N N 19 117.500 117.500 113.806 3.694 19694
1019 1 3 . 1 1 19 19 TYR HA H 19 5.240 5.240 4.782 0.458 19694
1020 1 3 . 1 1 19 19 TYR CA C 19 55.340 55.340 56.409 -1.069 19694
1021 1 3 . 1 1 19 19 TYR CB C 19 42.850 42.850 40.220 2.630 19694
1022 1 3 . 1 1 19 19 TYR H H 19 7.610 7.610 7.869 -0.259 19694
1023 1 3 . 1 1 20 20 ILE N N 20 121.430 121.430 121.902 -0.472 19694
1024 1 3 . 1 1 20 20 ILE HA H 20 4.137 4.137 4.246 -0.109 19694
1025 1 3 . 1 1 20 20 ILE CA C 20 60.010 60.010 60.099 -0.089 19694
1026 1 3 . 1 1 20 20 ILE CB C 20 41.570 41.570 40.603 0.967 19694
1027 1 3 . 1 1 20 20 ILE H H 20 9.350 9.350 8.204 1.146 19694
1028 1 3 . 1 1 21 21 LEU N N 21 126.720 126.720 127.164 -0.444 19694
1029 1 3 . 1 1 21 21 LEU HA H 21 5.090 5.090 4.555 0.535 19694
1030 1 3 . 1 1 21 21 LEU CA C 21 54.020 54.020 54.272 -0.252 19694
1031 1 3 . 1 1 21 21 LEU CB C 21 43.720 43.720 40.422 3.298 19694
1032 1 3 . 1 1 21 21 LEU H H 21 8.530 8.530 8.549 -0.019 19694
1033 1 3 . 1 1 22 22 ARG N N 22 123.930 123.930 126.104 -2.174 19694
1034 1 3 . 1 1 22 22 ARG HA H 22 4.440 4.440 4.411 0.029 19694
1035 1 3 . 1 1 22 22 ARG CA C 22 55.600 55.600 54.357 1.243 19694
1036 1 3 . 1 1 22 22 ARG CB C 22 32.280 32.280 31.798 0.482 19694
1037 1 3 . 1 1 22 22 ARG H H 22 9.080 9.080 9.044 0.036 19694
1038 1 3 . 1 1 23 23 GLU N N 23 128.500 128.500 123.903 4.597 19694
1039 1 3 . 1 1 23 23 GLU HA H 23 3.840 3.840 3.891 -0.051 19694
1040 1 3 . 1 1 23 23 GLU CA C 23 58.030 58.030 57.884 0.146 19694
1041 1 3 . 1 1 23 23 GLU CB C 23 27.200 27.200 27.548 -0.348 19694
1042 1 3 . 1 1 23 23 GLU H H 23 9.610 9.610 9.046 0.564 19694
1043 1 3 . 1 1 24 24 GLU N N 24 110.300 110.300 113.778 -3.478 19694
1044 1 3 . 1 1 24 24 GLU HA H 24 3.780 3.780 3.934 -0.154 19694
1045 1 3 . 1 1 24 24 GLU CA C 24 58.320 58.320 57.526 0.794 19694
1046 1 3 . 1 1 24 24 GLU CB C 24 28.220 28.220 28.454 -0.235 19694
1047 1 3 . 1 1 24 24 GLU H H 24 8.660 8.660 8.734 -0.074 19694
1048 1 3 . 1 1 25 25 SER N N 25 117.700 117.700 112.887 4.813 19694
1049 1 3 . 1 1 25 25 SER HA H 25 4.890 4.890 4.850 0.040 19694
1050 1 3 . 1 1 25 25 SER CA C 25 56.540 56.540 55.772 0.768 19694
1051 1 3 . 1 1 25 25 SER CB C 25 64.720 64.720 64.484 0.236 19694
1052 1 3 . 1 1 25 25 SER H H 25 7.900 7.900 7.774 0.126 19694
1053 1 3 . 1 1 26 26 PRO HA H 26 4.995 4.995 4.868 0.127 19694
1054 1 3 . 1 1 26 26 PRO CA C 26 61.750 61.750 63.203 -1.453 19694
1055 1 3 . 1 1 26 26 PRO CB C 26 32.660 32.660 31.706 0.954 19694
1056 1 3 . 1 1 27 27 TYR N N 27 118.100 118.100 123.838 -5.738 19694
1057 1 3 . 1 1 27 27 TYR HA H 27 5.910 5.910 4.972 0.938 19694
1058 1 3 . 1 1 27 27 TYR CA C 27 56.830 56.830 55.330 1.500 19694
1059 1 3 . 1 1 27 27 TYR CB C 27 42.810 42.810 42.716 0.094 19694
1060 1 3 . 1 1 27 27 TYR H H 27 9.040 9.040 9.006 0.034 19694
1061 1 3 . 1 1 28 28 CYS N N 28 122.230 122.230 118.762 3.468 19694
1062 1 3 . 1 1 28 28 CYS HA H 28 4.850 4.850 4.686 0.164 19694
1063 1 3 . 1 1 28 28 CYS CA C 28 58.110 58.110 58.336 -0.226 19694
1064 1 3 . 1 1 28 28 CYS CB C 28 30.530 30.530 29.144 1.386 19694
1065 1 3 . 1 1 28 28 CYS H H 28 9.850 9.850 8.304 1.546 19694
1066 1 3 . 1 1 29 29 VAL N N 29 118.200 118.200 122.884 -4.684 19694
1067 1 3 . 1 1 29 29 VAL HA H 29 3.650 3.650 3.695 -0.045 19694
1068 1 3 . 1 1 29 29 VAL CA C 29 67.400 67.400 67.206 0.194 19694
1069 1 3 . 1 1 29 29 VAL CB C 29 31.860 31.860 31.209 0.651 19694
1070 1 3 . 1 1 29 29 VAL H H 29 8.430 8.430 9.036 -0.606 19694
1071 1 3 . 1 1 30 30 VAL N N 30 119.570 119.570 118.317 1.253 19694
1072 1 3 . 1 1 30 30 VAL HA H 30 3.860 3.860 3.584 0.276 19694
1073 1 3 . 1 1 30 30 VAL CA C 30 66.450 66.450 66.066 0.384 19694
1074 1 3 . 1 1 30 30 VAL CB C 30 31.540 31.540 30.414 1.126 19694
1075 1 3 . 1 1 30 30 VAL H H 30 7.700 7.700 8.164 -0.464 19694
1076 1 3 . 1 1 31 31 CYS N N 31 125.890 125.890 119.547 6.343 19694
1077 1 3 . 1 1 31 31 CYS HA H 31 3.830 3.830 3.920 -0.090 19694
1078 1 3 . 1 1 31 31 CYS CA C 31 65.850 65.850 64.311 1.539 19694
1079 1 3 . 1 1 31 31 CYS CB C 31 29.510 29.510 25.565 3.945 19694
1080 1 3 . 1 1 31 31 CYS H H 31 9.050 9.050 7.592 1.458 19694
1081 1 3 . 1 1 32 32 PHE N N 32 119.000 119.000 119.255 -0.255 19694
1082 1 3 . 1 1 32 32 PHE HA H 32 3.780 3.780 3.697 0.083 19694
1083 1 3 . 1 1 32 32 PHE CA C 32 62.610 62.610 61.925 0.685 19694
1084 1 3 . 1 1 32 32 PHE CB C 32 39.920 39.920 39.057 0.863 19694
1085 1 3 . 1 1 32 32 PHE H H 32 9.080 9.080 7.873 1.207 19694
1086 1 3 . 1 1 33 33 GLU N N 33 117.470 117.470 117.895 -0.425 19694
1087 1 3 . 1 1 33 33 GLU HA H 33 3.760 3.760 3.987 -0.227 19694
1088 1 3 . 1 1 33 33 GLU CA C 33 59.210 59.210 59.493 -0.283 19694
1089 1 3 . 1 1 33 33 GLU CB C 33 29.480 29.480 29.402 0.078 19694
1090 1 3 . 1 1 33 33 GLU H H 33 8.510 8.510 7.979 0.531 19694
1091 1 3 . 1 1 34 34 THR N N 34 114.140 114.140 114.835 -0.695 19694
1092 1 3 . 1 1 34 34 THR HA H 34 3.730 3.730 4.014 -0.284 19694
1093 1 3 . 1 1 34 34 THR CA C 34 65.890 65.890 65.632 0.258 19694
1094 1 3 . 1 1 34 34 THR CB C 34 69.210 69.210 68.725 0.485 19694
1095 1 3 . 1 1 34 34 THR H H 34 7.880 7.880 8.183 -0.303 19694
1096 1 3 . 1 1 35 35 LEU N N 35 117.980 117.980 119.597 -1.617 19694
1097 1 3 . 1 1 35 35 LEU HA H 35 3.650 3.650 3.928 -0.278 19694
1098 1 3 . 1 1 35 35 LEU CA C 35 56.860 56.860 57.594 -0.734 19694
1099 1 3 . 1 1 35 35 LEU CB C 35 41.870 41.870 41.968 -0.098 19694
1100 1 3 . 1 1 35 35 LEU H H 35 7.660 7.660 7.898 -0.238 19694
1101 1 3 . 1 1 36 36 PHE N N 36 113.900 113.900 112.900 1.000 19694
1102 1 3 . 1 1 36 36 PHE HA H 36 4.597 4.597 4.466 0.131 19694
1103 1 3 . 1 1 36 36 PHE CA C 36 56.860 56.860 56.425 0.435 19694
1104 1 3 . 1 1 36 36 PHE CB C 36 40.570 40.570 38.280 2.290 19694
1105 1 3 . 1 1 36 36 PHE H H 36 7.730 7.730 6.682 1.048 19694
1106 1 3 . 1 1 37 37 ALA N N 37 121.920 121.920 123.747 -1.827 19694
1107 1 3 . 1 1 37 37 ALA HA H 37 4.070 4.070 4.088 -0.018 19694
1108 1 3 . 1 1 37 37 ALA CA C 37 52.900 52.900 52.391 0.509 19694
1109 1 3 . 1 1 37 37 ALA CB C 37 19.770 19.770 19.596 0.174 19694
1110 1 3 . 1 1 37 37 ALA H H 37 7.090 7.090 7.853 -0.763 19694
1111 1 3 . 1 1 38 38 ASN N N 38 119.230 119.230 119.521 -0.291 19694
1112 1 3 . 1 1 38 38 ASN HA H 38 4.450 4.450 4.612 -0.162 19694
1113 1 3 . 1 1 38 38 ASN CA C 38 52.850 52.850 53.050 -0.200 19694
1114 1 3 . 1 1 38 38 ASN CB C 38 38.950 38.950 39.767 -0.817 19694
1115 1 3 . 1 1 38 38 ASN H H 38 8.790 8.790 8.234 0.556 19694
1116 1 3 . 1 1 39 39 THR N N 39 116.330 116.330 116.095 0.235 19694
1117 1 3 . 1 1 39 39 THR HA H 39 3.990 3.990 4.336 -0.346 19694
1118 1 3 . 1 1 39 39 THR CA C 39 62.130 62.130 62.772 -0.642 19694
1119 1 3 . 1 1 39 39 THR CB C 39 69.920 69.920 69.647 0.273 19694
1120 1 3 . 1 1 39 39 THR H H 39 8.540 8.540 8.091 0.449 19694
1121 1 3 . 1 1 40 40 CYS N N 40 126.950 126.950 128.435 -1.485 19694
1122 1 3 . 1 1 40 40 CYS HA H 40 4.300 4.300 4.469 -0.169 19694
1123 1 3 . 1 1 40 40 CYS CA C 40 58.350 58.350 57.140 1.210 19694
1124 1 3 . 1 1 40 40 CYS CB C 40 31.600 31.600 26.579 5.021 19694
1125 1 3 . 1 1 40 40 CYS H H 40 7.940 7.940 8.522 -0.582 19694
1126 1 3 . 1 1 41 41 GLU N N 41 130.560 130.560 127.737 2.823 19694
1127 1 3 . 1 1 41 41 GLU HA H 41 3.690 3.690 3.833 -0.143 19694
1128 1 3 . 1 1 41 41 GLU CA C 41 58.600 58.600 59.116 -0.516 19694
1129 1 3 . 1 1 41 41 GLU CB C 41 30.460 30.460 29.378 1.082 19694
1130 1 3 . 1 1 41 41 GLU H H 41 8.810 8.810 8.628 0.182 19694
1131 1 3 . 1 1 42 42 GLU N N 42 119.680 119.680 117.981 1.699 19694
1132 1 3 . 1 1 42 42 GLU HA H 42 4.570 4.570 4.354 0.216 19694
1133 1 3 . 1 1 42 42 GLU CA C 42 58.000 58.000 58.036 -0.036 19694
1134 1 3 . 1 1 42 42 GLU CB C 42 31.680 31.680 30.643 1.037 19694
1135 1 3 . 1 1 42 42 GLU H H 42 8.500 8.500 8.117 0.384 19694
1136 1 3 . 1 1 43 43 CYS N N 43 115.600 115.600 116.518 -0.918 19694
1137 1 3 . 1 1 43 43 CYS HA H 43 5.010 5.010 4.639 0.371 19694
1138 1 3 . 1 1 43 43 CYS CA C 43 58.810 58.810 60.046 -1.236 19694
1139 1 3 . 1 1 43 43 CYS CB C 43 31.580 31.580 29.487 2.093 19694
1140 1 3 . 1 1 43 43 CYS H H 43 8.120 8.120 7.946 0.174 19694
1141 1 3 . 1 1 44 44 GLY N N 44 112.100 112.100 108.491 3.609 19694
1142 1 3 . 1 1 44 44 GLY CA C 44 46.420 46.420 45.232 1.188 19694
1143 1 3 . 1 1 44 44 GLY H H 44 7.900 7.900 8.568 -0.668 19694
1144 1 3 . 1 1 45 45 LYS N N 45 121.210 121.210 122.682 -1.472 19694
1145 1 3 . 1 1 45 45 LYS HA H 45 4.840 4.840 4.710 0.130 19694
1146 1 3 . 1 1 45 45 LYS CA C 45 54.360 54.360 53.025 1.335 19694
1147 1 3 . 1 1 45 45 LYS CB C 45 32.430 32.430 33.448 -1.018 19694
1148 1 3 . 1 1 45 45 LYS H H 45 8.180 8.180 7.933 0.247 19694
1149 1 3 . 1 1 46 46 PRO HA H 46 4.477 4.477 4.514 -0.037 19694
1150 1 3 . 1 1 46 46 PRO CA C 46 62.700 62.700 63.203 -0.503 19694
1151 1 3 . 1 1 46 46 PRO CB C 46 32.490 32.490 32.020 0.470 19694
1152 1 3 . 1 1 47 47 ILE N N 47 125.280 125.280 123.161 2.119 19694
1153 1 3 . 1 1 47 47 ILE HA H 47 3.830 3.830 4.297 -0.467 19694
1154 1 3 . 1 1 47 47 ILE CA C 47 61.040 61.040 60.781 0.259 19694
1155 1 3 . 1 1 47 47 ILE CB C 47 37.440 37.440 37.686 -0.246 19694
1156 1 3 . 1 1 47 47 ILE H H 47 8.540 8.540 8.923 -0.383 19694
1157 1 3 . 1 1 48 48 GLY N N 48 114.120 114.120 113.424 0.696 19694
1158 1 3 . 1 1 48 48 GLY CA C 48 45.240 45.240 44.681 0.559 19694
1159 1 3 . 1 1 48 48 GLY H H 48 8.660 8.660 8.417 0.243 19694
1160 1 3 . 1 1 49 49 CYS N N 49 117.140 117.140 120.779 -3.639 19694
1161 1 3 . 1 1 49 49 CYS HA H 49 4.280 4.280 4.281 -0.001 19694
1162 1 3 . 1 1 49 49 CYS CA C 49 60.880 60.880 60.326 0.554 19694
1163 1 3 . 1 1 49 49 CYS CB C 49 27.650 27.650 27.988 -0.338 19694
1164 1 3 . 1 1 49 49 CYS H H 49 9.210 9.210 8.678 0.532 19694
1165 1 3 . 1 1 50 50 ASP N N 50 119.300 119.300 121.243 -1.943 19694
1166 1 3 . 1 1 50 50 ASP HA H 50 4.620 4.620 4.681 -0.061 19694
1167 1 3 . 1 1 50 50 ASP CA C 50 54.160 54.160 55.456 -1.296 19694
1168 1 3 . 1 1 50 50 ASP CB C 50 40.380 40.380 40.202 0.178 19694
1169 1 3 . 1 1 50 50 ASP H H 50 8.800 8.800 8.462 0.338 19694
1170 1 3 . 1 1 51 51 CYS N N 51 118.150 118.150 117.062 1.088 19694
1171 1 3 . 1 1 51 51 CYS HA H 51 4.620 4.620 4.737 -0.117 19694
1172 1 3 . 1 1 51 51 CYS CA C 51 58.030 58.030 56.630 1.400 19694
1173 1 3 . 1 1 51 51 CYS CB C 51 30.090 30.090 31.681 -1.591 19694
1174 1 3 . 1 1 51 51 CYS H H 51 7.590 7.590 7.496 0.094 19694
1175 1 3 . 1 1 52 52 LYS N N 52 123.800 123.800 122.359 1.441 19694
1176 1 3 . 1 1 52 52 LYS HA H 52 4.180 4.180 4.354 -0.174 19694
1177 1 3 . 1 1 52 52 LYS CA C 52 57.240 57.240 56.032 1.208 19694
1178 1 3 . 1 1 52 52 LYS CB C 52 33.030 33.030 30.994 2.036 19694
1179 1 3 . 1 1 52 52 LYS H H 52 8.600 8.600 8.451 0.149 19694
1180 1 3 . 1 1 53 53 ASP N N 53 124.900 124.900 124.632 0.268 19694
1181 1 3 . 1 1 53 53 ASP HA H 53 4.230 4.230 4.732 -0.502 19694
1182 1 3 . 1 1 53 53 ASP CA C 53 53.130 53.130 52.608 0.522 19694
1183 1 3 . 1 1 53 53 ASP CB C 53 42.230 42.230 40.681 1.549 19694
1184 1 3 . 1 1 53 53 ASP H H 53 8.250 8.250 8.523 -0.273 19694
1185 1 3 . 1 1 54 54 LEU N N 54 130.160 130.160 124.698 5.462 19694
1186 1 3 . 1 1 54 54 LEU HA H 54 4.440 4.440 4.550 -0.110 19694
1187 1 3 . 1 1 54 54 LEU CA C 54 53.340 53.340 55.515 -2.175 19694
1188 1 3 . 1 1 54 54 LEU CB C 54 41.170 41.170 43.351 -2.181 19694
1189 1 3 . 1 1 54 54 LEU H H 54 8.670 8.670 8.929 -0.259 19694
1190 1 3 . 1 1 55 55 SER N N 55 113.820 113.820 121.427 -7.607 19694
1191 1 3 . 1 1 55 55 SER HA H 55 5.580 5.580 5.134 0.446 19694
1192 1 3 . 1 1 55 55 SER CA C 55 55.850 55.850 56.510 -0.660 19694
1193 1 3 . 1 1 55 55 SER CB C 55 67.300 67.300 64.303 2.997 19694
1194 1 3 . 1 1 55 55 SER H H 55 8.160 8.160 8.413 -0.253 19694
1195 1 3 . 1 1 56 56 TYR N N 56 122.610 122.610 125.198 -2.588 19694
1196 1 3 . 1 1 56 56 TYR HA H 56 4.620 4.620 4.640 -0.020 19694
1197 1 3 . 1 1 56 56 TYR CA C 56 58.810 58.810 58.736 0.074 19694
1198 1 3 . 1 1 56 56 TYR CB C 56 41.000 41.000 42.760 -1.760 19694
1199 1 3 . 1 1 56 56 TYR H H 56 8.450 8.450 8.857 -0.407 19694
1200 1 3 . 1 1 57 57 LYS N N 57 126.020 126.020 128.139 -2.119 19694
1201 1 3 . 1 1 57 57 LYS HA H 57 3.470 3.470 3.938 -0.468 19694
1202 1 3 . 1 1 57 57 LYS CA C 57 58.100 58.100 57.406 0.694 19694
1203 1 3 . 1 1 57 57 LYS CB C 57 29.480 29.480 32.098 -2.618 19694
1204 1 3 . 1 1 57 57 LYS H H 57 8.920 8.920 8.735 0.185 19694
1205 1 3 . 1 1 58 58 ASP HA H 58 3.830 3.830 4.234 -0.404 19694
1206 1 3 . 1 1 58 58 ASP CA C 58 54.900 54.900 55.287 -0.387 19694
1207 1 3 . 1 1 58 58 ASP CB C 58 40.080 40.080 40.495 -0.415 19694
1208 1 3 . 1 1 58 58 ASP H H 58 8.400 8.400 8.555 -0.155 19694
1209 1 3 . 1 1 59 59 ARG N N 59 121.190 121.190 116.284 4.906 19694
1210 1 3 . 1 1 59 59 ARG HA H 59 4.250 4.250 4.510 -0.260 19694
1211 1 3 . 1 1 59 59 ARG CA C 59 55.580 55.580 54.169 1.411 19694
1212 1 3 . 1 1 59 59 ARG CB C 59 33.460 33.460 33.300 0.160 19694
1213 1 3 . 1 1 59 59 ARG H H 59 7.980 7.980 7.974 0.006 19694
1214 1 3 . 1 1 60 60 HIS N N 60 118.420 118.420 117.893 0.527 19694
1215 1 3 . 1 1 60 60 HIS HA H 60 5.270 5.270 5.632 -0.362 19694
1216 1 3 . 1 1 60 60 HIS CA C 60 55.010 55.010 55.311 -0.301 19694
1217 1 3 . 1 1 60 60 HIS CB C 60 32.380 32.380 33.196 -0.816 19694
1218 1 3 . 1 1 60 60 HIS H H 60 8.350 8.350 8.131 0.219 19694
1219 1 3 . 1 1 61 61 TRP N N 61 119.990 119.990 118.462 1.528 19694
1220 1 3 . 1 1 61 61 TRP HA H 61 5.930 5.930 4.789 1.141 19694
1221 1 3 . 1 1 61 61 TRP CA C 61 57.400 57.400 57.101 0.299 19694
1222 1 3 . 1 1 61 61 TRP CB C 61 35.380 35.380 34.169 1.211 19694
1223 1 3 . 1 1 61 61 TRP H H 61 9.310 9.310 9.249 0.061 19694
1224 1 3 . 1 1 62 62 HIS N N 62 117.270 117.270 121.233 -3.963 19694
1225 1 3 . 1 1 62 62 HIS HA H 62 4.600 4.600 4.941 -0.341 19694
1226 1 3 . 1 1 62 62 HIS CA C 62 59.210 59.210 57.119 2.091 19694
1227 1 3 . 1 1 62 62 HIS CB C 62 31.200 31.200 30.340 0.861 19694
1228 1 3 . 1 1 62 62 HIS H H 62 8.430 8.430 9.154 -0.724 19694
1229 1 3 . 1 1 63 63 GLU N N 63 124.640 124.640 127.916 -3.276 19694
1230 1 3 . 1 1 63 63 GLU HA H 63 3.827 3.827 3.987 -0.160 19694
1231 1 3 . 1 1 63 63 GLU CA C 63 61.020 61.020 59.647 1.373 19694
1232 1 3 . 1 1 63 63 GLU CB C 63 30.310 30.310 29.654 0.656 19694
1233 1 3 . 1 1 63 63 GLU H H 63 9.040 9.040 8.280 0.760 19694
1234 1 3 . 1 1 64 64 ALA N N 64 117.050 117.050 117.791 -0.741 19694
1235 1 3 . 1 1 64 64 ALA HA H 64 4.230 4.230 4.437 -0.207 19694
1236 1 3 . 1 1 64 64 ALA CA C 64 54.000 54.000 52.927 1.073 19694
1237 1 3 . 1 1 64 64 ALA CB C 64 18.880 18.880 19.073 -0.193 19694
1238 1 3 . 1 1 64 64 ALA H H 64 8.680 8.680 8.227 0.453 19694
1239 1 3 . 1 1 65 65 CYS N N 65 115.380 115.380 117.439 -2.059 19694
1240 1 3 . 1 1 65 65 CYS HA H 65 4.295 4.295 4.561 -0.266 19694
1241 1 3 . 1 1 65 65 CYS CA C 65 59.850 59.850 60.579 -0.729 19694
1242 1 3 . 1 1 65 65 CYS CB C 65 32.840 32.840 27.438 5.402 19694
1243 1 3 . 1 1 65 65 CYS H H 65 7.490 7.490 8.305 -0.815 19694
1244 1 3 . 1 1 66 66 PHE N N 66 122.020 122.020 122.685 -0.665 19694
1245 1 3 . 1 1 66 66 PHE HA H 66 3.890 3.890 3.755 0.135 19694
1246 1 3 . 1 1 66 66 PHE CA C 66 57.010 57.010 58.622 -1.612 19694
1247 1 3 . 1 1 66 66 PHE CB C 66 38.070 38.070 37.894 0.176 19694
1248 1 3 . 1 1 66 66 PHE H H 66 7.110 7.110 7.695 -0.585 19694
1249 1 3 . 1 1 67 67 HIS N N 67 121.280 121.280 120.953 0.327 19694
1250 1 3 . 1 1 67 67 HIS HA H 67 4.720 4.720 5.212 -0.492 19694
1251 1 3 . 1 1 67 67 HIS CA C 67 52.730 52.730 53.726 -0.996 19694
1252 1 3 . 1 1 67 67 HIS CB C 67 32.230 32.230 31.835 0.395 19694
1253 1 3 . 1 1 67 67 HIS H H 67 7.380 7.380 7.024 0.356 19694
1254 1 3 . 1 1 68 68 CYS N N 68 121.590 121.590 119.060 2.530 19694
1255 1 3 . 1 1 68 68 CYS HA H 68 3.960 3.960 4.898 -0.938 19694
1256 1 3 . 1 1 68 68 CYS CA C 68 59.790 59.790 58.230 1.560 19694
1257 1 3 . 1 1 68 68 CYS CB C 68 31.200 31.200 29.748 1.452 19694
1258 1 3 . 1 1 68 68 CYS H H 68 8.530 8.530 8.344 0.186 19694
1259 1 3 . 1 1 69 69 SER N N 69 126.530 126.530 121.078 5.452 19694
1260 1 3 . 1 1 69 69 SER HA H 69 4.310 4.310 4.369 -0.059 19694
1261 1 3 . 1 1 69 69 SER CA C 69 61.760 61.760 61.101 0.659 19694
1262 1 3 . 1 1 69 69 SER CB C 69 64.040 64.040 63.289 0.751 19694
1263 1 3 . 1 1 69 69 SER H H 69 9.460 9.460 8.812 0.648 19694
1264 1 3 . 1 1 70 70 GLN N N 70 122.370 122.370 119.242 3.128 19694
1265 1 3 . 1 1 70 70 GLN HA H 70 4.510 4.510 4.384 0.126 19694
1266 1 3 . 1 1 70 70 GLN CA C 70 57.840 57.840 57.199 0.641 19694
1267 1 3 . 1 1 70 70 GLN CB C 70 30.430 30.430 29.532 0.898 19694
1268 1 3 . 1 1 70 70 GLN H H 70 8.980 8.980 8.116 0.864 19694
1269 1 3 . 1 1 71 71 CYS N N 71 118.860 118.860 116.419 2.441 19694
1270 1 3 . 1 1 71 71 CYS HA H 71 4.720 4.720 4.782 -0.062 19694
1271 1 3 . 1 1 71 71 CYS CA C 71 59.770 59.770 58.272 1.498 19694
1272 1 3 . 1 1 71 71 CYS CB C 71 31.910 31.910 27.863 4.048 19694
1273 1 3 . 1 1 71 71 CYS H H 71 8.220 8.220 7.815 0.405 19694
1274 1 3 . 1 1 72 72 ARG N N 72 114.380 114.380 118.751 -4.371 19694
1275 1 3 . 1 1 72 72 ARG HA H 72 3.965 3.965 3.895 0.070 19694
1276 1 3 . 1 1 72 72 ARG CA C 72 58.030 58.030 57.241 0.789 19694
1277 1 3 . 1 1 72 72 ARG CB C 72 27.720 27.720 28.590 -0.870 19694
1278 1 3 . 1 1 72 72 ARG H H 72 7.380 7.380 7.793 -0.413 19694
1279 1 3 . 1 1 73 73 ASN N N 73 121.480 121.480 115.603 5.877 19694
1280 1 3 . 1 1 73 73 ASN HA H 73 4.630 4.630 4.652 -0.022 19694
1281 1 3 . 1 1 73 73 ASN CA C 73 54.110 54.110 54.249 -0.140 19694
1282 1 3 . 1 1 73 73 ASN CB C 73 38.870 38.870 39.535 -0.665 19694
1283 1 3 . 1 1 73 73 ASN H H 73 8.722 8.722 8.162 0.560 19694
1284 1 3 . 1 1 74 74 SER N N 74 114.710 114.710 117.612 -2.902 19694
1285 1 3 . 1 1 74 74 SER HA H 74 4.060 4.060 4.875 -0.815 19694
1286 1 3 . 1 1 74 74 SER CA C 74 59.357 59.357 58.331 1.026 19694
1287 1 3 . 1 1 74 74 SER CB C 74 63.300 63.300 62.866 0.434 19694
1288 1 3 . 1 1 74 74 SER H H 74 8.690 8.690 8.494 0.196 19694
1289 1 3 . 1 1 75 75 LEU N N 75 125.757 125.757 126.955 -1.198 19694
1290 1 3 . 1 1 75 75 LEU HA H 75 4.280 4.280 4.311 -0.031 19694
1291 1 3 . 1 1 75 75 LEU CA C 75 53.510 53.510 54.756 -1.246 19694
1292 1 3 . 1 1 75 75 LEU CB C 75 42.200 42.200 41.705 0.495 19694
1293 1 3 . 1 1 75 75 LEU H H 75 7.970 7.970 8.027 -0.057 19694
1294 1 3 . 1 1 76 76 VAL N N 76 120.860 120.860 123.719 -2.859 19694
1295 1 3 . 1 1 76 76 VAL HA H 76 3.570 3.570 3.917 -0.347 19694
1296 1 3 . 1 1 76 76 VAL CA C 76 65.420 65.420 60.933 4.487 19694
1297 1 3 . 1 1 76 76 VAL CB C 76 31.540 31.540 35.613 -4.073 19694
1298 1 3 . 1 1 76 76 VAL H H 76 7.830 7.830 8.054 -0.224 19694
1299 1 3 . 1 1 77 77 ASP N N 77 122.360 122.360 124.394 -2.034 19694
1300 1 3 . 1 1 77 77 ASP HA H 77 4.230 4.230 4.461 -0.231 19694
1301 1 3 . 1 1 77 77 ASP CA C 77 56.200 56.200 55.869 0.331 19694
1302 1 3 . 1 1 77 77 ASP CB C 77 39.380 39.380 40.756 -1.376 19694
1303 1 3 . 1 1 77 77 ASP H H 77 8.910 8.910 8.618 0.292 19694
1304 1 3 . 1 1 78 78 LYS N N 78 118.100 118.100 118.409 -0.309 19694
1305 1 3 . 1 1 78 78 LYS HA H 78 4.870 4.870 4.636 0.234 19694
1306 1 3 . 1 1 78 78 LYS CA C 78 56.960 56.960 53.695 3.265 19694
1307 1 3 . 1 1 78 78 LYS CB C 78 34.680 34.680 33.745 0.935 19694
1308 1 3 . 1 1 78 78 LYS H H 78 7.660 7.660 7.639 0.021 19694
1309 1 3 . 1 1 79 79 PRO HA H 79 4.460 4.460 4.210 0.250 19694
1310 1 3 . 1 1 79 79 PRO CA C 79 62.520 62.520 62.967 -0.447 19694
1311 1 3 . 1 1 79 79 PRO CB C 79 32.160 32.160 31.839 0.321 19694
1312 1 3 . 1 1 80 80 PHE N N 80 114.050 114.050 117.060 -3.010 19694
1313 1 3 . 1 1 80 80 PHE HA H 80 4.910 4.910 5.048 -0.138 19694
1314 1 3 . 1 1 80 80 PHE CA C 80 56.060 56.060 55.033 1.027 19694
1315 1 3 . 1 1 80 80 PHE CB C 80 42.410 42.410 41.898 0.512 19694
1316 1 3 . 1 1 80 80 PHE H H 80 7.510 7.510 7.146 0.364 19694
1317 1 3 . 1 1 81 81 ALA N N 81 123.290 123.290 123.661 -0.371 19694
1318 1 3 . 1 1 81 81 ALA HA H 81 4.310 4.310 4.369 -0.059 19694
1319 1 3 . 1 1 81 81 ALA CA C 81 50.450 50.450 50.400 0.050 19694
1320 1 3 . 1 1 81 81 ALA CB C 81 21.920 21.920 18.989 2.930 19694
1321 1 3 . 1 1 81 81 ALA H H 81 9.030 9.030 9.029 0.001 19694
1322 1 3 . 1 1 82 82 ALA N N 82 122.490 122.490 128.685 -6.195 19694
1323 1 3 . 1 1 82 82 ALA HA H 82 5.110 5.110 4.371 0.739 19694
1324 1 3 . 1 1 82 82 ALA CA C 82 51.100 51.100 51.908 -0.809 19694
1325 1 3 . 1 1 82 82 ALA CB C 82 21.130 21.130 18.782 2.348 19694
1326 1 3 . 1 1 82 82 ALA H H 82 8.240 8.240 8.594 -0.354 19694
1327 1 3 . 1 1 83 83 LYS N N 83 123.580 123.580 126.072 -2.492 19694
1328 1 3 . 1 1 83 83 LYS HA H 83 4.490 4.490 4.493 -0.003 19694
1329 1 3 . 1 1 83 83 LYS CA C 83 55.800 55.800 55.407 0.393 19694
1330 1 3 . 1 1 83 83 LYS CB C 83 34.720 34.720 34.092 0.629 19694
1331 1 3 . 1 1 83 83 LYS H H 83 8.400 8.400 8.314 0.086 19694
1332 1 3 . 1 1 84 84 GLU N N 84 125.470 125.470 120.663 4.807 19694
1333 1 3 . 1 1 84 84 GLU HA H 84 3.820 3.820 4.114 -0.294 19694
1334 1 3 . 1 1 84 84 GLU CA C 84 58.620 58.620 58.981 -0.361 19694
1335 1 3 . 1 1 84 84 GLU CB C 84 27.210 27.210 29.739 -2.529 19694
1336 1 3 . 1 1 84 84 GLU H H 84 9.320 9.320 8.785 0.535 19694
1337 1 3 . 1 1 85 85 ASP N N 85 118.550 118.550 114.136 4.414 19694
1338 1 3 . 1 1 85 85 ASP HA H 85 4.600 4.600 4.761 -0.161 19694
1339 1 3 . 1 1 85 85 ASP CA C 85 55.400 55.400 54.111 1.289 19694
1340 1 3 . 1 1 85 85 ASP CB C 85 40.400 40.400 41.919 -1.519 19694
1341 1 3 . 1 1 85 85 ASP H H 85 8.730 8.730 8.198 0.532 19694
1342 1 3 . 1 1 86 86 GLN N N 86 119.050 119.050 116.698 2.352 19694
1343 1 3 . 1 1 86 86 GLN HA H 86 4.540 4.540 4.655 -0.115 19694
1344 1 3 . 1 1 86 86 GLN CA C 86 55.100 55.100 53.925 1.175 19694
1345 1 3 . 1 1 86 86 GLN CB C 86 31.110 31.110 32.017 -0.907 19694
1346 1 3 . 1 1 86 86 GLN H H 86 8.170 8.170 7.561 0.609 19694
1347 1 3 . 1 1 87 87 LEU N N 87 123.110 123.110 121.201 1.909 19694
1348 1 3 . 1 1 87 87 LEU HA H 87 4.620 4.620 5.195 -0.575 19694
1349 1 3 . 1 1 87 87 LEU CA C 87 54.520 54.520 53.952 0.568 19694
1350 1 3 . 1 1 87 87 LEU CB C 87 42.700 42.700 44.552 -1.852 19694
1351 1 3 . 1 1 87 87 LEU H H 87 8.490 8.490 8.481 0.009 19694
1352 1 3 . 1 1 88 88 LEU N N 88 123.690 123.690 120.050 3.640 19694
1353 1 3 . 1 1 88 88 LEU HA H 88 5.880 5.880 4.965 0.915 19694
1354 1 3 . 1 1 88 88 LEU CA C 88 53.340 53.340 52.842 0.498 19694
1355 1 3 . 1 1 88 88 LEU CB C 88 47.190 47.190 47.848 -0.658 19694
1356 1 3 . 1 1 88 88 LEU H H 88 8.930 8.930 8.360 0.570 19694
1357 1 3 . 1 1 89 89 CYS N N 89 122.270 122.270 119.701 2.569 19694
1358 1 3 . 1 1 89 89 CYS HA H 89 4.780 4.780 4.829 -0.049 19694
1359 1 3 . 1 1 89 89 CYS CA C 89 57.640 57.640 59.240 -1.600 19694
1360 1 3 . 1 1 89 89 CYS CB C 89 30.940 30.940 28.170 2.770 19694
1361 1 3 . 1 1 89 89 CYS H H 89 9.430 9.430 9.019 0.411 19694
1362 1 3 . 1 1 90 90 THR N N 90 110.620 110.620 117.396 -6.776 19694
1363 1 3 . 1 1 90 90 THR HA H 90 3.900 3.900 3.957 -0.057 19694
1364 1 3 . 1 1 90 90 THR CA C 90 65.460 65.460 65.860 -0.400 19694
1365 1 3 . 1 1 90 90 THR CB C 90 68.670 68.670 68.673 -0.003 19694
1366 1 3 . 1 1 90 90 THR H H 90 8.410 8.410 8.886 -0.476 19694
1367 1 3 . 1 1 91 91 ASP N N 91 123.470 123.470 121.661 1.809 19694
1368 1 3 . 1 1 91 91 ASP HA H 91 4.490 4.490 4.627 -0.137 19694
1369 1 3 . 1 1 91 91 ASP CA C 91 57.810 57.810 57.446 0.364 19694
1370 1 3 . 1 1 91 91 ASP CB C 91 41.160 41.160 40.543 0.617 19694
1371 1 3 . 1 1 91 91 ASP H H 91 8.150 8.150 8.489 -0.339 19694
1372 1 3 . 1 1 92 92 CYS N N 92 123.800 123.800 119.823 3.977 19694
1373 1 3 . 1 1 92 92 CYS HA H 92 3.970 3.970 4.288 -0.318 19694
1374 1 3 . 1 1 92 92 CYS CA C 92 64.100 64.100 61.834 2.267 19694
1375 1 3 . 1 1 92 92 CYS CB C 92 30.090 30.090 26.000 4.090 19694
1376 1 3 . 1 1 92 92 CYS H H 92 8.580 8.580 7.931 0.649 19694
1377 1 3 . 1 1 93 93 TYR N N 93 120.730 120.730 120.750 -0.020 19694
1378 1 3 . 1 1 93 93 TYR HA H 93 4.140 4.140 4.060 0.080 19694
1379 1 3 . 1 1 93 93 TYR CA C 93 60.380 60.380 61.428 -1.048 19694
1380 1 3 . 1 1 93 93 TYR CB C 93 39.300 39.300 38.260 1.040 19694
1381 1 3 . 1 1 93 93 TYR H H 93 8.540 8.540 9.148 -0.608 19694
1382 1 3 . 1 1 94 94 SER N N 94 115.010 115.010 112.977 2.033 19694
1383 1 3 . 1 1 94 94 SER HA H 94 4.220 4.220 4.051 0.169 19694
1384 1 3 . 1 1 94 94 SER CA C 94 59.300 59.300 61.066 -1.766 19694
1385 1 3 . 1 1 94 94 SER CB C 94 63.660 63.660 62.665 0.995 19694
1386 1 3 . 1 1 94 94 SER H H 94 7.750 7.750 8.110 -0.360 19694
1387 1 3 . 1 1 95 95 ASN N N 95 119.820 119.820 117.310 2.510 19694
1388 1 3 . 1 1 95 95 ASN HA H 95 4.510 4.510 4.545 -0.035 19694
1389 1 3 . 1 1 95 95 ASN CA C 95 53.880 53.880 55.583 -1.703 19694
1390 1 3 . 1 1 95 95 ASN CB C 95 39.300 39.300 38.886 0.414 19694
1391 1 3 . 1 1 95 95 ASN H H 95 7.780 7.780 7.892 -0.112 19694
1392 1 3 . 1 1 96 96 GLU N N 96 119.820 119.820 117.301 2.519 19694
1393 1 3 . 1 1 96 96 GLU HA H 96 4.096 4.096 4.182 -0.086 19694
1394 1 3 . 1 1 96 96 GLU CA C 96 56.910 56.910 57.206 -0.296 19694
1395 1 3 . 1 1 96 96 GLU CB C 96 30.220 30.220 29.485 0.735 19694
1396 1 3 . 1 1 96 96 GLU H H 96 7.950 7.950 7.685 0.265 19694
1397 1 3 . 1 1 97 97 TYR N N 97 120.370 120.370 119.930 0.440 19694
1398 1 3 . 1 1 97 97 TYR HA H 97 4.620 4.620 4.152 0.468 19694
1399 1 3 . 1 1 97 97 TYR CA C 97 57.700 57.700 58.861 -1.161 19694
1400 1 3 . 1 1 97 97 TYR CB C 97 38.710 38.710 38.839 -0.129 19694
1401 1 3 . 1 1 97 97 TYR H H 97 8.070 8.070 8.331 -0.261 19694
1402 1 4 . 1 1 2 2 THR N N 2 113.570 113.570 115.724 -2.154 19694
1403 1 4 . 1 1 2 2 THR HA H 2 4.240 4.240 4.137 0.103 19694
1404 1 4 . 1 1 2 2 THR CA C 2 62.130 62.130 63.914 -1.784 19694
1405 1 4 . 1 1 2 2 THR CB C 2 69.250 69.250 68.790 0.460 19694
1406 1 4 . 1 1 2 2 THR H H 2 8.090 8.090 8.222 -0.132 19694
1407 1 4 . 1 1 3 3 GLU N N 3 122.880 122.880 119.858 3.022 19694
1408 1 4 . 1 1 3 3 GLU HA H 3 4.280 4.280 4.345 -0.065 19694
1409 1 4 . 1 1 3 3 GLU CA C 3 56.860 56.860 56.110 0.750 19694
1410 1 4 . 1 1 3 3 GLU CB C 3 30.570 30.570 30.296 0.274 19694
1411 1 4 . 1 1 3 3 GLU H H 3 8.280 8.280 8.010 0.270 19694
1412 1 4 . 1 1 4 4 ARG N N 4 121.330 121.330 119.456 1.874 19694
1413 1 4 . 1 1 4 4 ARG HA H 4 4.300 4.300 4.539 -0.239 19694
1414 1 4 . 1 1 4 4 ARG CA C 4 55.870 55.870 55.225 0.645 19694
1415 1 4 . 1 1 4 4 ARG CB C 4 31.640 31.640 30.625 1.015 19694
1416 1 4 . 1 1 4 4 ARG H H 4 8.280 8.280 8.563 -0.283 19694
1417 1 4 . 1 1 5 5 PHE N N 5 125.490 125.490 125.155 0.335 19694
1418 1 4 . 1 1 5 5 PHE HA H 5 4.610 4.610 4.575 0.035 19694
1419 1 4 . 1 1 5 5 PHE CA C 5 56.380 56.380 56.481 -0.101 19694
1420 1 4 . 1 1 5 5 PHE CB C 5 39.560 39.560 39.678 -0.118 19694
1421 1 4 . 1 1 5 5 PHE H H 5 8.290 8.290 8.732 -0.442 19694
1422 1 4 . 1 1 6 6 ASP N N 6 123.260 123.260 121.563 1.697 19694
1423 1 4 . 1 1 6 6 ASP HA H 6 5.045 5.045 4.765 0.280 19694
1424 1 4 . 1 1 6 6 ASP CA C 6 52.180 52.180 53.069 -0.889 19694
1425 1 4 . 1 1 6 6 ASP CB C 6 44.210 44.210 44.801 -0.591 19694
1426 1 4 . 1 1 6 6 ASP H H 6 7.940 7.940 7.593 0.347 19694
1427 1 4 . 1 1 7 7 CYS N N 7 121.440 121.440 122.663 -1.223 19694
1428 1 4 . 1 1 7 7 CYS HA H 7 3.960 3.960 4.386 -0.426 19694
1429 1 4 . 1 1 7 7 CYS CA C 7 59.820 59.820 59.517 0.303 19694
1430 1 4 . 1 1 7 7 CYS CB C 7 30.950 30.950 26.252 4.698 19694
1431 1 4 . 1 1 7 7 CYS H H 7 8.700 8.700 8.643 0.057 19694
1432 1 4 . 1 1 8 8 HIS N N 8 129.390 129.390 130.174 -0.784 19694
1433 1 4 . 1 1 8 8 HIS HA H 8 4.200 4.200 4.252 -0.052 19694
1434 1 4 . 1 1 8 8 HIS CA C 8 58.240 58.240 59.706 -1.466 19694
1435 1 4 . 1 1 8 8 HIS CB C 8 29.480 29.480 30.004 -0.524 19694
1436 1 4 . 1 1 8 8 HIS H H 8 9.160 9.160 9.634 -0.474 19694
1437 1 4 . 1 1 9 9 HIS N N 9 118.740 118.740 117.568 1.172 19694
1438 1 4 . 1 1 9 9 HIS HA H 9 4.880 4.880 4.559 0.321 19694
1439 1 4 . 1 1 9 9 HIS CA C 9 58.680 58.680 57.185 1.495 19694
1440 1 4 . 1 1 9 9 HIS CB C 9 31.040 31.040 30.238 0.802 19694
1441 1 4 . 1 1 9 9 HIS H H 9 9.270 9.270 8.011 1.259 19694
1442 1 4 . 1 1 10 10 CYS N N 10 118.600 118.600 117.336 1.264 19694
1443 1 4 . 1 1 10 10 CYS HA H 10 4.600 4.600 4.399 0.201 19694
1444 1 4 . 1 1 10 10 CYS CA C 10 59.600 59.600 59.091 0.509 19694
1445 1 4 . 1 1 10 10 CYS CB C 10 32.330 32.330 27.805 4.524 19694
1446 1 4 . 1 1 10 10 CYS H H 10 8.550 8.550 7.828 0.722 19694
1447 1 4 . 1 1 11 11 ASN N N 11 116.220 116.220 118.305 -2.085 19694
1448 1 4 . 1 1 11 11 ASN HA H 11 4.410 4.410 4.356 0.054 19694
1449 1 4 . 1 1 11 11 ASN CA C 11 55.640 55.640 54.608 1.032 19694
1450 1 4 . 1 1 11 11 ASN CB C 11 38.200 38.200 37.761 0.439 19694
1451 1 4 . 1 1 11 11 ASN H H 11 7.690 7.690 8.652 -0.962 19694
1452 1 4 . 1 1 12 12 GLU N N 12 120.330 120.330 117.574 2.756 19694
1453 1 4 . 1 1 12 12 GLU HA H 12 4.220 4.220 4.489 -0.269 19694
1454 1 4 . 1 1 12 12 GLU CA C 12 56.700 56.700 55.352 1.348 19694
1455 1 4 . 1 1 12 12 GLU CB C 12 30.910 30.910 30.662 0.248 19694
1456 1 4 . 1 1 12 12 GLU H H 12 8.210 8.210 7.662 0.548 19694
1457 1 4 . 1 1 13 13 SER N N 13 116.190 116.190 119.668 -3.478 19694
1458 1 4 . 1 1 13 13 SER HA H 13 4.060 4.060 4.461 -0.401 19694
1459 1 4 . 1 1 13 13 SER CA C 13 59.350 59.350 58.682 0.668 19694
1460 1 4 . 1 1 13 13 SER CB C 13 63.820 63.820 63.575 0.245 19694
1461 1 4 . 1 1 13 13 SER H H 13 8.520 8.520 8.697 -0.177 19694
1462 1 4 . 1 1 14 14 LEU N N 14 126.060 126.060 126.659 -0.599 19694
1463 1 4 . 1 1 14 14 LEU HA H 14 4.310 4.310 4.341 -0.031 19694
1464 1 4 . 1 1 14 14 LEU CA C 14 54.100 54.100 55.828 -1.728 19694
1465 1 4 . 1 1 14 14 LEU CB C 14 42.200 42.200 41.620 0.580 19694
1466 1 4 . 1 1 14 14 LEU H H 14 8.910 8.910 7.710 1.200 19694
1467 1 4 . 1 1 15 15 PHE N N 15 120.660 120.660 121.219 -0.559 19694
1468 1 4 . 1 1 15 15 PHE HA H 15 4.480 4.480 4.599 -0.119 19694
1469 1 4 . 1 1 15 15 PHE CA C 15 60.400 60.400 56.624 3.776 19694
1470 1 4 . 1 1 15 15 PHE CB C 15 38.130 38.130 38.030 0.100 19694
1471 1 4 . 1 1 15 15 PHE H H 15 7.820 7.820 8.535 -0.715 19694
1472 1 4 . 1 1 16 16 GLY N N 16 114.730 114.730 110.923 3.807 19694
1473 1 4 . 1 1 16 16 GLY CA C 16 45.900 45.900 45.811 0.089 19694
1474 1 4 . 1 1 16 16 GLY H H 16 8.860 8.860 8.806 0.054 19694
1475 1 4 . 1 1 17 17 LYS N N 17 119.580 119.580 119.805 -0.225 19694
1476 1 4 . 1 1 17 17 LYS HA H 17 4.480 4.480 4.478 0.002 19694
1477 1 4 . 1 1 17 17 LYS CA C 17 54.460 54.460 54.553 -0.093 19694
1478 1 4 . 1 1 17 17 LYS CB C 17 35.800 35.800 33.992 1.808 19694
1479 1 4 . 1 1 17 17 LYS H H 17 8.030 8.030 7.261 0.769 19694
1480 1 4 . 1 1 18 18 LYS N N 18 120.330 120.330 122.019 -1.689 19694
1481 1 4 . 1 1 18 18 LYS HA H 18 4.280 4.280 4.331 -0.051 19694
1482 1 4 . 1 1 18 18 LYS CA C 18 56.800 56.800 57.581 -0.781 19694
1483 1 4 . 1 1 18 18 LYS CB C 18 33.010 33.010 33.039 -0.029 19694
1484 1 4 . 1 1 18 18 LYS H H 18 8.190 8.190 8.543 -0.353 19694
1485 1 4 . 1 1 19 19 TYR N N 19 117.500 117.500 114.420 3.080 19694
1486 1 4 . 1 1 19 19 TYR HA H 19 5.240 5.240 4.781 0.459 19694
1487 1 4 . 1 1 19 19 TYR CA C 19 55.340 55.340 56.452 -1.112 19694
1488 1 4 . 1 1 19 19 TYR CB C 19 42.850 42.850 40.231 2.619 19694
1489 1 4 . 1 1 19 19 TYR H H 19 7.610 7.610 7.903 -0.293 19694
1490 1 4 . 1 1 20 20 ILE N N 20 121.430 121.430 122.047 -0.617 19694
1491 1 4 . 1 1 20 20 ILE HA H 20 4.137 4.137 4.228 -0.091 19694
1492 1 4 . 1 1 20 20 ILE CA C 20 60.010 60.010 60.062 -0.052 19694
1493 1 4 . 1 1 20 20 ILE CB C 20 41.570 41.570 40.524 1.046 19694
1494 1 4 . 1 1 20 20 ILE H H 20 9.350 9.350 8.287 1.063 19694
1495 1 4 . 1 1 21 21 LEU N N 21 126.720 126.720 126.849 -0.129 19694
1496 1 4 . 1 1 21 21 LEU HA H 21 5.090 5.090 4.515 0.575 19694
1497 1 4 . 1 1 21 21 LEU CA C 21 54.020 54.020 54.344 -0.324 19694
1498 1 4 . 1 1 21 21 LEU CB C 21 43.720 43.720 40.575 3.146 19694
1499 1 4 . 1 1 21 21 LEU H H 21 8.530 8.530 8.507 0.023 19694
1500 1 4 . 1 1 22 22 ARG N N 22 123.930 123.930 126.471 -2.541 19694
1501 1 4 . 1 1 22 22 ARG HA H 22 4.440 4.440 4.481 -0.041 19694
1502 1 4 . 1 1 22 22 ARG CA C 22 55.600 55.600 53.881 1.719 19694
1503 1 4 . 1 1 22 22 ARG CB C 22 32.280 32.280 31.727 0.553 19694
1504 1 4 . 1 1 22 22 ARG H H 22 9.080 9.080 9.138 -0.058 19694
1505 1 4 . 1 1 23 23 GLU N N 23 128.500 128.500 124.197 4.303 19694
1506 1 4 . 1 1 23 23 GLU HA H 23 3.840 3.840 3.863 -0.023 19694
1507 1 4 . 1 1 23 23 GLU CA C 23 58.030 58.030 57.822 0.208 19694
1508 1 4 . 1 1 23 23 GLU CB C 23 27.200 27.200 27.490 -0.290 19694
1509 1 4 . 1 1 23 23 GLU H H 23 9.610 9.610 9.048 0.562 19694
1510 1 4 . 1 1 24 24 GLU N N 24 110.300 110.300 113.359 -3.059 19694
1511 1 4 . 1 1 24 24 GLU HA H 24 3.780 3.780 3.922 -0.142 19694
1512 1 4 . 1 1 24 24 GLU CA C 24 58.320 58.320 57.480 0.840 19694
1513 1 4 . 1 1 24 24 GLU CB C 24 28.220 28.220 28.285 -0.065 19694
1514 1 4 . 1 1 24 24 GLU H H 24 8.660 8.660 8.712 -0.052 19694
1515 1 4 . 1 1 25 25 SER N N 25 117.700 117.700 112.472 5.228 19694
1516 1 4 . 1 1 25 25 SER HA H 25 4.890 4.890 4.794 0.096 19694
1517 1 4 . 1 1 25 25 SER CA C 25 56.540 56.540 55.659 0.881 19694
1518 1 4 . 1 1 25 25 SER CB C 25 64.720 64.720 65.601 -0.881 19694
1519 1 4 . 1 1 25 25 SER H H 25 7.900 7.900 7.781 0.119 19694
1520 1 4 . 1 1 26 26 PRO HA H 26 4.995 4.995 4.814 0.181 19694
1521 1 4 . 1 1 26 26 PRO CA C 26 61.750 61.750 63.144 -1.394 19694
1522 1 4 . 1 1 26 26 PRO CB C 26 32.660 32.660 31.778 0.882 19694
1523 1 4 . 1 1 27 27 TYR N N 27 118.100 118.100 124.032 -5.932 19694
1524 1 4 . 1 1 27 27 TYR HA H 27 5.910 5.910 4.981 0.929 19694
1525 1 4 . 1 1 27 27 TYR CA C 27 56.830 56.830 55.158 1.672 19694
1526 1 4 . 1 1 27 27 TYR CB C 27 42.810 42.810 42.588 0.222 19694
1527 1 4 . 1 1 27 27 TYR H H 27 9.040 9.040 8.756 0.284 19694
1528 1 4 . 1 1 28 28 CYS N N 28 122.230 122.230 119.826 2.404 19694
1529 1 4 . 1 1 28 28 CYS HA H 28 4.850 4.850 4.654 0.196 19694
1530 1 4 . 1 1 28 28 CYS CA C 28 58.110 58.110 58.510 -0.399 19694
1531 1 4 . 1 1 28 28 CYS CB C 28 30.530 30.530 29.072 1.458 19694
1532 1 4 . 1 1 28 28 CYS H H 28 9.850 9.850 8.359 1.491 19694
1533 1 4 . 1 1 29 29 VAL N N 29 118.200 118.200 122.322 -4.122 19694
1534 1 4 . 1 1 29 29 VAL HA H 29 3.650 3.650 3.799 -0.149 19694
1535 1 4 . 1 1 29 29 VAL CA C 29 67.400 67.400 66.475 0.925 19694
1536 1 4 . 1 1 29 29 VAL CB C 29 31.860 31.860 31.074 0.786 19694
1537 1 4 . 1 1 29 29 VAL H H 29 8.430 8.430 8.945 -0.515 19694
1538 1 4 . 1 1 30 30 VAL N N 30 119.570 119.570 118.762 0.808 19694
1539 1 4 . 1 1 30 30 VAL HA H 30 3.860 3.860 3.672 0.188 19694
1540 1 4 . 1 1 30 30 VAL CA C 30 66.450 66.450 66.010 0.440 19694
1541 1 4 . 1 1 30 30 VAL CB C 30 31.540 31.540 30.617 0.923 19694
1542 1 4 . 1 1 30 30 VAL H H 30 7.700 7.700 7.969 -0.269 19694
1543 1 4 . 1 1 31 31 CYS N N 31 125.890 125.890 119.583 6.307 19694
1544 1 4 . 1 1 31 31 CYS HA H 31 3.830 3.830 3.925 -0.095 19694
1545 1 4 . 1 1 31 31 CYS CA C 31 65.850 65.850 64.289 1.561 19694
1546 1 4 . 1 1 31 31 CYS CB C 31 29.510 29.510 25.589 3.921 19694
1547 1 4 . 1 1 31 31 CYS H H 31 9.050 9.050 7.570 1.480 19694
1548 1 4 . 1 1 32 32 PHE N N 32 119.000 119.000 119.275 -0.275 19694
1549 1 4 . 1 1 32 32 PHE HA H 32 3.780 3.780 3.767 0.013 19694
1550 1 4 . 1 1 32 32 PHE CA C 32 62.610 62.610 61.916 0.694 19694
1551 1 4 . 1 1 32 32 PHE CB C 32 39.920 39.920 39.107 0.813 19694
1552 1 4 . 1 1 32 32 PHE H H 32 9.080 9.080 7.907 1.173 19694
1553 1 4 . 1 1 33 33 GLU N N 33 117.470 117.470 118.202 -0.732 19694
1554 1 4 . 1 1 33 33 GLU HA H 33 3.760 3.760 4.017 -0.257 19694
1555 1 4 . 1 1 33 33 GLU CA C 33 59.210 59.210 59.357 -0.147 19694
1556 1 4 . 1 1 33 33 GLU CB C 33 29.480 29.480 29.441 0.039 19694
1557 1 4 . 1 1 33 33 GLU H H 33 8.510 8.510 8.011 0.499 19694
1558 1 4 . 1 1 34 34 THR N N 34 114.140 114.140 115.057 -0.917 19694
1559 1 4 . 1 1 34 34 THR HA H 34 3.730 3.730 3.923 -0.193 19694
1560 1 4 . 1 1 34 34 THR CA C 34 65.890 65.890 66.085 -0.195 19694
1561 1 4 . 1 1 34 34 THR CB C 34 69.210 69.210 68.794 0.416 19694
1562 1 4 . 1 1 34 34 THR H H 34 7.880 7.880 8.210 -0.330 19694
1563 1 4 . 1 1 35 35 LEU N N 35 117.980 117.980 119.442 -1.462 19694
1564 1 4 . 1 1 35 35 LEU HA H 35 3.650 3.650 3.918 -0.268 19694
1565 1 4 . 1 1 35 35 LEU CA C 35 56.860 56.860 57.500 -0.640 19694
1566 1 4 . 1 1 35 35 LEU CB C 35 41.870 41.870 41.998 -0.128 19694
1567 1 4 . 1 1 35 35 LEU H H 35 7.660 7.660 7.813 -0.153 19694
1568 1 4 . 1 1 36 36 PHE N N 36 113.900 113.900 113.965 -0.065 19694
1569 1 4 . 1 1 36 36 PHE HA H 36 4.597 4.597 4.424 0.173 19694
1570 1 4 . 1 1 36 36 PHE CA C 36 56.860 56.860 56.350 0.510 19694
1571 1 4 . 1 1 36 36 PHE CB C 36 40.570 40.570 38.139 2.431 19694
1572 1 4 . 1 1 36 36 PHE H H 36 7.730 7.730 6.566 1.163 19694
1573 1 4 . 1 1 37 37 ALA N N 37 121.920 121.920 123.429 -1.509 19694
1574 1 4 . 1 1 37 37 ALA HA H 37 4.070 4.070 4.056 0.014 19694
1575 1 4 . 1 1 37 37 ALA CA C 37 52.900 52.900 52.497 0.403 19694
1576 1 4 . 1 1 37 37 ALA CB C 37 19.770 19.770 19.641 0.129 19694
1577 1 4 . 1 1 37 37 ALA H H 37 7.090 7.090 7.865 -0.775 19694
1578 1 4 . 1 1 38 38 ASN N N 38 119.230 119.230 118.994 0.236 19694
1579 1 4 . 1 1 38 38 ASN HA H 38 4.450 4.450 4.643 -0.193 19694
1580 1 4 . 1 1 38 38 ASN CA C 38 52.850 52.850 52.716 0.134 19694
1581 1 4 . 1 1 38 38 ASN CB C 38 38.950 38.950 40.014 -1.064 19694
1582 1 4 . 1 1 38 38 ASN H H 38 8.790 8.790 8.276 0.514 19694
1583 1 4 . 1 1 39 39 THR N N 39 116.330 116.330 115.664 0.666 19694
1584 1 4 . 1 1 39 39 THR HA H 39 3.990 3.990 4.323 -0.333 19694
1585 1 4 . 1 1 39 39 THR CA C 39 62.130 62.130 63.059 -0.929 19694
1586 1 4 . 1 1 39 39 THR CB C 39 69.920 69.920 69.638 0.282 19694
1587 1 4 . 1 1 39 39 THR H H 39 8.540 8.540 8.197 0.343 19694
1588 1 4 . 1 1 40 40 CYS N N 40 126.950 126.950 128.213 -1.263 19694
1589 1 4 . 1 1 40 40 CYS HA H 40 4.300 4.300 4.473 -0.173 19694
1590 1 4 . 1 1 40 40 CYS CA C 40 58.350 58.350 57.182 1.168 19694
1591 1 4 . 1 1 40 40 CYS CB C 40 31.600 31.600 26.619 4.981 19694
1592 1 4 . 1 1 40 40 CYS H H 40 7.940 7.940 8.457 -0.517 19694
1593 1 4 . 1 1 41 41 GLU N N 41 130.560 130.560 127.618 2.942 19694
1594 1 4 . 1 1 41 41 GLU HA H 41 3.690 3.690 3.848 -0.158 19694
1595 1 4 . 1 1 41 41 GLU CA C 41 58.600 58.600 59.128 -0.528 19694
1596 1 4 . 1 1 41 41 GLU CB C 41 30.460 30.460 29.434 1.026 19694
1597 1 4 . 1 1 41 41 GLU H H 41 8.810 8.810 8.686 0.124 19694
1598 1 4 . 1 1 42 42 GLU N N 42 119.680 119.680 118.165 1.515 19694
1599 1 4 . 1 1 42 42 GLU HA H 42 4.570 4.570 4.335 0.235 19694
1600 1 4 . 1 1 42 42 GLU CA C 42 58.000 58.000 58.134 -0.134 19694
1601 1 4 . 1 1 42 42 GLU CB C 42 31.680 31.680 30.586 1.094 19694
1602 1 4 . 1 1 42 42 GLU H H 42 8.500 8.500 8.129 0.371 19694
1603 1 4 . 1 1 43 43 CYS N N 43 115.600 115.600 116.177 -0.577 19694
1604 1 4 . 1 1 43 43 CYS HA H 43 5.010 5.010 4.673 0.337 19694
1605 1 4 . 1 1 43 43 CYS CA C 43 58.810 58.810 59.711 -0.901 19694
1606 1 4 . 1 1 43 43 CYS CB C 43 31.580 31.580 29.170 2.410 19694
1607 1 4 . 1 1 43 43 CYS H H 43 8.120 8.120 8.062 0.058 19694
1608 1 4 . 1 1 44 44 GLY N N 44 112.100 112.100 107.204 4.896 19694
1609 1 4 . 1 1 44 44 GLY CA C 44 46.420 46.420 45.275 1.145 19694
1610 1 4 . 1 1 44 44 GLY H H 44 7.900 7.900 8.585 -0.685 19694
1611 1 4 . 1 1 45 45 LYS N N 45 121.210 121.210 121.733 -0.523 19694
1612 1 4 . 1 1 45 45 LYS HA H 45 4.840 4.840 4.665 0.175 19694
1613 1 4 . 1 1 45 45 LYS CA C 45 54.360 54.360 52.782 1.578 19694
1614 1 4 . 1 1 45 45 LYS CB C 45 32.430 32.430 32.767 -0.337 19694
1615 1 4 . 1 1 45 45 LYS H H 45 8.180 8.180 7.839 0.341 19694
1616 1 4 . 1 1 46 46 PRO HA H 46 4.477 4.477 4.549 -0.072 19694
1617 1 4 . 1 1 46 46 PRO CA C 46 62.700 62.700 62.985 -0.285 19694
1618 1 4 . 1 1 46 46 PRO CB C 46 32.490 32.490 32.060 0.430 19694
1619 1 4 . 1 1 47 47 ILE N N 47 125.280 125.280 123.141 2.139 19694
1620 1 4 . 1 1 47 47 ILE HA H 47 3.830 3.830 4.307 -0.477 19694
1621 1 4 . 1 1 47 47 ILE CA C 47 61.040 61.040 60.791 0.249 19694
1622 1 4 . 1 1 47 47 ILE CB C 47 37.440 37.440 37.648 -0.208 19694
1623 1 4 . 1 1 47 47 ILE H H 47 8.540 8.540 8.867 -0.327 19694
1624 1 4 . 1 1 48 48 GLY N N 48 114.120 114.120 113.948 0.172 19694
1625 1 4 . 1 1 48 48 GLY CA C 48 45.240 45.240 44.191 1.049 19694
1626 1 4 . 1 1 48 48 GLY H H 48 8.660 8.660 8.447 0.213 19694
1627 1 4 . 1 1 49 49 CYS N N 49 117.140 117.140 116.978 0.162 19694
1628 1 4 . 1 1 49 49 CYS HA H 49 4.280 4.280 4.395 -0.115 19694
1629 1 4 . 1 1 49 49 CYS CA C 49 60.880 60.880 59.153 1.727 19694
1630 1 4 . 1 1 49 49 CYS CB C 49 27.650 27.650 27.865 -0.215 19694
1631 1 4 . 1 1 49 49 CYS H H 49 9.210 9.210 8.522 0.688 19694
1632 1 4 . 1 1 50 50 ASP N N 50 119.300 119.300 120.737 -1.437 19694
1633 1 4 . 1 1 50 50 ASP HA H 50 4.620 4.620 4.618 0.002 19694
1634 1 4 . 1 1 50 50 ASP CA C 50 54.160 54.160 55.027 -0.867 19694
1635 1 4 . 1 1 50 50 ASP CB C 50 40.380 40.380 40.605 -0.225 19694
1636 1 4 . 1 1 50 50 ASP H H 50 8.800 8.800 8.391 0.409 19694
1637 1 4 . 1 1 51 51 CYS N N 51 118.150 118.150 116.882 1.268 19694
1638 1 4 . 1 1 51 51 CYS HA H 51 4.620 4.620 4.737 -0.117 19694
1639 1 4 . 1 1 51 51 CYS CA C 51 58.030 58.030 57.087 0.943 19694
1640 1 4 . 1 1 51 51 CYS CB C 51 30.090 30.090 32.314 -2.224 19694
1641 1 4 . 1 1 51 51 CYS H H 51 7.590 7.590 7.427 0.163 19694
1642 1 4 . 1 1 52 52 LYS N N 52 123.800 123.800 122.708 1.092 19694
1643 1 4 . 1 1 52 52 LYS HA H 52 4.180 4.180 4.272 -0.092 19694
1644 1 4 . 1 1 52 52 LYS CA C 52 57.240 57.240 56.931 0.309 19694
1645 1 4 . 1 1 52 52 LYS CB C 52 33.030 33.030 31.855 1.175 19694
1646 1 4 . 1 1 52 52 LYS H H 52 8.600 8.600 8.588 0.012 19694
1647 1 4 . 1 1 53 53 ASP N N 53 124.900 124.900 124.244 0.656 19694
1648 1 4 . 1 1 53 53 ASP HA H 53 4.230 4.230 4.755 -0.525 19694
1649 1 4 . 1 1 53 53 ASP CA C 53 53.130 53.130 52.880 0.250 19694
1650 1 4 . 1 1 53 53 ASP CB C 53 42.230 42.230 41.330 0.900 19694
1651 1 4 . 1 1 53 53 ASP H H 53 8.250 8.250 8.432 -0.182 19694
1652 1 4 . 1 1 54 54 LEU N N 54 130.160 130.160 124.741 5.419 19694
1653 1 4 . 1 1 54 54 LEU HA H 54 4.440 4.440 4.739 -0.299 19694
1654 1 4 . 1 1 54 54 LEU CA C 54 53.340 53.340 54.477 -1.137 19694
1655 1 4 . 1 1 54 54 LEU CB C 54 41.170 41.170 43.473 -2.303 19694
1656 1 4 . 1 1 54 54 LEU H H 54 8.670 8.670 9.013 -0.343 19694
1657 1 4 . 1 1 55 55 SER N N 55 113.820 113.820 121.271 -7.451 19694
1658 1 4 . 1 1 55 55 SER HA H 55 5.580 5.580 5.146 0.434 19694
1659 1 4 . 1 1 55 55 SER CA C 55 55.850 55.850 56.643 -0.793 19694
1660 1 4 . 1 1 55 55 SER CB C 55 67.300 67.300 64.618 2.683 19694
1661 1 4 . 1 1 55 55 SER H H 55 8.160 8.160 8.620 -0.460 19694
1662 1 4 . 1 1 56 56 TYR N N 56 122.610 122.610 126.068 -3.458 19694
1663 1 4 . 1 1 56 56 TYR HA H 56 4.620 4.620 4.633 -0.013 19694
1664 1 4 . 1 1 56 56 TYR CA C 56 58.810 58.810 58.630 0.180 19694
1665 1 4 . 1 1 56 56 TYR CB C 56 41.000 41.000 41.739 -0.738 19694
1666 1 4 . 1 1 56 56 TYR H H 56 8.450 8.450 8.723 -0.273 19694
1667 1 4 . 1 1 57 57 LYS N N 57 126.020 126.020 129.440 -3.420 19694
1668 1 4 . 1 1 57 57 LYS HA H 57 3.470 3.470 3.874 -0.404 19694
1669 1 4 . 1 1 57 57 LYS CA C 57 58.100 58.100 57.143 0.957 19694
1670 1 4 . 1 1 57 57 LYS CB C 57 29.480 29.480 32.065 -2.585 19694
1671 1 4 . 1 1 57 57 LYS H H 57 8.920 8.920 8.580 0.340 19694
1672 1 4 . 1 1 58 58 ASP HA H 58 3.830 3.830 4.204 -0.374 19694
1673 1 4 . 1 1 58 58 ASP CA C 58 54.900 54.900 55.389 -0.489 19694
1674 1 4 . 1 1 58 58 ASP CB C 58 40.080 40.080 40.609 -0.529 19694
1675 1 4 . 1 1 58 58 ASP H H 58 8.400 8.400 8.609 -0.209 19694
1676 1 4 . 1 1 59 59 ARG N N 59 121.190 121.190 116.012 5.178 19694
1677 1 4 . 1 1 59 59 ARG HA H 59 4.250 4.250 4.476 -0.226 19694
1678 1 4 . 1 1 59 59 ARG CA C 59 55.580 55.580 54.100 1.480 19694
1679 1 4 . 1 1 59 59 ARG CB C 59 33.460 33.460 33.316 0.144 19694
1680 1 4 . 1 1 59 59 ARG H H 59 7.980 7.980 7.279 0.701 19694
1681 1 4 . 1 1 60 60 HIS N N 60 118.420 118.420 117.692 0.728 19694
1682 1 4 . 1 1 60 60 HIS HA H 60 5.270 5.270 5.646 -0.376 19694
1683 1 4 . 1 1 60 60 HIS CA C 60 55.010 55.010 55.096 -0.086 19694
1684 1 4 . 1 1 60 60 HIS CB C 60 32.380 32.380 33.376 -0.996 19694
1685 1 4 . 1 1 60 60 HIS H H 60 8.350 8.350 8.064 0.286 19694
1686 1 4 . 1 1 61 61 TRP N N 61 119.990 119.990 118.455 1.535 19694
1687 1 4 . 1 1 61 61 TRP HA H 61 5.930 5.930 4.799 1.131 19694
1688 1 4 . 1 1 61 61 TRP CA C 61 57.400 57.400 57.099 0.301 19694
1689 1 4 . 1 1 61 61 TRP CB C 61 35.380 35.380 34.207 1.173 19694
1690 1 4 . 1 1 61 61 TRP H H 61 9.310 9.310 9.259 0.051 19694
1691 1 4 . 1 1 62 62 HIS N N 62 117.270 117.270 121.511 -4.241 19694
1692 1 4 . 1 1 62 62 HIS HA H 62 4.600 4.600 4.881 -0.281 19694
1693 1 4 . 1 1 62 62 HIS CA C 62 59.210 59.210 57.285 1.925 19694
1694 1 4 . 1 1 62 62 HIS CB C 62 31.200 31.200 30.403 0.797 19694
1695 1 4 . 1 1 62 62 HIS H H 62 8.430 8.430 9.114 -0.684 19694
1696 1 4 . 1 1 63 63 GLU N N 63 124.640 124.640 128.783 -4.143 19694
1697 1 4 . 1 1 63 63 GLU HA H 63 3.827 3.827 3.982 -0.155 19694
1698 1 4 . 1 1 63 63 GLU CA C 63 61.020 61.020 59.545 1.475 19694
1699 1 4 . 1 1 63 63 GLU CB C 63 30.310 30.310 29.658 0.652 19694
1700 1 4 . 1 1 63 63 GLU H H 63 9.040 9.040 8.449 0.591 19694
1701 1 4 . 1 1 64 64 ALA N N 64 117.050 117.050 117.896 -0.846 19694
1702 1 4 . 1 1 64 64 ALA HA H 64 4.230 4.230 4.227 0.003 19694
1703 1 4 . 1 1 64 64 ALA CA C 64 54.000 54.000 53.094 0.906 19694
1704 1 4 . 1 1 64 64 ALA CB C 64 18.880 18.880 19.154 -0.274 19694
1705 1 4 . 1 1 64 64 ALA H H 64 8.680 8.680 8.310 0.370 19694
1706 1 4 . 1 1 65 65 CYS N N 65 115.380 115.380 116.845 -1.465 19694
1707 1 4 . 1 1 65 65 CYS HA H 65 4.295 4.295 4.015 0.280 19694
1708 1 4 . 1 1 65 65 CYS CA C 65 59.850 59.850 60.185 -0.335 19694
1709 1 4 . 1 1 65 65 CYS CB C 65 32.840 32.840 27.070 5.769 19694
1710 1 4 . 1 1 65 65 CYS H H 65 7.490 7.490 8.097 -0.607 19694
1711 1 4 . 1 1 66 66 PHE N N 66 122.020 122.020 123.135 -1.115 19694
1712 1 4 . 1 1 66 66 PHE HA H 66 3.890 3.890 3.897 -0.007 19694
1713 1 4 . 1 1 66 66 PHE CA C 66 57.010 57.010 58.480 -1.470 19694
1714 1 4 . 1 1 66 66 PHE CB C 66 38.070 38.070 38.180 -0.110 19694
1715 1 4 . 1 1 66 66 PHE H H 66 7.110 7.110 7.599 -0.489 19694
1716 1 4 . 1 1 67 67 HIS N N 67 121.280 121.280 121.995 -0.715 19694
1717 1 4 . 1 1 67 67 HIS HA H 67 4.720 4.720 5.284 -0.564 19694
1718 1 4 . 1 1 67 67 HIS CA C 67 52.730 52.730 52.809 -0.079 19694
1719 1 4 . 1 1 67 67 HIS CB C 67 32.230 32.230 30.810 1.420 19694
1720 1 4 . 1 1 67 67 HIS H H 67 7.380 7.380 7.809 -0.429 19694
1721 1 4 . 1 1 68 68 CYS N N 68 121.590 121.590 118.852 2.738 19694
1722 1 4 . 1 1 68 68 CYS HA H 68 3.960 3.960 4.948 -0.988 19694
1723 1 4 . 1 1 68 68 CYS CA C 68 59.790 59.790 57.885 1.905 19694
1724 1 4 . 1 1 68 68 CYS CB C 68 31.200 31.200 29.294 1.906 19694
1725 1 4 . 1 1 68 68 CYS H H 68 8.530 8.530 8.383 0.147 19694
1726 1 4 . 1 1 69 69 SER N N 69 126.530 126.530 120.138 6.392 19694
1727 1 4 . 1 1 69 69 SER HA H 69 4.310 4.310 4.070 0.240 19694
1728 1 4 . 1 1 69 69 SER CA C 69 61.760 61.760 60.774 0.986 19694
1729 1 4 . 1 1 69 69 SER CB C 69 64.040 64.040 63.341 0.699 19694
1730 1 4 . 1 1 69 69 SER H H 69 9.460 9.460 8.766 0.694 19694
1731 1 4 . 1 1 70 70 GLN N N 70 122.370 122.370 118.526 3.844 19694
1732 1 4 . 1 1 70 70 GLN HA H 70 4.510 4.510 4.424 0.086 19694
1733 1 4 . 1 1 70 70 GLN CA C 70 57.840 57.840 57.228 0.612 19694
1734 1 4 . 1 1 70 70 GLN CB C 70 30.430 30.430 29.974 0.456 19694
1735 1 4 . 1 1 70 70 GLN H H 70 8.980 8.980 7.831 1.149 19694
1736 1 4 . 1 1 71 71 CYS N N 71 118.860 118.860 116.807 2.053 19694
1737 1 4 . 1 1 71 71 CYS HA H 71 4.720 4.720 4.686 0.034 19694
1738 1 4 . 1 1 71 71 CYS CA C 71 59.770 59.770 58.246 1.524 19694
1739 1 4 . 1 1 71 71 CYS CB C 71 31.910 31.910 28.173 3.737 19694
1740 1 4 . 1 1 71 71 CYS H H 71 8.220 8.220 7.715 0.505 19694
1741 1 4 . 1 1 72 72 ARG N N 72 114.380 114.380 115.727 -1.347 19694
1742 1 4 . 1 1 72 72 ARG HA H 72 3.965 3.965 3.760 0.205 19694
1743 1 4 . 1 1 72 72 ARG CA C 72 58.030 58.030 57.220 0.810 19694
1744 1 4 . 1 1 72 72 ARG CB C 72 27.720 27.720 26.988 0.732 19694
1745 1 4 . 1 1 72 72 ARG H H 72 7.380 7.380 7.749 -0.369 19694
1746 1 4 . 1 1 73 73 ASN N N 73 121.480 121.480 116.434 5.046 19694
1747 1 4 . 1 1 73 73 ASN HA H 73 4.630 4.630 4.646 -0.016 19694
1748 1 4 . 1 1 73 73 ASN CA C 73 54.110 54.110 54.036 0.074 19694
1749 1 4 . 1 1 73 73 ASN CB C 73 38.870 38.870 39.607 -0.737 19694
1750 1 4 . 1 1 73 73 ASN H H 73 8.722 8.722 8.152 0.570 19694
1751 1 4 . 1 1 74 74 SER N N 74 114.710 114.710 117.645 -2.935 19694
1752 1 4 . 1 1 74 74 SER HA H 74 4.060 4.060 4.822 -0.762 19694
1753 1 4 . 1 1 74 74 SER CA C 74 59.357 59.357 58.049 1.308 19694
1754 1 4 . 1 1 74 74 SER CB C 74 63.300 63.300 62.718 0.582 19694
1755 1 4 . 1 1 74 74 SER H H 74 8.690 8.690 8.505 0.185 19694
1756 1 4 . 1 1 75 75 LEU N N 75 125.757 125.757 127.024 -1.267 19694
1757 1 4 . 1 1 75 75 LEU HA H 75 4.280 4.280 4.294 -0.014 19694
1758 1 4 . 1 1 75 75 LEU CA C 75 53.510 53.510 54.811 -1.301 19694
1759 1 4 . 1 1 75 75 LEU CB C 75 42.200 42.200 41.765 0.435 19694
1760 1 4 . 1 1 75 75 LEU H H 75 7.970 7.970 8.056 -0.086 19694
1761 1 4 . 1 1 76 76 VAL N N 76 120.860 120.860 124.365 -3.505 19694
1762 1 4 . 1 1 76 76 VAL HA H 76 3.570 3.570 3.929 -0.359 19694
1763 1 4 . 1 1 76 76 VAL CA C 76 65.420 65.420 60.923 4.497 19694
1764 1 4 . 1 1 76 76 VAL CB C 76 31.540 31.540 34.824 -3.284 19694
1765 1 4 . 1 1 76 76 VAL H H 76 7.830 7.830 8.048 -0.218 19694
1766 1 4 . 1 1 77 77 ASP N N 77 122.360 122.360 121.990 0.370 19694
1767 1 4 . 1 1 77 77 ASP HA H 77 4.230 4.230 4.444 -0.214 19694
1768 1 4 . 1 1 77 77 ASP CA C 77 56.200 56.200 55.796 0.404 19694
1769 1 4 . 1 1 77 77 ASP CB C 77 39.380 39.380 40.309 -0.929 19694
1770 1 4 . 1 1 77 77 ASP H H 77 8.910 8.910 8.470 0.440 19694
1771 1 4 . 1 1 78 78 LYS N N 78 118.100 118.100 119.023 -0.923 19694
1772 1 4 . 1 1 78 78 LYS HA H 78 4.870 4.870 4.616 0.254 19694
1773 1 4 . 1 1 78 78 LYS CA C 78 56.960 56.960 53.495 3.465 19694
1774 1 4 . 1 1 78 78 LYS CB C 78 34.680 34.680 33.859 0.820 19694
1775 1 4 . 1 1 78 78 LYS H H 78 7.660 7.660 7.611 0.049 19694
1776 1 4 . 1 1 79 79 PRO HA H 79 4.460 4.460 4.228 0.232 19694
1777 1 4 . 1 1 79 79 PRO CA C 79 62.520 62.520 62.917 -0.397 19694
1778 1 4 . 1 1 79 79 PRO CB C 79 32.160 32.160 31.896 0.264 19694
1779 1 4 . 1 1 80 80 PHE N N 80 114.050 114.050 117.095 -3.045 19694
1780 1 4 . 1 1 80 80 PHE HA H 80 4.910 4.910 5.042 -0.132 19694
1781 1 4 . 1 1 80 80 PHE CA C 80 56.060 56.060 55.176 0.884 19694
1782 1 4 . 1 1 80 80 PHE CB C 80 42.410 42.410 41.895 0.515 19694
1783 1 4 . 1 1 80 80 PHE H H 80 7.510 7.510 7.236 0.274 19694
1784 1 4 . 1 1 81 81 ALA N N 81 123.290 123.290 123.493 -0.203 19694
1785 1 4 . 1 1 81 81 ALA HA H 81 4.310 4.310 4.367 -0.057 19694
1786 1 4 . 1 1 81 81 ALA CA C 81 50.450 50.450 50.412 0.038 19694
1787 1 4 . 1 1 81 81 ALA CB C 81 21.920 21.920 18.893 3.027 19694
1788 1 4 . 1 1 81 81 ALA H H 81 9.030 9.030 8.924 0.106 19694
1789 1 4 . 1 1 82 82 ALA N N 82 122.490 122.490 128.363 -5.873 19694
1790 1 4 . 1 1 82 82 ALA HA H 82 5.110 5.110 4.392 0.718 19694
1791 1 4 . 1 1 82 82 ALA CA C 82 51.100 51.100 51.933 -0.833 19694
1792 1 4 . 1 1 82 82 ALA CB C 82 21.130 21.130 18.814 2.316 19694
1793 1 4 . 1 1 82 82 ALA H H 82 8.240 8.240 8.592 -0.352 19694
1794 1 4 . 1 1 83 83 LYS N N 83 123.580 123.580 125.912 -2.332 19694
1795 1 4 . 1 1 83 83 LYS HA H 83 4.490 4.490 4.465 0.025 19694
1796 1 4 . 1 1 83 83 LYS CA C 83 55.800 55.800 55.584 0.216 19694
1797 1 4 . 1 1 83 83 LYS CB C 83 34.720 34.720 34.108 0.612 19694
1798 1 4 . 1 1 83 83 LYS H H 83 8.400 8.400 8.294 0.106 19694
1799 1 4 . 1 1 84 84 GLU N N 84 125.470 125.470 120.093 5.377 19694
1800 1 4 . 1 1 84 84 GLU HA H 84 3.820 3.820 4.120 -0.300 19694
1801 1 4 . 1 1 84 84 GLU CA C 84 58.620 58.620 59.129 -0.509 19694
1802 1 4 . 1 1 84 84 GLU CB C 84 27.210 27.210 29.561 -2.351 19694
1803 1 4 . 1 1 84 84 GLU H H 84 9.320 9.320 8.659 0.661 19694
1804 1 4 . 1 1 85 85 ASP N N 85 118.550 118.550 114.189 4.361 19694
1805 1 4 . 1 1 85 85 ASP HA H 85 4.600 4.600 4.746 -0.146 19694
1806 1 4 . 1 1 85 85 ASP CA C 85 55.400 55.400 54.043 1.357 19694
1807 1 4 . 1 1 85 85 ASP CB C 85 40.400 40.400 42.069 -1.669 19694
1808 1 4 . 1 1 85 85 ASP H H 85 8.730 8.730 8.219 0.511 19694
1809 1 4 . 1 1 86 86 GLN N N 86 119.050 119.050 116.603 2.447 19694
1810 1 4 . 1 1 86 86 GLN HA H 86 4.540 4.540 4.486 0.054 19694
1811 1 4 . 1 1 86 86 GLN CA C 86 55.100 55.100 53.919 1.181 19694
1812 1 4 . 1 1 86 86 GLN CB C 86 31.110 31.110 31.445 -0.335 19694
1813 1 4 . 1 1 86 86 GLN H H 86 8.170 8.170 7.658 0.512 19694
1814 1 4 . 1 1 87 87 LEU N N 87 123.110 123.110 121.392 1.718 19694
1815 1 4 . 1 1 87 87 LEU HA H 87 4.620 4.620 5.191 -0.571 19694
1816 1 4 . 1 1 87 87 LEU CA C 87 54.520 54.520 54.037 0.483 19694
1817 1 4 . 1 1 87 87 LEU CB C 87 42.700 42.700 44.546 -1.846 19694
1818 1 4 . 1 1 87 87 LEU H H 87 8.490 8.490 8.510 -0.020 19694
1819 1 4 . 1 1 88 88 LEU N N 88 123.690 123.690 120.291 3.399 19694
1820 1 4 . 1 1 88 88 LEU HA H 88 5.880 5.880 4.953 0.927 19694
1821 1 4 . 1 1 88 88 LEU CA C 88 53.340 53.340 52.769 0.571 19694
1822 1 4 . 1 1 88 88 LEU CB C 88 47.190 47.190 47.754 -0.564 19694
1823 1 4 . 1 1 88 88 LEU H H 88 8.930 8.930 8.248 0.682 19694
1824 1 4 . 1 1 89 89 CYS N N 89 122.270 122.270 118.958 3.312 19694
1825 1 4 . 1 1 89 89 CYS HA H 89 4.780 4.780 4.848 -0.068 19694
1826 1 4 . 1 1 89 89 CYS CA C 89 57.640 57.640 59.193 -1.553 19694
1827 1 4 . 1 1 89 89 CYS CB C 89 30.940 30.940 28.017 2.923 19694
1828 1 4 . 1 1 89 89 CYS H H 89 9.430 9.430 9.095 0.335 19694
1829 1 4 . 1 1 90 90 THR N N 90 110.620 110.620 115.718 -5.098 19694
1830 1 4 . 1 1 90 90 THR HA H 90 3.900 3.900 3.953 -0.053 19694
1831 1 4 . 1 1 90 90 THR CA C 90 65.460 65.460 65.476 -0.016 19694
1832 1 4 . 1 1 90 90 THR CB C 90 68.670 68.670 68.759 -0.089 19694
1833 1 4 . 1 1 90 90 THR H H 90 8.410 8.410 8.813 -0.403 19694
1834 1 4 . 1 1 91 91 ASP N N 91 123.470 123.470 121.097 2.373 19694
1835 1 4 . 1 1 91 91 ASP HA H 91 4.490 4.490 4.626 -0.136 19694
1836 1 4 . 1 1 91 91 ASP CA C 91 57.810 57.810 57.010 0.800 19694
1837 1 4 . 1 1 91 91 ASP CB C 91 41.160 41.160 40.440 0.720 19694
1838 1 4 . 1 1 91 91 ASP H H 91 8.150 8.150 8.192 -0.042 19694
1839 1 4 . 1 1 92 92 CYS N N 92 123.800 123.800 119.691 4.109 19694
1840 1 4 . 1 1 92 92 CYS HA H 92 3.970 3.970 4.375 -0.405 19694
1841 1 4 . 1 1 92 92 CYS CA C 92 64.100 64.100 61.346 2.755 19694
1842 1 4 . 1 1 92 92 CYS CB C 92 30.090 30.090 26.141 3.949 19694
1843 1 4 . 1 1 92 92 CYS H H 92 8.580 8.580 7.838 0.742 19694
1844 1 4 . 1 1 93 93 TYR N N 93 120.730 120.730 121.125 -0.395 19694
1845 1 4 . 1 1 93 93 TYR HA H 93 4.140 4.140 4.101 0.039 19694
1846 1 4 . 1 1 93 93 TYR CA C 93 60.380 60.380 61.191 -0.810 19694
1847 1 4 . 1 1 93 93 TYR CB C 93 39.300 39.300 38.044 1.256 19694
1848 1 4 . 1 1 93 93 TYR H H 93 8.540 8.540 9.105 -0.565 19694
1849 1 4 . 1 1 94 94 SER N N 94 115.010 115.010 113.267 1.743 19694
1850 1 4 . 1 1 94 94 SER HA H 94 4.220 4.220 4.140 0.080 19694
1851 1 4 . 1 1 94 94 SER CA C 94 59.300 59.300 61.105 -1.806 19694
1852 1 4 . 1 1 94 94 SER CB C 94 63.660 63.660 62.753 0.907 19694
1853 1 4 . 1 1 94 94 SER H H 94 7.750 7.750 8.093 -0.343 19694
1854 1 4 . 1 1 95 95 ASN N N 95 119.820 119.820 118.533 1.287 19694
1855 1 4 . 1 1 95 95 ASN HA H 95 4.510 4.510 4.563 -0.053 19694
1856 1 4 . 1 1 95 95 ASN CA C 95 53.880 53.880 55.434 -1.554 19694
1857 1 4 . 1 1 95 95 ASN CB C 95 39.300 39.300 38.773 0.527 19694
1858 1 4 . 1 1 95 95 ASN H H 95 7.780 7.780 7.943 -0.163 19694
1859 1 4 . 1 1 96 96 GLU N N 96 119.820 119.820 118.207 1.613 19694
1860 1 4 . 1 1 96 96 GLU HA H 96 4.096 4.096 4.135 -0.039 19694
1861 1 4 . 1 1 96 96 GLU CA C 96 56.910 56.910 57.460 -0.550 19694
1862 1 4 . 1 1 96 96 GLU CB C 96 30.220 30.220 29.742 0.478 19694
1863 1 4 . 1 1 96 96 GLU H H 96 7.950 7.950 7.801 0.149 19694
1864 1 4 . 1 1 97 97 TYR N N 97 120.370 120.370 120.629 -0.259 19694
1865 1 4 . 1 1 97 97 TYR HA H 97 4.620 4.620 4.194 0.426 19694
1866 1 4 . 1 1 97 97 TYR CA C 97 57.700 57.700 59.667 -1.967 19694
1867 1 4 . 1 1 97 97 TYR CB C 97 38.710 38.710 38.684 0.026 19694
1868 1 4 . 1 1 97 97 TYR H H 97 8.070 8.070 8.089 -0.019 19694
1869 1 5 . 1 1 2 2 THR N N 2 113.570 113.570 116.306 -2.736 19694
1870 1 5 . 1 1 2 2 THR HA H 2 4.240 4.240 4.476 -0.236 19694
1871 1 5 . 1 1 2 2 THR CA C 2 62.130 62.130 62.356 -0.226 19694
1872 1 5 . 1 1 2 2 THR CB C 2 69.250 69.250 69.379 -0.129 19694
1873 1 5 . 1 1 2 2 THR H H 2 8.090 8.090 8.357 -0.267 19694
1874 1 5 . 1 1 3 3 GLU N N 3 122.880 122.880 121.271 1.609 19694
1875 1 5 . 1 1 3 3 GLU HA H 3 4.280 4.280 4.154 0.126 19694
1876 1 5 . 1 1 3 3 GLU CA C 3 56.860 56.860 56.798 0.062 19694
1877 1 5 . 1 1 3 3 GLU CB C 3 30.570 30.570 30.294 0.276 19694
1878 1 5 . 1 1 3 3 GLU H H 3 8.280 8.280 8.098 0.182 19694
1879 1 5 . 1 1 4 4 ARG N N 4 121.330 121.330 119.787 1.543 19694
1880 1 5 . 1 1 4 4 ARG HA H 4 4.300 4.300 4.543 -0.243 19694
1881 1 5 . 1 1 4 4 ARG CA C 4 55.870 55.870 55.261 0.609 19694
1882 1 5 . 1 1 4 4 ARG CB C 4 31.640 31.640 30.817 0.823 19694
1883 1 5 . 1 1 4 4 ARG H H 4 8.280 8.280 8.536 -0.256 19694
1884 1 5 . 1 1 5 5 PHE N N 5 125.490 125.490 124.835 0.655 19694
1885 1 5 . 1 1 5 5 PHE HA H 5 4.610 4.610 4.573 0.037 19694
1886 1 5 . 1 1 5 5 PHE CA C 5 56.380 56.380 56.823 -0.443 19694
1887 1 5 . 1 1 5 5 PHE CB C 5 39.560 39.560 39.824 -0.264 19694
1888 1 5 . 1 1 5 5 PHE H H 5 8.290 8.290 8.722 -0.432 19694
1889 1 5 . 1 1 6 6 ASP N N 6 123.260 123.260 121.390 1.870 19694
1890 1 5 . 1 1 6 6 ASP HA H 6 5.045 5.045 4.755 0.290 19694
1891 1 5 . 1 1 6 6 ASP CA C 6 52.180 52.180 53.141 -0.961 19694
1892 1 5 . 1 1 6 6 ASP CB C 6 44.210 44.210 44.975 -0.765 19694
1893 1 5 . 1 1 6 6 ASP H H 6 7.940 7.940 7.575 0.365 19694
1894 1 5 . 1 1 7 7 CYS N N 7 121.440 121.440 122.524 -1.084 19694
1895 1 5 . 1 1 7 7 CYS HA H 7 3.960 3.960 4.450 -0.490 19694
1896 1 5 . 1 1 7 7 CYS CA C 7 59.820 59.820 59.496 0.324 19694
1897 1 5 . 1 1 7 7 CYS CB C 7 30.950 30.950 26.085 4.865 19694
1898 1 5 . 1 1 7 7 CYS H H 7 8.700 8.700 8.633 0.067 19694
1899 1 5 . 1 1 8 8 HIS N N 8 129.390 129.390 129.879 -0.489 19694
1900 1 5 . 1 1 8 8 HIS HA H 8 4.200 4.200 4.264 -0.064 19694
1901 1 5 . 1 1 8 8 HIS CA C 8 58.240 58.240 59.456 -1.216 19694
1902 1 5 . 1 1 8 8 HIS CB C 8 29.480 29.480 30.006 -0.526 19694
1903 1 5 . 1 1 8 8 HIS H H 8 9.160 9.160 9.602 -0.442 19694
1904 1 5 . 1 1 9 9 HIS N N 9 118.740 118.740 116.746 1.994 19694
1905 1 5 . 1 1 9 9 HIS HA H 9 4.880 4.880 4.356 0.524 19694
1906 1 5 . 1 1 9 9 HIS CA C 9 58.680 58.680 56.938 1.742 19694
1907 1 5 . 1 1 9 9 HIS CB C 9 31.040 31.040 30.072 0.968 19694
1908 1 5 . 1 1 9 9 HIS H H 9 9.270 9.270 7.946 1.324 19694
1909 1 5 . 1 1 10 10 CYS N N 10 118.600 118.600 117.406 1.194 19694
1910 1 5 . 1 1 10 10 CYS HA H 10 4.600 4.600 4.378 0.222 19694
1911 1 5 . 1 1 10 10 CYS CA C 10 59.600 59.600 59.207 0.393 19694
1912 1 5 . 1 1 10 10 CYS CB C 10 32.330 32.330 27.890 4.440 19694
1913 1 5 . 1 1 10 10 CYS H H 10 8.550 8.550 7.835 0.715 19694
1914 1 5 . 1 1 11 11 ASN N N 11 116.220 116.220 117.046 -0.826 19694
1915 1 5 . 1 1 11 11 ASN HA H 11 4.410 4.410 4.393 0.017 19694
1916 1 5 . 1 1 11 11 ASN CA C 11 55.640 55.640 54.491 1.149 19694
1917 1 5 . 1 1 11 11 ASN CB C 11 38.200 38.200 36.502 1.698 19694
1918 1 5 . 1 1 11 11 ASN H H 11 7.690 7.690 8.675 -0.985 19694
1919 1 5 . 1 1 12 12 GLU N N 12 120.330 120.330 117.825 2.505 19694
1920 1 5 . 1 1 12 12 GLU HA H 12 4.220 4.220 4.529 -0.309 19694
1921 1 5 . 1 1 12 12 GLU CA C 12 56.700 56.700 54.788 1.912 19694
1922 1 5 . 1 1 12 12 GLU CB C 12 30.910 30.910 30.896 0.014 19694
1923 1 5 . 1 1 12 12 GLU H H 12 8.210 8.210 7.640 0.570 19694
1924 1 5 . 1 1 13 13 SER N N 13 116.190 116.190 119.759 -3.569 19694
1925 1 5 . 1 1 13 13 SER HA H 13 4.060 4.060 4.464 -0.404 19694
1926 1 5 . 1 1 13 13 SER CA C 13 59.350 59.350 58.835 0.515 19694
1927 1 5 . 1 1 13 13 SER CB C 13 63.820 63.820 63.610 0.210 19694
1928 1 5 . 1 1 13 13 SER H H 13 8.520 8.520 8.706 -0.186 19694
1929 1 5 . 1 1 14 14 LEU N N 14 126.060 126.060 126.431 -0.371 19694
1930 1 5 . 1 1 14 14 LEU HA H 14 4.310 4.310 4.333 -0.023 19694
1931 1 5 . 1 1 14 14 LEU CA C 14 54.100 54.100 55.865 -1.765 19694
1932 1 5 . 1 1 14 14 LEU CB C 14 42.200 42.200 41.816 0.384 19694
1933 1 5 . 1 1 14 14 LEU H H 14 8.910 8.910 7.749 1.161 19694
1934 1 5 . 1 1 15 15 PHE N N 15 120.660 120.660 121.058 -0.398 19694
1935 1 5 . 1 1 15 15 PHE HA H 15 4.480 4.480 4.549 -0.069 19694
1936 1 5 . 1 1 15 15 PHE CA C 15 60.400 60.400 56.810 3.590 19694
1937 1 5 . 1 1 15 15 PHE CB C 15 38.130 38.130 37.450 0.680 19694
1938 1 5 . 1 1 15 15 PHE H H 15 7.820 7.820 8.558 -0.738 19694
1939 1 5 . 1 1 16 16 GLY N N 16 114.730 114.730 111.646 3.084 19694
1940 1 5 . 1 1 16 16 GLY CA C 16 45.900 45.900 45.761 0.139 19694
1941 1 5 . 1 1 16 16 GLY H H 16 8.860 8.860 8.598 0.262 19694
1942 1 5 . 1 1 17 17 LYS N N 17 119.580 119.580 119.840 -0.260 19694
1943 1 5 . 1 1 17 17 LYS HA H 17 4.480 4.480 4.490 -0.010 19694
1944 1 5 . 1 1 17 17 LYS CA C 17 54.460 54.460 54.664 -0.204 19694
1945 1 5 . 1 1 17 17 LYS CB C 17 35.800 35.800 34.027 1.773 19694
1946 1 5 . 1 1 17 17 LYS H H 17 8.030 8.030 7.250 0.780 19694
1947 1 5 . 1 1 18 18 LYS N N 18 120.330 120.330 121.612 -1.282 19694
1948 1 5 . 1 1 18 18 LYS HA H 18 4.280 4.280 4.346 -0.066 19694
1949 1 5 . 1 1 18 18 LYS CA C 18 56.800 56.800 57.472 -0.672 19694
1950 1 5 . 1 1 18 18 LYS CB C 18 33.010 33.010 32.797 0.213 19694
1951 1 5 . 1 1 18 18 LYS H H 18 8.190 8.190 8.521 -0.331 19694
1952 1 5 . 1 1 19 19 TYR N N 19 117.500 117.500 114.307 3.193 19694
1953 1 5 . 1 1 19 19 TYR HA H 19 5.240 5.240 4.734 0.506 19694
1954 1 5 . 1 1 19 19 TYR CA C 19 55.340 55.340 56.421 -1.081 19694
1955 1 5 . 1 1 19 19 TYR CB C 19 42.850 42.850 40.287 2.563 19694
1956 1 5 . 1 1 19 19 TYR H H 19 7.610 7.610 7.801 -0.191 19694
1957 1 5 . 1 1 20 20 ILE N N 20 121.430 121.430 121.860 -0.430 19694
1958 1 5 . 1 1 20 20 ILE HA H 20 4.137 4.137 4.239 -0.102 19694
1959 1 5 . 1 1 20 20 ILE CA C 20 60.010 60.010 60.103 -0.093 19694
1960 1 5 . 1 1 20 20 ILE CB C 20 41.570 41.570 40.515 1.055 19694
1961 1 5 . 1 1 20 20 ILE H H 20 9.350 9.350 8.306 1.044 19694
1962 1 5 . 1 1 21 21 LEU N N 21 126.720 126.720 126.917 -0.197 19694
1963 1 5 . 1 1 21 21 LEU HA H 21 5.090 5.090 4.529 0.561 19694
1964 1 5 . 1 1 21 21 LEU CA C 21 54.020 54.020 54.317 -0.297 19694
1965 1 5 . 1 1 21 21 LEU CB C 21 43.720 43.720 40.564 3.156 19694
1966 1 5 . 1 1 21 21 LEU H H 21 8.530 8.530 8.518 0.012 19694
1967 1 5 . 1 1 22 22 ARG N N 22 123.930 123.930 126.320 -2.390 19694
1968 1 5 . 1 1 22 22 ARG HA H 22 4.440 4.440 4.497 -0.057 19694
1969 1 5 . 1 1 22 22 ARG CA C 22 55.600 55.600 53.916 1.684 19694
1970 1 5 . 1 1 22 22 ARG CB C 22 32.280 32.280 31.903 0.377 19694
1971 1 5 . 1 1 22 22 ARG H H 22 9.080 9.080 9.130 -0.050 19694
1972 1 5 . 1 1 23 23 GLU N N 23 128.500 128.500 124.495 4.005 19694
1973 1 5 . 1 1 23 23 GLU HA H 23 3.840 3.840 3.949 -0.109 19694
1974 1 5 . 1 1 23 23 GLU CA C 23 58.030 58.030 57.886 0.144 19694
1975 1 5 . 1 1 23 23 GLU CB C 23 27.200 27.200 27.769 -0.569 19694
1976 1 5 . 1 1 23 23 GLU H H 23 9.610 9.610 9.013 0.597 19694
1977 1 5 . 1 1 24 24 GLU N N 24 110.300 110.300 113.018 -2.718 19694
1978 1 5 . 1 1 24 24 GLU HA H 24 3.780 3.780 3.964 -0.184 19694
1979 1 5 . 1 1 24 24 GLU CA C 24 58.320 58.320 57.462 0.858 19694
1980 1 5 . 1 1 24 24 GLU CB C 24 28.220 28.220 28.076 0.143 19694
1981 1 5 . 1 1 24 24 GLU H H 24 8.660 8.660 8.676 -0.016 19694
1982 1 5 . 1 1 25 25 SER N N 25 117.700 117.700 113.397 4.303 19694
1983 1 5 . 1 1 25 25 SER HA H 25 4.890 4.890 4.792 0.098 19694
1984 1 5 . 1 1 25 25 SER CA C 25 56.540 56.540 55.814 0.726 19694
1985 1 5 . 1 1 25 25 SER CB C 25 64.720 64.720 65.393 -0.673 19694
1986 1 5 . 1 1 25 25 SER H H 25 7.900 7.900 7.830 0.070 19694
1987 1 5 . 1 1 26 26 PRO HA H 26 4.995 4.995 4.817 0.178 19694
1988 1 5 . 1 1 26 26 PRO CA C 26 61.750 61.750 63.092 -1.342 19694
1989 1 5 . 1 1 26 26 PRO CB C 26 32.660 32.660 31.776 0.884 19694
1990 1 5 . 1 1 27 27 TYR N N 27 118.100 118.100 123.980 -5.880 19694
1991 1 5 . 1 1 27 27 TYR HA H 27 5.910 5.910 4.977 0.933 19694
1992 1 5 . 1 1 27 27 TYR CA C 27 56.830 56.830 55.159 1.671 19694
1993 1 5 . 1 1 27 27 TYR CB C 27 42.810 42.810 42.583 0.228 19694
1994 1 5 . 1 1 27 27 TYR H H 27 9.040 9.040 8.779 0.261 19694
1995 1 5 . 1 1 28 28 CYS N N 28 122.230 122.230 119.086 3.144 19694
1996 1 5 . 1 1 28 28 CYS HA H 28 4.850 4.850 4.654 0.196 19694
1997 1 5 . 1 1 28 28 CYS CA C 28 58.110 58.110 58.470 -0.360 19694
1998 1 5 . 1 1 28 28 CYS CB C 28 30.530 30.530 29.067 1.463 19694
1999 1 5 . 1 1 28 28 CYS H H 28 9.850 9.850 8.294 1.556 19694
2000 1 5 . 1 1 29 29 VAL N N 29 118.200 118.200 123.276 -5.076 19694
2001 1 5 . 1 1 29 29 VAL HA H 29 3.650 3.650 3.673 -0.023 19694
2002 1 5 . 1 1 29 29 VAL CA C 29 67.400 67.400 67.263 0.137 19694
2003 1 5 . 1 1 29 29 VAL CB C 29 31.860 31.860 31.264 0.597 19694
2004 1 5 . 1 1 29 29 VAL H H 29 8.430 8.430 9.009 -0.579 19694
2005 1 5 . 1 1 30 30 VAL N N 30 119.570 119.570 118.712 0.858 19694
2006 1 5 . 1 1 30 30 VAL HA H 30 3.860 3.860 3.627 0.233 19694
2007 1 5 . 1 1 30 30 VAL CA C 30 66.450 66.450 66.546 -0.096 19694
2008 1 5 . 1 1 30 30 VAL CB C 30 31.540 31.540 30.945 0.595 19694
2009 1 5 . 1 1 30 30 VAL H H 30 7.700 7.700 8.168 -0.468 19694
2010 1 5 . 1 1 31 31 CYS N N 31 125.890 125.890 119.338 6.552 19694
2011 1 5 . 1 1 31 31 CYS HA H 31 3.830 3.830 3.907 -0.077 19694
2012 1 5 . 1 1 31 31 CYS CA C 31 65.850 65.850 64.382 1.468 19694
2013 1 5 . 1 1 31 31 CYS CB C 31 29.510 29.510 25.610 3.900 19694
2014 1 5 . 1 1 31 31 CYS H H 31 9.050 9.050 7.546 1.504 19694
2015 1 5 . 1 1 32 32 PHE N N 32 119.000 119.000 119.296 -0.296 19694
2016 1 5 . 1 1 32 32 PHE HA H 32 3.780 3.780 3.719 0.061 19694
2017 1 5 . 1 1 32 32 PHE CA C 32 62.610 62.610 61.795 0.815 19694
2018 1 5 . 1 1 32 32 PHE CB C 32 39.920 39.920 39.061 0.859 19694
2019 1 5 . 1 1 32 32 PHE H H 32 9.080 9.080 7.888 1.192 19694
2020 1 5 . 1 1 33 33 GLU N N 33 117.470 117.470 118.061 -0.591 19694
2021 1 5 . 1 1 33 33 GLU HA H 33 3.760 3.760 4.074 -0.314 19694
2022 1 5 . 1 1 33 33 GLU CA C 33 59.210 59.210 59.422 -0.212 19694
2023 1 5 . 1 1 33 33 GLU CB C 33 29.480 29.480 29.213 0.267 19694
2024 1 5 . 1 1 33 33 GLU H H 33 8.510 8.510 8.034 0.476 19694
2025 1 5 . 1 1 34 34 THR N N 34 114.140 114.140 115.604 -1.464 19694
2026 1 5 . 1 1 34 34 THR HA H 34 3.730 3.730 3.939 -0.209 19694
2027 1 5 . 1 1 34 34 THR CA C 34 65.890 65.890 66.023 -0.133 19694
2028 1 5 . 1 1 34 34 THR CB C 34 69.210 69.210 68.714 0.496 19694
2029 1 5 . 1 1 34 34 THR H H 34 7.880 7.880 8.318 -0.438 19694
2030 1 5 . 1 1 35 35 LEU N N 35 117.980 117.980 118.477 -0.497 19694
2031 1 5 . 1 1 35 35 LEU HA H 35 3.650 3.650 3.963 -0.313 19694
2032 1 5 . 1 1 35 35 LEU CA C 35 56.860 56.860 57.174 -0.314 19694
2033 1 5 . 1 1 35 35 LEU CB C 35 41.870 41.870 41.719 0.151 19694
2034 1 5 . 1 1 35 35 LEU H H 35 7.660 7.660 7.706 -0.046 19694
2035 1 5 . 1 1 36 36 PHE N N 36 113.900 113.900 112.927 0.973 19694
2036 1 5 . 1 1 36 36 PHE HA H 36 4.597 4.597 4.470 0.127 19694
2037 1 5 . 1 1 36 36 PHE CA C 36 56.860 56.860 56.389 0.471 19694
2038 1 5 . 1 1 36 36 PHE CB C 36 40.570 40.570 38.192 2.378 19694
2039 1 5 . 1 1 36 36 PHE H H 36 7.730 7.730 6.608 1.122 19694
2040 1 5 . 1 1 37 37 ALA N N 37 121.920 121.920 123.301 -1.381 19694
2041 1 5 . 1 1 37 37 ALA HA H 37 4.070 4.070 4.066 0.004 19694
2042 1 5 . 1 1 37 37 ALA CA C 37 52.900 52.900 52.307 0.593 19694
2043 1 5 . 1 1 37 37 ALA CB C 37 19.770 19.770 19.630 0.140 19694
2044 1 5 . 1 1 37 37 ALA H H 37 7.090 7.090 7.782 -0.692 19694
2045 1 5 . 1 1 38 38 ASN N N 38 119.230 119.230 119.344 -0.114 19694
2046 1 5 . 1 1 38 38 ASN HA H 38 4.450 4.450 4.633 -0.183 19694
2047 1 5 . 1 1 38 38 ASN CA C 38 52.850 52.850 52.867 -0.017 19694
2048 1 5 . 1 1 38 38 ASN CB C 38 38.950 38.950 39.660 -0.709 19694
2049 1 5 . 1 1 38 38 ASN H H 38 8.790 8.790 8.343 0.447 19694
2050 1 5 . 1 1 39 39 THR N N 39 116.330 116.330 115.880 0.450 19694
2051 1 5 . 1 1 39 39 THR HA H 39 3.990 3.990 4.313 -0.323 19694
2052 1 5 . 1 1 39 39 THR CA C 39 62.130 62.130 62.266 -0.136 19694
2053 1 5 . 1 1 39 39 THR CB C 39 69.920 69.920 69.922 -0.002 19694
2054 1 5 . 1 1 39 39 THR H H 39 8.540 8.540 8.175 0.365 19694
2055 1 5 . 1 1 40 40 CYS N N 40 126.950 126.950 128.126 -1.176 19694
2056 1 5 . 1 1 40 40 CYS HA H 40 4.300 4.300 4.423 -0.123 19694
2057 1 5 . 1 1 40 40 CYS CA C 40 58.350 58.350 57.314 1.036 19694
2058 1 5 . 1 1 40 40 CYS CB C 40 31.600 31.600 26.709 4.891 19694
2059 1 5 . 1 1 40 40 CYS H H 40 7.940 7.940 8.546 -0.606 19694
2060 1 5 . 1 1 41 41 GLU N N 41 130.560 130.560 127.576 2.984 19694
2061 1 5 . 1 1 41 41 GLU HA H 41 3.690 3.690 3.848 -0.158 19694
2062 1 5 . 1 1 41 41 GLU CA C 41 58.600 58.600 59.091 -0.491 19694
2063 1 5 . 1 1 41 41 GLU CB C 41 30.460 30.460 29.430 1.030 19694
2064 1 5 . 1 1 41 41 GLU H H 41 8.810 8.810 8.650 0.160 19694
2065 1 5 . 1 1 42 42 GLU N N 42 119.680 119.680 118.509 1.171 19694
2066 1 5 . 1 1 42 42 GLU HA H 42 4.570 4.570 4.335 0.235 19694
2067 1 5 . 1 1 42 42 GLU CA C 42 58.000 58.000 57.970 0.030 19694
2068 1 5 . 1 1 42 42 GLU CB C 42 31.680 31.680 30.611 1.069 19694
2069 1 5 . 1 1 42 42 GLU H H 42 8.500 8.500 8.065 0.435 19694
2070 1 5 . 1 1 43 43 CYS N N 43 115.600 115.600 116.301 -0.701 19694
2071 1 5 . 1 1 43 43 CYS HA H 43 5.010 5.010 4.444 0.566 19694
2072 1 5 . 1 1 43 43 CYS CA C 43 58.810 58.810 60.138 -1.328 19694
2073 1 5 . 1 1 43 43 CYS CB C 43 31.580 31.580 28.570 3.010 19694
2074 1 5 . 1 1 43 43 CYS H H 43 8.120 8.120 7.995 0.125 19694
2075 1 5 . 1 1 44 44 GLY N N 44 112.100 112.100 107.838 4.262 19694
2076 1 5 . 1 1 44 44 GLY CA C 44 46.420 46.420 45.229 1.191 19694
2077 1 5 . 1 1 44 44 GLY H H 44 7.900 7.900 8.579 -0.679 19694
2078 1 5 . 1 1 45 45 LYS N N 45 121.210 121.210 121.747 -0.537 19694
2079 1 5 . 1 1 45 45 LYS HA H 45 4.840 4.840 4.628 0.212 19694
2080 1 5 . 1 1 45 45 LYS CA C 45 54.360 54.360 53.178 1.183 19694
2081 1 5 . 1 1 45 45 LYS CB C 45 32.430 32.430 32.926 -0.496 19694
2082 1 5 . 1 1 45 45 LYS H H 45 8.180 8.180 7.865 0.315 19694
2083 1 5 . 1 1 46 46 PRO HA H 46 4.477 4.477 4.573 -0.096 19694
2084 1 5 . 1 1 46 46 PRO CA C 46 62.700 62.700 62.988 -0.288 19694
2085 1 5 . 1 1 46 46 PRO CB C 46 32.490 32.490 32.057 0.433 19694
2086 1 5 . 1 1 47 47 ILE N N 47 125.280 125.280 123.463 1.817 19694
2087 1 5 . 1 1 47 47 ILE HA H 47 3.830 3.830 4.276 -0.446 19694
2088 1 5 . 1 1 47 47 ILE CA C 47 61.040 61.040 60.838 0.202 19694
2089 1 5 . 1 1 47 47 ILE CB C 47 37.440 37.440 37.289 0.151 19694
2090 1 5 . 1 1 47 47 ILE H H 47 8.540 8.540 8.906 -0.366 19694
2091 1 5 . 1 1 48 48 GLY N N 48 114.120 114.120 113.223 0.897 19694
2092 1 5 . 1 1 48 48 GLY CA C 48 45.240 45.240 44.258 0.983 19694
2093 1 5 . 1 1 48 48 GLY H H 48 8.660 8.660 8.310 0.350 19694
2094 1 5 . 1 1 49 49 CYS N N 49 117.140 117.140 118.517 -1.377 19694
2095 1 5 . 1 1 49 49 CYS HA H 49 4.280 4.280 4.278 0.002 19694
2096 1 5 . 1 1 49 49 CYS CA C 49 60.880 60.880 60.769 0.111 19694
2097 1 5 . 1 1 49 49 CYS CB C 49 27.650 27.650 27.488 0.162 19694
2098 1 5 . 1 1 49 49 CYS H H 49 9.210 9.210 8.549 0.661 19694
2099 1 5 . 1 1 50 50 ASP N N 50 119.300 119.300 120.401 -1.101 19694
2100 1 5 . 1 1 50 50 ASP HA H 50 4.620 4.620 4.756 -0.136 19694
2101 1 5 . 1 1 50 50 ASP CA C 50 54.160 54.160 54.522 -0.361 19694
2102 1 5 . 1 1 50 50 ASP CB C 50 40.380 40.380 40.480 -0.100 19694
2103 1 5 . 1 1 50 50 ASP H H 50 8.800 8.800 8.458 0.342 19694
2104 1 5 . 1 1 51 51 CYS N N 51 118.150 118.150 116.409 1.741 19694
2105 1 5 . 1 1 51 51 CYS HA H 51 4.620 4.620 4.667 -0.047 19694
2106 1 5 . 1 1 51 51 CYS CA C 51 58.030 58.030 57.333 0.697 19694
2107 1 5 . 1 1 51 51 CYS CB C 51 30.090 30.090 31.874 -1.784 19694
2108 1 5 . 1 1 51 51 CYS H H 51 7.590 7.590 7.290 0.300 19694
2109 1 5 . 1 1 52 52 LYS N N 52 123.800 123.800 122.954 0.846 19694
2110 1 5 . 1 1 52 52 LYS HA H 52 4.180 4.180 4.380 -0.200 19694
2111 1 5 . 1 1 52 52 LYS CA C 52 57.240 57.240 56.126 1.114 19694
2112 1 5 . 1 1 52 52 LYS CB C 52 33.030 33.030 31.265 1.765 19694
2113 1 5 . 1 1 52 52 LYS H H 52 8.600 8.600 8.547 0.053 19694
2114 1 5 . 1 1 53 53 ASP N N 53 124.900 124.900 123.964 0.936 19694
2115 1 5 . 1 1 53 53 ASP HA H 53 4.230 4.230 4.674 -0.444 19694
2116 1 5 . 1 1 53 53 ASP CA C 53 53.130 53.130 53.227 -0.097 19694
2117 1 5 . 1 1 53 53 ASP CB C 53 42.230 42.230 40.585 1.645 19694
2118 1 5 . 1 1 53 53 ASP H H 53 8.250 8.250 8.376 -0.126 19694
2119 1 5 . 1 1 54 54 LEU N N 54 130.160 130.160 124.980 5.180 19694
2120 1 5 . 1 1 54 54 LEU HA H 54 4.440 4.440 4.583 -0.143 19694
2121 1 5 . 1 1 54 54 LEU CA C 54 53.340 53.340 55.371 -2.031 19694
2122 1 5 . 1 1 54 54 LEU CB C 54 41.170 41.170 43.035 -1.865 19694
2123 1 5 . 1 1 54 54 LEU H H 54 8.670 8.670 9.005 -0.335 19694
2124 1 5 . 1 1 55 55 SER N N 55 113.820 113.820 121.577 -7.757 19694
2125 1 5 . 1 1 55 55 SER HA H 55 5.580 5.580 5.084 0.496 19694
2126 1 5 . 1 1 55 55 SER CA C 55 55.850 55.850 56.603 -0.753 19694
2127 1 5 . 1 1 55 55 SER CB C 55 67.300 67.300 64.444 2.856 19694
2128 1 5 . 1 1 55 55 SER H H 55 8.160 8.160 8.498 -0.338 19694
2129 1 5 . 1 1 56 56 TYR N N 56 122.610 122.610 125.923 -3.313 19694
2130 1 5 . 1 1 56 56 TYR HA H 56 4.620 4.620 4.616 0.004 19694
2131 1 5 . 1 1 56 56 TYR CA C 56 58.810 58.810 58.850 -0.040 19694
2132 1 5 . 1 1 56 56 TYR CB C 56 41.000 41.000 41.925 -0.925 19694
2133 1 5 . 1 1 56 56 TYR H H 56 8.450 8.450 8.691 -0.241 19694
2134 1 5 . 1 1 57 57 LYS N N 57 126.020 126.020 129.250 -3.230 19694
2135 1 5 . 1 1 57 57 LYS HA H 57 3.470 3.470 3.905 -0.435 19694
2136 1 5 . 1 1 57 57 LYS CA C 57 58.100 58.100 57.108 0.992 19694
2137 1 5 . 1 1 57 57 LYS CB C 57 29.480 29.480 32.159 -2.679 19694
2138 1 5 . 1 1 57 57 LYS H H 57 8.920 8.920 8.568 0.352 19694
2139 1 5 . 1 1 58 58 ASP HA H 58 3.830 3.830 4.205 -0.375 19694
2140 1 5 . 1 1 58 58 ASP CA C 58 54.900 54.900 55.365 -0.465 19694
2141 1 5 . 1 1 58 58 ASP CB C 58 40.080 40.080 40.528 -0.448 19694
2142 1 5 . 1 1 58 58 ASP H H 58 8.400 8.400 8.612 -0.212 19694
2143 1 5 . 1 1 59 59 ARG N N 59 121.190 121.190 116.500 4.690 19694
2144 1 5 . 1 1 59 59 ARG HA H 59 4.250 4.250 4.333 -0.083 19694
2145 1 5 . 1 1 59 59 ARG CA C 59 55.580 55.580 54.267 1.313 19694
2146 1 5 . 1 1 59 59 ARG CB C 59 33.460 33.460 33.688 -0.228 19694
2147 1 5 . 1 1 59 59 ARG H H 59 7.980 7.980 7.281 0.699 19694
2148 1 5 . 1 1 60 60 HIS N N 60 118.420 118.420 117.576 0.844 19694
2149 1 5 . 1 1 60 60 HIS HA H 60 5.270 5.270 5.603 -0.333 19694
2150 1 5 . 1 1 60 60 HIS CA C 60 55.010 55.010 55.081 -0.071 19694
2151 1 5 . 1 1 60 60 HIS CB C 60 32.380 32.380 33.447 -1.067 19694
2152 1 5 . 1 1 60 60 HIS H H 60 8.350 8.350 8.113 0.237 19694
2153 1 5 . 1 1 61 61 TRP N N 61 119.990 119.990 118.323 1.667 19694
2154 1 5 . 1 1 61 61 TRP HA H 61 5.930 5.930 4.786 1.144 19694
2155 1 5 . 1 1 61 61 TRP CA C 61 57.400 57.400 57.100 0.300 19694
2156 1 5 . 1 1 61 61 TRP CB C 61 35.380 35.380 34.167 1.213 19694
2157 1 5 . 1 1 61 61 TRP H H 61 9.310 9.310 9.264 0.046 19694
2158 1 5 . 1 1 62 62 HIS N N 62 117.270 117.270 121.599 -4.329 19694
2159 1 5 . 1 1 62 62 HIS HA H 62 4.600 4.600 4.843 -0.243 19694
2160 1 5 . 1 1 62 62 HIS CA C 62 59.210 59.210 57.503 1.707 19694
2161 1 5 . 1 1 62 62 HIS CB C 62 31.200 31.200 30.481 0.719 19694
2162 1 5 . 1 1 62 62 HIS H H 62 8.430 8.430 9.171 -0.741 19694
2163 1 5 . 1 1 63 63 GLU N N 63 124.640 124.640 128.808 -4.168 19694
2164 1 5 . 1 1 63 63 GLU HA H 63 3.827 3.827 3.969 -0.142 19694
2165 1 5 . 1 1 63 63 GLU CA C 63 61.020 61.020 59.667 1.353 19694
2166 1 5 . 1 1 63 63 GLU CB C 63 30.310 30.310 29.721 0.589 19694
2167 1 5 . 1 1 63 63 GLU H H 63 9.040 9.040 8.416 0.624 19694
2168 1 5 . 1 1 64 64 ALA N N 64 117.050 117.050 117.933 -0.883 19694
2169 1 5 . 1 1 64 64 ALA HA H 64 4.230 4.230 4.311 -0.081 19694
2170 1 5 . 1 1 64 64 ALA CA C 64 54.000 54.000 53.131 0.869 19694
2171 1 5 . 1 1 64 64 ALA CB C 64 18.880 18.880 19.036 -0.156 19694
2172 1 5 . 1 1 64 64 ALA H H 64 8.680 8.680 8.337 0.343 19694
2173 1 5 . 1 1 65 65 CYS N N 65 115.380 115.380 117.163 -1.783 19694
2174 1 5 . 1 1 65 65 CYS HA H 65 4.295 4.295 4.265 0.030 19694
2175 1 5 . 1 1 65 65 CYS CA C 65 59.850 59.850 60.393 -0.543 19694
2176 1 5 . 1 1 65 65 CYS CB C 65 32.840 32.840 27.010 5.830 19694
2177 1 5 . 1 1 65 65 CYS H H 65 7.490 7.490 8.143 -0.653 19694
2178 1 5 . 1 1 66 66 PHE N N 66 122.020 122.020 122.959 -0.939 19694
2179 1 5 . 1 1 66 66 PHE HA H 66 3.890 3.890 3.708 0.182 19694
2180 1 5 . 1 1 66 66 PHE CA C 66 57.010 57.010 58.480 -1.470 19694
2181 1 5 . 1 1 66 66 PHE CB C 66 38.070 38.070 38.178 -0.108 19694
2182 1 5 . 1 1 66 66 PHE H H 66 7.110 7.110 7.547 -0.437 19694
2183 1 5 . 1 1 67 67 HIS N N 67 121.280 121.280 121.720 -0.440 19694
2184 1 5 . 1 1 67 67 HIS HA H 67 4.720 4.720 5.182 -0.462 19694
2185 1 5 . 1 1 67 67 HIS CA C 67 52.730 52.730 53.263 -0.533 19694
2186 1 5 . 1 1 67 67 HIS CB C 67 32.230 32.230 30.868 1.362 19694
2187 1 5 . 1 1 67 67 HIS H H 67 7.380 7.380 7.299 0.081 19694
2188 1 5 . 1 1 68 68 CYS N N 68 121.590 121.590 118.954 2.636 19694
2189 1 5 . 1 1 68 68 CYS HA H 68 3.960 3.960 5.009 -1.049 19694
2190 1 5 . 1 1 68 68 CYS CA C 68 59.790 59.790 57.966 1.824 19694
2191 1 5 . 1 1 68 68 CYS CB C 68 31.200 31.200 29.605 1.595 19694
2192 1 5 . 1 1 68 68 CYS H H 68 8.530 8.530 8.361 0.169 19694
2193 1 5 . 1 1 69 69 SER N N 69 126.530 126.530 120.978 5.552 19694
2194 1 5 . 1 1 69 69 SER HA H 69 4.310 4.310 4.161 0.149 19694
2195 1 5 . 1 1 69 69 SER CA C 69 61.760 61.760 61.001 0.759 19694
2196 1 5 . 1 1 69 69 SER CB C 69 64.040 64.040 63.174 0.866 19694
2197 1 5 . 1 1 69 69 SER H H 69 9.460 9.460 8.826 0.634 19694
2198 1 5 . 1 1 70 70 GLN N N 70 122.370 122.370 118.727 3.643 19694
2199 1 5 . 1 1 70 70 GLN HA H 70 4.510 4.510 4.437 0.073 19694
2200 1 5 . 1 1 70 70 GLN CA C 70 57.840 57.840 57.297 0.543 19694
2201 1 5 . 1 1 70 70 GLN CB C 70 30.430 30.430 29.518 0.912 19694
2202 1 5 . 1 1 70 70 GLN H H 70 8.980 8.980 7.861 1.119 19694
2203 1 5 . 1 1 71 71 CYS N N 71 118.860 118.860 116.487 2.373 19694
2204 1 5 . 1 1 71 71 CYS HA H 71 4.720 4.720 4.656 0.064 19694
2205 1 5 . 1 1 71 71 CYS CA C 71 59.770 59.770 58.380 1.390 19694
2206 1 5 . 1 1 71 71 CYS CB C 71 31.910 31.910 28.291 3.619 19694
2207 1 5 . 1 1 71 71 CYS H H 71 8.220 8.220 7.742 0.478 19694
2208 1 5 . 1 1 72 72 ARG N N 72 114.380 114.380 115.897 -1.517 19694
2209 1 5 . 1 1 72 72 ARG HA H 72 3.965 3.965 3.764 0.201 19694
2210 1 5 . 1 1 72 72 ARG CA C 72 58.030 58.030 57.129 0.901 19694
2211 1 5 . 1 1 72 72 ARG CB C 72 27.720 27.720 27.051 0.669 19694
2212 1 5 . 1 1 72 72 ARG H H 72 7.380 7.380 7.886 -0.506 19694
2213 1 5 . 1 1 73 73 ASN N N 73 121.480 121.480 116.640 4.840 19694
2214 1 5 . 1 1 73 73 ASN HA H 73 4.630 4.630 4.628 0.002 19694
2215 1 5 . 1 1 73 73 ASN CA C 73 54.110 54.110 53.791 0.319 19694
2216 1 5 . 1 1 73 73 ASN CB C 73 38.870 38.870 39.618 -0.748 19694
2217 1 5 . 1 1 73 73 ASN H H 73 8.722 8.722 8.014 0.708 19694
2218 1 5 . 1 1 74 74 SER N N 74 114.710 114.710 117.937 -3.227 19694
2219 1 5 . 1 1 74 74 SER HA H 74 4.060 4.060 4.818 -0.758 19694
2220 1 5 . 1 1 74 74 SER CA C 74 59.357 59.357 57.977 1.381 19694
2221 1 5 . 1 1 74 74 SER CB C 74 63.300 63.300 63.231 0.069 19694
2222 1 5 . 1 1 74 74 SER H H 74 8.690 8.690 8.517 0.173 19694
2223 1 5 . 1 1 75 75 LEU N N 75 125.757 125.757 128.816 -3.059 19694
2224 1 5 . 1 1 75 75 LEU HA H 75 4.280 4.280 4.319 -0.039 19694
2225 1 5 . 1 1 75 75 LEU CA C 75 53.510 53.510 54.680 -1.170 19694
2226 1 5 . 1 1 75 75 LEU CB C 75 42.200 42.200 42.231 -0.031 19694
2227 1 5 . 1 1 75 75 LEU H H 75 7.970 7.970 7.984 -0.014 19694
2228 1 5 . 1 1 76 76 VAL N N 76 120.860 120.860 123.532 -2.672 19694
2229 1 5 . 1 1 76 76 VAL HA H 76 3.570 3.570 3.861 -0.291 19694
2230 1 5 . 1 1 76 76 VAL CA C 76 65.420 65.420 60.708 4.712 19694
2231 1 5 . 1 1 76 76 VAL CB C 76 31.540 31.540 35.971 -4.431 19694
2232 1 5 . 1 1 76 76 VAL H H 76 7.830 7.830 7.991 -0.161 19694
2233 1 5 . 1 1 77 77 ASP N N 77 122.360 122.360 123.157 -0.797 19694
2234 1 5 . 1 1 77 77 ASP HA H 77 4.230 4.230 4.451 -0.221 19694
2235 1 5 . 1 1 77 77 ASP CA C 77 56.200 56.200 55.778 0.422 19694
2236 1 5 . 1 1 77 77 ASP CB C 77 39.380 39.380 40.812 -1.433 19694
2237 1 5 . 1 1 77 77 ASP H H 77 8.910 8.910 8.468 0.442 19694
2238 1 5 . 1 1 78 78 LYS N N 78 118.100 118.100 118.532 -0.432 19694
2239 1 5 . 1 1 78 78 LYS HA H 78 4.870 4.870 4.587 0.283 19694
2240 1 5 . 1 1 78 78 LYS CA C 78 56.960 56.960 53.734 3.226 19694
2241 1 5 . 1 1 78 78 LYS CB C 78 34.680 34.680 33.685 0.995 19694
2242 1 5 . 1 1 78 78 LYS H H 78 7.660 7.660 7.589 0.071 19694
2243 1 5 . 1 1 79 79 PRO HA H 79 4.460 4.460 4.217 0.243 19694
2244 1 5 . 1 1 79 79 PRO CA C 79 62.520 62.520 62.864 -0.344 19694
2245 1 5 . 1 1 79 79 PRO CB C 79 32.160 32.160 31.962 0.198 19694
2246 1 5 . 1 1 80 80 PHE N N 80 114.050 114.050 117.155 -3.105 19694
2247 1 5 . 1 1 80 80 PHE HA H 80 4.910 4.910 4.939 -0.029 19694
2248 1 5 . 1 1 80 80 PHE CA C 80 56.060 56.060 54.967 1.093 19694
2249 1 5 . 1 1 80 80 PHE CB C 80 42.410 42.410 41.531 0.879 19694
2250 1 5 . 1 1 80 80 PHE H H 80 7.510 7.510 7.047 0.463 19694
2251 1 5 . 1 1 81 81 ALA N N 81 123.290 123.290 123.418 -0.128 19694
2252 1 5 . 1 1 81 81 ALA HA H 81 4.310 4.310 4.360 -0.050 19694
2253 1 5 . 1 1 81 81 ALA CA C 81 50.450 50.450 50.431 0.019 19694
2254 1 5 . 1 1 81 81 ALA CB C 81 21.920 21.920 18.827 3.093 19694
2255 1 5 . 1 1 81 81 ALA H H 81 9.030 9.030 8.977 0.053 19694
2256 1 5 . 1 1 82 82 ALA N N 82 122.490 122.490 128.708 -6.218 19694
2257 1 5 . 1 1 82 82 ALA HA H 82 5.110 5.110 4.392 0.718 19694
2258 1 5 . 1 1 82 82 ALA CA C 82 51.100 51.100 51.917 -0.817 19694
2259 1 5 . 1 1 82 82 ALA CB C 82 21.130 21.130 18.799 2.331 19694
2260 1 5 . 1 1 82 82 ALA H H 82 8.240 8.240 8.598 -0.358 19694
2261 1 5 . 1 1 83 83 LYS N N 83 123.580 123.580 125.995 -2.415 19694
2262 1 5 . 1 1 83 83 LYS HA H 83 4.490 4.490 4.493 -0.003 19694
2263 1 5 . 1 1 83 83 LYS CA C 83 55.800 55.800 55.402 0.398 19694
2264 1 5 . 1 1 83 83 LYS CB C 83 34.720 34.720 34.080 0.640 19694
2265 1 5 . 1 1 83 83 LYS H H 83 8.400 8.400 8.323 0.077 19694
2266 1 5 . 1 1 84 84 GLU N N 84 125.470 125.470 120.439 5.031 19694
2267 1 5 . 1 1 84 84 GLU HA H 84 3.820 3.820 4.122 -0.302 19694
2268 1 5 . 1 1 84 84 GLU CA C 84 58.620 58.620 58.980 -0.360 19694
2269 1 5 . 1 1 84 84 GLU CB C 84 27.210 27.210 29.720 -2.510 19694
2270 1 5 . 1 1 84 84 GLU H H 84 9.320 9.320 8.787 0.533 19694
2271 1 5 . 1 1 85 85 ASP N N 85 118.550 118.550 114.466 4.084 19694
2272 1 5 . 1 1 85 85 ASP HA H 85 4.600 4.600 4.795 -0.195 19694
2273 1 5 . 1 1 85 85 ASP CA C 85 55.400 55.400 53.827 1.573 19694
2274 1 5 . 1 1 85 85 ASP CB C 85 40.400 40.400 42.002 -1.602 19694
2275 1 5 . 1 1 85 85 ASP H H 85 8.730 8.730 8.392 0.338 19694
2276 1 5 . 1 1 86 86 GLN N N 86 119.050 119.050 116.845 2.205 19694
2277 1 5 . 1 1 86 86 GLN HA H 86 4.540 4.540 4.525 0.015 19694
2278 1 5 . 1 1 86 86 GLN CA C 86 55.100 55.100 53.812 1.288 19694
2279 1 5 . 1 1 86 86 GLN CB C 86 31.110 31.110 31.589 -0.479 19694
2280 1 5 . 1 1 86 86 GLN H H 86 8.170 8.170 7.656 0.514 19694
2281 1 5 . 1 1 87 87 LEU N N 87 123.110 123.110 121.421 1.689 19694
2282 1 5 . 1 1 87 87 LEU HA H 87 4.620 4.620 5.188 -0.568 19694
2283 1 5 . 1 1 87 87 LEU CA C 87 54.520 54.520 54.045 0.475 19694
2284 1 5 . 1 1 87 87 LEU CB C 87 42.700 42.700 44.480 -1.780 19694
2285 1 5 . 1 1 87 87 LEU H H 87 8.490 8.490 8.539 -0.049 19694
2286 1 5 . 1 1 88 88 LEU N N 88 123.690 123.690 120.320 3.370 19694
2287 1 5 . 1 1 88 88 LEU HA H 88 5.880 5.880 4.971 0.909 19694
2288 1 5 . 1 1 88 88 LEU CA C 88 53.340 53.340 52.797 0.543 19694
2289 1 5 . 1 1 88 88 LEU CB C 88 47.190 47.190 47.774 -0.584 19694
2290 1 5 . 1 1 88 88 LEU H H 88 8.930 8.930 8.304 0.626 19694
2291 1 5 . 1 1 89 89 CYS N N 89 122.270 122.270 119.587 2.683 19694
2292 1 5 . 1 1 89 89 CYS HA H 89 4.780 4.780 4.872 -0.092 19694
2293 1 5 . 1 1 89 89 CYS CA C 89 57.640 57.640 59.051 -1.411 19694
2294 1 5 . 1 1 89 89 CYS CB C 89 30.940 30.940 28.322 2.618 19694
2295 1 5 . 1 1 89 89 CYS H H 89 9.430 9.430 9.065 0.365 19694
2296 1 5 . 1 1 90 90 THR N N 90 110.620 110.620 116.439 -5.819 19694
2297 1 5 . 1 1 90 90 THR HA H 90 3.900 3.900 3.980 -0.080 19694
2298 1 5 . 1 1 90 90 THR CA C 90 65.460 65.460 65.843 -0.383 19694
2299 1 5 . 1 1 90 90 THR CB C 90 68.670 68.670 68.600 0.070 19694
2300 1 5 . 1 1 90 90 THR H H 90 8.410 8.410 8.898 -0.488 19694
2301 1 5 . 1 1 91 91 ASP N N 91 123.470 123.470 122.427 1.043 19694
2302 1 5 . 1 1 91 91 ASP HA H 91 4.490 4.490 4.638 -0.148 19694
2303 1 5 . 1 1 91 91 ASP CA C 91 57.810 57.810 57.216 0.594 19694
2304 1 5 . 1 1 91 91 ASP CB C 91 41.160 41.160 40.468 0.693 19694
2305 1 5 . 1 1 91 91 ASP H H 91 8.150 8.150 8.482 -0.332 19694
2306 1 5 . 1 1 92 92 CYS N N 92 123.800 123.800 119.504 4.296 19694
2307 1 5 . 1 1 92 92 CYS HA H 92 3.970 3.970 4.297 -0.327 19694
2308 1 5 . 1 1 92 92 CYS CA C 92 64.100 64.100 61.520 2.580 19694
2309 1 5 . 1 1 92 92 CYS CB C 92 30.090 30.090 25.971 4.119 19694
2310 1 5 . 1 1 92 92 CYS H H 92 8.580 8.580 7.650 0.930 19694
2311 1 5 . 1 1 93 93 TYR N N 93 120.730 120.730 120.977 -0.247 19694
2312 1 5 . 1 1 93 93 TYR HA H 93 4.140 4.140 4.073 0.067 19694
2313 1 5 . 1 1 93 93 TYR CA C 93 60.380 60.380 61.479 -1.099 19694
2314 1 5 . 1 1 93 93 TYR CB C 93 39.300 39.300 38.327 0.973 19694
2315 1 5 . 1 1 93 93 TYR H H 93 8.540 8.540 9.165 -0.625 19694
2316 1 5 . 1 1 94 94 SER N N 94 115.010 115.010 113.040 1.970 19694
2317 1 5 . 1 1 94 94 SER HA H 94 4.220 4.220 4.229 -0.009 19694
2318 1 5 . 1 1 94 94 SER CA C 94 59.300 59.300 60.829 -1.529 19694
2319 1 5 . 1 1 94 94 SER CB C 94 63.660 63.660 62.612 1.048 19694
2320 1 5 . 1 1 94 94 SER H H 94 7.750 7.750 8.086 -0.336 19694
2321 1 5 . 1 1 95 95 ASN N N 95 119.820 119.820 118.413 1.407 19694
2322 1 5 . 1 1 95 95 ASN HA H 95 4.510 4.510 4.589 -0.079 19694
2323 1 5 . 1 1 95 95 ASN CA C 95 53.880 53.880 55.214 -1.334 19694
2324 1 5 . 1 1 95 95 ASN CB C 95 39.300 39.300 38.839 0.461 19694
2325 1 5 . 1 1 95 95 ASN H H 95 7.780 7.780 7.890 -0.110 19694
2326 1 5 . 1 1 96 96 GLU N N 96 119.820 119.820 118.359 1.461 19694
2327 1 5 . 1 1 96 96 GLU HA H 96 4.096 4.096 4.205 -0.109 19694
2328 1 5 . 1 1 96 96 GLU CA C 96 56.910 56.910 57.080 -0.170 19694
2329 1 5 . 1 1 96 96 GLU CB C 96 30.220 30.220 29.145 1.075 19694
2330 1 5 . 1 1 96 96 GLU H H 96 7.950 7.950 7.753 0.197 19694
2331 1 5 . 1 1 97 97 TYR N N 97 120.370 120.370 119.921 0.449 19694
2332 1 5 . 1 1 97 97 TYR HA H 97 4.620 4.620 4.083 0.537 19694
2333 1 5 . 1 1 97 97 TYR CA C 97 57.700 57.700 59.601 -1.901 19694
2334 1 5 . 1 1 97 97 TYR CB C 97 38.710 38.710 38.375 0.335 19694
2335 1 5 . 1 1 97 97 TYR H H 97 8.070 8.070 8.336 -0.266 19694
2336 1 6 . 1 1 2 2 THR N N 2 113.570 113.570 116.125 -2.555 19694
2337 1 6 . 1 1 2 2 THR HA H 2 4.240 4.240 4.244 -0.004 19694
2338 1 6 . 1 1 2 2 THR CA C 2 62.130 62.130 63.101 -0.971 19694
2339 1 6 . 1 1 2 2 THR CB C 2 69.250 69.250 69.230 0.020 19694
2340 1 6 . 1 1 2 2 THR H H 2 8.090 8.090 8.505 -0.415 19694
2341 1 6 . 1 1 3 3 GLU N N 3 122.880 122.880 120.802 2.078 19694
2342 1 6 . 1 1 3 3 GLU HA H 3 4.280 4.280 4.143 0.137 19694
2343 1 6 . 1 1 3 3 GLU CA C 3 56.860 56.860 56.687 0.173 19694
2344 1 6 . 1 1 3 3 GLU CB C 3 30.570 30.570 30.213 0.357 19694
2345 1 6 . 1 1 3 3 GLU H H 3 8.280 8.280 8.034 0.246 19694
2346 1 6 . 1 1 4 4 ARG N N 4 121.330 121.330 119.408 1.922 19694
2347 1 6 . 1 1 4 4 ARG HA H 4 4.300 4.300 4.537 -0.237 19694
2348 1 6 . 1 1 4 4 ARG CA C 4 55.870 55.870 55.130 0.740 19694
2349 1 6 . 1 1 4 4 ARG CB C 4 31.640 31.640 30.705 0.935 19694
2350 1 6 . 1 1 4 4 ARG H H 4 8.280 8.280 8.529 -0.249 19694
2351 1 6 . 1 1 5 5 PHE N N 5 125.490 125.490 125.875 -0.385 19694
2352 1 6 . 1 1 5 5 PHE HA H 5 4.610 4.610 4.539 0.071 19694
2353 1 6 . 1 1 5 5 PHE CA C 5 56.380 56.380 56.300 0.081 19694
2354 1 6 . 1 1 5 5 PHE CB C 5 39.560 39.560 39.461 0.099 19694
2355 1 6 . 1 1 5 5 PHE H H 5 8.290 8.290 8.803 -0.513 19694
2356 1 6 . 1 1 6 6 ASP N N 6 123.260 123.260 121.354 1.906 19694
2357 1 6 . 1 1 6 6 ASP HA H 6 5.045 5.045 4.828 0.217 19694
2358 1 6 . 1 1 6 6 ASP CA C 6 52.180 52.180 53.243 -1.063 19694
2359 1 6 . 1 1 6 6 ASP CB C 6 44.210 44.210 44.590 -0.380 19694
2360 1 6 . 1 1 6 6 ASP H H 6 7.940 7.940 7.569 0.371 19694
2361 1 6 . 1 1 7 7 CYS N N 7 121.440 121.440 122.907 -1.467 19694
2362 1 6 . 1 1 7 7 CYS HA H 7 3.960 3.960 4.415 -0.455 19694
2363 1 6 . 1 1 7 7 CYS CA C 7 59.820 59.820 59.687 0.133 19694
2364 1 6 . 1 1 7 7 CYS CB C 7 30.950 30.950 26.213 4.737 19694
2365 1 6 . 1 1 7 7 CYS H H 7 8.700 8.700 8.611 0.089 19694
2366 1 6 . 1 1 8 8 HIS N N 8 129.390 129.390 129.560 -0.170 19694
2367 1 6 . 1 1 8 8 HIS HA H 8 4.200 4.200 4.173 0.027 19694
2368 1 6 . 1 1 8 8 HIS CA C 8 58.240 58.240 59.363 -1.123 19694
2369 1 6 . 1 1 8 8 HIS CB C 8 29.480 29.480 30.142 -0.662 19694
2370 1 6 . 1 1 8 8 HIS H H 8 9.160 9.160 9.618 -0.458 19694
2371 1 6 . 1 1 9 9 HIS N N 9 118.740 118.740 117.462 1.278 19694
2372 1 6 . 1 1 9 9 HIS HA H 9 4.880 4.880 4.341 0.539 19694
2373 1 6 . 1 1 9 9 HIS CA C 9 58.680 58.680 57.105 1.575 19694
2374 1 6 . 1 1 9 9 HIS CB C 9 31.040 31.040 30.162 0.878 19694
2375 1 6 . 1 1 9 9 HIS H H 9 9.270 9.270 7.949 1.321 19694
2376 1 6 . 1 1 10 10 CYS N N 10 118.600 118.600 117.238 1.362 19694
2377 1 6 . 1 1 10 10 CYS HA H 10 4.600 4.600 4.391 0.209 19694
2378 1 6 . 1 1 10 10 CYS CA C 10 59.600 59.600 59.070 0.530 19694
2379 1 6 . 1 1 10 10 CYS CB C 10 32.330 32.330 27.803 4.527 19694
2380 1 6 . 1 1 10 10 CYS H H 10 8.550 8.550 7.804 0.746 19694
2381 1 6 . 1 1 11 11 ASN N N 11 116.220 116.220 118.262 -2.042 19694
2382 1 6 . 1 1 11 11 ASN HA H 11 4.410 4.410 4.396 0.014 19694
2383 1 6 . 1 1 11 11 ASN CA C 11 55.640 55.640 54.604 1.036 19694
2384 1 6 . 1 1 11 11 ASN CB C 11 38.200 38.200 37.869 0.331 19694
2385 1 6 . 1 1 11 11 ASN H H 11 7.690 7.690 8.632 -0.942 19694
2386 1 6 . 1 1 12 12 GLU N N 12 120.330 120.330 117.567 2.763 19694
2387 1 6 . 1 1 12 12 GLU HA H 12 4.220 4.220 4.471 -0.251 19694
2388 1 6 . 1 1 12 12 GLU CA C 12 56.700 56.700 55.226 1.474 19694
2389 1 6 . 1 1 12 12 GLU CB C 12 30.910 30.910 30.718 0.192 19694
2390 1 6 . 1 1 12 12 GLU H H 12 8.210 8.210 7.626 0.584 19694
2391 1 6 . 1 1 13 13 SER N N 13 116.190 116.190 119.825 -3.635 19694
2392 1 6 . 1 1 13 13 SER HA H 13 4.060 4.060 4.463 -0.403 19694
2393 1 6 . 1 1 13 13 SER CA C 13 59.350 59.350 58.984 0.366 19694
2394 1 6 . 1 1 13 13 SER CB C 13 63.820 63.820 63.616 0.204 19694
2395 1 6 . 1 1 13 13 SER H H 13 8.520 8.520 8.666 -0.146 19694
2396 1 6 . 1 1 14 14 LEU N N 14 126.060 126.060 126.719 -0.659 19694
2397 1 6 . 1 1 14 14 LEU HA H 14 4.310 4.310 4.337 -0.027 19694
2398 1 6 . 1 1 14 14 LEU CA C 14 54.100 54.100 55.763 -1.663 19694
2399 1 6 . 1 1 14 14 LEU CB C 14 42.200 42.200 41.617 0.583 19694
2400 1 6 . 1 1 14 14 LEU H H 14 8.910 8.910 7.762 1.148 19694
2401 1 6 . 1 1 15 15 PHE N N 15 120.660 120.660 120.832 -0.172 19694
2402 1 6 . 1 1 15 15 PHE HA H 15 4.480 4.480 4.613 -0.133 19694
2403 1 6 . 1 1 15 15 PHE CA C 15 60.400 60.400 56.314 4.086 19694
2404 1 6 . 1 1 15 15 PHE CB C 15 38.130 38.130 38.012 0.118 19694
2405 1 6 . 1 1 15 15 PHE H H 15 7.820 7.820 8.511 -0.691 19694
2406 1 6 . 1 1 16 16 GLY N N 16 114.730 114.730 110.953 3.777 19694
2407 1 6 . 1 1 16 16 GLY CA C 16 45.900 45.900 45.840 0.060 19694
2408 1 6 . 1 1 16 16 GLY H H 16 8.860 8.860 8.820 0.040 19694
2409 1 6 . 1 1 17 17 LYS N N 17 119.580 119.580 120.181 -0.601 19694
2410 1 6 . 1 1 17 17 LYS HA H 17 4.480 4.480 4.506 -0.026 19694
2411 1 6 . 1 1 17 17 LYS CA C 17 54.460 54.460 54.505 -0.045 19694
2412 1 6 . 1 1 17 17 LYS CB C 17 35.800 35.800 34.159 1.641 19694
2413 1 6 . 1 1 17 17 LYS H H 17 8.030 8.030 7.229 0.801 19694
2414 1 6 . 1 1 18 18 LYS N N 18 120.330 120.330 122.694 -2.364 19694
2415 1 6 . 1 1 18 18 LYS HA H 18 4.280 4.280 4.346 -0.066 19694
2416 1 6 . 1 1 18 18 LYS CA C 18 56.800 56.800 57.292 -0.492 19694
2417 1 6 . 1 1 18 18 LYS CB C 18 33.010 33.010 32.828 0.182 19694
2418 1 6 . 1 1 18 18 LYS H H 18 8.190 8.190 8.466 -0.277 19694
2419 1 6 . 1 1 19 19 TYR N N 19 117.500 117.500 115.531 1.969 19694
2420 1 6 . 1 1 19 19 TYR HA H 19 5.240 5.240 4.815 0.425 19694
2421 1 6 . 1 1 19 19 TYR CA C 19 55.340 55.340 56.145 -0.805 19694
2422 1 6 . 1 1 19 19 TYR CB C 19 42.850 42.850 40.184 2.666 19694
2423 1 6 . 1 1 19 19 TYR H H 19 7.610 7.610 7.868 -0.258 19694
2424 1 6 . 1 1 20 20 ILE N N 20 121.430 121.430 121.775 -0.345 19694
2425 1 6 . 1 1 20 20 ILE HA H 20 4.137 4.137 4.240 -0.103 19694
2426 1 6 . 1 1 20 20 ILE CA C 20 60.010 60.010 60.129 -0.119 19694
2427 1 6 . 1 1 20 20 ILE CB C 20 41.570 41.570 40.501 1.069 19694
2428 1 6 . 1 1 20 20 ILE H H 20 9.350 9.350 8.316 1.034 19694
2429 1 6 . 1 1 21 21 LEU N N 21 126.720 126.720 126.984 -0.264 19694
2430 1 6 . 1 1 21 21 LEU HA H 21 5.090 5.090 4.533 0.557 19694
2431 1 6 . 1 1 21 21 LEU CA C 21 54.020 54.020 54.317 -0.297 19694
2432 1 6 . 1 1 21 21 LEU CB C 21 43.720 43.720 40.544 3.176 19694
2433 1 6 . 1 1 21 21 LEU H H 21 8.530 8.530 8.527 0.003 19694
2434 1 6 . 1 1 22 22 ARG N N 22 123.930 123.930 125.636 -1.706 19694
2435 1 6 . 1 1 22 22 ARG HA H 22 4.440 4.440 4.531 -0.091 19694
2436 1 6 . 1 1 22 22 ARG CA C 22 55.600 55.600 53.939 1.661 19694
2437 1 6 . 1 1 22 22 ARG CB C 22 32.280 32.280 32.034 0.246 19694
2438 1 6 . 1 1 22 22 ARG H H 22 9.080 9.080 9.064 0.016 19694
2439 1 6 . 1 1 23 23 GLU N N 23 128.500 128.500 125.359 3.141 19694
2440 1 6 . 1 1 23 23 GLU HA H 23 3.840 3.840 3.962 -0.122 19694
2441 1 6 . 1 1 23 23 GLU CA C 23 58.030 58.030 57.778 0.252 19694
2442 1 6 . 1 1 23 23 GLU CB C 23 27.200 27.200 27.781 -0.581 19694
2443 1 6 . 1 1 23 23 GLU H H 23 9.610 9.610 9.021 0.589 19694
2444 1 6 . 1 1 24 24 GLU N N 24 110.300 110.300 113.131 -2.831 19694
2445 1 6 . 1 1 24 24 GLU HA H 24 3.780 3.780 3.902 -0.122 19694
2446 1 6 . 1 1 24 24 GLU CA C 24 58.320 58.320 57.534 0.786 19694
2447 1 6 . 1 1 24 24 GLU CB C 24 28.220 28.220 28.500 -0.280 19694
2448 1 6 . 1 1 24 24 GLU H H 24 8.660 8.660 8.641 0.019 19694
2449 1 6 . 1 1 25 25 SER N N 25 117.700 117.700 113.029 4.671 19694
2450 1 6 . 1 1 25 25 SER HA H 25 4.890 4.890 4.814 0.076 19694
2451 1 6 . 1 1 25 25 SER CA C 25 56.540 56.540 55.577 0.963 19694
2452 1 6 . 1 1 25 25 SER CB C 25 64.720 64.720 65.248 -0.528 19694
2453 1 6 . 1 1 25 25 SER H H 25 7.900 7.900 7.843 0.057 19694
2454 1 6 . 1 1 26 26 PRO HA H 26 4.995 4.995 4.838 0.157 19694
2455 1 6 . 1 1 26 26 PRO CA C 26 61.750 61.750 63.130 -1.380 19694
2456 1 6 . 1 1 26 26 PRO CB C 26 32.660 32.660 31.612 1.048 19694
2457 1 6 . 1 1 27 27 TYR N N 27 118.100 118.100 123.998 -5.898 19694
2458 1 6 . 1 1 27 27 TYR HA H 27 5.910 5.910 4.976 0.934 19694
2459 1 6 . 1 1 27 27 TYR CA C 27 56.830 56.830 55.157 1.673 19694
2460 1 6 . 1 1 27 27 TYR CB C 27 42.810 42.810 42.610 0.200 19694
2461 1 6 . 1 1 27 27 TYR H H 27 9.040 9.040 8.759 0.281 19694
2462 1 6 . 1 1 28 28 CYS N N 28 122.230 122.230 119.658 2.572 19694
2463 1 6 . 1 1 28 28 CYS HA H 28 4.850 4.850 4.667 0.183 19694
2464 1 6 . 1 1 28 28 CYS CA C 28 58.110 58.110 58.440 -0.330 19694
2465 1 6 . 1 1 28 28 CYS CB C 28 30.530 30.530 29.134 1.396 19694
2466 1 6 . 1 1 28 28 CYS H H 28 9.850 9.850 8.341 1.509 19694
2467 1 6 . 1 1 29 29 VAL N N 29 118.200 118.200 122.350 -4.150 19694
2468 1 6 . 1 1 29 29 VAL HA H 29 3.650 3.650 3.717 -0.067 19694
2469 1 6 . 1 1 29 29 VAL CA C 29 67.400 67.400 66.719 0.681 19694
2470 1 6 . 1 1 29 29 VAL CB C 29 31.860 31.860 30.794 1.066 19694
2471 1 6 . 1 1 29 29 VAL H H 29 8.430 8.430 9.057 -0.627 19694
2472 1 6 . 1 1 30 30 VAL N N 30 119.570 119.570 118.616 0.954 19694
2473 1 6 . 1 1 30 30 VAL HA H 30 3.860 3.860 3.629 0.231 19694
2474 1 6 . 1 1 30 30 VAL CA C 30 66.450 66.450 66.079 0.371 19694
2475 1 6 . 1 1 30 30 VAL CB C 30 31.540 31.540 30.384 1.156 19694
2476 1 6 . 1 1 30 30 VAL H H 30 7.700 7.700 8.250 -0.550 19694
2477 1 6 . 1 1 31 31 CYS N N 31 125.890 125.890 119.575 6.315 19694
2478 1 6 . 1 1 31 31 CYS HA H 31 3.830 3.830 3.917 -0.087 19694
2479 1 6 . 1 1 31 31 CYS CA C 31 65.850 65.850 64.299 1.551 19694
2480 1 6 . 1 1 31 31 CYS CB C 31 29.510 29.510 25.576 3.934 19694
2481 1 6 . 1 1 31 31 CYS H H 31 9.050 9.050 7.570 1.480 19694
2482 1 6 . 1 1 32 32 PHE N N 32 119.000 119.000 119.225 -0.225 19694
2483 1 6 . 1 1 32 32 PHE HA H 32 3.780 3.780 3.704 0.076 19694
2484 1 6 . 1 1 32 32 PHE CA C 32 62.610 62.610 61.907 0.703 19694
2485 1 6 . 1 1 32 32 PHE CB C 32 39.920 39.920 39.075 0.845 19694
2486 1 6 . 1 1 32 32 PHE H H 32 9.080 9.080 7.888 1.192 19694
2487 1 6 . 1 1 33 33 GLU N N 33 117.470 117.470 117.914 -0.444 19694
2488 1 6 . 1 1 33 33 GLU HA H 33 3.760 3.760 4.005 -0.245 19694
2489 1 6 . 1 1 33 33 GLU CA C 33 59.210 59.210 59.456 -0.246 19694
2490 1 6 . 1 1 33 33 GLU CB C 33 29.480 29.480 29.424 0.056 19694
2491 1 6 . 1 1 33 33 GLU H H 33 8.510 8.510 7.926 0.584 19694
2492 1 6 . 1 1 34 34 THR N N 34 114.140 114.140 115.174 -1.034 19694
2493 1 6 . 1 1 34 34 THR HA H 34 3.730 3.730 3.939 -0.209 19694
2494 1 6 . 1 1 34 34 THR CA C 34 65.890 65.890 66.156 -0.266 19694
2495 1 6 . 1 1 34 34 THR CB C 34 69.210 69.210 68.743 0.466 19694
2496 1 6 . 1 1 34 34 THR H H 34 7.880 7.880 8.162 -0.282 19694
2497 1 6 . 1 1 35 35 LEU N N 35 117.980 117.980 118.460 -0.480 19694
2498 1 6 . 1 1 35 35 LEU HA H 35 3.650 3.650 3.962 -0.312 19694
2499 1 6 . 1 1 35 35 LEU CA C 35 56.860 56.860 57.167 -0.307 19694
2500 1 6 . 1 1 35 35 LEU CB C 35 41.870 41.870 41.723 0.147 19694
2501 1 6 . 1 1 35 35 LEU H H 35 7.660 7.660 7.709 -0.049 19694
2502 1 6 . 1 1 36 36 PHE N N 36 113.900 113.900 114.079 -0.179 19694
2503 1 6 . 1 1 36 36 PHE HA H 36 4.597 4.597 4.418 0.179 19694
2504 1 6 . 1 1 36 36 PHE CA C 36 56.860 56.860 56.343 0.517 19694
2505 1 6 . 1 1 36 36 PHE CB C 36 40.570 40.570 38.121 2.449 19694
2506 1 6 . 1 1 36 36 PHE H H 36 7.730 7.730 6.614 1.116 19694
2507 1 6 . 1 1 37 37 ALA N N 37 121.920 121.920 123.383 -1.463 19694
2508 1 6 . 1 1 37 37 ALA HA H 37 4.070 4.070 4.092 -0.022 19694
2509 1 6 . 1 1 37 37 ALA CA C 37 52.900 52.900 52.373 0.527 19694
2510 1 6 . 1 1 37 37 ALA CB C 37 19.770 19.770 19.702 0.068 19694
2511 1 6 . 1 1 37 37 ALA H H 37 7.090 7.090 7.905 -0.815 19694
2512 1 6 . 1 1 38 38 ASN N N 38 119.230 119.230 118.588 0.642 19694
2513 1 6 . 1 1 38 38 ASN HA H 38 4.450 4.450 4.626 -0.176 19694
2514 1 6 . 1 1 38 38 ASN CA C 38 52.850 52.850 52.522 0.328 19694
2515 1 6 . 1 1 38 38 ASN CB C 38 38.950 38.950 39.748 -0.798 19694
2516 1 6 . 1 1 38 38 ASN H H 38 8.790 8.790 8.238 0.552 19694
2517 1 6 . 1 1 39 39 THR N N 39 116.330 116.330 115.852 0.478 19694
2518 1 6 . 1 1 39 39 THR HA H 39 3.990 3.990 4.470 -0.480 19694
2519 1 6 . 1 1 39 39 THR CA C 39 62.130 62.130 62.318 -0.188 19694
2520 1 6 . 1 1 39 39 THR CB C 39 69.920 69.920 69.529 0.391 19694
2521 1 6 . 1 1 39 39 THR H H 39 8.540 8.540 8.194 0.346 19694
2522 1 6 . 1 1 40 40 CYS N N 40 126.950 126.950 128.055 -1.105 19694
2523 1 6 . 1 1 40 40 CYS HA H 40 4.300 4.300 4.420 -0.120 19694
2524 1 6 . 1 1 40 40 CYS CA C 40 58.350 58.350 57.094 1.256 19694
2525 1 6 . 1 1 40 40 CYS CB C 40 31.600 31.600 26.627 4.973 19694
2526 1 6 . 1 1 40 40 CYS H H 40 7.940 7.940 8.456 -0.516 19694
2527 1 6 . 1 1 41 41 GLU N N 41 130.560 130.560 127.581 2.979 19694
2528 1 6 . 1 1 41 41 GLU HA H 41 3.690 3.690 3.844 -0.154 19694
2529 1 6 . 1 1 41 41 GLU CA C 41 58.600 58.600 59.128 -0.528 19694
2530 1 6 . 1 1 41 41 GLU CB C 41 30.460 30.460 29.437 1.023 19694
2531 1 6 . 1 1 41 41 GLU H H 41 8.810 8.810 8.660 0.150 19694
2532 1 6 . 1 1 42 42 GLU N N 42 119.680 119.680 118.389 1.291 19694
2533 1 6 . 1 1 42 42 GLU HA H 42 4.570 4.570 4.342 0.228 19694
2534 1 6 . 1 1 42 42 GLU CA C 42 58.000 58.000 58.105 -0.105 19694
2535 1 6 . 1 1 42 42 GLU CB C 42 31.680 31.680 30.522 1.158 19694
2536 1 6 . 1 1 42 42 GLU H H 42 8.500 8.500 8.093 0.407 19694
2537 1 6 . 1 1 43 43 CYS N N 43 115.600 115.600 116.421 -0.821 19694
2538 1 6 . 1 1 43 43 CYS HA H 43 5.010 5.010 4.536 0.474 19694
2539 1 6 . 1 1 43 43 CYS CA C 43 58.810 58.810 60.180 -1.370 19694
2540 1 6 . 1 1 43 43 CYS CB C 43 31.580 31.580 29.142 2.438 19694
2541 1 6 . 1 1 43 43 CYS H H 43 8.120 8.120 7.977 0.143 19694
2542 1 6 . 1 1 44 44 GLY N N 44 112.100 112.100 106.948 5.152 19694
2543 1 6 . 1 1 44 44 GLY CA C 44 46.420 46.420 45.340 1.081 19694
2544 1 6 . 1 1 44 44 GLY H H 44 7.900 7.900 8.607 -0.707 19694
2545 1 6 . 1 1 45 45 LYS N N 45 121.210 121.210 121.995 -0.785 19694
2546 1 6 . 1 1 45 45 LYS HA H 45 4.840 4.840 4.728 0.112 19694
2547 1 6 . 1 1 45 45 LYS CA C 45 54.360 54.360 52.892 1.468 19694
2548 1 6 . 1 1 45 45 LYS CB C 45 32.430 32.430 32.588 -0.158 19694
2549 1 6 . 1 1 45 45 LYS H H 45 8.180 8.180 7.860 0.320 19694
2550 1 6 . 1 1 46 46 PRO HA H 46 4.477 4.477 4.630 -0.153 19694
2551 1 6 . 1 1 46 46 PRO CA C 46 62.700 62.700 62.958 -0.258 19694
2552 1 6 . 1 1 46 46 PRO CB C 46 32.490 32.490 32.114 0.376 19694
2553 1 6 . 1 1 47 47 ILE N N 47 125.280 125.280 122.941 2.339 19694
2554 1 6 . 1 1 47 47 ILE HA H 47 3.830 3.830 4.313 -0.483 19694
2555 1 6 . 1 1 47 47 ILE CA C 47 61.040 61.040 60.669 0.371 19694
2556 1 6 . 1 1 47 47 ILE CB C 47 37.440 37.440 37.839 -0.399 19694
2557 1 6 . 1 1 47 47 ILE H H 47 8.540 8.540 8.889 -0.349 19694
2558 1 6 . 1 1 48 48 GLY N N 48 114.120 114.120 113.739 0.381 19694
2559 1 6 . 1 1 48 48 GLY CA C 48 45.240 45.240 44.485 0.755 19694
2560 1 6 . 1 1 48 48 GLY H H 48 8.660 8.660 8.603 0.057 19694
2561 1 6 . 1 1 49 49 CYS N N 49 117.140 117.140 120.209 -3.069 19694
2562 1 6 . 1 1 49 49 CYS HA H 49 4.280 4.280 4.491 -0.211 19694
2563 1 6 . 1 1 49 49 CYS CA C 49 60.880 60.880 59.510 1.370 19694
2564 1 6 . 1 1 49 49 CYS CB C 49 27.650 27.650 27.286 0.364 19694
2565 1 6 . 1 1 49 49 CYS H H 49 9.210 9.210 8.603 0.607 19694
2566 1 6 . 1 1 50 50 ASP N N 50 119.300 119.300 121.338 -2.038 19694
2567 1 6 . 1 1 50 50 ASP HA H 50 4.620 4.620 4.696 -0.076 19694
2568 1 6 . 1 1 50 50 ASP CA C 50 54.160 54.160 54.901 -0.741 19694
2569 1 6 . 1 1 50 50 ASP CB C 50 40.380 40.380 40.286 0.094 19694
2570 1 6 . 1 1 50 50 ASP H H 50 8.800 8.800 8.536 0.264 19694
2571 1 6 . 1 1 51 51 CYS N N 51 118.150 118.150 116.075 2.075 19694
2572 1 6 . 1 1 51 51 CYS HA H 51 4.620 4.620 4.653 -0.033 19694
2573 1 6 . 1 1 51 51 CYS CA C 51 58.030 58.030 57.371 0.659 19694
2574 1 6 . 1 1 51 51 CYS CB C 51 30.090 30.090 31.924 -1.834 19694
2575 1 6 . 1 1 51 51 CYS H H 51 7.590 7.590 7.812 -0.222 19694
2576 1 6 . 1 1 52 52 LYS N N 52 123.800 123.800 122.789 1.011 19694
2577 1 6 . 1 1 52 52 LYS HA H 52 4.180 4.180 4.363 -0.183 19694
2578 1 6 . 1 1 52 52 LYS CA C 52 57.240 57.240 56.172 1.068 19694
2579 1 6 . 1 1 52 52 LYS CB C 52 33.030 33.030 31.441 1.589 19694
2580 1 6 . 1 1 52 52 LYS H H 52 8.600 8.600 8.581 0.019 19694
2581 1 6 . 1 1 53 53 ASP N N 53 124.900 124.900 123.133 1.767 19694
2582 1 6 . 1 1 53 53 ASP HA H 53 4.230 4.230 4.756 -0.526 19694
2583 1 6 . 1 1 53 53 ASP CA C 53 53.130 53.130 53.358 -0.228 19694
2584 1 6 . 1 1 53 53 ASP CB C 53 42.230 42.230 40.764 1.466 19694
2585 1 6 . 1 1 53 53 ASP H H 53 8.250 8.250 8.326 -0.076 19694
2586 1 6 . 1 1 54 54 LEU N N 54 130.160 130.160 124.264 5.896 19694
2587 1 6 . 1 1 54 54 LEU HA H 54 4.440 4.440 4.508 -0.068 19694
2588 1 6 . 1 1 54 54 LEU CA C 54 53.340 53.340 55.438 -2.098 19694
2589 1 6 . 1 1 54 54 LEU CB C 54 41.170 41.170 43.021 -1.851 19694
2590 1 6 . 1 1 54 54 LEU H H 54 8.670 8.670 8.904 -0.234 19694
2591 1 6 . 1 1 55 55 SER N N 55 113.820 113.820 121.279 -7.459 19694
2592 1 6 . 1 1 55 55 SER HA H 55 5.580 5.580 5.123 0.457 19694
2593 1 6 . 1 1 55 55 SER CA C 55 55.850 55.850 56.780 -0.930 19694
2594 1 6 . 1 1 55 55 SER CB C 55 67.300 67.300 64.505 2.795 19694
2595 1 6 . 1 1 55 55 SER H H 55 8.160 8.160 8.478 -0.318 19694
2596 1 6 . 1 1 56 56 TYR N N 56 122.610 122.610 127.848 -5.238 19694
2597 1 6 . 1 1 56 56 TYR HA H 56 4.620 4.620 4.642 -0.022 19694
2598 1 6 . 1 1 56 56 TYR CA C 56 58.810 58.810 59.049 -0.239 19694
2599 1 6 . 1 1 56 56 TYR CB C 56 41.000 41.000 41.742 -0.742 19694
2600 1 6 . 1 1 56 56 TYR H H 56 8.450 8.450 8.598 -0.148 19694
2601 1 6 . 1 1 57 57 LYS N N 57 126.020 126.020 128.118 -2.098 19694
2602 1 6 . 1 1 57 57 LYS HA H 57 3.470 3.470 3.955 -0.485 19694
2603 1 6 . 1 1 57 57 LYS CA C 57 58.100 58.100 57.828 0.272 19694
2604 1 6 . 1 1 57 57 LYS CB C 57 29.480 29.480 31.372 -1.892 19694
2605 1 6 . 1 1 57 57 LYS H H 57 8.920 8.920 8.971 -0.051 19694
2606 1 6 . 1 1 58 58 ASP HA H 58 3.830 3.830 4.263 -0.433 19694
2607 1 6 . 1 1 58 58 ASP CA C 58 54.900 54.900 55.836 -0.935 19694
2608 1 6 . 1 1 58 58 ASP CB C 58 40.080 40.080 40.677 -0.597 19694
2609 1 6 . 1 1 58 58 ASP H H 58 8.400 8.400 8.548 -0.148 19694
2610 1 6 . 1 1 59 59 ARG N N 59 121.190 121.190 116.434 4.756 19694
2611 1 6 . 1 1 59 59 ARG HA H 59 4.250 4.250 4.417 -0.167 19694
2612 1 6 . 1 1 59 59 ARG CA C 59 55.580 55.580 54.258 1.322 19694
2613 1 6 . 1 1 59 59 ARG CB C 59 33.460 33.460 33.742 -0.282 19694
2614 1 6 . 1 1 59 59 ARG H H 59 7.980 7.980 7.838 0.142 19694
2615 1 6 . 1 1 60 60 HIS N N 60 118.420 118.420 117.592 0.828 19694
2616 1 6 . 1 1 60 60 HIS HA H 60 5.270 5.270 5.581 -0.311 19694
2617 1 6 . 1 1 60 60 HIS CA C 60 55.010 55.010 55.221 -0.211 19694
2618 1 6 . 1 1 60 60 HIS CB C 60 32.380 32.380 33.262 -0.882 19694
2619 1 6 . 1 1 60 60 HIS H H 60 8.350 8.350 8.178 0.172 19694
2620 1 6 . 1 1 61 61 TRP N N 61 119.990 119.990 118.414 1.576 19694
2621 1 6 . 1 1 61 61 TRP HA H 61 5.930 5.930 4.776 1.154 19694
2622 1 6 . 1 1 61 61 TRP CA C 61 57.400 57.400 57.102 0.298 19694
2623 1 6 . 1 1 61 61 TRP CB C 61 35.380 35.380 34.144 1.236 19694
2624 1 6 . 1 1 61 61 TRP H H 61 9.310 9.310 9.296 0.014 19694
2625 1 6 . 1 1 62 62 HIS N N 62 117.270 117.270 121.418 -4.148 19694
2626 1 6 . 1 1 62 62 HIS HA H 62 4.600 4.600 4.849 -0.249 19694
2627 1 6 . 1 1 62 62 HIS CA C 62 59.210 59.210 57.369 1.841 19694
2628 1 6 . 1 1 62 62 HIS CB C 62 31.200 31.200 30.449 0.751 19694
2629 1 6 . 1 1 62 62 HIS H H 62 8.430 8.430 9.138 -0.708 19694
2630 1 6 . 1 1 63 63 GLU N N 63 124.640 124.640 128.795 -4.155 19694
2631 1 6 . 1 1 63 63 GLU HA H 63 3.827 3.827 3.952 -0.125 19694
2632 1 6 . 1 1 63 63 GLU CA C 63 61.020 61.020 59.630 1.390 19694
2633 1 6 . 1 1 63 63 GLU CB C 63 30.310 30.310 29.688 0.622 19694
2634 1 6 . 1 1 63 63 GLU H H 63 9.040 9.040 8.393 0.647 19694
2635 1 6 . 1 1 64 64 ALA N N 64 117.050 117.050 117.899 -0.849 19694
2636 1 6 . 1 1 64 64 ALA HA H 64 4.230 4.230 4.265 -0.035 19694
2637 1 6 . 1 1 64 64 ALA CA C 64 54.000 54.000 53.077 0.923 19694
2638 1 6 . 1 1 64 64 ALA CB C 64 18.880 18.880 18.988 -0.108 19694
2639 1 6 . 1 1 64 64 ALA H H 64 8.680 8.680 8.324 0.356 19694
2640 1 6 . 1 1 65 65 CYS N N 65 115.380 115.380 117.090 -1.710 19694
2641 1 6 . 1 1 65 65 CYS HA H 65 4.295 4.295 4.096 0.199 19694
2642 1 6 . 1 1 65 65 CYS CA C 65 59.850 59.850 60.165 -0.315 19694
2643 1 6 . 1 1 65 65 CYS CB C 65 32.840 32.840 26.871 5.969 19694
2644 1 6 . 1 1 65 65 CYS H H 65 7.490 7.490 8.147 -0.657 19694
2645 1 6 . 1 1 66 66 PHE N N 66 122.020 122.020 123.132 -1.112 19694
2646 1 6 . 1 1 66 66 PHE HA H 66 3.890 3.890 3.822 0.068 19694
2647 1 6 . 1 1 66 66 PHE CA C 66 57.010 57.010 58.484 -1.474 19694
2648 1 6 . 1 1 66 66 PHE CB C 66 38.070 38.070 38.197 -0.127 19694
2649 1 6 . 1 1 66 66 PHE H H 66 7.110 7.110 7.550 -0.440 19694
2650 1 6 . 1 1 67 67 HIS N N 67 121.280 121.280 121.971 -0.691 19694
2651 1 6 . 1 1 67 67 HIS HA H 67 4.720 4.720 5.286 -0.566 19694
2652 1 6 . 1 1 67 67 HIS CA C 67 52.730 52.730 52.827 -0.097 19694
2653 1 6 . 1 1 67 67 HIS CB C 67 32.230 32.230 30.821 1.409 19694
2654 1 6 . 1 1 67 67 HIS H H 67 7.380 7.380 7.675 -0.295 19694
2655 1 6 . 1 1 68 68 CYS N N 68 121.590 121.590 118.860 2.730 19694
2656 1 6 . 1 1 68 68 CYS HA H 68 3.960 3.960 4.958 -0.998 19694
2657 1 6 . 1 1 68 68 CYS CA C 68 59.790 59.790 57.972 1.818 19694
2658 1 6 . 1 1 68 68 CYS CB C 68 31.200 31.200 29.327 1.873 19694
2659 1 6 . 1 1 68 68 CYS H H 68 8.530 8.530 8.396 0.134 19694
2660 1 6 . 1 1 69 69 SER N N 69 126.530 126.530 119.669 6.861 19694
2661 1 6 . 1 1 69 69 SER HA H 69 4.310 4.310 4.066 0.244 19694
2662 1 6 . 1 1 69 69 SER CA C 69 61.760 61.760 60.850 0.910 19694
2663 1 6 . 1 1 69 69 SER CB C 69 64.040 64.040 63.355 0.685 19694
2664 1 6 . 1 1 69 69 SER H H 69 9.460 9.460 8.691 0.769 19694
2665 1 6 . 1 1 70 70 GLN N N 70 122.370 122.370 118.429 3.941 19694
2666 1 6 . 1 1 70 70 GLN HA H 70 4.510 4.510 4.381 0.129 19694
2667 1 6 . 1 1 70 70 GLN CA C 70 57.840 57.840 57.401 0.438 19694
2668 1 6 . 1 1 70 70 GLN CB C 70 30.430 30.430 29.406 1.024 19694
2669 1 6 . 1 1 70 70 GLN H H 70 8.980 8.980 7.893 1.087 19694
2670 1 6 . 1 1 71 71 CYS N N 71 118.860 118.860 115.770 3.090 19694
2671 1 6 . 1 1 71 71 CYS HA H 71 4.720 4.720 4.712 0.008 19694
2672 1 6 . 1 1 71 71 CYS CA C 71 59.770 59.770 58.426 1.344 19694
2673 1 6 . 1 1 71 71 CYS CB C 71 31.910 31.910 28.166 3.744 19694
2674 1 6 . 1 1 71 71 CYS H H 71 8.220 8.220 7.708 0.512 19694
2675 1 6 . 1 1 72 72 ARG N N 72 114.380 114.380 115.956 -1.576 19694
2676 1 6 . 1 1 72 72 ARG HA H 72 3.965 3.965 3.774 0.191 19694
2677 1 6 . 1 1 72 72 ARG CA C 72 58.030 58.030 57.203 0.827 19694
2678 1 6 . 1 1 72 72 ARG CB C 72 27.720 27.720 27.240 0.480 19694
2679 1 6 . 1 1 72 72 ARG H H 72 7.380 7.380 7.858 -0.478 19694
2680 1 6 . 1 1 73 73 ASN N N 73 121.480 121.480 116.509 4.971 19694
2681 1 6 . 1 1 73 73 ASN HA H 73 4.630 4.630 4.662 -0.032 19694
2682 1 6 . 1 1 73 73 ASN CA C 73 54.110 54.110 53.585 0.525 19694
2683 1 6 . 1 1 73 73 ASN CB C 73 38.870 38.870 39.753 -0.883 19694
2684 1 6 . 1 1 73 73 ASN H H 73 8.722 8.722 7.986 0.736 19694
2685 1 6 . 1 1 74 74 SER N N 74 114.710 114.710 117.905 -3.195 19694
2686 1 6 . 1 1 74 74 SER HA H 74 4.060 4.060 4.870 -0.810 19694
2687 1 6 . 1 1 74 74 SER CA C 74 59.357 59.357 58.441 0.916 19694
2688 1 6 . 1 1 74 74 SER CB C 74 63.300 63.300 63.293 0.007 19694
2689 1 6 . 1 1 74 74 SER H H 74 8.690 8.690 8.608 0.082 19694
2690 1 6 . 1 1 75 75 LEU N N 75 125.757 125.757 127.766 -2.009 19694
2691 1 6 . 1 1 75 75 LEU HA H 75 4.280 4.280 4.334 -0.054 19694
2692 1 6 . 1 1 75 75 LEU CA C 75 53.510 53.510 54.780 -1.270 19694
2693 1 6 . 1 1 75 75 LEU CB C 75 42.200 42.200 41.706 0.494 19694
2694 1 6 . 1 1 75 75 LEU H H 75 7.970 7.970 8.088 -0.118 19694
2695 1 6 . 1 1 76 76 VAL N N 76 120.860 120.860 124.259 -3.399 19694
2696 1 6 . 1 1 76 76 VAL HA H 76 3.570 3.570 3.881 -0.311 19694
2697 1 6 . 1 1 76 76 VAL CA C 76 65.420 65.420 60.887 4.533 19694
2698 1 6 . 1 1 76 76 VAL CB C 76 31.540 31.540 34.774 -3.234 19694
2699 1 6 . 1 1 76 76 VAL H H 76 7.830 7.830 8.026 -0.196 19694
2700 1 6 . 1 1 77 77 ASP N N 77 122.360 122.360 121.844 0.516 19694
2701 1 6 . 1 1 77 77 ASP HA H 77 4.230 4.230 4.419 -0.189 19694
2702 1 6 . 1 1 77 77 ASP CA C 77 56.200 56.200 55.751 0.449 19694
2703 1 6 . 1 1 77 77 ASP CB C 77 39.380 39.380 40.316 -0.936 19694
2704 1 6 . 1 1 77 77 ASP H H 77 8.910 8.910 8.383 0.527 19694
2705 1 6 . 1 1 78 78 LYS N N 78 118.100 118.100 118.811 -0.711 19694
2706 1 6 . 1 1 78 78 LYS HA H 78 4.870 4.870 4.611 0.259 19694
2707 1 6 . 1 1 78 78 LYS CA C 78 56.960 56.960 53.489 3.471 19694
2708 1 6 . 1 1 78 78 LYS CB C 78 34.680 34.680 33.675 1.005 19694
2709 1 6 . 1 1 78 78 LYS H H 78 7.660 7.660 7.568 0.092 19694
2710 1 6 . 1 1 79 79 PRO HA H 79 4.460 4.460 4.155 0.305 19694
2711 1 6 . 1 1 79 79 PRO CA C 79 62.520 62.520 62.863 -0.343 19694
2712 1 6 . 1 1 79 79 PRO CB C 79 32.160 32.160 31.905 0.255 19694
2713 1 6 . 1 1 80 80 PHE N N 80 114.050 114.050 117.563 -3.513 19694
2714 1 6 . 1 1 80 80 PHE HA H 80 4.910 4.910 4.958 -0.048 19694
2715 1 6 . 1 1 80 80 PHE CA C 80 56.060 56.060 55.398 0.662 19694
2716 1 6 . 1 1 80 80 PHE CB C 80 42.410 42.410 41.228 1.182 19694
2717 1 6 . 1 1 80 80 PHE H H 80 7.510 7.510 7.306 0.204 19694
2718 1 6 . 1 1 81 81 ALA N N 81 123.290 123.290 123.636 -0.346 19694
2719 1 6 . 1 1 81 81 ALA HA H 81 4.310 4.310 4.347 -0.037 19694
2720 1 6 . 1 1 81 81 ALA CA C 81 50.450 50.450 50.374 0.076 19694
2721 1 6 . 1 1 81 81 ALA CB C 81 21.920 21.920 18.918 3.002 19694
2722 1 6 . 1 1 81 81 ALA H H 81 9.030 9.030 9.014 0.016 19694
2723 1 6 . 1 1 82 82 ALA N N 82 122.490 122.490 128.408 -5.918 19694
2724 1 6 . 1 1 82 82 ALA HA H 82 5.110 5.110 4.391 0.719 19694
2725 1 6 . 1 1 82 82 ALA CA C 82 51.100 51.100 51.937 -0.837 19694
2726 1 6 . 1 1 82 82 ALA CB C 82 21.130 21.130 18.816 2.314 19694
2727 1 6 . 1 1 82 82 ALA H H 82 8.240 8.240 8.593 -0.353 19694
2728 1 6 . 1 1 83 83 LYS N N 83 123.580 123.580 125.884 -2.304 19694
2729 1 6 . 1 1 83 83 LYS HA H 83 4.490 4.490 4.486 0.004 19694
2730 1 6 . 1 1 83 83 LYS CA C 83 55.800 55.800 55.604 0.196 19694
2731 1 6 . 1 1 83 83 LYS CB C 83 34.720 34.720 34.103 0.617 19694
2732 1 6 . 1 1 83 83 LYS H H 83 8.400 8.400 8.326 0.074 19694
2733 1 6 . 1 1 84 84 GLU N N 84 125.470 125.470 119.581 5.889 19694
2734 1 6 . 1 1 84 84 GLU HA H 84 3.820 3.820 4.132 -0.312 19694
2735 1 6 . 1 1 84 84 GLU CA C 84 58.620 58.620 59.101 -0.481 19694
2736 1 6 . 1 1 84 84 GLU CB C 84 27.210 27.210 29.557 -2.347 19694
2737 1 6 . 1 1 84 84 GLU H H 84 9.320 9.320 8.677 0.643 19694
2738 1 6 . 1 1 85 85 ASP N N 85 118.550 118.550 114.332 4.218 19694
2739 1 6 . 1 1 85 85 ASP HA H 85 4.600 4.600 4.769 -0.169 19694
2740 1 6 . 1 1 85 85 ASP CA C 85 55.400 55.400 53.901 1.499 19694
2741 1 6 . 1 1 85 85 ASP CB C 85 40.400 40.400 42.333 -1.933 19694
2742 1 6 . 1 1 85 85 ASP H H 85 8.730 8.730 8.370 0.360 19694
2743 1 6 . 1 1 86 86 GLN N N 86 119.050 119.050 117.679 1.371 19694
2744 1 6 . 1 1 86 86 GLN HA H 86 4.540 4.540 4.679 -0.139 19694
2745 1 6 . 1 1 86 86 GLN CA C 86 55.100 55.100 54.071 1.029 19694
2746 1 6 . 1 1 86 86 GLN CB C 86 31.110 31.110 31.932 -0.822 19694
2747 1 6 . 1 1 86 86 GLN H H 86 8.170 8.170 7.614 0.556 19694
2748 1 6 . 1 1 87 87 LEU N N 87 123.110 123.110 121.323 1.787 19694
2749 1 6 . 1 1 87 87 LEU HA H 87 4.620 4.620 5.218 -0.598 19694
2750 1 6 . 1 1 87 87 LEU CA C 87 54.520 54.520 53.999 0.521 19694
2751 1 6 . 1 1 87 87 LEU CB C 87 42.700 42.700 44.618 -1.919 19694
2752 1 6 . 1 1 87 87 LEU H H 87 8.490 8.490 8.520 -0.030 19694
2753 1 6 . 1 1 88 88 LEU N N 88 123.690 123.690 120.193 3.497 19694
2754 1 6 . 1 1 88 88 LEU HA H 88 5.880 5.880 4.950 0.930 19694
2755 1 6 . 1 1 88 88 LEU CA C 88 53.340 53.340 52.814 0.526 19694
2756 1 6 . 1 1 88 88 LEU CB C 88 47.190 47.190 47.814 -0.624 19694
2757 1 6 . 1 1 88 88 LEU H H 88 8.930 8.930 8.319 0.611 19694
2758 1 6 . 1 1 89 89 CYS N N 89 122.270 122.270 119.695 2.575 19694
2759 1 6 . 1 1 89 89 CYS HA H 89 4.780 4.780 4.828 -0.048 19694
2760 1 6 . 1 1 89 89 CYS CA C 89 57.640 57.640 59.211 -1.571 19694
2761 1 6 . 1 1 89 89 CYS CB C 89 30.940 30.940 28.188 2.752 19694
2762 1 6 . 1 1 89 89 CYS H H 89 9.430 9.430 9.038 0.392 19694
2763 1 6 . 1 1 90 90 THR N N 90 110.620 110.620 116.973 -6.353 19694
2764 1 6 . 1 1 90 90 THR HA H 90 3.900 3.900 3.974 -0.074 19694
2765 1 6 . 1 1 90 90 THR CA C 90 65.460 65.460 65.966 -0.506 19694
2766 1 6 . 1 1 90 90 THR CB C 90 68.670 68.670 68.860 -0.190 19694
2767 1 6 . 1 1 90 90 THR H H 90 8.410 8.410 8.821 -0.411 19694
2768 1 6 . 1 1 91 91 ASP N N 91 123.470 123.470 121.728 1.742 19694
2769 1 6 . 1 1 91 91 ASP HA H 91 4.490 4.490 4.653 -0.163 19694
2770 1 6 . 1 1 91 91 ASP CA C 91 57.810 57.810 57.130 0.680 19694
2771 1 6 . 1 1 91 91 ASP CB C 91 41.160 41.160 40.462 0.698 19694
2772 1 6 . 1 1 91 91 ASP H H 91 8.150 8.150 8.465 -0.315 19694
2773 1 6 . 1 1 92 92 CYS N N 92 123.800 123.800 119.701 4.099 19694
2774 1 6 . 1 1 92 92 CYS HA H 92 3.970 3.970 4.246 -0.276 19694
2775 1 6 . 1 1 92 92 CYS CA C 92 64.100 64.100 61.225 2.875 19694
2776 1 6 . 1 1 92 92 CYS CB C 92 30.090 30.090 25.569 4.521 19694
2777 1 6 . 1 1 92 92 CYS H H 92 8.580 8.580 7.934 0.646 19694
2778 1 6 . 1 1 93 93 TYR N N 93 120.730 120.730 121.007 -0.277 19694
2779 1 6 . 1 1 93 93 TYR HA H 93 4.140 4.140 4.097 0.043 19694
2780 1 6 . 1 1 93 93 TYR CA C 93 60.380 60.380 61.527 -1.147 19694
2781 1 6 . 1 1 93 93 TYR CB C 93 39.300 39.300 38.446 0.854 19694
2782 1 6 . 1 1 93 93 TYR H H 93 8.540 8.540 9.172 -0.632 19694
2783 1 6 . 1 1 94 94 SER N N 94 115.010 115.010 113.149 1.861 19694
2784 1 6 . 1 1 94 94 SER HA H 94 4.220 4.220 4.197 0.023 19694
2785 1 6 . 1 1 94 94 SER CA C 94 59.300 59.300 61.744 -2.444 19694
2786 1 6 . 1 1 94 94 SER CB C 94 63.660 63.660 62.465 1.196 19694
2787 1 6 . 1 1 94 94 SER H H 94 7.750 7.750 8.088 -0.338 19694
2788 1 6 . 1 1 95 95 ASN N N 95 119.820 119.820 119.268 0.552 19694
2789 1 6 . 1 1 95 95 ASN HA H 95 4.510 4.510 4.576 -0.066 19694
2790 1 6 . 1 1 95 95 ASN CA C 95 53.880 53.880 55.718 -1.838 19694
2791 1 6 . 1 1 95 95 ASN CB C 95 39.300 39.300 38.865 0.435 19694
2792 1 6 . 1 1 95 95 ASN H H 95 7.780 7.780 7.842 -0.062 19694
2793 1 6 . 1 1 96 96 GLU N N 96 119.820 119.820 117.606 2.214 19694
2794 1 6 . 1 1 96 96 GLU HA H 96 4.096 4.096 4.246 -0.150 19694
2795 1 6 . 1 1 96 96 GLU CA C 96 56.910 56.910 57.093 -0.183 19694
2796 1 6 . 1 1 96 96 GLU CB C 96 30.220 30.220 29.494 0.726 19694
2797 1 6 . 1 1 96 96 GLU H H 96 7.950 7.950 7.653 0.297 19694
2798 1 6 . 1 1 97 97 TYR N N 97 120.370 120.370 121.527 -1.157 19694
2799 1 6 . 1 1 97 97 TYR HA H 97 4.620 4.620 3.982 0.638 19694
2800 1 6 . 1 1 97 97 TYR CA C 97 57.700 57.700 60.049 -2.349 19694
2801 1 6 . 1 1 97 97 TYR CB C 97 38.710 38.710 38.190 0.520 19694
2802 1 6 . 1 1 97 97 TYR H H 97 8.070 8.070 8.517 -0.447 19694
2803 1 7 . 1 1 2 2 THR N N 2 113.570 113.570 116.015 -2.445 19694
2804 1 7 . 1 1 2 2 THR HA H 2 4.240 4.240 4.287 -0.047 19694
2805 1 7 . 1 1 2 2 THR CA C 2 62.130 62.130 62.927 -0.797 19694
2806 1 7 . 1 1 2 2 THR CB C 2 69.250 69.250 69.053 0.197 19694
2807 1 7 . 1 1 2 2 THR H H 2 8.090 8.090 8.143 -0.053 19694
2808 1 7 . 1 1 3 3 GLU N N 3 122.880 122.880 120.525 2.355 19694
2809 1 7 . 1 1 3 3 GLU HA H 3 4.280 4.280 4.223 0.057 19694
2810 1 7 . 1 1 3 3 GLU CA C 3 56.860 56.860 56.401 0.459 19694
2811 1 7 . 1 1 3 3 GLU CB C 3 30.570 30.570 30.196 0.374 19694
2812 1 7 . 1 1 3 3 GLU H H 3 8.280 8.280 8.048 0.232 19694
2813 1 7 . 1 1 4 4 ARG N N 4 121.330 121.330 119.244 2.086 19694
2814 1 7 . 1 1 4 4 ARG HA H 4 4.300 4.300 4.543 -0.243 19694
2815 1 7 . 1 1 4 4 ARG CA C 4 55.870 55.870 55.207 0.663 19694
2816 1 7 . 1 1 4 4 ARG CB C 4 31.640 31.640 30.749 0.891 19694
2817 1 7 . 1 1 4 4 ARG H H 4 8.280 8.280 8.518 -0.238 19694
2818 1 7 . 1 1 5 5 PHE N N 5 125.490 125.490 125.018 0.472 19694
2819 1 7 . 1 1 5 5 PHE HA H 5 4.610 4.610 4.532 0.078 19694
2820 1 7 . 1 1 5 5 PHE CA C 5 56.380 56.380 56.405 -0.025 19694
2821 1 7 . 1 1 5 5 PHE CB C 5 39.560 39.560 39.325 0.235 19694
2822 1 7 . 1 1 5 5 PHE H H 5 8.290 8.290 8.758 -0.468 19694
2823 1 7 . 1 1 6 6 ASP N N 6 123.260 123.260 121.245 2.015 19694
2824 1 7 . 1 1 6 6 ASP HA H 6 5.045 5.045 4.795 0.250 19694
2825 1 7 . 1 1 6 6 ASP CA C 6 52.180 52.180 53.141 -0.961 19694
2826 1 7 . 1 1 6 6 ASP CB C 6 44.210 44.210 45.084 -0.874 19694
2827 1 7 . 1 1 6 6 ASP H H 6 7.940 7.940 7.565 0.375 19694
2828 1 7 . 1 1 7 7 CYS N N 7 121.440 121.440 122.401 -0.961 19694
2829 1 7 . 1 1 7 7 CYS HA H 7 3.960 3.960 4.428 -0.468 19694
2830 1 7 . 1 1 7 7 CYS CA C 7 59.820 59.820 59.420 0.400 19694
2831 1 7 . 1 1 7 7 CYS CB C 7 30.950 30.950 26.234 4.716 19694
2832 1 7 . 1 1 7 7 CYS H H 7 8.700 8.700 8.678 0.022 19694
2833 1 7 . 1 1 8 8 HIS N N 8 129.390 129.390 129.809 -0.419 19694
2834 1 7 . 1 1 8 8 HIS HA H 8 4.200 4.200 4.216 -0.016 19694
2835 1 7 . 1 1 8 8 HIS CA C 8 58.240 58.240 59.644 -1.404 19694
2836 1 7 . 1 1 8 8 HIS CB C 8 29.480 29.480 30.111 -0.631 19694
2837 1 7 . 1 1 8 8 HIS H H 8 9.160 9.160 9.634 -0.474 19694
2838 1 7 . 1 1 9 9 HIS N N 9 118.740 118.740 117.538 1.202 19694
2839 1 7 . 1 1 9 9 HIS HA H 9 4.880 4.880 4.380 0.500 19694
2840 1 7 . 1 1 9 9 HIS CA C 9 58.680 58.680 57.217 1.463 19694
2841 1 7 . 1 1 9 9 HIS CB C 9 31.040 31.040 30.054 0.986 19694
2842 1 7 . 1 1 9 9 HIS H H 9 9.270 9.270 7.953 1.317 19694
2843 1 7 . 1 1 10 10 CYS N N 10 118.600 118.600 117.197 1.403 19694
2844 1 7 . 1 1 10 10 CYS HA H 10 4.600 4.600 4.471 0.129 19694
2845 1 7 . 1 1 10 10 CYS CA C 10 59.600 59.600 59.135 0.466 19694
2846 1 7 . 1 1 10 10 CYS CB C 10 32.330 32.330 28.127 4.203 19694
2847 1 7 . 1 1 10 10 CYS H H 10 8.550 8.550 7.838 0.712 19694
2848 1 7 . 1 1 11 11 ASN N N 11 116.220 116.220 117.279 -1.059 19694
2849 1 7 . 1 1 11 11 ASN HA H 11 4.410 4.410 4.362 0.048 19694
2850 1 7 . 1 1 11 11 ASN CA C 11 55.640 55.640 54.424 1.216 19694
2851 1 7 . 1 1 11 11 ASN CB C 11 38.200 38.200 36.404 1.796 19694
2852 1 7 . 1 1 11 11 ASN H H 11 7.690 7.690 8.659 -0.969 19694
2853 1 7 . 1 1 12 12 GLU N N 12 120.330 120.330 118.081 2.249 19694
2854 1 7 . 1 1 12 12 GLU HA H 12 4.220 4.220 4.565 -0.345 19694
2855 1 7 . 1 1 12 12 GLU CA C 12 56.700 56.700 54.753 1.947 19694
2856 1 7 . 1 1 12 12 GLU CB C 12 30.910 30.910 31.145 -0.235 19694
2857 1 7 . 1 1 12 12 GLU H H 12 8.210 8.210 7.687 0.523 19694
2858 1 7 . 1 1 13 13 SER N N 13 116.190 116.190 120.432 -4.242 19694
2859 1 7 . 1 1 13 13 SER HA H 13 4.060 4.060 4.293 -0.233 19694
2860 1 7 . 1 1 13 13 SER CA C 13 59.350 59.350 59.692 -0.342 19694
2861 1 7 . 1 1 13 13 SER CB C 13 63.820 63.820 63.515 0.305 19694
2862 1 7 . 1 1 13 13 SER H H 13 8.520 8.520 8.692 -0.172 19694
2863 1 7 . 1 1 14 14 LEU N N 14 126.060 126.060 124.400 1.660 19694
2864 1 7 . 1 1 14 14 LEU HA H 14 4.310 4.310 4.340 -0.030 19694
2865 1 7 . 1 1 14 14 LEU CA C 14 54.100 54.100 55.621 -1.522 19694
2866 1 7 . 1 1 14 14 LEU CB C 14 42.200 42.200 41.774 0.426 19694
2867 1 7 . 1 1 14 14 LEU H H 14 8.910 8.910 7.840 1.070 19694
2868 1 7 . 1 1 15 15 PHE N N 15 120.660 120.660 121.008 -0.348 19694
2869 1 7 . 1 1 15 15 PHE HA H 15 4.480 4.480 4.610 -0.130 19694
2870 1 7 . 1 1 15 15 PHE CA C 15 60.400 60.400 56.418 3.982 19694
2871 1 7 . 1 1 15 15 PHE CB C 15 38.130 38.130 37.890 0.240 19694
2872 1 7 . 1 1 15 15 PHE H H 15 7.820 7.820 8.502 -0.682 19694
2873 1 7 . 1 1 16 16 GLY N N 16 114.730 114.730 110.947 3.783 19694
2874 1 7 . 1 1 16 16 GLY CA C 16 45.900 45.900 45.796 0.104 19694
2875 1 7 . 1 1 16 16 GLY H H 16 8.860 8.860 8.816 0.044 19694
2876 1 7 . 1 1 17 17 LYS N N 17 119.580 119.580 119.728 -0.148 19694
2877 1 7 . 1 1 17 17 LYS HA H 17 4.480 4.480 4.471 0.009 19694
2878 1 7 . 1 1 17 17 LYS CA C 17 54.460 54.460 54.642 -0.183 19694
2879 1 7 . 1 1 17 17 LYS CB C 17 35.800 35.800 33.934 1.866 19694
2880 1 7 . 1 1 17 17 LYS H H 17 8.030 8.030 7.245 0.785 19694
2881 1 7 . 1 1 18 18 LYS N N 18 120.330 120.330 121.739 -1.409 19694
2882 1 7 . 1 1 18 18 LYS HA H 18 4.280 4.280 4.337 -0.057 19694
2883 1 7 . 1 1 18 18 LYS CA C 18 56.800 56.800 57.498 -0.698 19694
2884 1 7 . 1 1 18 18 LYS CB C 18 33.010 33.010 32.822 0.188 19694
2885 1 7 . 1 1 18 18 LYS H H 18 8.190 8.190 8.519 -0.329 19694
2886 1 7 . 1 1 19 19 TYR N N 19 117.500 117.500 114.073 3.427 19694
2887 1 7 . 1 1 19 19 TYR HA H 19 5.240 5.240 4.745 0.495 19694
2888 1 7 . 1 1 19 19 TYR CA C 19 55.340 55.340 56.413 -1.073 19694
2889 1 7 . 1 1 19 19 TYR CB C 19 42.850 42.850 40.379 2.471 19694
2890 1 7 . 1 1 19 19 TYR H H 19 7.610 7.610 7.804 -0.194 19694
2891 1 7 . 1 1 20 20 ILE N N 20 121.430 121.430 121.929 -0.499 19694
2892 1 7 . 1 1 20 20 ILE HA H 20 4.137 4.137 4.241 -0.104 19694
2893 1 7 . 1 1 20 20 ILE CA C 20 60.010 60.010 60.101 -0.091 19694
2894 1 7 . 1 1 20 20 ILE CB C 20 41.570 41.570 40.588 0.982 19694
2895 1 7 . 1 1 20 20 ILE H H 20 9.350 9.350 8.229 1.121 19694
2896 1 7 . 1 1 21 21 LEU N N 21 126.720 126.720 126.957 -0.237 19694
2897 1 7 . 1 1 21 21 LEU HA H 21 5.090 5.090 4.537 0.553 19694
2898 1 7 . 1 1 21 21 LEU CA C 21 54.020 54.020 54.260 -0.240 19694
2899 1 7 . 1 1 21 21 LEU CB C 21 43.720 43.720 40.491 3.229 19694
2900 1 7 . 1 1 21 21 LEU H H 21 8.530 8.530 8.521 0.009 19694
2901 1 7 . 1 1 22 22 ARG N N 22 123.930 123.930 126.077 -2.147 19694
2902 1 7 . 1 1 22 22 ARG HA H 22 4.440 4.440 4.420 0.020 19694
2903 1 7 . 1 1 22 22 ARG CA C 22 55.600 55.600 54.315 1.285 19694
2904 1 7 . 1 1 22 22 ARG CB C 22 32.280 32.280 31.868 0.412 19694
2905 1 7 . 1 1 22 22 ARG H H 22 9.080 9.080 9.031 0.049 19694
2906 1 7 . 1 1 23 23 GLU N N 23 128.500 128.500 124.524 3.976 19694
2907 1 7 . 1 1 23 23 GLU HA H 23 3.840 3.840 3.956 -0.116 19694
2908 1 7 . 1 1 23 23 GLU CA C 23 58.030 58.030 57.908 0.122 19694
2909 1 7 . 1 1 23 23 GLU CB C 23 27.200 27.200 27.433 -0.233 19694
2910 1 7 . 1 1 23 23 GLU H H 23 9.610 9.610 8.986 0.624 19694
2911 1 7 . 1 1 24 24 GLU N N 24 110.300 110.300 113.134 -2.834 19694
2912 1 7 . 1 1 24 24 GLU HA H 24 3.780 3.780 3.887 -0.107 19694
2913 1 7 . 1 1 24 24 GLU CA C 24 58.320 58.320 57.575 0.745 19694
2914 1 7 . 1 1 24 24 GLU CB C 24 28.220 28.220 28.534 -0.314 19694
2915 1 7 . 1 1 24 24 GLU H H 24 8.660 8.660 8.638 0.022 19694
2916 1 7 . 1 1 25 25 SER N N 25 117.700 117.700 112.896 4.804 19694
2917 1 7 . 1 1 25 25 SER HA H 25 4.890 4.890 4.826 0.064 19694
2918 1 7 . 1 1 25 25 SER CA C 25 56.540 56.540 55.723 0.817 19694
2919 1 7 . 1 1 25 25 SER CB C 25 64.720 64.720 65.191 -0.471 19694
2920 1 7 . 1 1 25 25 SER H H 25 7.900 7.900 7.905 -0.005 19694
2921 1 7 . 1 1 26 26 PRO HA H 26 4.995 4.995 4.866 0.129 19694
2922 1 7 . 1 1 26 26 PRO CA C 26 61.750 61.750 63.139 -1.389 19694
2923 1 7 . 1 1 26 26 PRO CB C 26 32.660 32.660 31.648 1.012 19694
2924 1 7 . 1 1 27 27 TYR N N 27 118.100 118.100 123.807 -5.707 19694
2925 1 7 . 1 1 27 27 TYR HA H 27 5.910 5.910 4.977 0.933 19694
2926 1 7 . 1 1 27 27 TYR CA C 27 56.830 56.830 55.296 1.534 19694
2927 1 7 . 1 1 27 27 TYR CB C 27 42.810 42.810 42.674 0.136 19694
2928 1 7 . 1 1 27 27 TYR H H 27 9.040 9.040 8.965 0.075 19694
2929 1 7 . 1 1 28 28 CYS N N 28 122.230 122.230 119.168 3.062 19694
2930 1 7 . 1 1 28 28 CYS HA H 28 4.850 4.850 4.734 0.116 19694
2931 1 7 . 1 1 28 28 CYS CA C 28 58.110 58.110 58.002 0.108 19694
2932 1 7 . 1 1 28 28 CYS CB C 28 30.530 30.530 29.215 1.315 19694
2933 1 7 . 1 1 28 28 CYS H H 28 9.850 9.850 8.358 1.492 19694
2934 1 7 . 1 1 29 29 VAL N N 29 118.200 118.200 123.198 -4.998 19694
2935 1 7 . 1 1 29 29 VAL HA H 29 3.650 3.650 3.649 0.001 19694
2936 1 7 . 1 1 29 29 VAL CA C 29 67.400 67.400 66.653 0.747 19694
2937 1 7 . 1 1 29 29 VAL CB C 29 31.860 31.860 31.546 0.314 19694
2938 1 7 . 1 1 29 29 VAL H H 29 8.430 8.430 8.936 -0.506 19694
2939 1 7 . 1 1 30 30 VAL N N 30 119.570 119.570 118.732 0.838 19694
2940 1 7 . 1 1 30 30 VAL HA H 30 3.860 3.860 3.544 0.316 19694
2941 1 7 . 1 1 30 30 VAL CA C 30 66.450 66.450 66.005 0.445 19694
2942 1 7 . 1 1 30 30 VAL CB C 30 31.540 31.540 31.164 0.376 19694
2943 1 7 . 1 1 30 30 VAL H H 30 7.700 7.700 8.178 -0.478 19694
2944 1 7 . 1 1 31 31 CYS N N 31 125.890 125.890 119.236 6.654 19694
2945 1 7 . 1 1 31 31 CYS HA H 31 3.830 3.830 3.908 -0.078 19694
2946 1 7 . 1 1 31 31 CYS CA C 31 65.850 65.850 64.238 1.612 19694
2947 1 7 . 1 1 31 31 CYS CB C 31 29.510 29.510 25.509 4.001 19694
2948 1 7 . 1 1 31 31 CYS H H 31 9.050 9.050 7.650 1.400 19694
2949 1 7 . 1 1 32 32 PHE N N 32 119.000 119.000 119.317 -0.317 19694
2950 1 7 . 1 1 32 32 PHE HA H 32 3.780 3.780 3.693 0.087 19694
2951 1 7 . 1 1 32 32 PHE CA C 32 62.610 62.610 61.770 0.841 19694
2952 1 7 . 1 1 32 32 PHE CB C 32 39.920 39.920 39.026 0.893 19694
2953 1 7 . 1 1 32 32 PHE H H 32 9.080 9.080 7.878 1.202 19694
2954 1 7 . 1 1 33 33 GLU N N 33 117.470 117.470 118.593 -1.123 19694
2955 1 7 . 1 1 33 33 GLU HA H 33 3.760 3.760 4.068 -0.308 19694
2956 1 7 . 1 1 33 33 GLU CA C 33 59.210 59.210 59.442 -0.232 19694
2957 1 7 . 1 1 33 33 GLU CB C 33 29.480 29.480 29.218 0.262 19694
2958 1 7 . 1 1 33 33 GLU H H 33 8.510 8.510 8.202 0.308 19694
2959 1 7 . 1 1 34 34 THR N N 34 114.140 114.140 115.054 -0.914 19694
2960 1 7 . 1 1 34 34 THR HA H 34 3.730 3.730 3.941 -0.211 19694
2961 1 7 . 1 1 34 34 THR CA C 34 65.890 65.890 65.961 -0.071 19694
2962 1 7 . 1 1 34 34 THR CB C 34 69.210 69.210 68.765 0.445 19694
2963 1 7 . 1 1 34 34 THR H H 34 7.880 7.880 8.304 -0.424 19694
2964 1 7 . 1 1 35 35 LEU N N 35 117.980 117.980 119.645 -1.665 19694
2965 1 7 . 1 1 35 35 LEU HA H 35 3.650 3.650 3.942 -0.292 19694
2966 1 7 . 1 1 35 35 LEU CA C 35 56.860 56.860 57.599 -0.739 19694
2967 1 7 . 1 1 35 35 LEU CB C 35 41.870 41.870 42.032 -0.162 19694
2968 1 7 . 1 1 35 35 LEU H H 35 7.660 7.660 7.899 -0.239 19694
2969 1 7 . 1 1 36 36 PHE N N 36 113.900 113.900 113.783 0.117 19694
2970 1 7 . 1 1 36 36 PHE HA H 36 4.597 4.597 4.443 0.154 19694
2971 1 7 . 1 1 36 36 PHE CA C 36 56.860 56.860 56.319 0.541 19694
2972 1 7 . 1 1 36 36 PHE CB C 36 40.570 40.570 38.212 2.358 19694
2973 1 7 . 1 1 36 36 PHE H H 36 7.730 7.730 6.710 1.020 19694
2974 1 7 . 1 1 37 37 ALA N N 37 121.920 121.920 123.383 -1.463 19694
2975 1 7 . 1 1 37 37 ALA HA H 37 4.070 4.070 4.046 0.024 19694
2976 1 7 . 1 1 37 37 ALA CA C 37 52.900 52.900 52.656 0.244 19694
2977 1 7 . 1 1 37 37 ALA CB C 37 19.770 19.770 19.582 0.188 19694
2978 1 7 . 1 1 37 37 ALA H H 37 7.090 7.090 7.899 -0.809 19694
2979 1 7 . 1 1 38 38 ASN N N 38 119.230 119.230 119.051 0.179 19694
2980 1 7 . 1 1 38 38 ASN HA H 38 4.450 4.450 4.669 -0.219 19694
2981 1 7 . 1 1 38 38 ASN CA C 38 52.850 52.850 52.372 0.478 19694
2982 1 7 . 1 1 38 38 ASN CB C 38 38.950 38.950 39.776 -0.826 19694
2983 1 7 . 1 1 38 38 ASN H H 38 8.790 8.790 8.286 0.504 19694
2984 1 7 . 1 1 39 39 THR N N 39 116.330 116.330 116.023 0.307 19694
2985 1 7 . 1 1 39 39 THR HA H 39 3.990 3.990 4.456 -0.466 19694
2986 1 7 . 1 1 39 39 THR CA C 39 62.130 62.130 62.448 -0.318 19694
2987 1 7 . 1 1 39 39 THR CB C 39 69.920 69.920 69.438 0.482 19694
2988 1 7 . 1 1 39 39 THR H H 39 8.540 8.540 8.256 0.284 19694
2989 1 7 . 1 1 40 40 CYS N N 40 126.950 126.950 128.150 -1.200 19694
2990 1 7 . 1 1 40 40 CYS HA H 40 4.300 4.300 4.412 -0.112 19694
2991 1 7 . 1 1 40 40 CYS CA C 40 58.350 58.350 57.197 1.153 19694
2992 1 7 . 1 1 40 40 CYS CB C 40 31.600 31.600 26.793 4.807 19694
2993 1 7 . 1 1 40 40 CYS H H 40 7.940 7.940 8.413 -0.473 19694
2994 1 7 . 1 1 41 41 GLU N N 41 130.560 130.560 127.636 2.924 19694
2995 1 7 . 1 1 41 41 GLU HA H 41 3.690 3.690 3.846 -0.156 19694
2996 1 7 . 1 1 41 41 GLU CA C 41 58.600 58.600 59.090 -0.490 19694
2997 1 7 . 1 1 41 41 GLU CB C 41 30.460 30.460 29.390 1.070 19694
2998 1 7 . 1 1 41 41 GLU H H 41 8.810 8.810 8.680 0.130 19694
2999 1 7 . 1 1 42 42 GLU N N 42 119.680 119.680 118.149 1.531 19694
3000 1 7 . 1 1 42 42 GLU HA H 42 4.570 4.570 4.332 0.238 19694
3001 1 7 . 1 1 42 42 GLU CA C 42 58.000 58.000 58.089 -0.089 19694
3002 1 7 . 1 1 42 42 GLU CB C 42 31.680 31.680 30.622 1.058 19694
3003 1 7 . 1 1 42 42 GLU H H 42 8.500 8.500 8.126 0.374 19694
3004 1 7 . 1 1 43 43 CYS N N 43 115.600 115.600 116.297 -0.697 19694
3005 1 7 . 1 1 43 43 CYS HA H 43 5.010 5.010 4.646 0.364 19694
3006 1 7 . 1 1 43 43 CYS CA C 43 58.810 58.810 60.061 -1.251 19694
3007 1 7 . 1 1 43 43 CYS CB C 43 31.580 31.580 29.575 2.005 19694
3008 1 7 . 1 1 43 43 CYS H H 43 8.120 8.120 7.953 0.167 19694
3009 1 7 . 1 1 44 44 GLY N N 44 112.100 112.100 107.779 4.321 19694
3010 1 7 . 1 1 44 44 GLY CA C 44 46.420 46.420 45.216 1.204 19694
3011 1 7 . 1 1 44 44 GLY H H 44 7.900 7.900 8.629 -0.729 19694
3012 1 7 . 1 1 45 45 LYS N N 45 121.210 121.210 121.462 -0.252 19694
3013 1 7 . 1 1 45 45 LYS HA H 45 4.840 4.840 4.696 0.144 19694
3014 1 7 . 1 1 45 45 LYS CA C 45 54.360 54.360 52.684 1.676 19694
3015 1 7 . 1 1 45 45 LYS CB C 45 32.430 32.430 32.787 -0.357 19694
3016 1 7 . 1 1 45 45 LYS H H 45 8.180 8.180 7.834 0.346 19694
3017 1 7 . 1 1 46 46 PRO HA H 46 4.477 4.477 4.538 -0.061 19694
3018 1 7 . 1 1 46 46 PRO CA C 46 62.700 62.700 63.006 -0.306 19694
3019 1 7 . 1 1 46 46 PRO CB C 46 32.490 32.490 32.040 0.450 19694
3020 1 7 . 1 1 47 47 ILE N N 47 125.280 125.280 123.280 2.000 19694
3021 1 7 . 1 1 47 47 ILE HA H 47 3.830 3.830 4.321 -0.491 19694
3022 1 7 . 1 1 47 47 ILE CA C 47 61.040 61.040 60.819 0.222 19694
3023 1 7 . 1 1 47 47 ILE CB C 47 37.440 37.440 37.514 -0.074 19694
3024 1 7 . 1 1 47 47 ILE H H 47 8.540 8.540 8.888 -0.348 19694
3025 1 7 . 1 1 48 48 GLY N N 48 114.120 114.120 113.481 0.639 19694
3026 1 7 . 1 1 48 48 GLY CA C 48 45.240 45.240 44.721 0.519 19694
3027 1 7 . 1 1 48 48 GLY H H 48 8.660 8.660 8.440 0.220 19694
3028 1 7 . 1 1 49 49 CYS N N 49 117.140 117.140 117.835 -0.695 19694
3029 1 7 . 1 1 49 49 CYS HA H 49 4.280 4.280 4.299 -0.019 19694
3030 1 7 . 1 1 49 49 CYS CA C 49 60.880 60.880 59.751 1.129 19694
3031 1 7 . 1 1 49 49 CYS CB C 49 27.650 27.650 28.494 -0.844 19694
3032 1 7 . 1 1 49 49 CYS H H 49 9.210 9.210 8.444 0.766 19694
3033 1 7 . 1 1 50 50 ASP N N 50 119.300 119.300 119.829 -0.529 19694
3034 1 7 . 1 1 50 50 ASP HA H 50 4.620 4.620 4.589 0.031 19694
3035 1 7 . 1 1 50 50 ASP CA C 50 54.160 54.160 54.929 -0.769 19694
3036 1 7 . 1 1 50 50 ASP CB C 50 40.380 40.380 40.049 0.331 19694
3037 1 7 . 1 1 50 50 ASP H H 50 8.800 8.800 8.375 0.425 19694
3038 1 7 . 1 1 51 51 CYS N N 51 118.150 118.150 117.215 0.935 19694
3039 1 7 . 1 1 51 51 CYS HA H 51 4.620 4.620 4.743 -0.123 19694
3040 1 7 . 1 1 51 51 CYS CA C 51 58.030 58.030 57.322 0.708 19694
3041 1 7 . 1 1 51 51 CYS CB C 51 30.090 30.090 31.904 -1.814 19694
3042 1 7 . 1 1 51 51 CYS H H 51 7.590 7.590 7.390 0.200 19694
3043 1 7 . 1 1 52 52 LYS N N 52 123.800 123.800 123.397 0.403 19694
3044 1 7 . 1 1 52 52 LYS HA H 52 4.180 4.180 4.300 -0.120 19694
3045 1 7 . 1 1 52 52 LYS CA C 52 57.240 57.240 56.278 0.962 19694
3046 1 7 . 1 1 52 52 LYS CB C 52 33.030 33.030 31.369 1.661 19694
3047 1 7 . 1 1 52 52 LYS H H 52 8.600 8.600 8.574 0.026 19694
3048 1 7 . 1 1 53 53 ASP N N 53 124.900 124.900 123.722 1.178 19694
3049 1 7 . 1 1 53 53 ASP HA H 53 4.230 4.230 4.568 -0.338 19694
3050 1 7 . 1 1 53 53 ASP CA C 53 53.130 53.130 53.520 -0.390 19694
3051 1 7 . 1 1 53 53 ASP CB C 53 42.230 42.230 40.341 1.889 19694
3052 1 7 . 1 1 53 53 ASP H H 53 8.250 8.250 8.269 -0.019 19694
3053 1 7 . 1 1 54 54 LEU N N 54 130.160 130.160 125.579 4.581 19694
3054 1 7 . 1 1 54 54 LEU HA H 54 4.440 4.440 4.492 -0.052 19694
3055 1 7 . 1 1 54 54 LEU CA C 54 53.340 53.340 55.829 -2.489 19694
3056 1 7 . 1 1 54 54 LEU CB C 54 41.170 41.170 42.689 -1.519 19694
3057 1 7 . 1 1 54 54 LEU H H 54 8.670 8.670 8.580 0.090 19694
3058 1 7 . 1 1 55 55 SER N N 55 113.820 113.820 121.719 -7.899 19694
3059 1 7 . 1 1 55 55 SER HA H 55 5.580 5.580 5.312 0.268 19694
3060 1 7 . 1 1 55 55 SER CA C 55 55.850 55.850 57.041 -1.191 19694
3061 1 7 . 1 1 55 55 SER CB C 55 67.300 67.300 64.749 2.551 19694
3062 1 7 . 1 1 55 55 SER H H 55 8.160 8.160 8.481 -0.321 19694
3063 1 7 . 1 1 56 56 TYR N N 56 122.610 122.610 125.353 -2.743 19694
3064 1 7 . 1 1 56 56 TYR HA H 56 4.620 4.620 4.645 -0.025 19694
3065 1 7 . 1 1 56 56 TYR CA C 56 58.810 58.810 58.442 0.368 19694
3066 1 7 . 1 1 56 56 TYR CB C 56 41.000 41.000 42.710 -1.710 19694
3067 1 7 . 1 1 56 56 TYR H H 56 8.450 8.450 9.095 -0.645 19694
3068 1 7 . 1 1 57 57 LYS N N 57 126.020 126.020 128.284 -2.264 19694
3069 1 7 . 1 1 57 57 LYS HA H 57 3.470 3.470 3.896 -0.426 19694
3070 1 7 . 1 1 57 57 LYS CA C 57 58.100 58.100 57.354 0.746 19694
3071 1 7 . 1 1 57 57 LYS CB C 57 29.480 29.480 32.056 -2.576 19694
3072 1 7 . 1 1 57 57 LYS H H 57 8.920 8.920 8.631 0.289 19694
3073 1 7 . 1 1 58 58 ASP HA H 58 3.830 3.830 4.210 -0.380 19694
3074 1 7 . 1 1 58 58 ASP CA C 58 54.900 54.900 55.371 -0.471 19694
3075 1 7 . 1 1 58 58 ASP CB C 58 40.080 40.080 40.569 -0.489 19694
3076 1 7 . 1 1 58 58 ASP H H 58 8.400 8.400 8.632 -0.232 19694
3077 1 7 . 1 1 59 59 ARG N N 59 121.190 121.190 116.265 4.925 19694
3078 1 7 . 1 1 59 59 ARG HA H 59 4.250 4.250 4.402 -0.152 19694
3079 1 7 . 1 1 59 59 ARG CA C 59 55.580 55.580 54.090 1.490 19694
3080 1 7 . 1 1 59 59 ARG CB C 59 33.460 33.460 33.401 0.059 19694
3081 1 7 . 1 1 59 59 ARG H H 59 7.980 7.980 7.896 0.084 19694
3082 1 7 . 1 1 60 60 HIS N N 60 118.420 118.420 117.670 0.750 19694
3083 1 7 . 1 1 60 60 HIS HA H 60 5.270 5.270 5.659 -0.389 19694
3084 1 7 . 1 1 60 60 HIS CA C 60 55.010 55.010 55.101 -0.091 19694
3085 1 7 . 1 1 60 60 HIS CB C 60 32.380 32.380 33.411 -1.032 19694
3086 1 7 . 1 1 60 60 HIS H H 60 8.350 8.350 8.044 0.306 19694
3087 1 7 . 1 1 61 61 TRP N N 61 119.990 119.990 118.278 1.712 19694
3088 1 7 . 1 1 61 61 TRP HA H 61 5.930 5.930 4.799 1.131 19694
3089 1 7 . 1 1 61 61 TRP CA C 61 57.400 57.400 57.170 0.230 19694
3090 1 7 . 1 1 61 61 TRP CB C 61 35.380 35.380 34.249 1.131 19694
3091 1 7 . 1 1 61 61 TRP H H 61 9.310 9.310 9.285 0.025 19694
3092 1 7 . 1 1 62 62 HIS N N 62 117.270 117.270 121.036 -3.766 19694
3093 1 7 . 1 1 62 62 HIS HA H 62 4.600 4.600 4.639 -0.039 19694
3094 1 7 . 1 1 62 62 HIS CA C 62 59.210 59.210 57.656 1.554 19694
3095 1 7 . 1 1 62 62 HIS CB C 62 31.200 31.200 30.590 0.610 19694
3096 1 7 . 1 1 62 62 HIS H H 62 8.430 8.430 9.207 -0.777 19694
3097 1 7 . 1 1 63 63 GLU N N 63 124.640 124.640 128.702 -4.062 19694
3098 1 7 . 1 1 63 63 GLU HA H 63 3.827 3.827 3.963 -0.136 19694
3099 1 7 . 1 1 63 63 GLU CA C 63 61.020 61.020 59.882 1.138 19694
3100 1 7 . 1 1 63 63 GLU CB C 63 30.310 30.310 29.874 0.436 19694
3101 1 7 . 1 1 63 63 GLU H H 63 9.040 9.040 8.186 0.854 19694
3102 1 7 . 1 1 64 64 ALA N N 64 117.050 117.050 117.250 -0.200 19694
3103 1 7 . 1 1 64 64 ALA HA H 64 4.230 4.230 4.405 -0.175 19694
3104 1 7 . 1 1 64 64 ALA CA C 64 54.000 54.000 53.219 0.781 19694
3105 1 7 . 1 1 64 64 ALA CB C 64 18.880 18.880 18.949 -0.069 19694
3106 1 7 . 1 1 64 64 ALA H H 64 8.680 8.680 8.213 0.467 19694
3107 1 7 . 1 1 65 65 CYS N N 65 115.380 115.380 116.733 -1.353 19694
3108 1 7 . 1 1 65 65 CYS HA H 65 4.295 4.295 4.536 -0.241 19694
3109 1 7 . 1 1 65 65 CYS CA C 65 59.850 59.850 60.821 -0.971 19694
3110 1 7 . 1 1 65 65 CYS CB C 65 32.840 32.840 27.383 5.457 19694
3111 1 7 . 1 1 65 65 CYS H H 65 7.490 7.490 8.371 -0.881 19694
3112 1 7 . 1 1 66 66 PHE N N 66 122.020 122.020 122.925 -0.905 19694
3113 1 7 . 1 1 66 66 PHE HA H 66 3.890 3.890 3.861 0.029 19694
3114 1 7 . 1 1 66 66 PHE CA C 66 57.010 57.010 58.614 -1.603 19694
3115 1 7 . 1 1 66 66 PHE CB C 66 38.070 38.070 38.036 0.034 19694
3116 1 7 . 1 1 66 66 PHE H H 66 7.110 7.110 7.728 -0.618 19694
3117 1 7 . 1 1 67 67 HIS N N 67 121.280 121.280 121.194 0.086 19694
3118 1 7 . 1 1 67 67 HIS HA H 67 4.720 4.720 5.289 -0.569 19694
3119 1 7 . 1 1 67 67 HIS CA C 67 52.730 52.730 53.738 -1.008 19694
3120 1 7 . 1 1 67 67 HIS CB C 67 32.230 32.230 31.863 0.367 19694
3121 1 7 . 1 1 67 67 HIS H H 67 7.380 7.380 7.062 0.318 19694
3122 1 7 . 1 1 68 68 CYS N N 68 121.590 121.590 118.946 2.644 19694
3123 1 7 . 1 1 68 68 CYS HA H 68 3.960 3.960 4.939 -0.979 19694
3124 1 7 . 1 1 68 68 CYS CA C 68 59.790 59.790 58.166 1.624 19694
3125 1 7 . 1 1 68 68 CYS CB C 68 31.200 31.200 29.487 1.713 19694
3126 1 7 . 1 1 68 68 CYS H H 68 8.530 8.530 8.415 0.115 19694
3127 1 7 . 1 1 69 69 SER N N 69 126.530 126.530 120.182 6.348 19694
3128 1 7 . 1 1 69 69 SER HA H 69 4.310 4.310 4.396 -0.086 19694
3129 1 7 . 1 1 69 69 SER CA C 69 61.760 61.760 60.732 1.028 19694
3130 1 7 . 1 1 69 69 SER CB C 69 64.040 64.040 63.509 0.531 19694
3131 1 7 . 1 1 69 69 SER H H 69 9.460 9.460 8.789 0.671 19694
3132 1 7 . 1 1 70 70 GLN N N 70 122.370 122.370 118.936 3.434 19694
3133 1 7 . 1 1 70 70 GLN HA H 70 4.510 4.510 4.386 0.124 19694
3134 1 7 . 1 1 70 70 GLN CA C 70 57.840 57.840 57.251 0.589 19694
3135 1 7 . 1 1 70 70 GLN CB C 70 30.430 30.430 29.659 0.771 19694
3136 1 7 . 1 1 70 70 GLN H H 70 8.980 8.980 8.157 0.823 19694
3137 1 7 . 1 1 71 71 CYS N N 71 118.860 118.860 116.015 2.845 19694
3138 1 7 . 1 1 71 71 CYS HA H 71 4.720 4.720 4.712 0.008 19694
3139 1 7 . 1 1 71 71 CYS CA C 71 59.770 59.770 58.492 1.278 19694
3140 1 7 . 1 1 71 71 CYS CB C 71 31.910 31.910 28.260 3.650 19694
3141 1 7 . 1 1 71 71 CYS H H 71 8.220 8.220 7.846 0.374 19694
3142 1 7 . 1 1 72 72 ARG N N 72 114.380 114.380 117.628 -3.248 19694
3143 1 7 . 1 1 72 72 ARG HA H 72 3.965 3.965 4.077 -0.112 19694
3144 1 7 . 1 1 72 72 ARG CA C 72 58.030 58.030 57.076 0.954 19694
3145 1 7 . 1 1 72 72 ARG CB C 72 27.720 27.720 27.883 -0.163 19694
3146 1 7 . 1 1 72 72 ARG H H 72 7.380 7.380 7.940 -0.560 19694
3147 1 7 . 1 1 73 73 ASN N N 73 121.480 121.480 116.265 5.215 19694
3148 1 7 . 1 1 73 73 ASN HA H 73 4.630 4.630 4.636 -0.006 19694
3149 1 7 . 1 1 73 73 ASN CA C 73 54.110 54.110 53.795 0.315 19694
3150 1 7 . 1 1 73 73 ASN CB C 73 38.870 38.870 39.740 -0.870 19694
3151 1 7 . 1 1 73 73 ASN H H 73 8.722 8.722 8.227 0.495 19694
3152 1 7 . 1 1 74 74 SER N N 74 114.710 114.710 118.163 -3.453 19694
3153 1 7 . 1 1 74 74 SER HA H 74 4.060 4.060 4.860 -0.800 19694
3154 1 7 . 1 1 74 74 SER CA C 74 59.357 59.357 58.212 1.145 19694
3155 1 7 . 1 1 74 74 SER CB C 74 63.300 63.300 63.214 0.086 19694
3156 1 7 . 1 1 74 74 SER H H 74 8.690 8.690 8.490 0.200 19694
3157 1 7 . 1 1 75 75 LEU N N 75 125.757 125.757 128.183 -2.426 19694
3158 1 7 . 1 1 75 75 LEU HA H 75 4.280 4.280 4.287 -0.007 19694
3159 1 7 . 1 1 75 75 LEU CA C 75 53.510 53.510 54.796 -1.286 19694
3160 1 7 . 1 1 75 75 LEU CB C 75 42.200 42.200 41.830 0.370 19694
3161 1 7 . 1 1 75 75 LEU H H 75 7.970 7.970 8.099 -0.129 19694
3162 1 7 . 1 1 76 76 VAL N N 76 120.860 120.860 124.944 -4.084 19694
3163 1 7 . 1 1 76 76 VAL HA H 76 3.570 3.570 3.834 -0.264 19694
3164 1 7 . 1 1 76 76 VAL CA C 76 65.420 65.420 61.044 4.376 19694
3165 1 7 . 1 1 76 76 VAL CB C 76 31.540 31.540 34.975 -3.435 19694
3166 1 7 . 1 1 76 76 VAL H H 76 7.830 7.830 7.991 -0.161 19694
3167 1 7 . 1 1 77 77 ASP N N 77 122.360 122.360 123.878 -1.518 19694
3168 1 7 . 1 1 77 77 ASP HA H 77 4.230 4.230 4.503 -0.273 19694
3169 1 7 . 1 1 77 77 ASP CA C 77 56.200 56.200 55.847 0.353 19694
3170 1 7 . 1 1 77 77 ASP CB C 77 39.380 39.380 40.907 -1.527 19694
3171 1 7 . 1 1 77 77 ASP H H 77 8.910 8.910 8.433 0.477 19694
3172 1 7 . 1 1 78 78 LYS N N 78 118.100 118.100 118.235 -0.135 19694
3173 1 7 . 1 1 78 78 LYS HA H 78 4.870 4.870 4.683 0.187 19694
3174 1 7 . 1 1 78 78 LYS CA C 78 56.960 56.960 53.735 3.225 19694
3175 1 7 . 1 1 78 78 LYS CB C 78 34.680 34.680 33.593 1.087 19694
3176 1 7 . 1 1 78 78 LYS H H 78 7.660 7.660 7.660 -0.000 19694
3177 1 7 . 1 1 79 79 PRO HA H 79 4.460 4.460 4.230 0.230 19694
3178 1 7 . 1 1 79 79 PRO CA C 79 62.520 62.520 62.922 -0.402 19694
3179 1 7 . 1 1 79 79 PRO CB C 79 32.160 32.160 31.767 0.393 19694
3180 1 7 . 1 1 80 80 PHE N N 80 114.050 114.050 117.050 -3.000 19694
3181 1 7 . 1 1 80 80 PHE HA H 80 4.910 4.910 5.070 -0.160 19694
3182 1 7 . 1 1 80 80 PHE CA C 80 56.060 56.060 55.081 0.979 19694
3183 1 7 . 1 1 80 80 PHE CB C 80 42.410 42.410 41.954 0.456 19694
3184 1 7 . 1 1 80 80 PHE H H 80 7.510 7.510 7.199 0.311 19694
3185 1 7 . 1 1 81 81 ALA N N 81 123.290 123.290 123.793 -0.503 19694
3186 1 7 . 1 1 81 81 ALA HA H 81 4.310 4.310 4.343 -0.033 19694
3187 1 7 . 1 1 81 81 ALA CA C 81 50.450 50.450 50.352 0.098 19694
3188 1 7 . 1 1 81 81 ALA CB C 81 21.920 21.920 18.988 2.932 19694
3189 1 7 . 1 1 81 81 ALA H H 81 9.030 9.030 9.020 0.010 19694
3190 1 7 . 1 1 82 82 ALA N N 82 122.490 122.490 129.142 -6.652 19694
3191 1 7 . 1 1 82 82 ALA HA H 82 5.110 5.110 4.362 0.748 19694
3192 1 7 . 1 1 82 82 ALA CA C 82 51.100 51.100 51.675 -0.576 19694
3193 1 7 . 1 1 82 82 ALA CB C 82 21.130 21.130 18.790 2.340 19694
3194 1 7 . 1 1 82 82 ALA H H 82 8.240 8.240 8.619 -0.379 19694
3195 1 7 . 1 1 83 83 LYS N N 83 123.580 123.580 125.537 -1.957 19694
3196 1 7 . 1 1 83 83 LYS HA H 83 4.490 4.490 4.505 -0.015 19694
3197 1 7 . 1 1 83 83 LYS CA C 83 55.800 55.800 55.287 0.513 19694
3198 1 7 . 1 1 83 83 LYS CB C 83 34.720 34.720 34.086 0.634 19694
3199 1 7 . 1 1 83 83 LYS H H 83 8.400 8.400 8.217 0.183 19694
3200 1 7 . 1 1 84 84 GLU N N 84 125.470 125.470 120.863 4.607 19694
3201 1 7 . 1 1 84 84 GLU HA H 84 3.820 3.820 4.119 -0.299 19694
3202 1 7 . 1 1 84 84 GLU CA C 84 58.620 58.620 59.175 -0.555 19694
3203 1 7 . 1 1 84 84 GLU CB C 84 27.210 27.210 29.619 -2.409 19694
3204 1 7 . 1 1 84 84 GLU H H 84 9.320 9.320 8.745 0.575 19694
3205 1 7 . 1 1 85 85 ASP N N 85 118.550 118.550 114.524 4.026 19694
3206 1 7 . 1 1 85 85 ASP HA H 85 4.600 4.600 4.754 -0.154 19694
3207 1 7 . 1 1 85 85 ASP CA C 85 55.400 55.400 53.986 1.414 19694
3208 1 7 . 1 1 85 85 ASP CB C 85 40.400 40.400 41.979 -1.579 19694
3209 1 7 . 1 1 85 85 ASP H H 85 8.730 8.730 8.324 0.406 19694
3210 1 7 . 1 1 86 86 GLN N N 86 119.050 119.050 117.153 1.897 19694
3211 1 7 . 1 1 86 86 GLN HA H 86 4.540 4.540 4.594 -0.054 19694
3212 1 7 . 1 1 86 86 GLN CA C 86 55.100 55.100 53.905 1.195 19694
3213 1 7 . 1 1 86 86 GLN CB C 86 31.110 31.110 31.690 -0.580 19694
3214 1 7 . 1 1 86 86 GLN H H 86 8.170 8.170 7.610 0.560 19694
3215 1 7 . 1 1 87 87 LEU N N 87 123.110 123.110 121.304 1.806 19694
3216 1 7 . 1 1 87 87 LEU HA H 87 4.620 4.620 5.145 -0.525 19694
3217 1 7 . 1 1 87 87 LEU CA C 87 54.520 54.520 53.975 0.545 19694
3218 1 7 . 1 1 87 87 LEU CB C 87 42.700 42.700 44.405 -1.705 19694
3219 1 7 . 1 1 87 87 LEU H H 87 8.490 8.490 8.467 0.023 19694
3220 1 7 . 1 1 88 88 LEU N N 88 123.690 123.690 120.206 3.484 19694
3221 1 7 . 1 1 88 88 LEU HA H 88 5.880 5.880 4.960 0.920 19694
3222 1 7 . 1 1 88 88 LEU CA C 88 53.340 53.340 52.803 0.537 19694
3223 1 7 . 1 1 88 88 LEU CB C 88 47.190 47.190 47.811 -0.621 19694
3224 1 7 . 1 1 88 88 LEU H H 88 8.930 8.930 8.406 0.524 19694
3225 1 7 . 1 1 89 89 CYS N N 89 122.270 122.270 118.574 3.696 19694
3226 1 7 . 1 1 89 89 CYS HA H 89 4.780 4.780 4.775 0.005 19694
3227 1 7 . 1 1 89 89 CYS CA C 89 57.640 57.640 59.059 -1.419 19694
3228 1 7 . 1 1 89 89 CYS CB C 89 30.940 30.940 27.664 3.276 19694
3229 1 7 . 1 1 89 89 CYS H H 89 9.430 9.430 9.112 0.318 19694
3230 1 7 . 1 1 90 90 THR N N 90 110.620 110.620 117.005 -6.385 19694
3231 1 7 . 1 1 90 90 THR HA H 90 3.900 3.900 3.994 -0.094 19694
3232 1 7 . 1 1 90 90 THR CA C 90 65.460 65.460 65.884 -0.424 19694
3233 1 7 . 1 1 90 90 THR CB C 90 68.670 68.670 68.935 -0.265 19694
3234 1 7 . 1 1 90 90 THR H H 90 8.410 8.410 9.053 -0.643 19694
3235 1 7 . 1 1 91 91 ASP N N 91 123.470 123.470 120.744 2.726 19694
3236 1 7 . 1 1 91 91 ASP HA H 91 4.490 4.490 4.603 -0.113 19694
3237 1 7 . 1 1 91 91 ASP CA C 91 57.810 57.810 57.500 0.310 19694
3238 1 7 . 1 1 91 91 ASP CB C 91 41.160 41.160 40.518 0.642 19694
3239 1 7 . 1 1 91 91 ASP H H 91 8.150 8.150 8.431 -0.281 19694
3240 1 7 . 1 1 92 92 CYS N N 92 123.800 123.800 119.627 4.173 19694
3241 1 7 . 1 1 92 92 CYS HA H 92 3.970 3.970 4.259 -0.289 19694
3242 1 7 . 1 1 92 92 CYS CA C 92 64.100 64.100 61.371 2.728 19694
3243 1 7 . 1 1 92 92 CYS CB C 92 30.090 30.090 25.646 4.444 19694
3244 1 7 . 1 1 92 92 CYS H H 92 8.580 8.580 8.027 0.553 19694
3245 1 7 . 1 1 93 93 TYR N N 93 120.730 120.730 120.925 -0.195 19694
3246 1 7 . 1 1 93 93 TYR HA H 93 4.140 4.140 4.089 0.051 19694
3247 1 7 . 1 1 93 93 TYR CA C 93 60.380 60.380 61.504 -1.124 19694
3248 1 7 . 1 1 93 93 TYR CB C 93 39.300 39.300 38.344 0.956 19694
3249 1 7 . 1 1 93 93 TYR H H 93 8.540 8.540 9.166 -0.626 19694
3250 1 7 . 1 1 94 94 SER N N 94 115.010 115.010 113.227 1.783 19694
3251 1 7 . 1 1 94 94 SER HA H 94 4.220 4.220 4.263 -0.043 19694
3252 1 7 . 1 1 94 94 SER CA C 94 59.300 59.300 61.625 -2.325 19694
3253 1 7 . 1 1 94 94 SER CB C 94 63.660 63.660 62.903 0.757 19694
3254 1 7 . 1 1 94 94 SER H H 94 7.750 7.750 7.887 -0.137 19694
3255 1 7 . 1 1 95 95 ASN N N 95 119.820 119.820 119.718 0.102 19694
3256 1 7 . 1 1 95 95 ASN HA H 95 4.510 4.510 4.596 -0.086 19694
3257 1 7 . 1 1 95 95 ASN CA C 95 53.880 53.880 55.581 -1.701 19694
3258 1 7 . 1 1 95 95 ASN CB C 95 39.300 39.300 38.446 0.854 19694
3259 1 7 . 1 1 95 95 ASN H H 95 7.780 7.780 7.644 0.136 19694
3260 1 7 . 1 1 96 96 GLU N N 96 119.820 119.820 117.244 2.576 19694
3261 1 7 . 1 1 96 96 GLU HA H 96 4.096 4.096 4.255 -0.159 19694
3262 1 7 . 1 1 96 96 GLU CA C 96 56.910 56.910 57.411 -0.501 19694
3263 1 7 . 1 1 96 96 GLU CB C 96 30.220 30.220 29.509 0.710 19694
3264 1 7 . 1 1 96 96 GLU H H 96 7.950 7.950 7.684 0.266 19694
3265 1 7 . 1 1 97 97 TYR N N 97 120.370 120.370 121.213 -0.843 19694
3266 1 7 . 1 1 97 97 TYR HA H 97 4.620 4.620 4.094 0.526 19694
3267 1 7 . 1 1 97 97 TYR CA C 97 57.700 57.700 60.019 -2.319 19694
3268 1 7 . 1 1 97 97 TYR CB C 97 38.710 38.710 38.546 0.164 19694
3269 1 7 . 1 1 97 97 TYR H H 97 8.070 8.070 8.577 -0.507 19694
3270 1 8 . 1 1 2 2 THR N N 2 113.570 113.570 116.195 -2.625 19694
3271 1 8 . 1 1 2 2 THR HA H 2 4.240 4.240 4.345 -0.105 19694
3272 1 8 . 1 1 2 2 THR CA C 2 62.130 62.130 62.950 -0.820 19694
3273 1 8 . 1 1 2 2 THR CB C 2 69.250 69.250 69.374 -0.124 19694
3274 1 8 . 1 1 2 2 THR H H 2 8.090 8.090 8.389 -0.299 19694
3275 1 8 . 1 1 3 3 GLU N N 3 122.880 122.880 121.167 1.713 19694
3276 1 8 . 1 1 3 3 GLU HA H 3 4.280 4.280 4.295 -0.015 19694
3277 1 8 . 1 1 3 3 GLU CA C 3 56.860 56.860 55.995 0.865 19694
3278 1 8 . 1 1 3 3 GLU CB C 3 30.570 30.570 30.272 0.298 19694
3279 1 8 . 1 1 3 3 GLU H H 3 8.280 8.280 8.063 0.217 19694
3280 1 8 . 1 1 4 4 ARG N N 4 121.330 121.330 119.683 1.647 19694
3281 1 8 . 1 1 4 4 ARG HA H 4 4.300 4.300 4.554 -0.254 19694
3282 1 8 . 1 1 4 4 ARG CA C 4 55.870 55.870 55.305 0.565 19694
3283 1 8 . 1 1 4 4 ARG CB C 4 31.640 31.640 30.758 0.882 19694
3284 1 8 . 1 1 4 4 ARG H H 4 8.280 8.280 8.550 -0.270 19694
3285 1 8 . 1 1 5 5 PHE N N 5 125.490 125.490 124.789 0.701 19694
3286 1 8 . 1 1 5 5 PHE HA H 5 4.610 4.610 4.579 0.031 19694
3287 1 8 . 1 1 5 5 PHE CA C 5 56.380 56.380 56.428 -0.049 19694
3288 1 8 . 1 1 5 5 PHE CB C 5 39.560 39.560 39.699 -0.139 19694
3289 1 8 . 1 1 5 5 PHE H H 5 8.290 8.290 8.709 -0.419 19694
3290 1 8 . 1 1 6 6 ASP N N 6 123.260 123.260 121.841 1.419 19694
3291 1 8 . 1 1 6 6 ASP HA H 6 5.045 5.045 4.786 0.259 19694
3292 1 8 . 1 1 6 6 ASP CA C 6 52.180 52.180 52.942 -0.762 19694
3293 1 8 . 1 1 6 6 ASP CB C 6 44.210 44.210 44.583 -0.373 19694
3294 1 8 . 1 1 6 6 ASP H H 6 7.940 7.940 7.630 0.310 19694
3295 1 8 . 1 1 7 7 CYS N N 7 121.440 121.440 122.860 -1.420 19694
3296 1 8 . 1 1 7 7 CYS HA H 7 3.960 3.960 4.432 -0.472 19694
3297 1 8 . 1 1 7 7 CYS CA C 7 59.820 59.820 59.545 0.275 19694
3298 1 8 . 1 1 7 7 CYS CB C 7 30.950 30.950 26.175 4.775 19694
3299 1 8 . 1 1 7 7 CYS H H 7 8.700 8.700 8.564 0.136 19694
3300 1 8 . 1 1 8 8 HIS N N 8 129.390 129.390 129.779 -0.389 19694
3301 1 8 . 1 1 8 8 HIS HA H 8 4.200 4.200 4.295 -0.095 19694
3302 1 8 . 1 1 8 8 HIS CA C 8 58.240 58.240 59.459 -1.219 19694
3303 1 8 . 1 1 8 8 HIS CB C 8 29.480 29.480 29.925 -0.445 19694
3304 1 8 . 1 1 8 8 HIS H H 8 9.160 9.160 9.635 -0.475 19694
3305 1 8 . 1 1 9 9 HIS N N 9 118.740 118.740 116.703 2.037 19694
3306 1 8 . 1 1 9 9 HIS HA H 9 4.880 4.880 4.504 0.376 19694
3307 1 8 . 1 1 9 9 HIS CA C 9 58.680 58.680 57.260 1.421 19694
3308 1 8 . 1 1 9 9 HIS CB C 9 31.040 31.040 30.558 0.482 19694
3309 1 8 . 1 1 9 9 HIS H H 9 9.270 9.270 7.869 1.401 19694
3310 1 8 . 1 1 10 10 CYS N N 10 118.600 118.600 117.072 1.528 19694
3311 1 8 . 1 1 10 10 CYS HA H 10 4.600 4.600 4.430 0.170 19694
3312 1 8 . 1 1 10 10 CYS CA C 10 59.600 59.600 58.987 0.613 19694
3313 1 8 . 1 1 10 10 CYS CB C 10 32.330 32.330 27.885 4.445 19694
3314 1 8 . 1 1 10 10 CYS H H 10 8.550 8.550 7.801 0.749 19694
3315 1 8 . 1 1 11 11 ASN N N 11 116.220 116.220 118.216 -1.996 19694
3316 1 8 . 1 1 11 11 ASN HA H 11 4.410 4.410 4.401 0.009 19694
3317 1 8 . 1 1 11 11 ASN CA C 11 55.640 55.640 54.416 1.224 19694
3318 1 8 . 1 1 11 11 ASN CB C 11 38.200 38.200 37.265 0.935 19694
3319 1 8 . 1 1 11 11 ASN H H 11 7.690 7.690 8.651 -0.961 19694
3320 1 8 . 1 1 12 12 GLU N N 12 120.330 120.330 117.102 3.228 19694
3321 1 8 . 1 1 12 12 GLU HA H 12 4.220 4.220 4.507 -0.287 19694
3322 1 8 . 1 1 12 12 GLU CA C 12 56.700 56.700 55.037 1.663 19694
3323 1 8 . 1 1 12 12 GLU CB C 12 30.910 30.910 30.724 0.185 19694
3324 1 8 . 1 1 12 12 GLU H H 12 8.210 8.210 7.780 0.430 19694
3325 1 8 . 1 1 13 13 SER N N 13 116.190 116.190 119.339 -3.149 19694
3326 1 8 . 1 1 13 13 SER HA H 13 4.060 4.060 4.526 -0.466 19694
3327 1 8 . 1 1 13 13 SER CA C 13 59.350 59.350 58.946 0.404 19694
3328 1 8 . 1 1 13 13 SER CB C 13 63.820 63.820 63.607 0.213 19694
3329 1 8 . 1 1 13 13 SER H H 13 8.520 8.520 8.658 -0.138 19694
3330 1 8 . 1 1 14 14 LEU N N 14 126.060 126.060 124.722 1.338 19694
3331 1 8 . 1 1 14 14 LEU HA H 14 4.310 4.310 4.352 -0.042 19694
3332 1 8 . 1 1 14 14 LEU CA C 14 54.100 54.100 55.770 -1.670 19694
3333 1 8 . 1 1 14 14 LEU CB C 14 42.200 42.200 41.479 0.721 19694
3334 1 8 . 1 1 14 14 LEU H H 14 8.910 8.910 7.733 1.177 19694
3335 1 8 . 1 1 15 15 PHE N N 15 120.660 120.660 121.243 -0.583 19694
3336 1 8 . 1 1 15 15 PHE HA H 15 4.480 4.480 4.595 -0.115 19694
3337 1 8 . 1 1 15 15 PHE CA C 15 60.400 60.400 56.322 4.078 19694
3338 1 8 . 1 1 15 15 PHE CB C 15 38.130 38.130 38.142 -0.012 19694
3339 1 8 . 1 1 15 15 PHE H H 15 7.820 7.820 8.554 -0.734 19694
3340 1 8 . 1 1 16 16 GLY N N 16 114.730 114.730 110.937 3.793 19694
3341 1 8 . 1 1 16 16 GLY CA C 16 45.900 45.900 45.801 0.099 19694
3342 1 8 . 1 1 16 16 GLY H H 16 8.860 8.860 8.810 0.050 19694
3343 1 8 . 1 1 17 17 LYS N N 17 119.580 119.580 120.168 -0.588 19694
3344 1 8 . 1 1 17 17 LYS HA H 17 4.480 4.480 4.516 -0.036 19694
3345 1 8 . 1 1 17 17 LYS CA C 17 54.460 54.460 54.446 0.014 19694
3346 1 8 . 1 1 17 17 LYS CB C 17 35.800 35.800 34.296 1.504 19694
3347 1 8 . 1 1 17 17 LYS H H 17 8.030 8.030 7.227 0.803 19694
3348 1 8 . 1 1 18 18 LYS N N 18 120.330 120.330 122.383 -2.053 19694
3349 1 8 . 1 1 18 18 LYS HA H 18 4.280 4.280 4.320 -0.040 19694
3350 1 8 . 1 1 18 18 LYS CA C 18 56.800 56.800 57.462 -0.662 19694
3351 1 8 . 1 1 18 18 LYS CB C 18 33.010 33.010 32.820 0.190 19694
3352 1 8 . 1 1 18 18 LYS H H 18 8.190 8.190 8.472 -0.282 19694
3353 1 8 . 1 1 19 19 TYR N N 19 117.500 117.500 115.444 2.056 19694
3354 1 8 . 1 1 19 19 TYR HA H 19 5.240 5.240 4.842 0.398 19694
3355 1 8 . 1 1 19 19 TYR CA C 19 55.340 55.340 56.291 -0.951 19694
3356 1 8 . 1 1 19 19 TYR CB C 19 42.850 42.850 40.324 2.526 19694
3357 1 8 . 1 1 19 19 TYR H H 19 7.610 7.610 7.908 -0.298 19694
3358 1 8 . 1 1 20 20 ILE N N 20 121.430 121.430 121.715 -0.285 19694
3359 1 8 . 1 1 20 20 ILE HA H 20 4.137 4.137 4.238 -0.101 19694
3360 1 8 . 1 1 20 20 ILE CA C 20 60.010 60.010 60.095 -0.085 19694
3361 1 8 . 1 1 20 20 ILE CB C 20 41.570 41.570 40.704 0.866 19694
3362 1 8 . 1 1 20 20 ILE H H 20 9.350 9.350 8.213 1.137 19694
3363 1 8 . 1 1 21 21 LEU N N 21 126.720 126.720 125.871 0.849 19694
3364 1 8 . 1 1 21 21 LEU HA H 21 5.090 5.090 4.784 0.306 19694
3365 1 8 . 1 1 21 21 LEU CA C 21 54.020 54.020 53.910 0.110 19694
3366 1 8 . 1 1 21 21 LEU CB C 21 43.720 43.720 40.909 2.811 19694
3367 1 8 . 1 1 21 21 LEU H H 21 8.530 8.530 8.490 0.040 19694
3368 1 8 . 1 1 22 22 ARG N N 22 123.930 123.930 125.905 -1.975 19694
3369 1 8 . 1 1 22 22 ARG HA H 22 4.440 4.440 4.533 -0.093 19694
3370 1 8 . 1 1 22 22 ARG CA C 22 55.600 55.600 54.007 1.593 19694
3371 1 8 . 1 1 22 22 ARG CB C 22 32.280 32.280 32.606 -0.327 19694
3372 1 8 . 1 1 22 22 ARG H H 22 9.080 9.080 8.834 0.246 19694
3373 1 8 . 1 1 23 23 GLU N N 23 128.500 128.500 123.834 4.666 19694
3374 1 8 . 1 1 23 23 GLU HA H 23 3.840 3.840 3.952 -0.112 19694
3375 1 8 . 1 1 23 23 GLU CA C 23 58.030 58.030 57.919 0.111 19694
3376 1 8 . 1 1 23 23 GLU CB C 23 27.200 27.200 28.031 -0.831 19694
3377 1 8 . 1 1 23 23 GLU H H 23 9.610 9.610 9.057 0.553 19694
3378 1 8 . 1 1 24 24 GLU N N 24 110.300 110.300 113.497 -3.197 19694
3379 1 8 . 1 1 24 24 GLU HA H 24 3.780 3.780 3.979 -0.199 19694
3380 1 8 . 1 1 24 24 GLU CA C 24 58.320 58.320 57.347 0.973 19694
3381 1 8 . 1 1 24 24 GLU CB C 24 28.220 28.220 27.477 0.743 19694
3382 1 8 . 1 1 24 24 GLU H H 24 8.660 8.660 8.837 -0.177 19694
3383 1 8 . 1 1 25 25 SER N N 25 117.700 117.700 113.253 4.447 19694
3384 1 8 . 1 1 25 25 SER HA H 25 4.890 4.890 4.725 0.165 19694
3385 1 8 . 1 1 25 25 SER CA C 25 56.540 56.540 56.009 0.531 19694
3386 1 8 . 1 1 25 25 SER CB C 25 64.720 64.720 64.871 -0.151 19694
3387 1 8 . 1 1 25 25 SER H H 25 7.900 7.900 7.735 0.165 19694
3388 1 8 . 1 1 26 26 PRO HA H 26 4.995 4.995 4.847 0.148 19694
3389 1 8 . 1 1 26 26 PRO CA C 26 61.750 61.750 63.049 -1.299 19694
3390 1 8 . 1 1 26 26 PRO CB C 26 32.660 32.660 31.731 0.929 19694
3391 1 8 . 1 1 27 27 TYR N N 27 118.100 118.100 123.562 -5.462 19694
3392 1 8 . 1 1 27 27 TYR HA H 27 5.910 5.910 4.979 0.931 19694
3393 1 8 . 1 1 27 27 TYR CA C 27 56.830 56.830 54.811 2.019 19694
3394 1 8 . 1 1 27 27 TYR CB C 27 42.810 42.810 42.498 0.312 19694
3395 1 8 . 1 1 27 27 TYR H H 27 9.040 9.040 8.640 0.400 19694
3396 1 8 . 1 1 28 28 CYS N N 28 122.230 122.230 118.999 3.231 19694
3397 1 8 . 1 1 28 28 CYS HA H 28 4.850 4.850 4.664 0.186 19694
3398 1 8 . 1 1 28 28 CYS CA C 28 58.110 58.110 58.454 -0.344 19694
3399 1 8 . 1 1 28 28 CYS CB C 28 30.530 30.530 29.073 1.456 19694
3400 1 8 . 1 1 28 28 CYS H H 28 9.850 9.850 8.325 1.525 19694
3401 1 8 . 1 1 29 29 VAL N N 29 118.200 118.200 122.921 -4.721 19694
3402 1 8 . 1 1 29 29 VAL HA H 29 3.650 3.650 3.757 -0.107 19694
3403 1 8 . 1 1 29 29 VAL CA C 29 67.400 67.400 66.836 0.564 19694
3404 1 8 . 1 1 29 29 VAL CB C 29 31.860 31.860 31.465 0.395 19694
3405 1 8 . 1 1 29 29 VAL H H 29 8.430 8.430 8.941 -0.511 19694
3406 1 8 . 1 1 30 30 VAL N N 30 119.570 119.570 118.744 0.826 19694
3407 1 8 . 1 1 30 30 VAL HA H 30 3.860 3.860 3.619 0.241 19694
3408 1 8 . 1 1 30 30 VAL CA C 30 66.450 66.450 66.005 0.445 19694
3409 1 8 . 1 1 30 30 VAL CB C 30 31.540 31.540 30.529 1.011 19694
3410 1 8 . 1 1 30 30 VAL H H 30 7.700 7.700 7.887 -0.187 19694
3411 1 8 . 1 1 31 31 CYS N N 31 125.890 125.890 119.648 6.242 19694
3412 1 8 . 1 1 31 31 CYS HA H 31 3.830 3.830 3.901 -0.071 19694
3413 1 8 . 1 1 31 31 CYS CA C 31 65.850 65.850 64.332 1.518 19694
3414 1 8 . 1 1 31 31 CYS CB C 31 29.510 29.510 25.559 3.951 19694
3415 1 8 . 1 1 31 31 CYS H H 31 9.050 9.050 7.640 1.410 19694
3416 1 8 . 1 1 32 32 PHE N N 32 119.000 119.000 119.325 -0.325 19694
3417 1 8 . 1 1 32 32 PHE HA H 32 3.780 3.780 3.681 0.099 19694
3418 1 8 . 1 1 32 32 PHE CA C 32 62.610 62.610 61.695 0.915 19694
3419 1 8 . 1 1 32 32 PHE CB C 32 39.920 39.920 39.049 0.871 19694
3420 1 8 . 1 1 32 32 PHE H H 32 9.080 9.080 7.892 1.188 19694
3421 1 8 . 1 1 33 33 GLU N N 33 117.470 117.470 118.519 -1.049 19694
3422 1 8 . 1 1 33 33 GLU HA H 33 3.760 3.760 4.072 -0.311 19694
3423 1 8 . 1 1 33 33 GLU CA C 33 59.210 59.210 59.386 -0.176 19694
3424 1 8 . 1 1 33 33 GLU CB C 33 29.480 29.480 29.240 0.240 19694
3425 1 8 . 1 1 33 33 GLU H H 33 8.510 8.510 8.318 0.192 19694
3426 1 8 . 1 1 34 34 THR N N 34 114.140 114.140 115.360 -1.220 19694
3427 1 8 . 1 1 34 34 THR HA H 34 3.730 3.730 3.900 -0.170 19694
3428 1 8 . 1 1 34 34 THR CA C 34 65.890 65.890 66.052 -0.161 19694
3429 1 8 . 1 1 34 34 THR CB C 34 69.210 69.210 68.735 0.475 19694
3430 1 8 . 1 1 34 34 THR H H 34 7.880 7.880 8.330 -0.450 19694
3431 1 8 . 1 1 35 35 LEU N N 35 117.980 117.980 118.818 -0.838 19694
3432 1 8 . 1 1 35 35 LEU HA H 35 3.650 3.650 3.944 -0.294 19694
3433 1 8 . 1 1 35 35 LEU CA C 35 56.860 56.860 57.213 -0.353 19694
3434 1 8 . 1 1 35 35 LEU CB C 35 41.870 41.870 41.791 0.079 19694
3435 1 8 . 1 1 35 35 LEU H H 35 7.660 7.660 7.716 -0.056 19694
3436 1 8 . 1 1 36 36 PHE N N 36 113.900 113.900 112.903 0.997 19694
3437 1 8 . 1 1 36 36 PHE HA H 36 4.597 4.597 4.468 0.129 19694
3438 1 8 . 1 1 36 36 PHE CA C 36 56.860 56.860 56.361 0.499 19694
3439 1 8 . 1 1 36 36 PHE CB C 36 40.570 40.570 38.294 2.276 19694
3440 1 8 . 1 1 36 36 PHE H H 36 7.730 7.730 6.665 1.065 19694
3441 1 8 . 1 1 37 37 ALA N N 37 121.920 121.920 123.295 -1.375 19694
3442 1 8 . 1 1 37 37 ALA HA H 37 4.070 4.070 4.059 0.011 19694
3443 1 8 . 1 1 37 37 ALA CA C 37 52.900 52.900 52.361 0.539 19694
3444 1 8 . 1 1 37 37 ALA CB C 37 19.770 19.770 19.642 0.129 19694
3445 1 8 . 1 1 37 37 ALA H H 37 7.090 7.090 7.776 -0.686 19694
3446 1 8 . 1 1 38 38 ASN N N 38 119.230 119.230 119.519 -0.289 19694
3447 1 8 . 1 1 38 38 ASN HA H 38 4.450 4.450 4.650 -0.200 19694
3448 1 8 . 1 1 38 38 ASN CA C 38 52.850 52.850 52.692 0.158 19694
3449 1 8 . 1 1 38 38 ASN CB C 38 38.950 38.950 39.876 -0.926 19694
3450 1 8 . 1 1 38 38 ASN H H 38 8.790 8.790 8.399 0.391 19694
3451 1 8 . 1 1 39 39 THR N N 39 116.330 116.330 115.732 0.598 19694
3452 1 8 . 1 1 39 39 THR HA H 39 3.990 3.990 4.427 -0.437 19694
3453 1 8 . 1 1 39 39 THR CA C 39 62.130 62.130 62.526 -0.396 19694
3454 1 8 . 1 1 39 39 THR CB C 39 69.920 69.920 69.877 0.043 19694
3455 1 8 . 1 1 39 39 THR H H 39 8.540 8.540 8.212 0.328 19694
3456 1 8 . 1 1 40 40 CYS N N 40 126.950 126.950 127.961 -1.011 19694
3457 1 8 . 1 1 40 40 CYS HA H 40 4.300 4.300 4.479 -0.179 19694
3458 1 8 . 1 1 40 40 CYS CA C 40 58.350 58.350 57.130 1.220 19694
3459 1 8 . 1 1 40 40 CYS CB C 40 31.600 31.600 26.646 4.954 19694
3460 1 8 . 1 1 40 40 CYS H H 40 7.940 7.940 8.547 -0.607 19694
3461 1 8 . 1 1 41 41 GLU N N 41 130.560 130.560 127.601 2.959 19694
3462 1 8 . 1 1 41 41 GLU HA H 41 3.690 3.690 3.836 -0.146 19694
3463 1 8 . 1 1 41 41 GLU CA C 41 58.600 58.600 59.136 -0.537 19694
3464 1 8 . 1 1 41 41 GLU CB C 41 30.460 30.460 29.404 1.056 19694
3465 1 8 . 1 1 41 41 GLU H H 41 8.810 8.810 8.685 0.125 19694
3466 1 8 . 1 1 42 42 GLU N N 42 119.680 119.680 118.258 1.422 19694
3467 1 8 . 1 1 42 42 GLU HA H 42 4.570 4.570 4.355 0.215 19694
3468 1 8 . 1 1 42 42 GLU CA C 42 58.000 58.000 57.990 0.010 19694
3469 1 8 . 1 1 42 42 GLU CB C 42 31.680 31.680 30.672 1.008 19694
3470 1 8 . 1 1 42 42 GLU H H 42 8.500 8.500 8.076 0.424 19694
3471 1 8 . 1 1 43 43 CYS N N 43 115.600 115.600 116.305 -0.705 19694
3472 1 8 . 1 1 43 43 CYS HA H 43 5.010 5.010 4.443 0.567 19694
3473 1 8 . 1 1 43 43 CYS CA C 43 58.810 58.810 60.169 -1.359 19694
3474 1 8 . 1 1 43 43 CYS CB C 43 31.580 31.580 28.635 2.945 19694
3475 1 8 . 1 1 43 43 CYS H H 43 8.120 8.120 7.971 0.149 19694
3476 1 8 . 1 1 44 44 GLY N N 44 112.100 112.100 106.867 5.233 19694
3477 1 8 . 1 1 44 44 GLY CA C 44 46.420 46.420 45.374 1.046 19694
3478 1 8 . 1 1 44 44 GLY H H 44 7.900 7.900 8.601 -0.701 19694
3479 1 8 . 1 1 45 45 LYS N N 45 121.210 121.210 121.804 -0.594 19694
3480 1 8 . 1 1 45 45 LYS HA H 45 4.840 4.840 4.756 0.084 19694
3481 1 8 . 1 1 45 45 LYS CA C 45 54.360 54.360 52.611 1.749 19694
3482 1 8 . 1 1 45 45 LYS CB C 45 32.430 32.430 32.433 -0.003 19694
3483 1 8 . 1 1 45 45 LYS H H 45 8.180 8.180 7.848 0.332 19694
3484 1 8 . 1 1 46 46 PRO HA H 46 4.477 4.477 4.574 -0.097 19694
3485 1 8 . 1 1 46 46 PRO CA C 46 62.700 62.700 63.008 -0.308 19694
3486 1 8 . 1 1 46 46 PRO CB C 46 32.490 32.490 32.052 0.438 19694
3487 1 8 . 1 1 47 47 ILE N N 47 125.280 125.280 123.086 2.194 19694
3488 1 8 . 1 1 47 47 ILE HA H 47 3.830 3.830 4.277 -0.447 19694
3489 1 8 . 1 1 47 47 ILE CA C 47 61.040 61.040 60.751 0.289 19694
3490 1 8 . 1 1 47 47 ILE CB C 47 37.440 37.440 37.629 -0.189 19694
3491 1 8 . 1 1 47 47 ILE H H 47 8.540 8.540 8.844 -0.304 19694
3492 1 8 . 1 1 48 48 GLY N N 48 114.120 114.120 113.410 0.710 19694
3493 1 8 . 1 1 48 48 GLY CA C 48 45.240 45.240 44.725 0.515 19694
3494 1 8 . 1 1 48 48 GLY H H 48 8.660 8.660 8.564 0.096 19694
3495 1 8 . 1 1 49 49 CYS N N 49 117.140 117.140 119.789 -2.649 19694
3496 1 8 . 1 1 49 49 CYS HA H 49 4.280 4.280 4.245 0.035 19694
3497 1 8 . 1 1 49 49 CYS CA C 49 60.880 60.880 60.312 0.568 19694
3498 1 8 . 1 1 49 49 CYS CB C 49 27.650 27.650 27.596 0.054 19694
3499 1 8 . 1 1 49 49 CYS H H 49 9.210 9.210 8.608 0.602 19694
3500 1 8 . 1 1 50 50 ASP N N 50 119.300 119.300 120.205 -0.905 19694
3501 1 8 . 1 1 50 50 ASP HA H 50 4.620 4.620 4.628 -0.008 19694
3502 1 8 . 1 1 50 50 ASP CA C 50 54.160 54.160 55.045 -0.885 19694
3503 1 8 . 1 1 50 50 ASP CB C 50 40.380 40.380 40.411 -0.031 19694
3504 1 8 . 1 1 50 50 ASP H H 50 8.800 8.800 8.466 0.334 19694
3505 1 8 . 1 1 51 51 CYS N N 51 118.150 118.150 117.201 0.949 19694
3506 1 8 . 1 1 51 51 CYS HA H 51 4.620 4.620 4.770 -0.150 19694
3507 1 8 . 1 1 51 51 CYS CA C 51 58.030 58.030 56.959 1.071 19694
3508 1 8 . 1 1 51 51 CYS CB C 51 30.090 30.090 32.232 -2.142 19694
3509 1 8 . 1 1 51 51 CYS H H 51 7.590 7.590 7.407 0.183 19694
3510 1 8 . 1 1 52 52 LYS N N 52 123.800 123.800 122.364 1.436 19694
3511 1 8 . 1 1 52 52 LYS HA H 52 4.180 4.180 4.277 -0.097 19694
3512 1 8 . 1 1 52 52 LYS CA C 52 57.240 57.240 56.854 0.386 19694
3513 1 8 . 1 1 52 52 LYS CB C 52 33.030 33.030 31.551 1.479 19694
3514 1 8 . 1 1 52 52 LYS H H 52 8.600 8.600 8.564 0.036 19694
3515 1 8 . 1 1 53 53 ASP N N 53 124.900 124.900 124.459 0.441 19694
3516 1 8 . 1 1 53 53 ASP HA H 53 4.230 4.230 4.732 -0.502 19694
3517 1 8 . 1 1 53 53 ASP CA C 53 53.130 53.130 52.831 0.299 19694
3518 1 8 . 1 1 53 53 ASP CB C 53 42.230 42.230 40.835 1.395 19694
3519 1 8 . 1 1 53 53 ASP H H 53 8.250 8.250 8.374 -0.124 19694
3520 1 8 . 1 1 54 54 LEU N N 54 130.160 130.160 125.623 4.537 19694
3521 1 8 . 1 1 54 54 LEU HA H 54 4.440 4.440 4.621 -0.181 19694
3522 1 8 . 1 1 54 54 LEU CA C 54 53.340 53.340 55.253 -1.913 19694
3523 1 8 . 1 1 54 54 LEU CB C 54 41.170 41.170 43.150 -1.980 19694
3524 1 8 . 1 1 54 54 LEU H H 54 8.670 8.670 8.922 -0.252 19694
3525 1 8 . 1 1 55 55 SER N N 55 113.820 113.820 119.909 -6.089 19694
3526 1 8 . 1 1 55 55 SER HA H 55 5.580 5.580 5.326 0.254 19694
3527 1 8 . 1 1 55 55 SER CA C 55 55.850 55.850 56.363 -0.513 19694
3528 1 8 . 1 1 55 55 SER CB C 55 67.300 67.300 64.532 2.768 19694
3529 1 8 . 1 1 55 55 SER H H 55 8.160 8.160 8.520 -0.360 19694
3530 1 8 . 1 1 56 56 TYR N N 56 122.610 122.610 126.529 -3.919 19694
3531 1 8 . 1 1 56 56 TYR HA H 56 4.620 4.620 4.655 -0.035 19694
3532 1 8 . 1 1 56 56 TYR CA C 56 58.810 58.810 58.859 -0.049 19694
3533 1 8 . 1 1 56 56 TYR CB C 56 41.000 41.000 42.108 -1.108 19694
3534 1 8 . 1 1 56 56 TYR H H 56 8.450 8.450 8.790 -0.340 19694
3535 1 8 . 1 1 57 57 LYS N N 57 126.020 126.020 126.694 -0.674 19694
3536 1 8 . 1 1 57 57 LYS HA H 57 3.470 3.470 3.946 -0.476 19694
3537 1 8 . 1 1 57 57 LYS CA C 57 58.100 58.100 57.652 0.448 19694
3538 1 8 . 1 1 57 57 LYS CB C 57 29.480 29.480 31.851 -2.371 19694
3539 1 8 . 1 1 57 57 LYS H H 57 8.920 8.920 8.802 0.118 19694
3540 1 8 . 1 1 58 58 ASP HA H 58 3.830 3.830 4.210 -0.380 19694
3541 1 8 . 1 1 58 58 ASP CA C 58 54.900 54.900 55.446 -0.546 19694
3542 1 8 . 1 1 58 58 ASP CB C 58 40.080 40.080 40.605 -0.525 19694
3543 1 8 . 1 1 58 58 ASP H H 58 8.400 8.400 8.608 -0.208 19694
3544 1 8 . 1 1 59 59 ARG N N 59 121.190 121.190 116.485 4.705 19694
3545 1 8 . 1 1 59 59 ARG HA H 59 4.250 4.250 4.313 -0.063 19694
3546 1 8 . 1 1 59 59 ARG CA C 59 55.580 55.580 54.192 1.388 19694
3547 1 8 . 1 1 59 59 ARG CB C 59 33.460 33.460 33.740 -0.280 19694
3548 1 8 . 1 1 59 59 ARG H H 59 7.980 7.980 7.895 0.085 19694
3549 1 8 . 1 1 60 60 HIS N N 60 118.420 118.420 117.741 0.679 19694
3550 1 8 . 1 1 60 60 HIS HA H 60 5.270 5.270 5.582 -0.312 19694
3551 1 8 . 1 1 60 60 HIS CA C 60 55.010 55.010 55.157 -0.147 19694
3552 1 8 . 1 1 60 60 HIS CB C 60 32.380 32.380 32.969 -0.590 19694
3553 1 8 . 1 1 60 60 HIS H H 60 8.350 8.350 8.164 0.186 19694
3554 1 8 . 1 1 61 61 TRP N N 61 119.990 119.990 118.723 1.267 19694
3555 1 8 . 1 1 61 61 TRP HA H 61 5.930 5.930 4.806 1.124 19694
3556 1 8 . 1 1 61 61 TRP CA C 61 57.400 57.400 57.058 0.342 19694
3557 1 8 . 1 1 61 61 TRP CB C 61 35.380 35.380 34.217 1.163 19694
3558 1 8 . 1 1 61 61 TRP H H 61 9.310 9.310 9.249 0.061 19694
3559 1 8 . 1 1 62 62 HIS N N 62 117.270 117.270 121.335 -4.065 19694
3560 1 8 . 1 1 62 62 HIS HA H 62 4.600 4.600 4.872 -0.272 19694
3561 1 8 . 1 1 62 62 HIS CA C 62 59.210 59.210 57.295 1.915 19694
3562 1 8 . 1 1 62 62 HIS CB C 62 31.200 31.200 30.506 0.694 19694
3563 1 8 . 1 1 62 62 HIS H H 62 8.430 8.430 9.125 -0.695 19694
3564 1 8 . 1 1 63 63 GLU N N 63 124.640 124.640 128.744 -4.104 19694
3565 1 8 . 1 1 63 63 GLU HA H 63 3.827 3.827 3.969 -0.142 19694
3566 1 8 . 1 1 63 63 GLU CA C 63 61.020 61.020 59.597 1.423 19694
3567 1 8 . 1 1 63 63 GLU CB C 63 30.310 30.310 29.665 0.645 19694
3568 1 8 . 1 1 63 63 GLU H H 63 9.040 9.040 8.425 0.615 19694
3569 1 8 . 1 1 64 64 ALA N N 64 117.050 117.050 117.717 -0.667 19694
3570 1 8 . 1 1 64 64 ALA HA H 64 4.230 4.230 4.206 0.024 19694
3571 1 8 . 1 1 64 64 ALA CA C 64 54.000 54.000 52.942 1.058 19694
3572 1 8 . 1 1 64 64 ALA CB C 64 18.880 18.880 19.094 -0.214 19694
3573 1 8 . 1 1 64 64 ALA H H 64 8.680 8.680 8.267 0.413 19694
3574 1 8 . 1 1 65 65 CYS N N 65 115.380 115.380 116.763 -1.383 19694
3575 1 8 . 1 1 65 65 CYS HA H 65 4.295 4.295 3.958 0.337 19694
3576 1 8 . 1 1 65 65 CYS CA C 65 59.850 59.850 60.120 -0.270 19694
3577 1 8 . 1 1 65 65 CYS CB C 65 32.840 32.840 27.157 5.683 19694
3578 1 8 . 1 1 65 65 CYS H H 65 7.490 7.490 8.103 -0.613 19694
3579 1 8 . 1 1 66 66 PHE N N 66 122.020 122.020 123.104 -1.084 19694
3580 1 8 . 1 1 66 66 PHE HA H 66 3.890 3.890 3.881 0.009 19694
3581 1 8 . 1 1 66 66 PHE CA C 66 57.010 57.010 58.615 -1.605 19694
3582 1 8 . 1 1 66 66 PHE CB C 66 38.070 38.070 38.174 -0.104 19694
3583 1 8 . 1 1 66 66 PHE H H 66 7.110 7.110 7.566 -0.456 19694
3584 1 8 . 1 1 67 67 HIS N N 67 121.280 121.280 122.086 -0.806 19694
3585 1 8 . 1 1 67 67 HIS HA H 67 4.720 4.720 5.198 -0.478 19694
3586 1 8 . 1 1 67 67 HIS CA C 67 52.730 52.730 52.852 -0.122 19694
3587 1 8 . 1 1 67 67 HIS CB C 67 32.230 32.230 30.685 1.545 19694
3588 1 8 . 1 1 67 67 HIS H H 67 7.380 7.380 8.011 -0.631 19694
3589 1 8 . 1 1 68 68 CYS N N 68 121.590 121.590 118.940 2.650 19694
3590 1 8 . 1 1 68 68 CYS HA H 68 3.960 3.960 4.825 -0.865 19694
3591 1 8 . 1 1 68 68 CYS CA C 68 59.790 59.790 58.281 1.509 19694
3592 1 8 . 1 1 68 68 CYS CB C 68 31.200 31.200 29.193 2.007 19694
3593 1 8 . 1 1 68 68 CYS H H 68 8.530 8.530 8.258 0.272 19694
3594 1 8 . 1 1 69 69 SER N N 69 126.530 126.530 120.650 5.880 19694
3595 1 8 . 1 1 69 69 SER HA H 69 4.310 4.310 4.114 0.196 19694
3596 1 8 . 1 1 69 69 SER CA C 69 61.760 61.760 60.777 0.983 19694
3597 1 8 . 1 1 69 69 SER CB C 69 64.040 64.040 63.214 0.826 19694
3598 1 8 . 1 1 69 69 SER H H 69 9.460 9.460 8.831 0.629 19694
3599 1 8 . 1 1 70 70 GLN N N 70 122.370 122.370 118.652 3.718 19694
3600 1 8 . 1 1 70 70 GLN HA H 70 4.510 4.510 4.466 0.044 19694
3601 1 8 . 1 1 70 70 GLN CA C 70 57.840 57.840 57.326 0.514 19694
3602 1 8 . 1 1 70 70 GLN CB C 70 30.430 30.430 29.681 0.749 19694
3603 1 8 . 1 1 70 70 GLN H H 70 8.980 8.980 7.838 1.142 19694
3604 1 8 . 1 1 71 71 CYS N N 71 118.860 118.860 116.928 1.932 19694
3605 1 8 . 1 1 71 71 CYS HA H 71 4.720 4.720 4.759 -0.039 19694
3606 1 8 . 1 1 71 71 CYS CA C 71 59.770 59.770 58.120 1.650 19694
3607 1 8 . 1 1 71 71 CYS CB C 71 31.910 31.910 27.906 4.004 19694
3608 1 8 . 1 1 71 71 CYS H H 71 8.220 8.220 7.719 0.501 19694
3609 1 8 . 1 1 72 72 ARG N N 72 114.380 114.380 117.147 -2.767 19694
3610 1 8 . 1 1 72 72 ARG HA H 72 3.965 3.965 3.808 0.157 19694
3611 1 8 . 1 1 72 72 ARG CA C 72 58.030 58.030 57.209 0.821 19694
3612 1 8 . 1 1 72 72 ARG CB C 72 27.720 27.720 27.080 0.640 19694
3613 1 8 . 1 1 72 72 ARG H H 72 7.380 7.380 7.766 -0.386 19694
3614 1 8 . 1 1 73 73 ASN N N 73 121.480 121.480 117.398 4.082 19694
3615 1 8 . 1 1 73 73 ASN HA H 73 4.630 4.630 4.660 -0.030 19694
3616 1 8 . 1 1 73 73 ASN CA C 73 54.110 54.110 54.065 0.045 19694
3617 1 8 . 1 1 73 73 ASN CB C 73 38.870 38.870 39.526 -0.656 19694
3618 1 8 . 1 1 73 73 ASN H H 73 8.722 8.722 8.179 0.543 19694
3619 1 8 . 1 1 74 74 SER N N 74 114.710 114.710 117.748 -3.038 19694
3620 1 8 . 1 1 74 74 SER HA H 74 4.060 4.060 4.806 -0.746 19694
3621 1 8 . 1 1 74 74 SER CA C 74 59.357 59.357 58.149 1.208 19694
3622 1 8 . 1 1 74 74 SER CB C 74 63.300 63.300 62.622 0.678 19694
3623 1 8 . 1 1 74 74 SER H H 74 8.690 8.690 8.495 0.195 19694
3624 1 8 . 1 1 75 75 LEU N N 75 125.757 125.757 127.730 -1.973 19694
3625 1 8 . 1 1 75 75 LEU HA H 75 4.280 4.280 4.265 0.015 19694
3626 1 8 . 1 1 75 75 LEU CA C 75 53.510 53.510 54.918 -1.408 19694
3627 1 8 . 1 1 75 75 LEU CB C 75 42.200 42.200 41.793 0.407 19694
3628 1 8 . 1 1 75 75 LEU H H 75 7.970 7.970 8.010 -0.040 19694
3629 1 8 . 1 1 76 76 VAL N N 76 120.860 120.860 124.565 -3.705 19694
3630 1 8 . 1 1 76 76 VAL HA H 76 3.570 3.570 3.791 -0.221 19694
3631 1 8 . 1 1 76 76 VAL CA C 76 65.420 65.420 60.997 4.423 19694
3632 1 8 . 1 1 76 76 VAL CB C 76 31.540 31.540 35.004 -3.464 19694
3633 1 8 . 1 1 76 76 VAL H H 76 7.830 7.830 7.992 -0.162 19694
3634 1 8 . 1 1 77 77 ASP N N 77 122.360 122.360 122.488 -0.128 19694
3635 1 8 . 1 1 77 77 ASP HA H 77 4.230 4.230 4.438 -0.208 19694
3636 1 8 . 1 1 77 77 ASP CA C 77 56.200 56.200 55.824 0.376 19694
3637 1 8 . 1 1 77 77 ASP CB C 77 39.380 39.380 40.825 -1.445 19694
3638 1 8 . 1 1 77 77 ASP H H 77 8.910 8.910 8.582 0.328 19694
3639 1 8 . 1 1 78 78 LYS N N 78 118.100 118.100 119.056 -0.956 19694
3640 1 8 . 1 1 78 78 LYS HA H 78 4.870 4.870 4.548 0.322 19694
3641 1 8 . 1 1 78 78 LYS CA C 78 56.960 56.960 53.937 3.023 19694
3642 1 8 . 1 1 78 78 LYS CB C 78 34.680 34.680 33.694 0.986 19694
3643 1 8 . 1 1 78 78 LYS H H 78 7.660 7.660 7.560 0.100 19694
3644 1 8 . 1 1 79 79 PRO HA H 79 4.460 4.460 4.212 0.248 19694
3645 1 8 . 1 1 79 79 PRO CA C 79 62.520 62.520 62.992 -0.472 19694
3646 1 8 . 1 1 79 79 PRO CB C 79 32.160 32.160 31.847 0.313 19694
3647 1 8 . 1 1 80 80 PHE N N 80 114.050 114.050 117.044 -2.994 19694
3648 1 8 . 1 1 80 80 PHE HA H 80 4.910 4.910 5.051 -0.141 19694
3649 1 8 . 1 1 80 80 PHE CA C 80 56.060 56.060 54.965 1.095 19694
3650 1 8 . 1 1 80 80 PHE CB C 80 42.410 42.410 42.000 0.410 19694
3651 1 8 . 1 1 80 80 PHE H H 80 7.510 7.510 7.147 0.363 19694
3652 1 8 . 1 1 81 81 ALA N N 81 123.290 123.290 123.716 -0.426 19694
3653 1 8 . 1 1 81 81 ALA HA H 81 4.310 4.310 4.345 -0.035 19694
3654 1 8 . 1 1 81 81 ALA CA C 81 50.450 50.450 50.373 0.077 19694
3655 1 8 . 1 1 81 81 ALA CB C 81 21.920 21.920 18.936 2.984 19694
3656 1 8 . 1 1 81 81 ALA H H 81 9.030 9.030 8.981 0.049 19694
3657 1 8 . 1 1 82 82 ALA N N 82 122.490 122.490 128.677 -6.187 19694
3658 1 8 . 1 1 82 82 ALA HA H 82 5.110 5.110 4.405 0.705 19694
3659 1 8 . 1 1 82 82 ALA CA C 82 51.100 51.100 51.940 -0.840 19694
3660 1 8 . 1 1 82 82 ALA CB C 82 21.130 21.130 18.792 2.338 19694
3661 1 8 . 1 1 82 82 ALA H H 82 8.240 8.240 8.591 -0.351 19694
3662 1 8 . 1 1 83 83 LYS N N 83 123.580 123.580 126.098 -2.518 19694
3663 1 8 . 1 1 83 83 LYS HA H 83 4.490 4.490 4.498 -0.008 19694
3664 1 8 . 1 1 83 83 LYS CA C 83 55.800 55.800 55.423 0.377 19694
3665 1 8 . 1 1 83 83 LYS CB C 83 34.720 34.720 34.097 0.623 19694
3666 1 8 . 1 1 83 83 LYS H H 83 8.400 8.400 8.324 0.076 19694
3667 1 8 . 1 1 84 84 GLU N N 84 125.470 125.470 120.675 4.795 19694
3668 1 8 . 1 1 84 84 GLU HA H 84 3.820 3.820 4.120 -0.300 19694
3669 1 8 . 1 1 84 84 GLU CA C 84 58.620 58.620 59.029 -0.409 19694
3670 1 8 . 1 1 84 84 GLU CB C 84 27.210 27.210 29.733 -2.523 19694
3671 1 8 . 1 1 84 84 GLU H H 84 9.320 9.320 8.784 0.536 19694
3672 1 8 . 1 1 85 85 ASP N N 85 118.550 118.550 114.263 4.287 19694
3673 1 8 . 1 1 85 85 ASP HA H 85 4.600 4.600 4.782 -0.182 19694
3674 1 8 . 1 1 85 85 ASP CA C 85 55.400 55.400 54.016 1.384 19694
3675 1 8 . 1 1 85 85 ASP CB C 85 40.400 40.400 41.922 -1.522 19694
3676 1 8 . 1 1 85 85 ASP H H 85 8.730 8.730 8.252 0.478 19694
3677 1 8 . 1 1 86 86 GLN N N 86 119.050 119.050 116.299 2.751 19694
3678 1 8 . 1 1 86 86 GLN HA H 86 4.540 4.540 4.489 0.051 19694
3679 1 8 . 1 1 86 86 GLN CA C 86 55.100 55.100 53.805 1.295 19694
3680 1 8 . 1 1 86 86 GLN CB C 86 31.110 31.110 31.556 -0.446 19694
3681 1 8 . 1 1 86 86 GLN H H 86 8.170 8.170 7.643 0.527 19694
3682 1 8 . 1 1 87 87 LEU N N 87 123.110 123.110 121.344 1.766 19694
3683 1 8 . 1 1 87 87 LEU HA H 87 4.620 4.620 5.203 -0.583 19694
3684 1 8 . 1 1 87 87 LEU CA C 87 54.520 54.520 54.016 0.505 19694
3685 1 8 . 1 1 87 87 LEU CB C 87 42.700 42.700 44.522 -1.822 19694
3686 1 8 . 1 1 87 87 LEU H H 87 8.490 8.490 8.511 -0.021 19694
3687 1 8 . 1 1 88 88 LEU N N 88 123.690 123.690 120.243 3.447 19694
3688 1 8 . 1 1 88 88 LEU HA H 88 5.880 5.880 4.953 0.927 19694
3689 1 8 . 1 1 88 88 LEU CA C 88 53.340 53.340 52.759 0.581 19694
3690 1 8 . 1 1 88 88 LEU CB C 88 47.190 47.190 47.780 -0.590 19694
3691 1 8 . 1 1 88 88 LEU H H 88 8.930 8.930 8.337 0.593 19694
3692 1 8 . 1 1 89 89 CYS N N 89 122.270 122.270 119.576 2.694 19694
3693 1 8 . 1 1 89 89 CYS HA H 89 4.780 4.780 4.825 -0.045 19694
3694 1 8 . 1 1 89 89 CYS CA C 89 57.640 57.640 59.195 -1.555 19694
3695 1 8 . 1 1 89 89 CYS CB C 89 30.940 30.940 28.241 2.699 19694
3696 1 8 . 1 1 89 89 CYS H H 89 9.430 9.430 8.995 0.435 19694
3697 1 8 . 1 1 90 90 THR N N 90 110.620 110.620 117.034 -6.414 19694
3698 1 8 . 1 1 90 90 THR HA H 90 3.900 3.900 3.941 -0.041 19694
3699 1 8 . 1 1 90 90 THR CA C 90 65.460 65.460 66.108 -0.648 19694
3700 1 8 . 1 1 90 90 THR CB C 90 68.670 68.670 68.818 -0.148 19694
3701 1 8 . 1 1 90 90 THR H H 90 8.410 8.410 8.887 -0.477 19694
3702 1 8 . 1 1 91 91 ASP N N 91 123.470 123.470 121.835 1.635 19694
3703 1 8 . 1 1 91 91 ASP HA H 91 4.490 4.490 4.682 -0.192 19694
3704 1 8 . 1 1 91 91 ASP CA C 91 57.810 57.810 57.994 -0.184 19694
3705 1 8 . 1 1 91 91 ASP CB C 91 41.160 41.160 40.899 0.261 19694
3706 1 8 . 1 1 91 91 ASP H H 91 8.150 8.150 8.405 -0.255 19694
3707 1 8 . 1 1 92 92 CYS N N 92 123.800 123.800 119.661 4.139 19694
3708 1 8 . 1 1 92 92 CYS HA H 92 3.970 3.970 4.394 -0.424 19694
3709 1 8 . 1 1 92 92 CYS CA C 92 64.100 64.100 61.102 2.998 19694
3710 1 8 . 1 1 92 92 CYS CB C 92 30.090 30.090 26.084 4.006 19694
3711 1 8 . 1 1 92 92 CYS H H 92 8.580 8.580 7.792 0.788 19694
3712 1 8 . 1 1 93 93 TYR N N 93 120.730 120.730 121.032 -0.302 19694
3713 1 8 . 1 1 93 93 TYR HA H 93 4.140 4.140 4.091 0.049 19694
3714 1 8 . 1 1 93 93 TYR CA C 93 60.380 60.380 61.264 -0.884 19694
3715 1 8 . 1 1 93 93 TYR CB C 93 39.300 39.300 38.392 0.908 19694
3716 1 8 . 1 1 93 93 TYR H H 93 8.540 8.540 9.140 -0.600 19694
3717 1 8 . 1 1 94 94 SER N N 94 115.010 115.010 113.402 1.608 19694
3718 1 8 . 1 1 94 94 SER HA H 94 4.220 4.220 4.231 -0.011 19694
3719 1 8 . 1 1 94 94 SER CA C 94 59.300 59.300 61.336 -2.036 19694
3720 1 8 . 1 1 94 94 SER CB C 94 63.660 63.660 62.550 1.109 19694
3721 1 8 . 1 1 94 94 SER H H 94 7.750 7.750 8.133 -0.383 19694
3722 1 8 . 1 1 95 95 ASN N N 95 119.820 119.820 119.187 0.633 19694
3723 1 8 . 1 1 95 95 ASN HA H 95 4.510 4.510 4.572 -0.062 19694
3724 1 8 . 1 1 95 95 ASN CA C 95 53.880 53.880 55.696 -1.816 19694
3725 1 8 . 1 1 95 95 ASN CB C 95 39.300 39.300 39.146 0.154 19694
3726 1 8 . 1 1 95 95 ASN H H 95 7.780 7.780 7.911 -0.131 19694
3727 1 8 . 1 1 96 96 GLU N N 96 119.820 119.820 116.999 2.821 19694
3728 1 8 . 1 1 96 96 GLU HA H 96 4.096 4.096 4.221 -0.125 19694
3729 1 8 . 1 1 96 96 GLU CA C 96 56.910 56.910 57.693 -0.783 19694
3730 1 8 . 1 1 96 96 GLU CB C 96 30.220 30.220 29.535 0.685 19694
3731 1 8 . 1 1 96 96 GLU H H 96 7.950 7.950 7.541 0.409 19694
3732 1 8 . 1 1 97 97 TYR N N 97 120.370 120.370 121.955 -1.585 19694
3733 1 8 . 1 1 97 97 TYR HA H 97 4.620 4.620 4.111 0.509 19694
3734 1 8 . 1 1 97 97 TYR CA C 97 57.700 57.700 59.050 -1.351 19694
3735 1 8 . 1 1 97 97 TYR CB C 97 38.710 38.710 38.496 0.214 19694
3736 1 8 . 1 1 97 97 TYR H H 97 8.070 8.070 8.584 -0.514 19694
3737 1 9 . 1 1 2 2 THR N N 2 113.570 113.570 116.929 -3.359 19694
3738 1 9 . 1 1 2 2 THR HA H 2 4.240 4.240 4.329 -0.089 19694
3739 1 9 . 1 1 2 2 THR CA C 2 62.130 62.130 63.043 -0.913 19694
3740 1 9 . 1 1 2 2 THR CB C 2 69.250 69.250 69.162 0.088 19694
3741 1 9 . 1 1 2 2 THR H H 2 8.090 8.090 8.293 -0.203 19694
3742 1 9 . 1 1 3 3 GLU N N 3 122.880 122.880 121.285 1.595 19694
3743 1 9 . 1 1 3 3 GLU HA H 3 4.280 4.280 4.391 -0.111 19694
3744 1 9 . 1 1 3 3 GLU CA C 3 56.860 56.860 55.614 1.246 19694
3745 1 9 . 1 1 3 3 GLU CB C 3 30.570 30.570 30.419 0.151 19694
3746 1 9 . 1 1 3 3 GLU H H 3 8.280 8.280 8.051 0.229 19694
3747 1 9 . 1 1 4 4 ARG N N 4 121.330 121.330 119.850 1.480 19694
3748 1 9 . 1 1 4 4 ARG HA H 4 4.300 4.300 4.546 -0.246 19694
3749 1 9 . 1 1 4 4 ARG CA C 4 55.870 55.870 55.674 0.196 19694
3750 1 9 . 1 1 4 4 ARG CB C 4 31.640 31.640 30.861 0.779 19694
3751 1 9 . 1 1 4 4 ARG H H 4 8.280 8.280 8.509 -0.229 19694
3752 1 9 . 1 1 5 5 PHE N N 5 125.490 125.490 123.794 1.696 19694
3753 1 9 . 1 1 5 5 PHE HA H 5 4.610 4.610 4.626 -0.016 19694
3754 1 9 . 1 1 5 5 PHE CA C 5 56.380 56.380 56.237 0.143 19694
3755 1 9 . 1 1 5 5 PHE CB C 5 39.560 39.560 39.782 -0.223 19694
3756 1 9 . 1 1 5 5 PHE H H 5 8.290 8.290 8.676 -0.386 19694
3757 1 9 . 1 1 6 6 ASP N N 6 123.260 123.260 119.547 3.713 19694
3758 1 9 . 1 1 6 6 ASP HA H 6 5.045 5.045 4.846 0.199 19694
3759 1 9 . 1 1 6 6 ASP CA C 6 52.180 52.180 52.079 0.101 19694
3760 1 9 . 1 1 6 6 ASP CB C 6 44.210 44.210 43.287 0.923 19694
3761 1 9 . 1 1 6 6 ASP H H 6 7.940 7.940 7.554 0.386 19694
3762 1 9 . 1 1 7 7 CYS N N 7 121.440 121.440 121.839 -0.399 19694
3763 1 9 . 1 1 7 7 CYS HA H 7 3.960 3.960 4.427 -0.467 19694
3764 1 9 . 1 1 7 7 CYS CA C 7 59.820 59.820 59.477 0.343 19694
3765 1 9 . 1 1 7 7 CYS CB C 7 30.950 30.950 26.097 4.853 19694
3766 1 9 . 1 1 7 7 CYS H H 7 8.700 8.700 8.506 0.194 19694
3767 1 9 . 1 1 8 8 HIS N N 8 129.390 129.390 128.920 0.470 19694
3768 1 9 . 1 1 8 8 HIS HA H 8 4.200 4.200 4.225 -0.025 19694
3769 1 9 . 1 1 8 8 HIS CA C 8 58.240 58.240 59.243 -1.003 19694
3770 1 9 . 1 1 8 8 HIS CB C 8 29.480 29.480 30.019 -0.539 19694
3771 1 9 . 1 1 8 8 HIS H H 8 9.160 9.160 9.510 -0.350 19694
3772 1 9 . 1 1 9 9 HIS N N 9 118.740 118.740 117.513 1.227 19694
3773 1 9 . 1 1 9 9 HIS HA H 9 4.880 4.880 4.407 0.473 19694
3774 1 9 . 1 1 9 9 HIS CA C 9 58.680 58.680 57.098 1.582 19694
3775 1 9 . 1 1 9 9 HIS CB C 9 31.040 31.040 30.334 0.706 19694
3776 1 9 . 1 1 9 9 HIS H H 9 9.270 9.270 7.998 1.272 19694
3777 1 9 . 1 1 10 10 CYS N N 10 118.600 118.600 117.529 1.071 19694
3778 1 9 . 1 1 10 10 CYS HA H 10 4.600 4.600 4.425 0.175 19694
3779 1 9 . 1 1 10 10 CYS CA C 10 59.600 59.600 59.207 0.393 19694
3780 1 9 . 1 1 10 10 CYS CB C 10 32.330 32.330 27.981 4.349 19694
3781 1 9 . 1 1 10 10 CYS H H 10 8.550 8.550 7.867 0.683 19694
3782 1 9 . 1 1 11 11 ASN N N 11 116.220 116.220 117.113 -0.893 19694
3783 1 9 . 1 1 11 11 ASN HA H 11 4.410 4.410 4.388 0.022 19694
3784 1 9 . 1 1 11 11 ASN CA C 11 55.640 55.640 54.487 1.153 19694
3785 1 9 . 1 1 11 11 ASN CB C 11 38.200 38.200 36.483 1.717 19694
3786 1 9 . 1 1 11 11 ASN H H 11 7.690 7.690 8.772 -1.082 19694
3787 1 9 . 1 1 12 12 GLU N N 12 120.330 120.330 118.222 2.108 19694
3788 1 9 . 1 1 12 12 GLU HA H 12 4.220 4.220 4.576 -0.356 19694
3789 1 9 . 1 1 12 12 GLU CA C 12 56.700 56.700 54.861 1.839 19694
3790 1 9 . 1 1 12 12 GLU CB C 12 30.910 30.910 31.024 -0.114 19694
3791 1 9 . 1 1 12 12 GLU H H 12 8.210 8.210 7.712 0.498 19694
3792 1 9 . 1 1 13 13 SER N N 13 116.190 116.190 120.363 -4.173 19694
3793 1 9 . 1 1 13 13 SER HA H 13 4.060 4.060 4.387 -0.327 19694
3794 1 9 . 1 1 13 13 SER CA C 13 59.350 59.350 58.956 0.394 19694
3795 1 9 . 1 1 13 13 SER CB C 13 63.820 63.820 63.603 0.217 19694
3796 1 9 . 1 1 13 13 SER H H 13 8.520 8.520 8.640 -0.120 19694
3797 1 9 . 1 1 14 14 LEU N N 14 126.060 126.060 124.581 1.479 19694
3798 1 9 . 1 1 14 14 LEU HA H 14 4.310 4.310 4.321 -0.011 19694
3799 1 9 . 1 1 14 14 LEU CA C 14 54.100 54.100 55.565 -1.464 19694
3800 1 9 . 1 1 14 14 LEU CB C 14 42.200 42.200 41.706 0.494 19694
3801 1 9 . 1 1 14 14 LEU H H 14 8.910 8.910 7.766 1.144 19694
3802 1 9 . 1 1 15 15 PHE N N 15 120.660 120.660 121.124 -0.464 19694
3803 1 9 . 1 1 15 15 PHE HA H 15 4.480 4.480 4.619 -0.139 19694
3804 1 9 . 1 1 15 15 PHE CA C 15 60.400 60.400 56.607 3.793 19694
3805 1 9 . 1 1 15 15 PHE CB C 15 38.130 38.130 37.902 0.228 19694
3806 1 9 . 1 1 15 15 PHE H H 15 7.820 7.820 8.597 -0.777 19694
3807 1 9 . 1 1 16 16 GLY N N 16 114.730 114.730 110.936 3.794 19694
3808 1 9 . 1 1 16 16 GLY CA C 16 45.900 45.900 45.810 0.090 19694
3809 1 9 . 1 1 16 16 GLY H H 16 8.860 8.860 8.813 0.047 19694
3810 1 9 . 1 1 17 17 LYS N N 17 119.580 119.580 119.842 -0.262 19694
3811 1 9 . 1 1 17 17 LYS HA H 17 4.480 4.480 4.480 0.000 19694
3812 1 9 . 1 1 17 17 LYS CA C 17 54.460 54.460 54.563 -0.103 19694
3813 1 9 . 1 1 17 17 LYS CB C 17 35.800 35.800 34.012 1.788 19694
3814 1 9 . 1 1 17 17 LYS H H 17 8.030 8.030 7.262 0.768 19694
3815 1 9 . 1 1 18 18 LYS N N 18 120.330 120.330 122.052 -1.722 19694
3816 1 9 . 1 1 18 18 LYS HA H 18 4.280 4.280 4.341 -0.061 19694
3817 1 9 . 1 1 18 18 LYS CA C 18 56.800 56.800 57.577 -0.777 19694
3818 1 9 . 1 1 18 18 LYS CB C 18 33.010 33.010 33.032 -0.022 19694
3819 1 9 . 1 1 18 18 LYS H H 18 8.190 8.190 8.544 -0.354 19694
3820 1 9 . 1 1 19 19 TYR N N 19 117.500 117.500 114.493 3.007 19694
3821 1 9 . 1 1 19 19 TYR HA H 19 5.240 5.240 4.787 0.453 19694
3822 1 9 . 1 1 19 19 TYR CA C 19 55.340 55.340 56.422 -1.082 19694
3823 1 9 . 1 1 19 19 TYR CB C 19 42.850 42.850 40.267 2.583 19694
3824 1 9 . 1 1 19 19 TYR H H 19 7.610 7.610 7.915 -0.305 19694
3825 1 9 . 1 1 20 20 ILE N N 20 121.430 121.430 121.796 -0.366 19694
3826 1 9 . 1 1 20 20 ILE HA H 20 4.137 4.137 4.255 -0.118 19694
3827 1 9 . 1 1 20 20 ILE CA C 20 60.010 60.010 60.119 -0.109 19694
3828 1 9 . 1 1 20 20 ILE CB C 20 41.570 41.570 40.666 0.904 19694
3829 1 9 . 1 1 20 20 ILE H H 20 9.350 9.350 8.232 1.118 19694
3830 1 9 . 1 1 21 21 LEU N N 21 126.720 126.720 125.977 0.743 19694
3831 1 9 . 1 1 21 21 LEU HA H 21 5.090 5.090 4.780 0.310 19694
3832 1 9 . 1 1 21 21 LEU CA C 21 54.020 54.020 53.934 0.086 19694
3833 1 9 . 1 1 21 21 LEU CB C 21 43.720 43.720 40.874 2.846 19694
3834 1 9 . 1 1 21 21 LEU H H 21 8.530 8.530 8.506 0.024 19694
3835 1 9 . 1 1 22 22 ARG N N 22 123.930 123.930 126.233 -2.303 19694
3836 1 9 . 1 1 22 22 ARG HA H 22 4.440 4.440 4.500 -0.060 19694
3837 1 9 . 1 1 22 22 ARG CA C 22 55.600 55.600 54.558 1.042 19694
3838 1 9 . 1 1 22 22 ARG CB C 22 32.280 32.280 32.276 0.004 19694
3839 1 9 . 1 1 22 22 ARG H H 22 9.080 9.080 8.848 0.233 19694
3840 1 9 . 1 1 23 23 GLU N N 23 128.500 128.500 123.563 4.937 19694
3841 1 9 . 1 1 23 23 GLU HA H 23 3.840 3.840 3.939 -0.099 19694
3842 1 9 . 1 1 23 23 GLU CA C 23 58.030 58.030 57.928 0.102 19694
3843 1 9 . 1 1 23 23 GLU CB C 23 27.200 27.200 27.771 -0.571 19694
3844 1 9 . 1 1 23 23 GLU H H 23 9.610 9.610 8.995 0.615 19694
3845 1 9 . 1 1 24 24 GLU N N 24 110.300 110.300 113.079 -2.779 19694
3846 1 9 . 1 1 24 24 GLU HA H 24 3.780 3.780 3.988 -0.208 19694
3847 1 9 . 1 1 24 24 GLU CA C 24 58.320 58.320 57.374 0.946 19694
3848 1 9 . 1 1 24 24 GLU CB C 24 28.220 28.220 28.505 -0.285 19694
3849 1 9 . 1 1 24 24 GLU H H 24 8.660 8.660 8.693 -0.033 19694
3850 1 9 . 1 1 25 25 SER N N 25 117.700 117.700 112.900 4.800 19694
3851 1 9 . 1 1 25 25 SER HA H 25 4.890 4.890 4.784 0.106 19694
3852 1 9 . 1 1 25 25 SER CA C 25 56.540 56.540 55.776 0.764 19694
3853 1 9 . 1 1 25 25 SER CB C 25 64.720 64.720 64.688 0.032 19694
3854 1 9 . 1 1 25 25 SER H H 25 7.900 7.900 7.759 0.141 19694
3855 1 9 . 1 1 26 26 PRO HA H 26 4.995 4.995 4.870 0.125 19694
3856 1 9 . 1 1 26 26 PRO CA C 26 61.750 61.750 63.119 -1.369 19694
3857 1 9 . 1 1 26 26 PRO CB C 26 32.660 32.660 31.608 1.052 19694
3858 1 9 . 1 1 27 27 TYR N N 27 118.100 118.100 123.709 -5.609 19694
3859 1 9 . 1 1 27 27 TYR HA H 27 5.910 5.910 4.978 0.932 19694
3860 1 9 . 1 1 27 27 TYR CA C 27 56.830 56.830 54.868 1.962 19694
3861 1 9 . 1 1 27 27 TYR CB C 27 42.810 42.810 42.515 0.295 19694
3862 1 9 . 1 1 27 27 TYR H H 27 9.040 9.040 8.690 0.350 19694
3863 1 9 . 1 1 28 28 CYS N N 28 122.230 122.230 119.274 2.956 19694
3864 1 9 . 1 1 28 28 CYS HA H 28 4.850 4.850 4.719 0.131 19694
3865 1 9 . 1 1 28 28 CYS CA C 28 58.110 58.110 58.079 0.031 19694
3866 1 9 . 1 1 28 28 CYS CB C 28 30.530 30.530 29.167 1.363 19694
3867 1 9 . 1 1 28 28 CYS H H 28 9.850 9.850 8.372 1.478 19694
3868 1 9 . 1 1 29 29 VAL N N 29 118.200 118.200 122.234 -4.034 19694
3869 1 9 . 1 1 29 29 VAL HA H 29 3.650 3.650 3.753 -0.103 19694
3870 1 9 . 1 1 29 29 VAL CA C 29 67.400 67.400 66.420 0.980 19694
3871 1 9 . 1 1 29 29 VAL CB C 29 31.860 31.860 31.703 0.157 19694
3872 1 9 . 1 1 29 29 VAL H H 29 8.430 8.430 8.851 -0.421 19694
3873 1 9 . 1 1 30 30 VAL N N 30 119.570 119.570 117.833 1.737 19694
3874 1 9 . 1 1 30 30 VAL HA H 30 3.860 3.860 3.614 0.246 19694
3875 1 9 . 1 1 30 30 VAL CA C 30 66.450 66.450 66.652 -0.202 19694
3876 1 9 . 1 1 30 30 VAL CB C 30 31.540 31.540 30.883 0.657 19694
3877 1 9 . 1 1 30 30 VAL H H 30 7.700 7.700 7.848 -0.148 19694
3878 1 9 . 1 1 31 31 CYS N N 31 125.890 125.890 119.316 6.574 19694
3879 1 9 . 1 1 31 31 CYS HA H 31 3.830 3.830 3.886 -0.056 19694
3880 1 9 . 1 1 31 31 CYS CA C 31 65.850 65.850 64.360 1.490 19694
3881 1 9 . 1 1 31 31 CYS CB C 31 29.510 29.510 25.573 3.937 19694
3882 1 9 . 1 1 31 31 CYS H H 31 9.050 9.050 7.599 1.451 19694
3883 1 9 . 1 1 32 32 PHE N N 32 119.000 119.000 119.313 -0.313 19694
3884 1 9 . 1 1 32 32 PHE HA H 32 3.780 3.780 3.671 0.109 19694
3885 1 9 . 1 1 32 32 PHE CA C 32 62.610 62.610 61.755 0.855 19694
3886 1 9 . 1 1 32 32 PHE CB C 32 39.920 39.920 39.030 0.890 19694
3887 1 9 . 1 1 32 32 PHE H H 32 9.080 9.080 7.871 1.209 19694
3888 1 9 . 1 1 33 33 GLU N N 33 117.470 117.470 117.759 -0.289 19694
3889 1 9 . 1 1 33 33 GLU HA H 33 3.760 3.760 4.051 -0.291 19694
3890 1 9 . 1 1 33 33 GLU CA C 33 59.210 59.210 59.480 -0.270 19694
3891 1 9 . 1 1 33 33 GLU CB C 33 29.480 29.480 29.188 0.292 19694
3892 1 9 . 1 1 33 33 GLU H H 33 8.510 8.510 8.190 0.320 19694
3893 1 9 . 1 1 34 34 THR N N 34 114.140 114.140 115.329 -1.189 19694
3894 1 9 . 1 1 34 34 THR HA H 34 3.730 3.730 3.974 -0.244 19694
3895 1 9 . 1 1 34 34 THR CA C 34 65.890 65.890 65.531 0.358 19694
3896 1 9 . 1 1 34 34 THR CB C 34 69.210 69.210 68.609 0.601 19694
3897 1 9 . 1 1 34 34 THR H H 34 7.880 7.880 8.314 -0.434 19694
3898 1 9 . 1 1 35 35 LEU N N 35 117.980 117.980 118.824 -0.844 19694
3899 1 9 . 1 1 35 35 LEU HA H 35 3.650 3.650 3.933 -0.283 19694
3900 1 9 . 1 1 35 35 LEU CA C 35 56.860 56.860 57.232 -0.372 19694
3901 1 9 . 1 1 35 35 LEU CB C 35 41.870 41.870 41.777 0.093 19694
3902 1 9 . 1 1 35 35 LEU H H 35 7.660 7.660 7.767 -0.107 19694
3903 1 9 . 1 1 36 36 PHE N N 36 113.900 113.900 112.957 0.943 19694
3904 1 9 . 1 1 36 36 PHE HA H 36 4.597 4.597 4.466 0.131 19694
3905 1 9 . 1 1 36 36 PHE CA C 36 56.860 56.860 56.436 0.424 19694
3906 1 9 . 1 1 36 36 PHE CB C 36 40.570 40.570 38.279 2.291 19694
3907 1 9 . 1 1 36 36 PHE H H 36 7.730 7.730 6.679 1.051 19694
3908 1 9 . 1 1 37 37 ALA N N 37 121.920 121.920 123.327 -1.407 19694
3909 1 9 . 1 1 37 37 ALA HA H 37 4.070 4.070 4.086 -0.016 19694
3910 1 9 . 1 1 37 37 ALA CA C 37 52.900 52.900 52.247 0.653 19694
3911 1 9 . 1 1 37 37 ALA CB C 37 19.770 19.770 19.709 0.061 19694
3912 1 9 . 1 1 37 37 ALA H H 37 7.090 7.090 7.784 -0.694 19694
3913 1 9 . 1 1 38 38 ASN N N 38 119.230 119.230 119.304 -0.074 19694
3914 1 9 . 1 1 38 38 ASN HA H 38 4.450 4.450 4.633 -0.183 19694
3915 1 9 . 1 1 38 38 ASN CA C 38 52.850 52.850 52.763 0.087 19694
3916 1 9 . 1 1 38 38 ASN CB C 38 38.950 38.950 40.009 -1.059 19694
3917 1 9 . 1 1 38 38 ASN H H 38 8.790 8.790 8.344 0.446 19694
3918 1 9 . 1 1 39 39 THR N N 39 116.330 116.330 115.573 0.757 19694
3919 1 9 . 1 1 39 39 THR HA H 39 3.990 3.990 4.419 -0.429 19694
3920 1 9 . 1 1 39 39 THR CA C 39 62.130 62.130 62.378 -0.248 19694
3921 1 9 . 1 1 39 39 THR CB C 39 69.920 69.920 69.950 -0.030 19694
3922 1 9 . 1 1 39 39 THR H H 39 8.540 8.540 8.165 0.375 19694
3923 1 9 . 1 1 40 40 CYS N N 40 126.950 126.950 127.787 -0.837 19694
3924 1 9 . 1 1 40 40 CYS HA H 40 4.300 4.300 4.492 -0.192 19694
3925 1 9 . 1 1 40 40 CYS CA C 40 58.350 58.350 57.000 1.350 19694
3926 1 9 . 1 1 40 40 CYS CB C 40 31.600 31.600 26.612 4.988 19694
3927 1 9 . 1 1 40 40 CYS H H 40 7.940 7.940 8.552 -0.612 19694
3928 1 9 . 1 1 41 41 GLU N N 41 130.560 130.560 127.549 3.011 19694
3929 1 9 . 1 1 41 41 GLU HA H 41 3.690 3.690 3.823 -0.133 19694
3930 1 9 . 1 1 41 41 GLU CA C 41 58.600 58.600 59.119 -0.519 19694
3931 1 9 . 1 1 41 41 GLU CB C 41 30.460 30.460 29.386 1.075 19694
3932 1 9 . 1 1 41 41 GLU H H 41 8.810 8.810 8.656 0.154 19694
3933 1 9 . 1 1 42 42 GLU N N 42 119.680 119.680 118.268 1.412 19694
3934 1 9 . 1 1 42 42 GLU HA H 42 4.570 4.570 4.331 0.239 19694
3935 1 9 . 1 1 42 42 GLU CA C 42 58.000 58.000 58.097 -0.097 19694
3936 1 9 . 1 1 42 42 GLU CB C 42 31.680 31.680 30.575 1.105 19694
3937 1 9 . 1 1 42 42 GLU H H 42 8.500 8.500 8.103 0.397 19694
3938 1 9 . 1 1 43 43 CYS N N 43 115.600 115.600 116.425 -0.825 19694
3939 1 9 . 1 1 43 43 CYS HA H 43 5.010 5.010 4.575 0.435 19694
3940 1 9 . 1 1 43 43 CYS CA C 43 58.810 58.810 60.159 -1.349 19694
3941 1 9 . 1 1 43 43 CYS CB C 43 31.580 31.580 29.271 2.309 19694
3942 1 9 . 1 1 43 43 CYS H H 43 8.120 8.120 7.974 0.146 19694
3943 1 9 . 1 1 44 44 GLY N N 44 112.100 112.100 107.540 4.560 19694
3944 1 9 . 1 1 44 44 GLY CA C 44 46.420 46.420 45.223 1.197 19694
3945 1 9 . 1 1 44 44 GLY H H 44 7.900 7.900 8.630 -0.730 19694
3946 1 9 . 1 1 45 45 LYS N N 45 121.210 121.210 121.866 -0.656 19694
3947 1 9 . 1 1 45 45 LYS HA H 45 4.840 4.840 4.675 0.166 19694
3948 1 9 . 1 1 45 45 LYS CA C 45 54.360 54.360 52.815 1.545 19694
3949 1 9 . 1 1 45 45 LYS CB C 45 32.430 32.430 33.010 -0.580 19694
3950 1 9 . 1 1 45 45 LYS H H 45 8.180 8.180 7.849 0.331 19694
3951 1 9 . 1 1 46 46 PRO HA H 46 4.477 4.477 4.541 -0.064 19694
3952 1 9 . 1 1 46 46 PRO CA C 46 62.700 62.700 63.018 -0.318 19694
3953 1 9 . 1 1 46 46 PRO CB C 46 32.490 32.490 32.071 0.419 19694
3954 1 9 . 1 1 47 47 ILE N N 47 125.280 125.280 123.133 2.147 19694
3955 1 9 . 1 1 47 47 ILE HA H 47 3.830 3.830 4.272 -0.442 19694
3956 1 9 . 1 1 47 47 ILE CA C 47 61.040 61.040 60.667 0.373 19694
3957 1 9 . 1 1 47 47 ILE CB C 47 37.440 37.440 37.700 -0.260 19694
3958 1 9 . 1 1 47 47 ILE H H 47 8.540 8.540 8.896 -0.356 19694
3959 1 9 . 1 1 48 48 GLY N N 48 114.120 114.120 113.768 0.352 19694
3960 1 9 . 1 1 48 48 GLY CA C 48 45.240 45.240 45.059 0.181 19694
3961 1 9 . 1 1 48 48 GLY H H 48 8.660 8.660 8.592 0.068 19694
3962 1 9 . 1 1 49 49 CYS N N 49 117.140 117.140 123.237 -6.097 19694
3963 1 9 . 1 1 49 49 CYS HA H 49 4.280 4.280 4.243 0.037 19694
3964 1 9 . 1 1 49 49 CYS CA C 49 60.880 60.880 60.159 0.721 19694
3965 1 9 . 1 1 49 49 CYS CB C 49 27.650 27.650 27.696 -0.046 19694
3966 1 9 . 1 1 49 49 CYS H H 49 9.210 9.210 8.703 0.507 19694
3967 1 9 . 1 1 50 50 ASP N N 50 119.300 119.300 121.019 -1.719 19694
3968 1 9 . 1 1 50 50 ASP HA H 50 4.620 4.620 4.730 -0.110 19694
3969 1 9 . 1 1 50 50 ASP CA C 50 54.160 54.160 55.749 -1.589 19694
3970 1 9 . 1 1 50 50 ASP CB C 50 40.380 40.380 40.337 0.043 19694
3971 1 9 . 1 1 50 50 ASP H H 50 8.800 8.800 8.209 0.591 19694
3972 1 9 . 1 1 51 51 CYS N N 51 118.150 118.150 116.483 1.667 19694
3973 1 9 . 1 1 51 51 CYS HA H 51 4.620 4.620 4.656 -0.036 19694
3974 1 9 . 1 1 51 51 CYS CA C 51 58.030 58.030 56.718 1.312 19694
3975 1 9 . 1 1 51 51 CYS CB C 51 30.090 30.090 31.777 -1.687 19694
3976 1 9 . 1 1 51 51 CYS H H 51 7.590 7.590 7.134 0.456 19694
3977 1 9 . 1 1 52 52 LYS N N 52 123.800 123.800 122.305 1.495 19694
3978 1 9 . 1 1 52 52 LYS HA H 52 4.180 4.180 4.308 -0.128 19694
3979 1 9 . 1 1 52 52 LYS CA C 52 57.240 57.240 56.572 0.668 19694
3980 1 9 . 1 1 52 52 LYS CB C 52 33.030 33.030 31.479 1.551 19694
3981 1 9 . 1 1 52 52 LYS H H 52 8.600 8.600 8.506 0.094 19694
3982 1 9 . 1 1 53 53 ASP N N 53 124.900 124.900 124.116 0.784 19694
3983 1 9 . 1 1 53 53 ASP HA H 53 4.230 4.230 4.765 -0.535 19694
3984 1 9 . 1 1 53 53 ASP CA C 53 53.130 53.130 52.490 0.640 19694
3985 1 9 . 1 1 53 53 ASP CB C 53 42.230 42.230 40.675 1.555 19694
3986 1 9 . 1 1 53 53 ASP H H 53 8.250 8.250 8.290 -0.040 19694
3987 1 9 . 1 1 54 54 LEU N N 54 130.160 130.160 125.982 4.178 19694
3988 1 9 . 1 1 54 54 LEU HA H 54 4.440 4.440 4.566 -0.126 19694
3989 1 9 . 1 1 54 54 LEU CA C 54 53.340 53.340 55.371 -2.031 19694
3990 1 9 . 1 1 54 54 LEU CB C 54 41.170 41.170 43.106 -1.936 19694
3991 1 9 . 1 1 54 54 LEU H H 54 8.670 8.670 8.900 -0.230 19694
3992 1 9 . 1 1 55 55 SER N N 55 113.820 113.820 120.639 -6.819 19694
3993 1 9 . 1 1 55 55 SER HA H 55 5.580 5.580 5.153 0.427 19694
3994 1 9 . 1 1 55 55 SER CA C 55 55.850 55.850 56.599 -0.749 19694
3995 1 9 . 1 1 55 55 SER CB C 55 67.300 67.300 64.449 2.851 19694
3996 1 9 . 1 1 55 55 SER H H 55 8.160 8.160 8.465 -0.305 19694
3997 1 9 . 1 1 56 56 TYR N N 56 122.610 122.610 128.194 -5.584 19694
3998 1 9 . 1 1 56 56 TYR HA H 56 4.620 4.620 4.636 -0.016 19694
3999 1 9 . 1 1 56 56 TYR CA C 56 58.810 58.810 58.944 -0.134 19694
4000 1 9 . 1 1 56 56 TYR CB C 56 41.000 41.000 41.690 -0.690 19694
4001 1 9 . 1 1 56 56 TYR H H 56 8.450 8.450 8.766 -0.316 19694
4002 1 9 . 1 1 57 57 LYS N N 57 126.020 126.020 128.337 -2.317 19694
4003 1 9 . 1 1 57 57 LYS HA H 57 3.470 3.470 3.957 -0.487 19694
4004 1 9 . 1 1 57 57 LYS CA C 57 58.100 58.100 57.837 0.263 19694
4005 1 9 . 1 1 57 57 LYS CB C 57 29.480 29.480 31.350 -1.870 19694
4006 1 9 . 1 1 57 57 LYS H H 57 8.920 8.920 8.966 -0.046 19694
4007 1 9 . 1 1 58 58 ASP HA H 58 3.830 3.830 4.282 -0.452 19694
4008 1 9 . 1 1 58 58 ASP CA C 58 54.900 54.900 55.857 -0.957 19694
4009 1 9 . 1 1 58 58 ASP CB C 58 40.080 40.080 40.705 -0.625 19694
4010 1 9 . 1 1 58 58 ASP H H 58 8.400 8.400 8.562 -0.162 19694
4011 1 9 . 1 1 59 59 ARG N N 59 121.190 121.190 116.015 5.175 19694
4012 1 9 . 1 1 59 59 ARG HA H 59 4.250 4.250 4.570 -0.320 19694
4013 1 9 . 1 1 59 59 ARG CA C 59 55.580 55.580 54.058 1.522 19694
4014 1 9 . 1 1 59 59 ARG CB C 59 33.460 33.460 33.428 0.032 19694
4015 1 9 . 1 1 59 59 ARG H H 59 7.980 7.980 7.955 0.025 19694
4016 1 9 . 1 1 60 60 HIS N N 60 118.420 118.420 117.819 0.601 19694
4017 1 9 . 1 1 60 60 HIS HA H 60 5.270 5.270 5.665 -0.395 19694
4018 1 9 . 1 1 60 60 HIS CA C 60 55.010 55.010 55.351 -0.341 19694
4019 1 9 . 1 1 60 60 HIS CB C 60 32.380 32.380 33.253 -0.873 19694
4020 1 9 . 1 1 60 60 HIS H H 60 8.350 8.350 8.148 0.202 19694
4021 1 9 . 1 1 61 61 TRP N N 61 119.990 119.990 118.303 1.687 19694
4022 1 9 . 1 1 61 61 TRP HA H 61 5.930 5.930 4.796 1.134 19694
4023 1 9 . 1 1 61 61 TRP CA C 61 57.400 57.400 57.128 0.272 19694
4024 1 9 . 1 1 61 61 TRP CB C 61 35.380 35.380 34.203 1.177 19694
4025 1 9 . 1 1 61 61 TRP H H 61 9.310 9.310 9.293 0.017 19694
4026 1 9 . 1 1 62 62 HIS N N 62 117.270 117.270 120.659 -3.389 19694
4027 1 9 . 1 1 62 62 HIS HA H 62 4.600 4.600 4.897 -0.297 19694
4028 1 9 . 1 1 62 62 HIS CA C 62 59.210 59.210 57.365 1.845 19694
4029 1 9 . 1 1 62 62 HIS CB C 62 31.200 31.200 30.428 0.772 19694
4030 1 9 . 1 1 62 62 HIS H H 62 8.430 8.430 9.143 -0.713 19694
4031 1 9 . 1 1 63 63 GLU N N 63 124.640 124.640 127.890 -3.250 19694
4032 1 9 . 1 1 63 63 GLU HA H 63 3.827 3.827 4.028 -0.201 19694
4033 1 9 . 1 1 63 63 GLU CA C 63 61.020 61.020 59.426 1.594 19694
4034 1 9 . 1 1 63 63 GLU CB C 63 30.310 30.310 29.469 0.841 19694
4035 1 9 . 1 1 63 63 GLU H H 63 9.040 9.040 8.325 0.715 19694
4036 1 9 . 1 1 64 64 ALA N N 64 117.050 117.050 117.978 -0.928 19694
4037 1 9 . 1 1 64 64 ALA HA H 64 4.230 4.230 4.408 -0.178 19694
4038 1 9 . 1 1 64 64 ALA CA C 64 54.000 54.000 53.012 0.988 19694
4039 1 9 . 1 1 64 64 ALA CB C 64 18.880 18.880 19.006 -0.126 19694
4040 1 9 . 1 1 64 64 ALA H H 64 8.680 8.680 8.259 0.421 19694
4041 1 9 . 1 1 65 65 CYS N N 65 115.380 115.380 117.510 -2.130 19694
4042 1 9 . 1 1 65 65 CYS HA H 65 4.295 4.295 4.577 -0.282 19694
4043 1 9 . 1 1 65 65 CYS CA C 65 59.850 59.850 60.635 -0.784 19694
4044 1 9 . 1 1 65 65 CYS CB C 65 32.840 32.840 27.531 5.309 19694
4045 1 9 . 1 1 65 65 CYS H H 65 7.490 7.490 8.226 -0.736 19694
4046 1 9 . 1 1 66 66 PHE N N 66 122.020 122.020 122.900 -0.880 19694
4047 1 9 . 1 1 66 66 PHE HA H 66 3.890 3.890 3.835 0.055 19694
4048 1 9 . 1 1 66 66 PHE CA C 66 57.010 57.010 58.592 -1.582 19694
4049 1 9 . 1 1 66 66 PHE CB C 66 38.070 38.070 37.973 0.097 19694
4050 1 9 . 1 1 66 66 PHE H H 66 7.110 7.110 7.729 -0.619 19694
4051 1 9 . 1 1 67 67 HIS N N 67 121.280 121.280 121.059 0.221 19694
4052 1 9 . 1 1 67 67 HIS HA H 67 4.720 4.720 5.269 -0.549 19694
4053 1 9 . 1 1 67 67 HIS CA C 67 52.730 52.730 53.736 -1.006 19694
4054 1 9 . 1 1 67 67 HIS CB C 67 32.230 32.230 31.852 0.378 19694
4055 1 9 . 1 1 67 67 HIS H H 67 7.380 7.380 7.037 0.343 19694
4056 1 9 . 1 1 68 68 CYS N N 68 121.590 121.590 118.902 2.688 19694
4057 1 9 . 1 1 68 68 CYS HA H 68 3.960 3.960 4.957 -0.997 19694
4058 1 9 . 1 1 68 68 CYS CA C 68 59.790 59.790 58.089 1.701 19694
4059 1 9 . 1 1 68 68 CYS CB C 68 31.200 31.200 29.505 1.695 19694
4060 1 9 . 1 1 68 68 CYS H H 68 8.530 8.530 8.379 0.151 19694
4061 1 9 . 1 1 69 69 SER N N 69 126.530 126.530 119.633 6.897 19694
4062 1 9 . 1 1 69 69 SER HA H 69 4.310 4.310 4.286 0.024 19694
4063 1 9 . 1 1 69 69 SER CA C 69 61.760 61.760 61.082 0.678 19694
4064 1 9 . 1 1 69 69 SER CB C 69 64.040 64.040 63.459 0.581 19694
4065 1 9 . 1 1 69 69 SER H H 69 9.460 9.460 8.693 0.767 19694
4066 1 9 . 1 1 70 70 GLN N N 70 122.370 122.370 118.591 3.779 19694
4067 1 9 . 1 1 70 70 GLN HA H 70 4.510 4.510 4.396 0.114 19694
4068 1 9 . 1 1 70 70 GLN CA C 70 57.840 57.840 57.531 0.309 19694
4069 1 9 . 1 1 70 70 GLN CB C 70 30.430 30.430 29.390 1.040 19694
4070 1 9 . 1 1 70 70 GLN H H 70 8.980 8.980 7.978 1.002 19694
4071 1 9 . 1 1 71 71 CYS N N 71 118.860 118.860 115.620 3.240 19694
4072 1 9 . 1 1 71 71 CYS HA H 71 4.720 4.720 4.731 -0.011 19694
4073 1 9 . 1 1 71 71 CYS CA C 71 59.770 59.770 58.520 1.250 19694
4074 1 9 . 1 1 71 71 CYS CB C 71 31.910 31.910 28.331 3.579 19694
4075 1 9 . 1 1 71 71 CYS H H 71 8.220 8.220 7.736 0.484 19694
4076 1 9 . 1 1 72 72 ARG N N 72 114.380 114.380 115.297 -0.917 19694
4077 1 9 . 1 1 72 72 ARG HA H 72 3.965 3.965 3.954 0.011 19694
4078 1 9 . 1 1 72 72 ARG CA C 72 58.030 58.030 57.194 0.835 19694
4079 1 9 . 1 1 72 72 ARG CB C 72 27.720 27.720 27.113 0.607 19694
4080 1 9 . 1 1 72 72 ARG H H 72 7.380 7.380 7.852 -0.472 19694
4081 1 9 . 1 1 73 73 ASN N N 73 121.480 121.480 116.472 5.008 19694
4082 1 9 . 1 1 73 73 ASN HA H 73 4.630 4.630 4.674 -0.044 19694
4083 1 9 . 1 1 73 73 ASN CA C 73 54.110 54.110 53.885 0.225 19694
4084 1 9 . 1 1 73 73 ASN CB C 73 38.870 38.870 39.547 -0.677 19694
4085 1 9 . 1 1 73 73 ASN H H 73 8.722 8.722 8.133 0.589 19694
4086 1 9 . 1 1 74 74 SER N N 74 114.710 114.710 117.661 -2.951 19694
4087 1 9 . 1 1 74 74 SER HA H 74 4.060 4.060 4.881 -0.821 19694
4088 1 9 . 1 1 74 74 SER CA C 74 59.357 59.357 58.388 0.969 19694
4089 1 9 . 1 1 74 74 SER CB C 74 63.300 63.300 62.995 0.305 19694
4090 1 9 . 1 1 74 74 SER H H 74 8.690 8.690 8.496 0.194 19694
4091 1 9 . 1 1 75 75 LEU N N 75 125.757 125.757 127.759 -2.002 19694
4092 1 9 . 1 1 75 75 LEU HA H 75 4.280 4.280 4.273 0.007 19694
4093 1 9 . 1 1 75 75 LEU CA C 75 53.510 53.510 54.894 -1.384 19694
4094 1 9 . 1 1 75 75 LEU CB C 75 42.200 42.200 41.750 0.450 19694
4095 1 9 . 1 1 75 75 LEU H H 75 7.970 7.970 8.022 -0.052 19694
4096 1 9 . 1 1 76 76 VAL N N 76 120.860 120.860 124.451 -3.591 19694
4097 1 9 . 1 1 76 76 VAL HA H 76 3.570 3.570 3.812 -0.242 19694
4098 1 9 . 1 1 76 76 VAL CA C 76 65.420 65.420 60.991 4.429 19694
4099 1 9 . 1 1 76 76 VAL CB C 76 31.540 31.540 35.050 -3.510 19694
4100 1 9 . 1 1 76 76 VAL H H 76 7.830 7.830 8.001 -0.171 19694
4101 1 9 . 1 1 77 77 ASP N N 77 122.360 122.360 123.333 -0.973 19694
4102 1 9 . 1 1 77 77 ASP HA H 77 4.230 4.230 4.477 -0.247 19694
4103 1 9 . 1 1 77 77 ASP CA C 77 56.200 56.200 55.861 0.339 19694
4104 1 9 . 1 1 77 77 ASP CB C 77 39.380 39.380 40.994 -1.614 19694
4105 1 9 . 1 1 77 77 ASP H H 77 8.910 8.910 8.422 0.488 19694
4106 1 9 . 1 1 78 78 LYS N N 78 118.100 118.100 118.390 -0.290 19694
4107 1 9 . 1 1 78 78 LYS HA H 78 4.870 4.870 4.626 0.244 19694
4108 1 9 . 1 1 78 78 LYS CA C 78 56.960 56.960 53.660 3.300 19694
4109 1 9 . 1 1 78 78 LYS CB C 78 34.680 34.680 33.732 0.948 19694
4110 1 9 . 1 1 78 78 LYS H H 78 7.660 7.660 7.576 0.084 19694
4111 1 9 . 1 1 79 79 PRO HA H 79 4.460 4.460 4.212 0.248 19694
4112 1 9 . 1 1 79 79 PRO CA C 79 62.520 62.520 62.962 -0.442 19694
4113 1 9 . 1 1 79 79 PRO CB C 79 32.160 32.160 31.854 0.306 19694
4114 1 9 . 1 1 80 80 PHE N N 80 114.050 114.050 117.048 -2.998 19694
4115 1 9 . 1 1 80 80 PHE HA H 80 4.910 4.910 5.060 -0.150 19694
4116 1 9 . 1 1 80 80 PHE CA C 80 56.060 56.060 55.002 1.058 19694
4117 1 9 . 1 1 80 80 PHE CB C 80 42.410 42.410 41.966 0.444 19694
4118 1 9 . 1 1 80 80 PHE H H 80 7.510 7.510 7.154 0.356 19694
4119 1 9 . 1 1 81 81 ALA N N 81 123.290 123.290 123.828 -0.538 19694
4120 1 9 . 1 1 81 81 ALA HA H 81 4.310 4.310 4.354 -0.044 19694
4121 1 9 . 1 1 81 81 ALA CA C 81 50.450 50.450 50.364 0.086 19694
4122 1 9 . 1 1 81 81 ALA CB C 81 21.920 21.920 18.987 2.933 19694
4123 1 9 . 1 1 81 81 ALA H H 81 9.030 9.030 9.001 0.029 19694
4124 1 9 . 1 1 82 82 ALA N N 82 122.490 122.490 128.685 -6.195 19694
4125 1 9 . 1 1 82 82 ALA HA H 82 5.110 5.110 4.367 0.743 19694
4126 1 9 . 1 1 82 82 ALA CA C 82 51.100 51.100 51.904 -0.804 19694
4127 1 9 . 1 1 82 82 ALA CB C 82 21.130 21.130 18.837 2.292 19694
4128 1 9 . 1 1 82 82 ALA H H 82 8.240 8.240 8.587 -0.347 19694
4129 1 9 . 1 1 83 83 LYS N N 83 123.580 123.580 126.074 -2.494 19694
4130 1 9 . 1 1 83 83 LYS HA H 83 4.490 4.490 4.487 0.003 19694
4131 1 9 . 1 1 83 83 LYS CA C 83 55.800 55.800 55.396 0.404 19694
4132 1 9 . 1 1 83 83 LYS CB C 83 34.720 34.720 34.095 0.625 19694
4133 1 9 . 1 1 83 83 LYS H H 83 8.400 8.400 8.265 0.135 19694
4134 1 9 . 1 1 84 84 GLU N N 84 125.470 125.470 120.631 4.839 19694
4135 1 9 . 1 1 84 84 GLU HA H 84 3.820 3.820 4.113 -0.293 19694
4136 1 9 . 1 1 84 84 GLU CA C 84 58.620 58.620 59.017 -0.397 19694
4137 1 9 . 1 1 84 84 GLU CB C 84 27.210 27.210 29.724 -2.514 19694
4138 1 9 . 1 1 84 84 GLU H H 84 9.320 9.320 8.775 0.545 19694
4139 1 9 . 1 1 85 85 ASP N N 85 118.550 118.550 114.230 4.320 19694
4140 1 9 . 1 1 85 85 ASP HA H 85 4.600 4.600 4.779 -0.179 19694
4141 1 9 . 1 1 85 85 ASP CA C 85 55.400 55.400 53.895 1.505 19694
4142 1 9 . 1 1 85 85 ASP CB C 85 40.400 40.400 41.822 -1.422 19694
4143 1 9 . 1 1 85 85 ASP H H 85 8.730 8.730 8.260 0.470 19694
4144 1 9 . 1 1 86 86 GLN N N 86 119.050 119.050 116.705 2.345 19694
4145 1 9 . 1 1 86 86 GLN HA H 86 4.540 4.540 4.644 -0.104 19694
4146 1 9 . 1 1 86 86 GLN CA C 86 55.100 55.100 53.910 1.190 19694
4147 1 9 . 1 1 86 86 GLN CB C 86 31.110 31.110 31.980 -0.870 19694
4148 1 9 . 1 1 86 86 GLN H H 86 8.170 8.170 7.573 0.597 19694
4149 1 9 . 1 1 87 87 LEU N N 87 123.110 123.110 121.280 1.830 19694
4150 1 9 . 1 1 87 87 LEU HA H 87 4.620 4.620 5.157 -0.537 19694
4151 1 9 . 1 1 87 87 LEU CA C 87 54.520 54.520 53.964 0.556 19694
4152 1 9 . 1 1 87 87 LEU CB C 87 42.700 42.700 44.457 -1.757 19694
4153 1 9 . 1 1 87 87 LEU H H 87 8.490 8.490 8.470 0.020 19694
4154 1 9 . 1 1 88 88 LEU N N 88 123.690 123.690 120.151 3.539 19694
4155 1 9 . 1 1 88 88 LEU HA H 88 5.880 5.880 4.968 0.912 19694
4156 1 9 . 1 1 88 88 LEU CA C 88 53.340 53.340 52.781 0.560 19694
4157 1 9 . 1 1 88 88 LEU CB C 88 47.190 47.190 47.808 -0.618 19694
4158 1 9 . 1 1 88 88 LEU H H 88 8.930 8.930 8.402 0.528 19694
4159 1 9 . 1 1 89 89 CYS N N 89 122.270 122.270 119.152 3.118 19694
4160 1 9 . 1 1 89 89 CYS HA H 89 4.780 4.780 4.823 -0.043 19694
4161 1 9 . 1 1 89 89 CYS CA C 89 57.640 57.640 59.459 -1.819 19694
4162 1 9 . 1 1 89 89 CYS CB C 89 30.940 30.940 27.711 3.229 19694
4163 1 9 . 1 1 89 89 CYS H H 89 9.430 9.430 9.089 0.341 19694
4164 1 9 . 1 1 90 90 THR N N 90 110.620 110.620 117.547 -6.927 19694
4165 1 9 . 1 1 90 90 THR HA H 90 3.900 3.900 3.933 -0.033 19694
4166 1 9 . 1 1 90 90 THR CA C 90 65.460 65.460 65.818 -0.358 19694
4167 1 9 . 1 1 90 90 THR CB C 90 68.670 68.670 68.816 -0.146 19694
4168 1 9 . 1 1 90 90 THR H H 90 8.410 8.410 8.881 -0.471 19694
4169 1 9 . 1 1 91 91 ASP N N 91 123.470 123.470 120.997 2.473 19694
4170 1 9 . 1 1 91 91 ASP HA H 91 4.490 4.490 4.583 -0.093 19694
4171 1 9 . 1 1 91 91 ASP CA C 91 57.810 57.810 57.132 0.678 19694
4172 1 9 . 1 1 91 91 ASP CB C 91 41.160 41.160 40.408 0.752 19694
4173 1 9 . 1 1 91 91 ASP H H 91 8.150 8.150 8.356 -0.206 19694
4174 1 9 . 1 1 92 92 CYS N N 92 123.800 123.800 119.579 4.221 19694
4175 1 9 . 1 1 92 92 CYS HA H 92 3.970 3.970 4.235 -0.265 19694
4176 1 9 . 1 1 92 92 CYS CA C 92 64.100 64.100 61.429 2.671 19694
4177 1 9 . 1 1 92 92 CYS CB C 92 30.090 30.090 25.638 4.452 19694
4178 1 9 . 1 1 92 92 CYS H H 92 8.580 8.580 7.978 0.602 19694
4179 1 9 . 1 1 93 93 TYR N N 93 120.730 120.730 120.884 -0.154 19694
4180 1 9 . 1 1 93 93 TYR HA H 93 4.140 4.140 4.079 0.061 19694
4181 1 9 . 1 1 93 93 TYR CA C 93 60.380 60.380 61.236 -0.856 19694
4182 1 9 . 1 1 93 93 TYR CB C 93 39.300 39.300 38.297 1.003 19694
4183 1 9 . 1 1 93 93 TYR H H 93 8.540 8.540 9.115 -0.575 19694
4184 1 9 . 1 1 94 94 SER N N 94 115.010 115.010 112.769 2.241 19694
4185 1 9 . 1 1 94 94 SER HA H 94 4.220 4.220 4.237 -0.017 19694
4186 1 9 . 1 1 94 94 SER CA C 94 59.300 59.300 61.140 -1.840 19694
4187 1 9 . 1 1 94 94 SER CB C 94 63.660 63.660 62.661 0.999 19694
4188 1 9 . 1 1 94 94 SER H H 94 7.750 7.750 8.033 -0.283 19694
4189 1 9 . 1 1 95 95 ASN N N 95 119.820 119.820 120.321 -0.501 19694
4190 1 9 . 1 1 95 95 ASN HA H 95 4.510 4.510 4.617 -0.107 19694
4191 1 9 . 1 1 95 95 ASN CA C 95 53.880 53.880 55.538 -1.658 19694
4192 1 9 . 1 1 95 95 ASN CB C 95 39.300 39.300 38.580 0.720 19694
4193 1 9 . 1 1 95 95 ASN H H 95 7.780 7.780 7.988 -0.208 19694
4194 1 9 . 1 1 96 96 GLU N N 96 119.820 119.820 117.098 2.722 19694
4195 1 9 . 1 1 96 96 GLU HA H 96 4.096 4.096 4.254 -0.158 19694
4196 1 9 . 1 1 96 96 GLU CA C 96 56.910 56.910 56.855 0.055 19694
4197 1 9 . 1 1 96 96 GLU CB C 96 30.220 30.220 29.676 0.544 19694
4198 1 9 . 1 1 96 96 GLU H H 96 7.950 7.950 7.752 0.198 19694
4199 1 9 . 1 1 97 97 TYR N N 97 120.370 120.370 121.592 -1.222 19694
4200 1 9 . 1 1 97 97 TYR HA H 97 4.620 4.620 3.950 0.670 19694
4201 1 9 . 1 1 97 97 TYR CA C 97 57.700 57.700 60.250 -2.550 19694
4202 1 9 . 1 1 97 97 TYR CB C 97 38.710 38.710 38.344 0.366 19694
4203 1 9 . 1 1 97 97 TYR H H 97 8.070 8.070 8.501 -0.431 19694
4204 1 10 . 1 1 2 2 THR N N 2 113.570 113.570 115.565 -1.995 19694
4205 1 10 . 1 1 2 2 THR HA H 2 4.240 4.240 4.161 0.079 19694
4206 1 10 . 1 1 2 2 THR CA C 2 62.130 62.130 63.293 -1.163 19694
4207 1 10 . 1 1 2 2 THR CB C 2 69.250 69.250 68.870 0.380 19694
4208 1 10 . 1 1 2 2 THR H H 2 8.090 8.090 8.121 -0.031 19694
4209 1 10 . 1 1 3 3 GLU N N 3 122.880 122.880 120.437 2.443 19694
4210 1 10 . 1 1 3 3 GLU HA H 3 4.280 4.280 4.319 -0.039 19694
4211 1 10 . 1 1 3 3 GLU CA C 3 56.860 56.860 55.631 1.229 19694
4212 1 10 . 1 1 3 3 GLU CB C 3 30.570 30.570 30.361 0.209 19694
4213 1 10 . 1 1 3 3 GLU H H 3 8.280 8.280 8.070 0.210 19694
4214 1 10 . 1 1 4 4 ARG N N 4 121.330 121.330 119.544 1.786 19694
4215 1 10 . 1 1 4 4 ARG HA H 4 4.300 4.300 4.577 -0.277 19694
4216 1 10 . 1 1 4 4 ARG CA C 4 55.870 55.870 55.335 0.535 19694
4217 1 10 . 1 1 4 4 ARG CB C 4 31.640 31.640 30.976 0.664 19694
4218 1 10 . 1 1 4 4 ARG H H 4 8.280 8.280 8.483 -0.203 19694
4219 1 10 . 1 1 5 5 PHE N N 5 125.490 125.490 125.286 0.204 19694
4220 1 10 . 1 1 5 5 PHE HA H 5 4.610 4.610 4.559 0.051 19694
4221 1 10 . 1 1 5 5 PHE CA C 5 56.380 56.380 56.032 0.348 19694
4222 1 10 . 1 1 5 5 PHE CB C 5 39.560 39.560 39.581 -0.021 19694
4223 1 10 . 1 1 5 5 PHE H H 5 8.290 8.290 8.698 -0.408 19694
4224 1 10 . 1 1 6 6 ASP N N 6 123.260 123.260 119.595 3.665 19694
4225 1 10 . 1 1 6 6 ASP HA H 6 5.045 5.045 4.761 0.284 19694
4226 1 10 . 1 1 6 6 ASP CA C 6 52.180 52.180 51.808 0.372 19694
4227 1 10 . 1 1 6 6 ASP CB C 6 44.210 44.210 43.050 1.159 19694
4228 1 10 . 1 1 6 6 ASP H H 6 7.940 7.940 7.548 0.392 19694
4229 1 10 . 1 1 7 7 CYS N N 7 121.440 121.440 121.788 -0.348 19694
4230 1 10 . 1 1 7 7 CYS HA H 7 3.960 3.960 4.463 -0.503 19694
4231 1 10 . 1 1 7 7 CYS CA C 7 59.820 59.820 59.607 0.213 19694
4232 1 10 . 1 1 7 7 CYS CB C 7 30.950 30.950 25.952 4.998 19694
4233 1 10 . 1 1 7 7 CYS H H 7 8.700 8.700 8.543 0.157 19694
4234 1 10 . 1 1 8 8 HIS N N 8 129.390 129.390 128.927 0.463 19694
4235 1 10 . 1 1 8 8 HIS HA H 8 4.200 4.200 4.290 -0.090 19694
4236 1 10 . 1 1 8 8 HIS CA C 8 58.240 58.240 59.527 -1.287 19694
4237 1 10 . 1 1 8 8 HIS CB C 8 29.480 29.480 30.006 -0.527 19694
4238 1 10 . 1 1 8 8 HIS H H 8 9.160 9.160 9.527 -0.367 19694
4239 1 10 . 1 1 9 9 HIS N N 9 118.740 118.740 116.700 2.040 19694
4240 1 10 . 1 1 9 9 HIS HA H 9 4.880 4.880 4.477 0.403 19694
4241 1 10 . 1 1 9 9 HIS CA C 9 58.680 58.680 56.967 1.713 19694
4242 1 10 . 1 1 9 9 HIS CB C 9 31.040 31.040 30.250 0.790 19694
4243 1 10 . 1 1 9 9 HIS H H 9 9.270 9.270 7.983 1.287 19694
4244 1 10 . 1 1 10 10 CYS N N 10 118.600 118.600 117.608 0.992 19694
4245 1 10 . 1 1 10 10 CYS HA H 10 4.600 4.600 4.415 0.185 19694
4246 1 10 . 1 1 10 10 CYS CA C 10 59.600 59.600 59.236 0.364 19694
4247 1 10 . 1 1 10 10 CYS CB C 10 32.330 32.330 27.958 4.372 19694
4248 1 10 . 1 1 10 10 CYS H H 10 8.550 8.550 7.870 0.680 19694
4249 1 10 . 1 1 11 11 ASN N N 11 116.220 116.220 117.102 -0.882 19694
4250 1 10 . 1 1 11 11 ASN HA H 11 4.410 4.410 4.370 0.040 19694
4251 1 10 . 1 1 11 11 ASN CA C 11 55.640 55.640 54.475 1.165 19694
4252 1 10 . 1 1 11 11 ASN CB C 11 38.200 38.200 36.480 1.720 19694
4253 1 10 . 1 1 11 11 ASN H H 11 7.690 7.690 8.761 -1.071 19694
4254 1 10 . 1 1 12 12 GLU N N 12 120.330 120.330 117.630 2.700 19694
4255 1 10 . 1 1 12 12 GLU HA H 12 4.220 4.220 4.521 -0.301 19694
4256 1 10 . 1 1 12 12 GLU CA C 12 56.700 56.700 54.750 1.950 19694
4257 1 10 . 1 1 12 12 GLU CB C 12 30.910 30.910 31.262 -0.351 19694
4258 1 10 . 1 1 12 12 GLU H H 12 8.210 8.210 7.679 0.531 19694
4259 1 10 . 1 1 13 13 SER N N 13 116.190 116.190 119.555 -3.365 19694
4260 1 10 . 1 1 13 13 SER HA H 13 4.060 4.060 4.384 -0.324 19694
4261 1 10 . 1 1 13 13 SER CA C 13 59.350 59.350 58.991 0.359 19694
4262 1 10 . 1 1 13 13 SER CB C 13 63.820 63.820 63.630 0.190 19694
4263 1 10 . 1 1 13 13 SER H H 13 8.520 8.520 8.650 -0.130 19694
4264 1 10 . 1 1 14 14 LEU N N 14 126.060 126.060 124.878 1.182 19694
4265 1 10 . 1 1 14 14 LEU HA H 14 4.310 4.310 4.361 -0.051 19694
4266 1 10 . 1 1 14 14 LEU CA C 14 54.100 54.100 55.812 -1.712 19694
4267 1 10 . 1 1 14 14 LEU CB C 14 42.200 42.200 41.535 0.665 19694
4268 1 10 . 1 1 14 14 LEU H H 14 8.910 8.910 7.763 1.147 19694
4269 1 10 . 1 1 15 15 PHE N N 15 120.660 120.660 120.948 -0.288 19694
4270 1 10 . 1 1 15 15 PHE HA H 15 4.480 4.480 4.611 -0.131 19694
4271 1 10 . 1 1 15 15 PHE CA C 15 60.400 60.400 56.035 4.365 19694
4272 1 10 . 1 1 15 15 PHE CB C 15 38.130 38.130 37.938 0.193 19694
4273 1 10 . 1 1 15 15 PHE H H 15 7.820 7.820 8.492 -0.672 19694
4274 1 10 . 1 1 16 16 GLY N N 16 114.730 114.730 110.954 3.776 19694
4275 1 10 . 1 1 16 16 GLY CA C 16 45.900 45.900 45.807 0.093 19694
4276 1 10 . 1 1 16 16 GLY H H 16 8.860 8.860 8.807 0.053 19694
4277 1 10 . 1 1 17 17 LYS N N 17 119.580 119.580 120.206 -0.626 19694
4278 1 10 . 1 1 17 17 LYS HA H 17 4.480 4.480 4.518 -0.038 19694
4279 1 10 . 1 1 17 17 LYS CA C 17 54.460 54.460 54.443 0.017 19694
4280 1 10 . 1 1 17 17 LYS CB C 17 35.800 35.800 34.319 1.481 19694
4281 1 10 . 1 1 17 17 LYS H H 17 8.030 8.030 7.226 0.804 19694
4282 1 10 . 1 1 18 18 LYS N N 18 120.330 120.330 122.257 -1.927 19694
4283 1 10 . 1 1 18 18 LYS HA H 18 4.280 4.280 4.316 -0.036 19694
4284 1 10 . 1 1 18 18 LYS CA C 18 56.800 56.800 57.472 -0.672 19694
4285 1 10 . 1 1 18 18 LYS CB C 18 33.010 33.010 32.788 0.222 19694
4286 1 10 . 1 1 18 18 LYS H H 18 8.190 8.190 8.464 -0.274 19694
4287 1 10 . 1 1 19 19 TYR N N 19 117.500 117.500 115.247 2.253 19694
4288 1 10 . 1 1 19 19 TYR HA H 19 5.240 5.240 4.840 0.401 19694
4289 1 10 . 1 1 19 19 TYR CA C 19 55.340 55.340 56.288 -0.948 19694
4290 1 10 . 1 1 19 19 TYR CB C 19 42.850 42.850 40.334 2.516 19694
4291 1 10 . 1 1 19 19 TYR H H 19 7.610 7.610 7.883 -0.273 19694
4292 1 10 . 1 1 20 20 ILE N N 20 121.430 121.430 121.761 -0.331 19694
4293 1 10 . 1 1 20 20 ILE HA H 20 4.137 4.137 4.253 -0.116 19694
4294 1 10 . 1 1 20 20 ILE CA C 20 60.010 60.010 60.114 -0.104 19694
4295 1 10 . 1 1 20 20 ILE CB C 20 41.570 41.570 40.681 0.888 19694
4296 1 10 . 1 1 20 20 ILE H H 20 9.350 9.350 8.215 1.135 19694
4297 1 10 . 1 1 21 21 LEU N N 21 126.720 126.720 126.015 0.705 19694
4298 1 10 . 1 1 21 21 LEU HA H 21 5.090 5.090 4.768 0.322 19694
4299 1 10 . 1 1 21 21 LEU CA C 21 54.020 54.020 53.931 0.089 19694
4300 1 10 . 1 1 21 21 LEU CB C 21 43.720 43.720 40.833 2.887 19694
4301 1 10 . 1 1 21 21 LEU H H 21 8.530 8.530 8.505 0.025 19694
4302 1 10 . 1 1 22 22 ARG N N 22 123.930 123.930 125.437 -1.507 19694
4303 1 10 . 1 1 22 22 ARG HA H 22 4.440 4.440 4.517 -0.077 19694
4304 1 10 . 1 1 22 22 ARG CA C 22 55.600 55.600 54.054 1.546 19694
4305 1 10 . 1 1 22 22 ARG CB C 22 32.280 32.280 32.422 -0.142 19694
4306 1 10 . 1 1 22 22 ARG H H 22 9.080 9.080 8.916 0.164 19694
4307 1 10 . 1 1 23 23 GLU N N 23 128.500 128.500 124.883 3.617 19694
4308 1 10 . 1 1 23 23 GLU HA H 23 3.840 3.840 3.951 -0.111 19694
4309 1 10 . 1 1 23 23 GLU CA C 23 58.030 58.030 57.712 0.318 19694
4310 1 10 . 1 1 23 23 GLU CB C 23 27.200 27.200 27.848 -0.648 19694
4311 1 10 . 1 1 23 23 GLU H H 23 9.610 9.610 9.014 0.596 19694
4312 1 10 . 1 1 24 24 GLU N N 24 110.300 110.300 113.316 -3.016 19694
4313 1 10 . 1 1 24 24 GLU HA H 24 3.780 3.780 3.935 -0.155 19694
4314 1 10 . 1 1 24 24 GLU CA C 24 58.320 58.320 57.240 1.080 19694
4315 1 10 . 1 1 24 24 GLU CB C 24 28.220 28.220 28.188 0.032 19694
4316 1 10 . 1 1 24 24 GLU H H 24 8.660 8.660 8.666 -0.006 19694
4317 1 10 . 1 1 25 25 SER N N 25 117.700 117.700 113.113 4.587 19694
4318 1 10 . 1 1 25 25 SER HA H 25 4.890 4.890 4.774 0.116 19694
4319 1 10 . 1 1 25 25 SER CA C 25 56.540 56.540 55.461 1.079 19694
4320 1 10 . 1 1 25 25 SER CB C 25 64.720 64.720 65.092 -0.372 19694
4321 1 10 . 1 1 25 25 SER H H 25 7.900 7.900 7.736 0.164 19694
4322 1 10 . 1 1 26 26 PRO HA H 26 4.995 4.995 4.856 0.139 19694
4323 1 10 . 1 1 26 26 PRO CA C 26 61.750 61.750 63.026 -1.276 19694
4324 1 10 . 1 1 26 26 PRO CB C 26 32.660 32.660 31.686 0.974 19694
4325 1 10 . 1 1 27 27 TYR N N 27 118.100 118.100 123.677 -5.577 19694
4326 1 10 . 1 1 27 27 TYR HA H 27 5.910 5.910 4.980 0.930 19694
4327 1 10 . 1 1 27 27 TYR CA C 27 56.830 56.830 54.889 1.941 19694
4328 1 10 . 1 1 27 27 TYR CB C 27 42.810 42.810 42.521 0.289 19694
4329 1 10 . 1 1 27 27 TYR H H 27 9.040 9.040 8.751 0.289 19694
4330 1 10 . 1 1 28 28 CYS N N 28 122.230 122.230 118.907 3.323 19694
4331 1 10 . 1 1 28 28 CYS HA H 28 4.850 4.850 4.677 0.173 19694
4332 1 10 . 1 1 28 28 CYS CA C 28 58.110 58.110 58.405 -0.295 19694
4333 1 10 . 1 1 28 28 CYS CB C 28 30.530 30.530 29.116 1.413 19694
4334 1 10 . 1 1 28 28 CYS H H 28 9.850 9.850 8.303 1.547 19694
4335 1 10 . 1 1 29 29 VAL N N 29 118.200 118.200 123.287 -5.087 19694
4336 1 10 . 1 1 29 29 VAL HA H 29 3.650 3.650 3.671 -0.021 19694
4337 1 10 . 1 1 29 29 VAL CA C 29 67.400 67.400 67.399 0.001 19694
4338 1 10 . 1 1 29 29 VAL CB C 29 31.860 31.860 31.282 0.578 19694
4339 1 10 . 1 1 29 29 VAL H H 29 8.430 8.430 9.026 -0.596 19694
4340 1 10 . 1 1 30 30 VAL N N 30 119.570 119.570 118.556 1.014 19694
4341 1 10 . 1 1 30 30 VAL HA H 30 3.860 3.860 3.482 0.378 19694
4342 1 10 . 1 1 30 30 VAL CA C 30 66.450 66.450 67.229 -0.779 19694
4343 1 10 . 1 1 30 30 VAL CB C 30 31.540 31.540 30.912 0.628 19694
4344 1 10 . 1 1 30 30 VAL H H 30 7.700 7.700 8.108 -0.408 19694
4345 1 10 . 1 1 31 31 CYS N N 31 125.890 125.890 119.319 6.571 19694
4346 1 10 . 1 1 31 31 CYS HA H 31 3.830 3.830 3.883 -0.053 19694
4347 1 10 . 1 1 31 31 CYS CA C 31 65.850 65.850 64.346 1.504 19694
4348 1 10 . 1 1 31 31 CYS CB C 31 29.510 29.510 25.566 3.944 19694
4349 1 10 . 1 1 31 31 CYS H H 31 9.050 9.050 7.592 1.458 19694
4350 1 10 . 1 1 32 32 PHE N N 32 119.000 119.000 119.277 -0.277 19694
4351 1 10 . 1 1 32 32 PHE HA H 32 3.780 3.780 3.688 0.092 19694
4352 1 10 . 1 1 32 32 PHE CA C 32 62.610 62.610 61.787 0.823 19694
4353 1 10 . 1 1 32 32 PHE CB C 32 39.920 39.920 39.030 0.890 19694
4354 1 10 . 1 1 32 32 PHE H H 32 9.080 9.080 7.858 1.222 19694
4355 1 10 . 1 1 33 33 GLU N N 33 117.470 117.470 117.659 -0.189 19694
4356 1 10 . 1 1 33 33 GLU HA H 33 3.760 3.760 4.050 -0.290 19694
4357 1 10 . 1 1 33 33 GLU CA C 33 59.210 59.210 59.461 -0.251 19694
4358 1 10 . 1 1 33 33 GLU CB C 33 29.480 29.480 29.182 0.298 19694
4359 1 10 . 1 1 33 33 GLU H H 33 8.510 8.510 8.079 0.431 19694
4360 1 10 . 1 1 34 34 THR N N 34 114.140 114.140 115.362 -1.222 19694
4361 1 10 . 1 1 34 34 THR HA H 34 3.730 3.730 3.970 -0.240 19694
4362 1 10 . 1 1 34 34 THR CA C 34 65.890 65.890 65.530 0.360 19694
4363 1 10 . 1 1 34 34 THR CB C 34 69.210 69.210 68.606 0.604 19694
4364 1 10 . 1 1 34 34 THR H H 34 7.880 7.880 8.317 -0.437 19694
4365 1 10 . 1 1 35 35 LEU N N 35 117.980 117.980 118.798 -0.818 19694
4366 1 10 . 1 1 35 35 LEU HA H 35 3.650 3.650 3.925 -0.275 19694
4367 1 10 . 1 1 35 35 LEU CA C 35 56.860 56.860 57.239 -0.379 19694
4368 1 10 . 1 1 35 35 LEU CB C 35 41.870 41.870 41.760 0.111 19694
4369 1 10 . 1 1 35 35 LEU H H 35 7.660 7.660 7.774 -0.114 19694
4370 1 10 . 1 1 36 36 PHE N N 36 113.900 113.900 113.997 -0.097 19694
4371 1 10 . 1 1 36 36 PHE HA H 36 4.597 4.597 4.423 0.174 19694
4372 1 10 . 1 1 36 36 PHE CA C 36 56.860 56.860 56.383 0.477 19694
4373 1 10 . 1 1 36 36 PHE CB C 36 40.570 40.570 38.250 2.320 19694
4374 1 10 . 1 1 36 36 PHE H H 36 7.730 7.730 6.665 1.065 19694
4375 1 10 . 1 1 37 37 ALA N N 37 121.920 121.920 122.983 -1.063 19694
4376 1 10 . 1 1 37 37 ALA HA H 37 4.070 4.070 4.067 0.003 19694
4377 1 10 . 1 1 37 37 ALA CA C 37 52.900 52.900 52.247 0.653 19694
4378 1 10 . 1 1 37 37 ALA CB C 37 19.770 19.770 19.822 -0.052 19694
4379 1 10 . 1 1 37 37 ALA H H 37 7.090 7.090 7.808 -0.718 19694
4380 1 10 . 1 1 38 38 ASN N N 38 119.230 119.230 118.837 0.393 19694
4381 1 10 . 1 1 38 38 ASN HA H 38 4.450 4.450 4.649 -0.199 19694
4382 1 10 . 1 1 38 38 ASN CA C 38 52.850 52.850 52.507 0.343 19694
4383 1 10 . 1 1 38 38 ASN CB C 38 38.950 38.950 40.179 -1.229 19694
4384 1 10 . 1 1 38 38 ASN H H 38 8.790 8.790 8.310 0.480 19694
4385 1 10 . 1 1 39 39 THR N N 39 116.330 116.330 115.748 0.582 19694
4386 1 10 . 1 1 39 39 THR HA H 39 3.990 3.990 4.317 -0.327 19694
4387 1 10 . 1 1 39 39 THR CA C 39 62.130 62.130 62.928 -0.798 19694
4388 1 10 . 1 1 39 39 THR CB C 39 69.920 69.920 69.570 0.350 19694
4389 1 10 . 1 1 39 39 THR H H 39 8.540 8.540 8.219 0.321 19694
4390 1 10 . 1 1 40 40 CYS N N 40 126.950 126.950 128.202 -1.252 19694
4391 1 10 . 1 1 40 40 CYS HA H 40 4.300 4.300 4.483 -0.183 19694
4392 1 10 . 1 1 40 40 CYS CA C 40 58.350 58.350 56.936 1.414 19694
4393 1 10 . 1 1 40 40 CYS CB C 40 31.600 31.600 26.630 4.970 19694
4394 1 10 . 1 1 40 40 CYS H H 40 7.940 7.940 8.441 -0.501 19694
4395 1 10 . 1 1 41 41 GLU N N 41 130.560 130.560 127.525 3.035 19694
4396 1 10 . 1 1 41 41 GLU HA H 41 3.690 3.690 3.826 -0.136 19694
4397 1 10 . 1 1 41 41 GLU CA C 41 58.600 58.600 59.116 -0.516 19694
4398 1 10 . 1 1 41 41 GLU CB C 41 30.460 30.460 29.393 1.067 19694
4399 1 10 . 1 1 41 41 GLU H H 41 8.810 8.810 8.641 0.169 19694
4400 1 10 . 1 1 42 42 GLU N N 42 119.680 119.680 118.344 1.336 19694
4401 1 10 . 1 1 42 42 GLU HA H 42 4.570 4.570 4.340 0.230 19694
4402 1 10 . 1 1 42 42 GLU CA C 42 58.000 58.000 57.978 0.022 19694
4403 1 10 . 1 1 42 42 GLU CB C 42 31.680 31.680 30.611 1.069 19694
4404 1 10 . 1 1 42 42 GLU H H 42 8.500 8.500 8.068 0.432 19694
4405 1 10 . 1 1 43 43 CYS N N 43 115.600 115.600 116.757 -1.157 19694
4406 1 10 . 1 1 43 43 CYS HA H 43 5.010 5.010 4.456 0.554 19694
4407 1 10 . 1 1 43 43 CYS CA C 43 58.810 58.810 59.899 -1.089 19694
4408 1 10 . 1 1 43 43 CYS CB C 43 31.580 31.580 28.433 3.147 19694
4409 1 10 . 1 1 43 43 CYS H H 43 8.120 8.120 8.083 0.037 19694
4410 1 10 . 1 1 44 44 GLY N N 44 112.100 112.100 106.978 5.122 19694
4411 1 10 . 1 1 44 44 GLY CA C 44 46.420 46.420 45.250 1.170 19694
4412 1 10 . 1 1 44 44 GLY H H 44 7.900 7.900 8.558 -0.658 19694
4413 1 10 . 1 1 45 45 LYS N N 45 121.210 121.210 121.777 -0.567 19694
4414 1 10 . 1 1 45 45 LYS HA H 45 4.840 4.840 4.676 0.164 19694
4415 1 10 . 1 1 45 45 LYS CA C 45 54.360 54.360 52.722 1.638 19694
4416 1 10 . 1 1 45 45 LYS CB C 45 32.430 32.430 32.938 -0.508 19694
4417 1 10 . 1 1 45 45 LYS H H 45 8.180 8.180 7.835 0.345 19694
4418 1 10 . 1 1 46 46 PRO HA H 46 4.477 4.477 4.511 -0.034 19694
4419 1 10 . 1 1 46 46 PRO CA C 46 62.700 62.700 63.043 -0.343 19694
4420 1 10 . 1 1 46 46 PRO CB C 46 32.490 32.490 32.048 0.442 19694
4421 1 10 . 1 1 47 47 ILE N N 47 125.280 125.280 123.127 2.153 19694
4422 1 10 . 1 1 47 47 ILE HA H 47 3.830 3.830 4.275 -0.445 19694
4423 1 10 . 1 1 47 47 ILE CA C 47 61.040 61.040 60.707 0.333 19694
4424 1 10 . 1 1 47 47 ILE CB C 47 37.440 37.440 37.663 -0.223 19694
4425 1 10 . 1 1 47 47 ILE H H 47 8.540 8.540 8.911 -0.371 19694
4426 1 10 . 1 1 48 48 GLY N N 48 114.120 114.120 113.742 0.378 19694
4427 1 10 . 1 1 48 48 GLY CA C 48 45.240 45.240 44.746 0.494 19694
4428 1 10 . 1 1 48 48 GLY H H 48 8.660 8.660 8.491 0.169 19694
4429 1 10 . 1 1 49 49 CYS N N 49 117.140 117.140 119.892 -2.752 19694
4430 1 10 . 1 1 49 49 CYS HA H 49 4.280 4.280 4.350 -0.070 19694
4431 1 10 . 1 1 49 49 CYS CA C 49 60.880 60.880 58.709 2.171 19694
4432 1 10 . 1 1 49 49 CYS CB C 49 27.650 27.650 28.096 -0.446 19694
4433 1 10 . 1 1 49 49 CYS H H 49 9.210 9.210 9.214 -0.004 19694
4434 1 10 . 1 1 50 50 ASP N N 50 119.300 119.300 119.858 -0.558 19694
4435 1 10 . 1 1 50 50 ASP HA H 50 4.620 4.620 4.548 0.072 19694
4436 1 10 . 1 1 50 50 ASP CA C 50 54.160 54.160 54.698 -0.538 19694
4437 1 10 . 1 1 50 50 ASP CB C 50 40.380 40.380 39.989 0.391 19694
4438 1 10 . 1 1 50 50 ASP H H 50 8.800 8.800 8.314 0.486 19694
4439 1 10 . 1 1 51 51 CYS N N 51 118.150 118.150 117.570 0.580 19694
4440 1 10 . 1 1 51 51 CYS HA H 51 4.620 4.620 4.627 -0.007 19694
4441 1 10 . 1 1 51 51 CYS CA C 51 58.030 58.030 57.405 0.625 19694
4442 1 10 . 1 1 51 51 CYS CB C 51 30.090 30.090 31.900 -1.810 19694
4443 1 10 . 1 1 51 51 CYS H H 51 7.590 7.590 7.429 0.161 19694
4444 1 10 . 1 1 52 52 LYS N N 52 123.800 123.800 122.073 1.727 19694
4445 1 10 . 1 1 52 52 LYS HA H 52 4.180 4.180 4.408 -0.228 19694
4446 1 10 . 1 1 52 52 LYS CA C 52 57.240 57.240 56.182 1.058 19694
4447 1 10 . 1 1 52 52 LYS CB C 52 33.030 33.030 31.858 1.172 19694
4448 1 10 . 1 1 52 52 LYS H H 52 8.600 8.600 8.502 0.098 19694
4449 1 10 . 1 1 53 53 ASP N N 53 124.900 124.900 123.961 0.939 19694
4450 1 10 . 1 1 53 53 ASP HA H 53 4.230 4.230 4.747 -0.517 19694
4451 1 10 . 1 1 53 53 ASP CA C 53 53.130 53.130 52.651 0.479 19694
4452 1 10 . 1 1 53 53 ASP CB C 53 42.230 42.230 40.676 1.554 19694
4453 1 10 . 1 1 53 53 ASP H H 53 8.250 8.250 8.461 -0.211 19694
4454 1 10 . 1 1 54 54 LEU N N 54 130.160 130.160 125.574 4.586 19694
4455 1 10 . 1 1 54 54 LEU HA H 54 4.440 4.440 4.566 -0.126 19694
4456 1 10 . 1 1 54 54 LEU CA C 54 53.340 53.340 55.303 -1.963 19694
4457 1 10 . 1 1 54 54 LEU CB C 54 41.170 41.170 42.863 -1.693 19694
4458 1 10 . 1 1 54 54 LEU H H 54 8.670 8.670 8.928 -0.258 19694
4459 1 10 . 1 1 55 55 SER N N 55 113.820 113.820 119.877 -6.057 19694
4460 1 10 . 1 1 55 55 SER HA H 55 5.580 5.580 5.175 0.405 19694
4461 1 10 . 1 1 55 55 SER CA C 55 55.850 55.850 56.511 -0.661 19694
4462 1 10 . 1 1 55 55 SER CB C 55 67.300 67.300 64.689 2.611 19694
4463 1 10 . 1 1 55 55 SER H H 55 8.160 8.160 8.486 -0.326 19694
4464 1 10 . 1 1 56 56 TYR N N 56 122.610 122.610 126.725 -4.115 19694
4465 1 10 . 1 1 56 56 TYR HA H 56 4.620 4.620 4.724 -0.104 19694
4466 1 10 . 1 1 56 56 TYR CA C 56 58.810 58.810 58.657 0.152 19694
4467 1 10 . 1 1 56 56 TYR CB C 56 41.000 41.000 42.176 -1.176 19694
4468 1 10 . 1 1 56 56 TYR H H 56 8.450 8.450 8.957 -0.507 19694
4469 1 10 . 1 1 57 57 LYS N N 57 126.020 126.020 127.866 -1.846 19694
4470 1 10 . 1 1 57 57 LYS HA H 57 3.470 3.470 3.976 -0.506 19694
4471 1 10 . 1 1 57 57 LYS CA C 57 58.100 58.100 57.434 0.665 19694
4472 1 10 . 1 1 57 57 LYS CB C 57 29.480 29.480 31.895 -2.415 19694
4473 1 10 . 1 1 57 57 LYS H H 57 8.920 8.920 8.597 0.323 19694
4474 1 10 . 1 1 58 58 ASP HA H 58 3.830 3.830 4.300 -0.470 19694
4475 1 10 . 1 1 58 58 ASP CA C 58 54.900 54.900 55.553 -0.653 19694
4476 1 10 . 1 1 58 58 ASP CB C 58 40.080 40.080 40.651 -0.571 19694
4477 1 10 . 1 1 58 58 ASP H H 58 8.400 8.400 8.485 -0.085 19694
4478 1 10 . 1 1 59 59 ARG N N 59 121.190 121.190 116.576 4.614 19694
4479 1 10 . 1 1 59 59 ARG HA H 59 4.250 4.250 4.404 -0.154 19694
4480 1 10 . 1 1 59 59 ARG CA C 59 55.580 55.580 54.170 1.409 19694
4481 1 10 . 1 1 59 59 ARG CB C 59 33.460 33.460 33.764 -0.304 19694
4482 1 10 . 1 1 59 59 ARG H H 59 7.980 7.980 7.884 0.096 19694
4483 1 10 . 1 1 60 60 HIS N N 60 118.420 118.420 117.679 0.741 19694
4484 1 10 . 1 1 60 60 HIS HA H 60 5.270 5.270 5.634 -0.364 19694
4485 1 10 . 1 1 60 60 HIS CA C 60 55.010 55.010 55.220 -0.210 19694
4486 1 10 . 1 1 60 60 HIS CB C 60 32.380 32.380 33.303 -0.923 19694
4487 1 10 . 1 1 60 60 HIS H H 60 8.350 8.350 8.214 0.136 19694
4488 1 10 . 1 1 61 61 TRP N N 61 119.990 119.990 118.269 1.721 19694
4489 1 10 . 1 1 61 61 TRP HA H 61 5.930 5.930 4.781 1.149 19694
4490 1 10 . 1 1 61 61 TRP CA C 61 57.400 57.400 57.118 0.282 19694
4491 1 10 . 1 1 61 61 TRP CB C 61 35.380 35.380 34.193 1.187 19694
4492 1 10 . 1 1 61 61 TRP H H 61 9.310 9.310 9.271 0.039 19694
4493 1 10 . 1 1 62 62 HIS N N 62 117.270 117.270 121.180 -3.910 19694
4494 1 10 . 1 1 62 62 HIS HA H 62 4.600 4.600 4.887 -0.287 19694
4495 1 10 . 1 1 62 62 HIS CA C 62 59.210 59.210 57.142 2.068 19694
4496 1 10 . 1 1 62 62 HIS CB C 62 31.200 31.200 30.311 0.889 19694
4497 1 10 . 1 1 62 62 HIS H H 62 8.430 8.430 9.146 -0.716 19694
4498 1 10 . 1 1 63 63 GLU N N 63 124.640 124.640 128.293 -3.653 19694
4499 1 10 . 1 1 63 63 GLU HA H 63 3.827 3.827 3.925 -0.098 19694
4500 1 10 . 1 1 63 63 GLU CA C 63 61.020 61.020 60.147 0.874 19694
4501 1 10 . 1 1 63 63 GLU CB C 63 30.310 30.310 29.620 0.689 19694
4502 1 10 . 1 1 63 63 GLU H H 63 9.040 9.040 8.279 0.761 19694
4503 1 10 . 1 1 64 64 ALA N N 64 117.050 117.050 117.858 -0.808 19694
4504 1 10 . 1 1 64 64 ALA HA H 64 4.230 4.230 4.377 -0.147 19694
4505 1 10 . 1 1 64 64 ALA CA C 64 54.000 54.000 52.917 1.083 19694
4506 1 10 . 1 1 64 64 ALA CB C 64 18.880 18.880 18.778 0.102 19694
4507 1 10 . 1 1 64 64 ALA H H 64 8.680 8.680 8.282 0.398 19694
4508 1 10 . 1 1 65 65 CYS N N 65 115.380 115.380 117.096 -1.716 19694
4509 1 10 . 1 1 65 65 CYS HA H 65 4.295 4.295 4.130 0.165 19694
4510 1 10 . 1 1 65 65 CYS CA C 65 59.850 59.850 60.310 -0.461 19694
4511 1 10 . 1 1 65 65 CYS CB C 65 32.840 32.840 26.949 5.891 19694
4512 1 10 . 1 1 65 65 CYS H H 65 7.490 7.490 8.128 -0.638 19694
4513 1 10 . 1 1 66 66 PHE N N 66 122.020 122.020 123.049 -1.029 19694
4514 1 10 . 1 1 66 66 PHE HA H 66 3.890 3.890 3.809 0.081 19694
4515 1 10 . 1 1 66 66 PHE CA C 66 57.010 57.010 58.432 -1.422 19694
4516 1 10 . 1 1 66 66 PHE CB C 66 38.070 38.070 38.173 -0.103 19694
4517 1 10 . 1 1 66 66 PHE H H 66 7.110 7.110 7.566 -0.456 19694
4518 1 10 . 1 1 67 67 HIS N N 67 121.280 121.280 121.843 -0.563 19694
4519 1 10 . 1 1 67 67 HIS HA H 67 4.720 4.720 5.287 -0.567 19694
4520 1 10 . 1 1 67 67 HIS CA C 67 52.730 52.730 52.882 -0.152 19694
4521 1 10 . 1 1 67 67 HIS CB C 67 32.230 32.230 30.863 1.367 19694
4522 1 10 . 1 1 67 67 HIS H H 67 7.380 7.380 7.569 -0.189 19694
4523 1 10 . 1 1 68 68 CYS N N 68 121.590 121.590 118.858 2.732 19694
4524 1 10 . 1 1 68 68 CYS HA H 68 3.960 3.960 4.984 -1.024 19694
4525 1 10 . 1 1 68 68 CYS CA C 68 59.790 59.790 57.877 1.913 19694
4526 1 10 . 1 1 68 68 CYS CB C 68 31.200 31.200 29.628 1.572 19694
4527 1 10 . 1 1 68 68 CYS H H 68 8.530 8.530 8.277 0.253 19694
4528 1 10 . 1 1 69 69 SER N N 69 126.530 126.530 120.766 5.764 19694
4529 1 10 . 1 1 69 69 SER HA H 69 4.310 4.310 4.121 0.189 19694
4530 1 10 . 1 1 69 69 SER CA C 69 61.760 61.760 60.958 0.802 19694
4531 1 10 . 1 1 69 69 SER CB C 69 64.040 64.040 63.144 0.896 19694
4532 1 10 . 1 1 69 69 SER H H 69 9.460 9.460 8.833 0.627 19694
4533 1 10 . 1 1 70 70 GLN N N 70 122.370 122.370 119.178 3.192 19694
4534 1 10 . 1 1 70 70 GLN HA H 70 4.510 4.510 4.345 0.165 19694
4535 1 10 . 1 1 70 70 GLN CA C 70 57.840 57.840 57.239 0.601 19694
4536 1 10 . 1 1 70 70 GLN CB C 70 30.430 30.430 29.519 0.911 19694
4537 1 10 . 1 1 70 70 GLN H H 70 8.980 8.980 8.078 0.902 19694
4538 1 10 . 1 1 71 71 CYS N N 71 118.860 118.860 116.358 2.502 19694
4539 1 10 . 1 1 71 71 CYS HA H 71 4.720 4.720 4.771 -0.051 19694
4540 1 10 . 1 1 71 71 CYS CA C 71 59.770 59.770 58.228 1.542 19694
4541 1 10 . 1 1 71 71 CYS CB C 71 31.910 31.910 27.840 4.070 19694
4542 1 10 . 1 1 71 71 CYS H H 71 8.220 8.220 7.785 0.435 19694
4543 1 10 . 1 1 72 72 ARG N N 72 114.380 114.380 118.474 -4.094 19694
4544 1 10 . 1 1 72 72 ARG HA H 72 3.965 3.965 3.782 0.183 19694
4545 1 10 . 1 1 72 72 ARG CA C 72 58.030 58.030 57.301 0.729 19694
4546 1 10 . 1 1 72 72 ARG CB C 72 27.720 27.720 28.659 -0.939 19694
4547 1 10 . 1 1 72 72 ARG H H 72 7.380 7.380 7.794 -0.414 19694
4548 1 10 . 1 1 73 73 ASN N N 73 121.480 121.480 115.885 5.595 19694
4549 1 10 . 1 1 73 73 ASN HA H 73 4.630 4.630 4.612 0.018 19694
4550 1 10 . 1 1 73 73 ASN CA C 73 54.110 54.110 54.053 0.057 19694
4551 1 10 . 1 1 73 73 ASN CB C 73 38.870 38.870 39.640 -0.770 19694
4552 1 10 . 1 1 73 73 ASN H H 73 8.722 8.722 8.097 0.625 19694
4553 1 10 . 1 1 74 74 SER N N 74 114.710 114.710 118.085 -3.375 19694
4554 1 10 . 1 1 74 74 SER HA H 74 4.060 4.060 4.832 -0.772 19694
4555 1 10 . 1 1 74 74 SER CA C 74 59.357 59.357 58.236 1.121 19694
4556 1 10 . 1 1 74 74 SER CB C 74 63.300 63.300 63.267 0.033 19694
4557 1 10 . 1 1 74 74 SER H H 74 8.690 8.690 8.515 0.175 19694
4558 1 10 . 1 1 75 75 LEU N N 75 125.757 125.757 127.902 -2.145 19694
4559 1 10 . 1 1 75 75 LEU HA H 75 4.280 4.280 4.293 -0.013 19694
4560 1 10 . 1 1 75 75 LEU CA C 75 53.510 53.510 54.720 -1.210 19694
4561 1 10 . 1 1 75 75 LEU CB C 75 42.200 42.200 41.754 0.446 19694
4562 1 10 . 1 1 75 75 LEU H H 75 7.970 7.970 8.127 -0.157 19694
4563 1 10 . 1 1 76 76 VAL N N 76 120.860 120.860 124.240 -3.380 19694
4564 1 10 . 1 1 76 76 VAL HA H 76 3.570 3.570 3.915 -0.345 19694
4565 1 10 . 1 1 76 76 VAL CA C 76 65.420 65.420 60.911 4.509 19694
4566 1 10 . 1 1 76 76 VAL CB C 76 31.540 31.540 34.851 -3.311 19694
4567 1 10 . 1 1 76 76 VAL H H 76 7.830 7.830 8.015 -0.185 19694
4568 1 10 . 1 1 77 77 ASP N N 77 122.360 122.360 121.780 0.580 19694
4569 1 10 . 1 1 77 77 ASP HA H 77 4.230 4.230 4.428 -0.198 19694
4570 1 10 . 1 1 77 77 ASP CA C 77 56.200 56.200 55.761 0.439 19694
4571 1 10 . 1 1 77 77 ASP CB C 77 39.380 39.380 40.332 -0.952 19694
4572 1 10 . 1 1 77 77 ASP H H 77 8.910 8.910 8.425 0.485 19694
4573 1 10 . 1 1 78 78 LYS N N 78 118.100 118.100 118.832 -0.732 19694
4574 1 10 . 1 1 78 78 LYS HA H 78 4.870 4.870 4.635 0.235 19694
4575 1 10 . 1 1 78 78 LYS CA C 78 56.960 56.960 53.440 3.520 19694
4576 1 10 . 1 1 78 78 LYS CB C 78 34.680 34.680 33.752 0.928 19694
4577 1 10 . 1 1 78 78 LYS H H 78 7.660 7.660 7.592 0.068 19694
4578 1 10 . 1 1 79 79 PRO HA H 79 4.460 4.460 4.233 0.227 19694
4579 1 10 . 1 1 79 79 PRO CA C 79 62.520 62.520 62.897 -0.377 19694
4580 1 10 . 1 1 79 79 PRO CB C 79 32.160 32.160 31.830 0.330 19694
4581 1 10 . 1 1 80 80 PHE N N 80 114.050 114.050 116.960 -2.910 19694
4582 1 10 . 1 1 80 80 PHE HA H 80 4.910 4.910 5.070 -0.160 19694
4583 1 10 . 1 1 80 80 PHE CA C 80 56.060 56.060 55.018 1.042 19694
4584 1 10 . 1 1 80 80 PHE CB C 80 42.410 42.410 42.012 0.398 19694
4585 1 10 . 1 1 80 80 PHE H H 80 7.510 7.510 7.141 0.369 19694
4586 1 10 . 1 1 81 81 ALA N N 81 123.290 123.290 123.554 -0.264 19694
4587 1 10 . 1 1 81 81 ALA HA H 81 4.310 4.310 4.352 -0.042 19694
4588 1 10 . 1 1 81 81 ALA CA C 81 50.450 50.450 50.383 0.067 19694
4589 1 10 . 1 1 81 81 ALA CB C 81 21.920 21.920 18.917 3.003 19694
4590 1 10 . 1 1 81 81 ALA H H 81 9.030 9.030 9.011 0.019 19694
4591 1 10 . 1 1 82 82 ALA N N 82 122.490 122.490 129.122 -6.632 19694
4592 1 10 . 1 1 82 82 ALA HA H 82 5.110 5.110 4.385 0.725 19694
4593 1 10 . 1 1 82 82 ALA CA C 82 51.100 51.100 51.743 -0.643 19694
4594 1 10 . 1 1 82 82 ALA CB C 82 21.130 21.130 18.753 2.377 19694
4595 1 10 . 1 1 82 82 ALA H H 82 8.240 8.240 8.624 -0.384 19694
4596 1 10 . 1 1 83 83 LYS N N 83 123.580 123.580 125.949 -2.369 19694
4597 1 10 . 1 1 83 83 LYS HA H 83 4.490 4.490 4.524 -0.034 19694
4598 1 10 . 1 1 83 83 LYS CA C 83 55.800 55.800 55.291 0.509 19694
4599 1 10 . 1 1 83 83 LYS CB C 83 34.720 34.720 34.138 0.582 19694
4600 1 10 . 1 1 83 83 LYS H H 83 8.400 8.400 8.252 0.148 19694
4601 1 10 . 1 1 84 84 GLU N N 84 125.470 125.470 120.391 5.079 19694
4602 1 10 . 1 1 84 84 GLU HA H 84 3.820 3.820 4.125 -0.305 19694
4603 1 10 . 1 1 84 84 GLU CA C 84 58.620 58.620 58.963 -0.343 19694
4604 1 10 . 1 1 84 84 GLU CB C 84 27.210 27.210 29.727 -2.518 19694
4605 1 10 . 1 1 84 84 GLU H H 84 9.320 9.320 8.804 0.516 19694
4606 1 10 . 1 1 85 85 ASP N N 85 118.550 118.550 114.519 4.031 19694
4607 1 10 . 1 1 85 85 ASP HA H 85 4.600 4.600 4.797 -0.197 19694
4608 1 10 . 1 1 85 85 ASP CA C 85 55.400 55.400 53.852 1.548 19694
4609 1 10 . 1 1 85 85 ASP CB C 85 40.400 40.400 42.120 -1.720 19694
4610 1 10 . 1 1 85 85 ASP H H 85 8.730 8.730 8.387 0.343 19694
4611 1 10 . 1 1 86 86 GLN N N 86 119.050 119.050 117.338 1.712 19694
4612 1 10 . 1 1 86 86 GLN HA H 86 4.540 4.540 4.705 -0.165 19694
4613 1 10 . 1 1 86 86 GLN CA C 86 55.100 55.100 54.049 1.051 19694
4614 1 10 . 1 1 86 86 GLN CB C 86 31.110 31.110 32.065 -0.955 19694
4615 1 10 . 1 1 86 86 GLN H H 86 8.170 8.170 7.592 0.578 19694
4616 1 10 . 1 1 87 87 LEU N N 87 123.110 123.110 121.342 1.768 19694
4617 1 10 . 1 1 87 87 LEU HA H 87 4.620 4.620 5.224 -0.604 19694
4618 1 10 . 1 1 87 87 LEU CA C 87 54.520 54.520 54.016 0.504 19694
4619 1 10 . 1 1 87 87 LEU CB C 87 42.700 42.700 44.590 -1.890 19694
4620 1 10 . 1 1 87 87 LEU H H 87 8.490 8.490 8.534 -0.044 19694
4621 1 10 . 1 1 88 88 LEU N N 88 123.690 123.690 120.222 3.468 19694
4622 1 10 . 1 1 88 88 LEU HA H 88 5.880 5.880 4.959 0.921 19694
4623 1 10 . 1 1 88 88 LEU CA C 88 53.340 53.340 52.812 0.527 19694
4624 1 10 . 1 1 88 88 LEU CB C 88 47.190 47.190 47.800 -0.610 19694
4625 1 10 . 1 1 88 88 LEU H H 88 8.930 8.930 8.340 0.590 19694
4626 1 10 . 1 1 89 89 CYS N N 89 122.270 122.270 119.113 3.157 19694
4627 1 10 . 1 1 89 89 CYS HA H 89 4.780 4.780 4.862 -0.082 19694
4628 1 10 . 1 1 89 89 CYS CA C 89 57.640 57.640 59.156 -1.516 19694
4629 1 10 . 1 1 89 89 CYS CB C 89 30.940 30.940 27.960 2.980 19694
4630 1 10 . 1 1 89 89 CYS H H 89 9.430 9.430 9.102 0.328 19694
4631 1 10 . 1 1 90 90 THR N N 90 110.620 110.620 115.346 -4.726 19694
4632 1 10 . 1 1 90 90 THR HA H 90 3.900 3.900 3.933 -0.033 19694
4633 1 10 . 1 1 90 90 THR CA C 90 65.460 65.460 65.623 -0.163 19694
4634 1 10 . 1 1 90 90 THR CB C 90 68.670 68.670 68.893 -0.223 19694
4635 1 10 . 1 1 90 90 THR H H 90 8.410 8.410 8.785 -0.375 19694
4636 1 10 . 1 1 91 91 ASP N N 91 123.470 123.470 120.941 2.529 19694
4637 1 10 . 1 1 91 91 ASP HA H 91 4.490 4.490 4.642 -0.152 19694
4638 1 10 . 1 1 91 91 ASP CA C 91 57.810 57.810 57.935 -0.126 19694
4639 1 10 . 1 1 91 91 ASP CB C 91 41.160 41.160 40.669 0.491 19694
4640 1 10 . 1 1 91 91 ASP H H 91 8.150 8.150 8.088 0.062 19694
4641 1 10 . 1 1 92 92 CYS N N 92 123.800 123.800 119.753 4.047 19694
4642 1 10 . 1 1 92 92 CYS HA H 92 3.970 3.970 4.390 -0.420 19694
4643 1 10 . 1 1 92 92 CYS CA C 92 64.100 64.100 61.161 2.939 19694
4644 1 10 . 1 1 92 92 CYS CB C 92 30.090 30.090 25.864 4.226 19694
4645 1 10 . 1 1 92 92 CYS H H 92 8.580 8.580 7.972 0.608 19694
4646 1 10 . 1 1 93 93 TYR N N 93 120.730 120.730 121.543 -0.813 19694
4647 1 10 . 1 1 93 93 TYR HA H 93 4.140 4.140 4.167 -0.027 19694
4648 1 10 . 1 1 93 93 TYR CA C 93 60.380 60.380 61.211 -0.831 19694
4649 1 10 . 1 1 93 93 TYR CB C 93 39.300 39.300 38.235 1.065 19694
4650 1 10 . 1 1 93 93 TYR H H 93 8.540 8.540 9.162 -0.622 19694
4651 1 10 . 1 1 94 94 SER N N 94 115.010 115.010 114.101 0.909 19694
4652 1 10 . 1 1 94 94 SER HA H 94 4.220 4.220 4.124 0.096 19694
4653 1 10 . 1 1 94 94 SER CA C 94 59.300 59.300 61.471 -2.171 19694
4654 1 10 . 1 1 94 94 SER CB C 94 63.660 63.660 62.995 0.665 19694
4655 1 10 . 1 1 94 94 SER H H 94 7.750 7.750 7.980 -0.230 19694
4656 1 10 . 1 1 95 95 ASN N N 95 119.820 119.820 118.701 1.119 19694
4657 1 10 . 1 1 95 95 ASN HA H 95 4.510 4.510 4.519 -0.009 19694
4658 1 10 . 1 1 95 95 ASN CA C 95 53.880 53.880 55.586 -1.706 19694
4659 1 10 . 1 1 95 95 ASN CB C 95 39.300 39.300 38.817 0.483 19694
4660 1 10 . 1 1 95 95 ASN H H 95 7.780 7.780 7.721 0.059 19694
4661 1 10 . 1 1 96 96 GLU N N 96 119.820 119.820 117.590 2.230 19694
4662 1 10 . 1 1 96 96 GLU HA H 96 4.096 4.096 4.278 -0.182 19694
4663 1 10 . 1 1 96 96 GLU CA C 96 56.910 56.910 57.243 -0.333 19694
4664 1 10 . 1 1 96 96 GLU CB C 96 30.220 30.220 29.309 0.911 19694
4665 1 10 . 1 1 96 96 GLU H H 96 7.950 7.950 7.800 0.150 19694
4666 1 10 . 1 1 97 97 TYR N N 97 120.370 120.370 121.372 -1.002 19694
4667 1 10 . 1 1 97 97 TYR HA H 97 4.620 4.620 3.952 0.668 19694
4668 1 10 . 1 1 97 97 TYR CA C 97 57.700 57.700 59.999 -2.299 19694
4669 1 10 . 1 1 97 97 TYR CB C 97 38.710 38.710 38.172 0.538 19694
4670 1 10 . 1 1 97 97 TYR H H 97 8.070 8.070 8.532 -0.462 19694
4671 1 11 . 1 1 2 2 THR N N 2 113.570 113.570 117.551 -3.981 19694
4672 1 11 . 1 1 2 2 THR HA H 2 4.240 4.240 4.396 -0.156 19694
4673 1 11 . 1 1 2 2 THR CA C 2 62.130 62.130 63.150 -1.020 19694
4674 1 11 . 1 1 2 2 THR CB C 2 69.250 69.250 69.162 0.088 19694
4675 1 11 . 1 1 2 2 THR H H 2 8.090 8.090 8.233 -0.143 19694
4676 1 11 . 1 1 3 3 GLU N N 3 122.880 122.880 119.837 3.043 19694
4677 1 11 . 1 1 3 3 GLU HA H 3 4.280 4.280 4.564 -0.284 19694
4678 1 11 . 1 1 3 3 GLU CA C 3 56.860 56.860 55.164 1.696 19694
4679 1 11 . 1 1 3 3 GLU CB C 3 30.570 30.570 30.757 -0.187 19694
4680 1 11 . 1 1 3 3 GLU H H 3 8.280 8.280 7.908 0.372 19694
4681 1 11 . 1 1 4 4 ARG N N 4 121.330 121.330 119.996 1.334 19694
4682 1 11 . 1 1 4 4 ARG HA H 4 4.300 4.300 4.645 -0.345 19694
4683 1 11 . 1 1 4 4 ARG CA C 4 55.870 55.870 55.294 0.576 19694
4684 1 11 . 1 1 4 4 ARG CB C 4 31.640 31.640 31.042 0.598 19694
4685 1 11 . 1 1 4 4 ARG H H 4 8.280 8.280 8.557 -0.277 19694
4686 1 11 . 1 1 5 5 PHE N N 5 125.490 125.490 124.604 0.886 19694
4687 1 11 . 1 1 5 5 PHE HA H 5 4.610 4.610 4.549 0.061 19694
4688 1 11 . 1 1 5 5 PHE CA C 5 56.380 56.380 56.460 -0.080 19694
4689 1 11 . 1 1 5 5 PHE CB C 5 39.560 39.560 39.603 -0.043 19694
4690 1 11 . 1 1 5 5 PHE H H 5 8.290 8.290 8.724 -0.434 19694
4691 1 11 . 1 1 6 6 ASP N N 6 123.260 123.260 121.700 1.560 19694
4692 1 11 . 1 1 6 6 ASP HA H 6 5.045 5.045 4.795 0.251 19694
4693 1 11 . 1 1 6 6 ASP CA C 6 52.180 52.180 53.093 -0.913 19694
4694 1 11 . 1 1 6 6 ASP CB C 6 44.210 44.210 44.802 -0.592 19694
4695 1 11 . 1 1 6 6 ASP H H 6 7.940 7.940 7.630 0.310 19694
4696 1 11 . 1 1 7 7 CYS N N 7 121.440 121.440 122.924 -1.484 19694
4697 1 11 . 1 1 7 7 CYS HA H 7 3.960 3.960 4.432 -0.472 19694
4698 1 11 . 1 1 7 7 CYS CA C 7 59.820 59.820 59.550 0.270 19694
4699 1 11 . 1 1 7 7 CYS CB C 7 30.950 30.950 26.158 4.792 19694
4700 1 11 . 1 1 7 7 CYS H H 7 8.700 8.700 8.593 0.107 19694
4701 1 11 . 1 1 8 8 HIS N N 8 129.390 129.390 129.975 -0.585 19694
4702 1 11 . 1 1 8 8 HIS HA H 8 4.200 4.200 4.280 -0.080 19694
4703 1 11 . 1 1 8 8 HIS CA C 8 58.240 58.240 59.401 -1.161 19694
4704 1 11 . 1 1 8 8 HIS CB C 8 29.480 29.480 29.980 -0.500 19694
4705 1 11 . 1 1 8 8 HIS H H 8 9.160 9.160 9.604 -0.444 19694
4706 1 11 . 1 1 9 9 HIS N N 9 118.740 118.740 116.812 1.928 19694
4707 1 11 . 1 1 9 9 HIS HA H 9 4.880 4.880 4.397 0.483 19694
4708 1 11 . 1 1 9 9 HIS CA C 9 58.680 58.680 57.041 1.639 19694
4709 1 11 . 1 1 9 9 HIS CB C 9 31.040 31.040 30.266 0.774 19694
4710 1 11 . 1 1 9 9 HIS H H 9 9.270 9.270 8.047 1.223 19694
4711 1 11 . 1 1 10 10 CYS N N 10 118.600 118.600 116.996 1.604 19694
4712 1 11 . 1 1 10 10 CYS HA H 10 4.600 4.600 4.438 0.162 19694
4713 1 11 . 1 1 10 10 CYS CA C 10 59.600 59.600 58.974 0.626 19694
4714 1 11 . 1 1 10 10 CYS CB C 10 32.330 32.330 27.894 4.436 19694
4715 1 11 . 1 1 10 10 CYS H H 10 8.550 8.550 7.790 0.760 19694
4716 1 11 . 1 1 11 11 ASN N N 11 116.220 116.220 118.222 -2.002 19694
4717 1 11 . 1 1 11 11 ASN HA H 11 4.410 4.410 4.435 -0.025 19694
4718 1 11 . 1 1 11 11 ASN CA C 11 55.640 55.640 54.449 1.191 19694
4719 1 11 . 1 1 11 11 ASN CB C 11 38.200 38.200 37.288 0.912 19694
4720 1 11 . 1 1 11 11 ASN H H 11 7.690 7.690 8.673 -0.983 19694
4721 1 11 . 1 1 12 12 GLU N N 12 120.330 120.330 117.268 3.062 19694
4722 1 11 . 1 1 12 12 GLU HA H 12 4.220 4.220 4.525 -0.305 19694
4723 1 11 . 1 1 12 12 GLU CA C 12 56.700 56.700 55.263 1.437 19694
4724 1 11 . 1 1 12 12 GLU CB C 12 30.910 30.910 30.665 0.246 19694
4725 1 11 . 1 1 12 12 GLU H H 12 8.210 8.210 7.798 0.412 19694
4726 1 11 . 1 1 13 13 SER N N 13 116.190 116.190 120.608 -4.418 19694
4727 1 11 . 1 1 13 13 SER HA H 13 4.060 4.060 4.512 -0.452 19694
4728 1 11 . 1 1 13 13 SER CA C 13 59.350 59.350 59.530 -0.180 19694
4729 1 11 . 1 1 13 13 SER CB C 13 63.820 63.820 63.569 0.251 19694
4730 1 11 . 1 1 13 13 SER H H 13 8.520 8.520 8.630 -0.110 19694
4731 1 11 . 1 1 14 14 LEU N N 14 126.060 126.060 124.720 1.340 19694
4732 1 11 . 1 1 14 14 LEU HA H 14 4.310 4.310 4.325 -0.015 19694
4733 1 11 . 1 1 14 14 LEU CA C 14 54.100 54.100 55.590 -1.490 19694
4734 1 11 . 1 1 14 14 LEU CB C 14 42.200 42.200 41.773 0.427 19694
4735 1 11 . 1 1 14 14 LEU H H 14 8.910 8.910 7.770 1.140 19694
4736 1 11 . 1 1 15 15 PHE N N 15 120.660 120.660 121.001 -0.341 19694
4737 1 11 . 1 1 15 15 PHE HA H 15 4.480 4.480 4.610 -0.130 19694
4738 1 11 . 1 1 15 15 PHE CA C 15 60.400 60.400 56.422 3.978 19694
4739 1 11 . 1 1 15 15 PHE CB C 15 38.130 38.130 37.897 0.233 19694
4740 1 11 . 1 1 15 15 PHE H H 15 7.820 7.820 8.509 -0.689 19694
4741 1 11 . 1 1 16 16 GLY N N 16 114.730 114.730 110.949 3.781 19694
4742 1 11 . 1 1 16 16 GLY CA C 16 45.900 45.900 45.811 0.089 19694
4743 1 11 . 1 1 16 16 GLY H H 16 8.860 8.860 8.818 0.042 19694
4744 1 11 . 1 1 17 17 LYS N N 17 119.580 119.580 119.786 -0.206 19694
4745 1 11 . 1 1 17 17 LYS HA H 17 4.480 4.480 4.463 0.017 19694
4746 1 11 . 1 1 17 17 LYS CA C 17 54.460 54.460 54.529 -0.069 19694
4747 1 11 . 1 1 17 17 LYS CB C 17 35.800 35.800 33.961 1.839 19694
4748 1 11 . 1 1 17 17 LYS H H 17 8.030 8.030 7.241 0.789 19694
4749 1 11 . 1 1 18 18 LYS N N 18 120.330 120.330 121.531 -1.201 19694
4750 1 11 . 1 1 18 18 LYS HA H 18 4.280 4.280 4.349 -0.069 19694
4751 1 11 . 1 1 18 18 LYS CA C 18 56.800 56.800 57.353 -0.554 19694
4752 1 11 . 1 1 18 18 LYS CB C 18 33.010 33.010 33.014 -0.004 19694
4753 1 11 . 1 1 18 18 LYS H H 18 8.190 8.190 8.569 -0.379 19694
4754 1 11 . 1 1 19 19 TYR N N 19 117.500 117.500 114.082 3.418 19694
4755 1 11 . 1 1 19 19 TYR HA H 19 5.240 5.240 4.796 0.444 19694
4756 1 11 . 1 1 19 19 TYR CA C 19 55.340 55.340 56.367 -1.027 19694
4757 1 11 . 1 1 19 19 TYR CB C 19 42.850 42.850 40.236 2.614 19694
4758 1 11 . 1 1 19 19 TYR H H 19 7.610 7.610 7.910 -0.300 19694
4759 1 11 . 1 1 20 20 ILE N N 20 121.430 121.430 121.786 -0.356 19694
4760 1 11 . 1 1 20 20 ILE HA H 20 4.137 4.137 4.255 -0.118 19694
4761 1 11 . 1 1 20 20 ILE CA C 20 60.010 60.010 60.125 -0.115 19694
4762 1 11 . 1 1 20 20 ILE CB C 20 41.570 41.570 40.663 0.907 19694
4763 1 11 . 1 1 20 20 ILE H H 20 9.350 9.350 8.201 1.149 19694
4764 1 11 . 1 1 21 21 LEU N N 21 126.720 126.720 126.074 0.646 19694
4765 1 11 . 1 1 21 21 LEU HA H 21 5.090 5.090 4.775 0.315 19694
4766 1 11 . 1 1 21 21 LEU CA C 21 54.020 54.020 53.925 0.095 19694
4767 1 11 . 1 1 21 21 LEU CB C 21 43.720 43.720 40.855 2.865 19694
4768 1 11 . 1 1 21 21 LEU H H 21 8.530 8.530 8.512 0.018 19694
4769 1 11 . 1 1 22 22 ARG N N 22 123.930 123.930 125.522 -1.592 19694
4770 1 11 . 1 1 22 22 ARG HA H 22 4.440 4.440 4.532 -0.092 19694
4771 1 11 . 1 1 22 22 ARG CA C 22 55.600 55.600 54.087 1.513 19694
4772 1 11 . 1 1 22 22 ARG CB C 22 32.280 32.280 32.470 -0.190 19694
4773 1 11 . 1 1 22 22 ARG H H 22 9.080 9.080 8.909 0.171 19694
4774 1 11 . 1 1 23 23 GLU N N 23 128.500 128.500 124.846 3.654 19694
4775 1 11 . 1 1 23 23 GLU HA H 23 3.840 3.840 3.977 -0.137 19694
4776 1 11 . 1 1 23 23 GLU CA C 23 58.030 58.030 57.757 0.273 19694
4777 1 11 . 1 1 23 23 GLU CB C 23 27.200 27.200 27.891 -0.691 19694
4778 1 11 . 1 1 23 23 GLU H H 23 9.610 9.610 9.022 0.588 19694
4779 1 11 . 1 1 24 24 GLU N N 24 110.300 110.300 113.573 -3.273 19694
4780 1 11 . 1 1 24 24 GLU HA H 24 3.780 3.780 3.951 -0.171 19694
4781 1 11 . 1 1 24 24 GLU CA C 24 58.320 58.320 57.222 1.098 19694
4782 1 11 . 1 1 24 24 GLU CB C 24 28.220 28.220 28.200 0.020 19694
4783 1 11 . 1 1 24 24 GLU H H 24 8.660 8.660 8.711 -0.051 19694
4784 1 11 . 1 1 25 25 SER N N 25 117.700 117.700 113.226 4.474 19694
4785 1 11 . 1 1 25 25 SER HA H 25 4.890 4.890 4.786 0.104 19694
4786 1 11 . 1 1 25 25 SER CA C 25 56.540 56.540 55.448 1.092 19694
4787 1 11 . 1 1 25 25 SER CB C 25 64.720 64.720 65.195 -0.475 19694
4788 1 11 . 1 1 25 25 SER H H 25 7.900 7.900 7.711 0.189 19694
4789 1 11 . 1 1 26 26 PRO HA H 26 4.995 4.995 4.845 0.150 19694
4790 1 11 . 1 1 26 26 PRO CA C 26 61.750 61.750 62.989 -1.239 19694
4791 1 11 . 1 1 26 26 PRO CB C 26 32.660 32.660 31.793 0.867 19694
4792 1 11 . 1 1 27 27 TYR N N 27 118.100 118.100 123.506 -5.406 19694
4793 1 11 . 1 1 27 27 TYR HA H 27 5.910 5.910 4.978 0.932 19694
4794 1 11 . 1 1 27 27 TYR CA C 27 56.830 56.830 54.819 2.011 19694
4795 1 11 . 1 1 27 27 TYR CB C 27 42.810 42.810 42.516 0.294 19694
4796 1 11 . 1 1 27 27 TYR H H 27 9.040 9.040 8.741 0.299 19694
4797 1 11 . 1 1 28 28 CYS N N 28 122.230 122.230 119.637 2.593 19694
4798 1 11 . 1 1 28 28 CYS HA H 28 4.850 4.850 4.674 0.176 19694
4799 1 11 . 1 1 28 28 CYS CA C 28 58.110 58.110 58.412 -0.302 19694
4800 1 11 . 1 1 28 28 CYS CB C 28 30.530 30.530 29.194 1.336 19694
4801 1 11 . 1 1 28 28 CYS H H 28 9.850 9.850 8.388 1.462 19694
4802 1 11 . 1 1 29 29 VAL N N 29 118.200 118.200 122.396 -4.196 19694
4803 1 11 . 1 1 29 29 VAL HA H 29 3.650 3.650 3.713 -0.063 19694
4804 1 11 . 1 1 29 29 VAL CA C 29 67.400 67.400 66.884 0.516 19694
4805 1 11 . 1 1 29 29 VAL CB C 29 31.860 31.860 30.729 1.131 19694
4806 1 11 . 1 1 29 29 VAL H H 29 8.430 8.430 9.102 -0.672 19694
4807 1 11 . 1 1 30 30 VAL N N 30 119.570 119.570 119.097 0.473 19694
4808 1 11 . 1 1 30 30 VAL HA H 30 3.860 3.860 3.543 0.317 19694
4809 1 11 . 1 1 30 30 VAL CA C 30 66.450 66.450 66.414 0.036 19694
4810 1 11 . 1 1 30 30 VAL CB C 30 31.540 31.540 30.402 1.138 19694
4811 1 11 . 1 1 30 30 VAL H H 30 7.700 7.700 8.307 -0.607 19694
4812 1 11 . 1 1 31 31 CYS N N 31 125.890 125.890 119.614 6.276 19694
4813 1 11 . 1 1 31 31 CYS HA H 31 3.830 3.830 3.894 -0.064 19694
4814 1 11 . 1 1 31 31 CYS CA C 31 65.850 65.850 64.312 1.538 19694
4815 1 11 . 1 1 31 31 CYS CB C 31 29.510 29.510 25.537 3.973 19694
4816 1 11 . 1 1 31 31 CYS H H 31 9.050 9.050 7.632 1.418 19694
4817 1 11 . 1 1 32 32 PHE N N 32 119.000 119.000 119.337 -0.337 19694
4818 1 11 . 1 1 32 32 PHE HA H 32 3.780 3.780 3.676 0.104 19694
4819 1 11 . 1 1 32 32 PHE CA C 32 62.610 62.610 61.750 0.860 19694
4820 1 11 . 1 1 32 32 PHE CB C 32 39.920 39.920 39.036 0.883 19694
4821 1 11 . 1 1 32 32 PHE H H 32 9.080 9.080 7.897 1.183 19694
4822 1 11 . 1 1 33 33 GLU N N 33 117.470 117.470 118.021 -0.551 19694
4823 1 11 . 1 1 33 33 GLU HA H 33 3.760 3.760 4.076 -0.316 19694
4824 1 11 . 1 1 33 33 GLU CA C 33 59.210 59.210 59.410 -0.200 19694
4825 1 11 . 1 1 33 33 GLU CB C 33 29.480 29.480 29.200 0.280 19694
4826 1 11 . 1 1 33 33 GLU H H 33 8.510 8.510 8.224 0.286 19694
4827 1 11 . 1 1 34 34 THR N N 34 114.140 114.140 115.351 -1.211 19694
4828 1 11 . 1 1 34 34 THR HA H 34 3.730 3.730 3.973 -0.243 19694
4829 1 11 . 1 1 34 34 THR CA C 34 65.890 65.890 65.419 0.471 19694
4830 1 11 . 1 1 34 34 THR CB C 34 69.210 69.210 68.609 0.601 19694
4831 1 11 . 1 1 34 34 THR H H 34 7.880 7.880 8.305 -0.425 19694
4832 1 11 . 1 1 35 35 LEU N N 35 117.980 117.980 118.884 -0.904 19694
4833 1 11 . 1 1 35 35 LEU HA H 35 3.650 3.650 3.924 -0.274 19694
4834 1 11 . 1 1 35 35 LEU CA C 35 56.860 56.860 57.213 -0.353 19694
4835 1 11 . 1 1 35 35 LEU CB C 35 41.870 41.870 41.743 0.127 19694
4836 1 11 . 1 1 35 35 LEU H H 35 7.660 7.660 7.767 -0.107 19694
4837 1 11 . 1 1 36 36 PHE N N 36 113.900 113.900 113.041 0.859 19694
4838 1 11 . 1 1 36 36 PHE HA H 36 4.597 4.597 4.511 0.086 19694
4839 1 11 . 1 1 36 36 PHE CA C 36 56.860 56.860 56.160 0.700 19694
4840 1 11 . 1 1 36 36 PHE CB C 36 40.570 40.570 38.434 2.136 19694
4841 1 11 . 1 1 36 36 PHE H H 36 7.730 7.730 6.679 1.051 19694
4842 1 11 . 1 1 37 37 ALA N N 37 121.920 121.920 123.119 -1.199 19694
4843 1 11 . 1 1 37 37 ALA HA H 37 4.070 4.070 4.075 -0.005 19694
4844 1 11 . 1 1 37 37 ALA CA C 37 52.900 52.900 52.253 0.647 19694
4845 1 11 . 1 1 37 37 ALA CB C 37 19.770 19.770 19.557 0.213 19694
4846 1 11 . 1 1 37 37 ALA H H 37 7.090 7.090 7.899 -0.809 19694
4847 1 11 . 1 1 38 38 ASN N N 38 119.230 119.230 120.355 -1.125 19694
4848 1 11 . 1 1 38 38 ASN HA H 38 4.450 4.450 4.663 -0.213 19694
4849 1 11 . 1 1 38 38 ASN CA C 38 52.850 52.850 52.423 0.427 19694
4850 1 11 . 1 1 38 38 ASN CB C 38 38.950 38.950 40.472 -1.522 19694
4851 1 11 . 1 1 38 38 ASN H H 38 8.790 8.790 8.323 0.467 19694
4852 1 11 . 1 1 39 39 THR N N 39 116.330 116.330 115.559 0.771 19694
4853 1 11 . 1 1 39 39 THR HA H 39 3.990 3.990 4.421 -0.431 19694
4854 1 11 . 1 1 39 39 THR CA C 39 62.130 62.130 62.487 -0.357 19694
4855 1 11 . 1 1 39 39 THR CB C 39 69.920 69.920 69.870 0.050 19694
4856 1 11 . 1 1 39 39 THR H H 39 8.540 8.540 8.232 0.308 19694
4857 1 11 . 1 1 40 40 CYS N N 40 126.950 126.950 127.766 -0.816 19694
4858 1 11 . 1 1 40 40 CYS HA H 40 4.300 4.300 4.510 -0.210 19694
4859 1 11 . 1 1 40 40 CYS CA C 40 58.350 58.350 56.966 1.384 19694
4860 1 11 . 1 1 40 40 CYS CB C 40 31.600 31.600 26.676 4.924 19694
4861 1 11 . 1 1 40 40 CYS H H 40 7.940 7.940 8.549 -0.609 19694
4862 1 11 . 1 1 41 41 GLU N N 41 130.560 130.560 127.571 2.989 19694
4863 1 11 . 1 1 41 41 GLU HA H 41 3.690 3.690 3.839 -0.149 19694
4864 1 11 . 1 1 41 41 GLU CA C 41 58.600 58.600 59.127 -0.527 19694
4865 1 11 . 1 1 41 41 GLU CB C 41 30.460 30.460 29.404 1.056 19694
4866 1 11 . 1 1 41 41 GLU H H 41 8.810 8.810 8.692 0.118 19694
4867 1 11 . 1 1 42 42 GLU N N 42 119.680 119.680 118.102 1.578 19694
4868 1 11 . 1 1 42 42 GLU HA H 42 4.570 4.570 4.354 0.216 19694
4869 1 11 . 1 1 42 42 GLU CA C 42 58.000 58.000 58.093 -0.093 19694
4870 1 11 . 1 1 42 42 GLU CB C 42 31.680 31.680 30.623 1.057 19694
4871 1 11 . 1 1 42 42 GLU H H 42 8.500 8.500 8.125 0.375 19694
4872 1 11 . 1 1 43 43 CYS N N 43 115.600 115.600 116.305 -0.705 19694
4873 1 11 . 1 1 43 43 CYS HA H 43 5.010 5.010 4.672 0.338 19694
4874 1 11 . 1 1 43 43 CYS CA C 43 58.810 58.810 59.615 -0.805 19694
4875 1 11 . 1 1 43 43 CYS CB C 43 31.580 31.580 29.174 2.406 19694
4876 1 11 . 1 1 43 43 CYS H H 43 8.120 8.120 8.072 0.048 19694
4877 1 11 . 1 1 44 44 GLY N N 44 112.100 112.100 107.286 4.814 19694
4878 1 11 . 1 1 44 44 GLY CA C 44 46.420 46.420 45.266 1.154 19694
4879 1 11 . 1 1 44 44 GLY H H 44 7.900 7.900 8.568 -0.668 19694
4880 1 11 . 1 1 45 45 LYS N N 45 121.210 121.210 121.597 -0.387 19694
4881 1 11 . 1 1 45 45 LYS HA H 45 4.840 4.840 4.794 0.046 19694
4882 1 11 . 1 1 45 45 LYS CA C 45 54.360 54.360 52.791 1.569 19694
4883 1 11 . 1 1 45 45 LYS CB C 45 32.430 32.430 33.116 -0.686 19694
4884 1 11 . 1 1 45 45 LYS H H 45 8.180 8.180 8.035 0.145 19694
4885 1 11 . 1 1 46 46 PRO HA H 46 4.477 4.477 4.513 -0.036 19694
4886 1 11 . 1 1 46 46 PRO CA C 46 62.700 62.700 63.033 -0.333 19694
4887 1 11 . 1 1 46 46 PRO CB C 46 32.490 32.490 32.050 0.440 19694
4888 1 11 . 1 1 47 47 ILE N N 47 125.280 125.280 123.204 2.076 19694
4889 1 11 . 1 1 47 47 ILE HA H 47 3.830 3.830 4.248 -0.418 19694
4890 1 11 . 1 1 47 47 ILE CA C 47 61.040 61.040 60.833 0.207 19694
4891 1 11 . 1 1 47 47 ILE CB C 47 37.440 37.440 37.528 -0.088 19694
4892 1 11 . 1 1 47 47 ILE H H 47 8.540 8.540 8.885 -0.345 19694
4893 1 11 . 1 1 48 48 GLY N N 48 114.120 114.120 113.719 0.401 19694
4894 1 11 . 1 1 48 48 GLY CA C 48 45.240 45.240 44.593 0.647 19694
4895 1 11 . 1 1 48 48 GLY H H 48 8.660 8.660 8.409 0.251 19694
4896 1 11 . 1 1 49 49 CYS N N 49 117.140 117.140 121.079 -3.939 19694
4897 1 11 . 1 1 49 49 CYS HA H 49 4.280 4.280 4.274 0.006 19694
4898 1 11 . 1 1 49 49 CYS CA C 49 60.880 60.880 60.718 0.162 19694
4899 1 11 . 1 1 49 49 CYS CB C 49 27.650 27.650 27.991 -0.341 19694
4900 1 11 . 1 1 49 49 CYS H H 49 9.210 9.210 9.596 -0.386 19694
4901 1 11 . 1 1 50 50 ASP N N 50 119.300 119.300 119.429 -0.129 19694
4902 1 11 . 1 1 50 50 ASP HA H 50 4.620 4.620 4.579 0.041 19694
4903 1 11 . 1 1 50 50 ASP CA C 50 54.160 54.160 54.995 -0.835 19694
4904 1 11 . 1 1 50 50 ASP CB C 50 40.380 40.380 39.886 0.493 19694
4905 1 11 . 1 1 50 50 ASP H H 50 8.800 8.800 8.289 0.511 19694
4906 1 11 . 1 1 51 51 CYS N N 51 118.150 118.150 117.565 0.585 19694
4907 1 11 . 1 1 51 51 CYS HA H 51 4.620 4.620 4.682 -0.062 19694
4908 1 11 . 1 1 51 51 CYS CA C 51 58.030 58.030 57.129 0.901 19694
4909 1 11 . 1 1 51 51 CYS CB C 51 30.090 30.090 31.845 -1.755 19694
4910 1 11 . 1 1 51 51 CYS H H 51 7.590 7.590 7.491 0.099 19694
4911 1 11 . 1 1 52 52 LYS N N 52 123.800 123.800 122.694 1.106 19694
4912 1 11 . 1 1 52 52 LYS HA H 52 4.180 4.180 4.423 -0.243 19694
4913 1 11 . 1 1 52 52 LYS CA C 52 57.240 57.240 55.376 1.864 19694
4914 1 11 . 1 1 52 52 LYS CB C 52 33.030 33.030 30.767 2.263 19694
4915 1 11 . 1 1 52 52 LYS H H 52 8.600 8.600 8.470 0.130 19694
4916 1 11 . 1 1 53 53 ASP N N 53 124.900 124.900 123.519 1.381 19694
4917 1 11 . 1 1 53 53 ASP HA H 53 4.230 4.230 4.665 -0.435 19694
4918 1 11 . 1 1 53 53 ASP CA C 53 53.130 53.130 53.578 -0.448 19694
4919 1 11 . 1 1 53 53 ASP CB C 53 42.230 42.230 40.978 1.252 19694
4920 1 11 . 1 1 53 53 ASP H H 53 8.250 8.250 8.442 -0.192 19694
4921 1 11 . 1 1 54 54 LEU N N 54 130.160 130.160 126.337 3.823 19694
4922 1 11 . 1 1 54 54 LEU HA H 54 4.440 4.440 4.642 -0.202 19694
4923 1 11 . 1 1 54 54 LEU CA C 54 53.340 53.340 55.045 -1.705 19694
4924 1 11 . 1 1 54 54 LEU CB C 54 41.170 41.170 43.201 -2.031 19694
4925 1 11 . 1 1 54 54 LEU H H 54 8.670 8.670 8.934 -0.264 19694
4926 1 11 . 1 1 55 55 SER N N 55 113.820 113.820 121.282 -7.462 19694
4927 1 11 . 1 1 55 55 SER HA H 55 5.580 5.580 5.017 0.563 19694
4928 1 11 . 1 1 55 55 SER CA C 55 55.850 55.850 56.805 -0.955 19694
4929 1 11 . 1 1 55 55 SER CB C 55 67.300 67.300 64.409 2.891 19694
4930 1 11 . 1 1 55 55 SER H H 55 8.160 8.160 8.596 -0.436 19694
4931 1 11 . 1 1 56 56 TYR N N 56 122.610 122.610 128.107 -5.497 19694
4932 1 11 . 1 1 56 56 TYR HA H 56 4.620 4.620 4.669 -0.049 19694
4933 1 11 . 1 1 56 56 TYR CA C 56 58.810 58.810 58.537 0.273 19694
4934 1 11 . 1 1 56 56 TYR CB C 56 41.000 41.000 41.930 -0.930 19694
4935 1 11 . 1 1 56 56 TYR H H 56 8.450 8.450 8.938 -0.488 19694
4936 1 11 . 1 1 57 57 LYS N N 57 126.020 126.020 129.249 -3.229 19694
4937 1 11 . 1 1 57 57 LYS HA H 57 3.470 3.470 3.932 -0.462 19694
4938 1 11 . 1 1 57 57 LYS CA C 57 58.100 58.100 57.171 0.929 19694
4939 1 11 . 1 1 57 57 LYS CB C 57 29.480 29.480 31.653 -2.173 19694
4940 1 11 . 1 1 57 57 LYS H H 57 8.920 8.920 8.862 0.058 19694
4941 1 11 . 1 1 58 58 ASP HA H 58 3.830 3.830 4.274 -0.444 19694
4942 1 11 . 1 1 58 58 ASP CA C 58 54.900 54.900 55.873 -0.973 19694
4943 1 11 . 1 1 58 58 ASP CB C 58 40.080 40.080 40.696 -0.616 19694
4944 1 11 . 1 1 58 58 ASP H H 58 8.400 8.400 8.569 -0.169 19694
4945 1 11 . 1 1 59 59 ARG N N 59 121.190 121.190 115.869 5.321 19694
4946 1 11 . 1 1 59 59 ARG HA H 59 4.250 4.250 4.539 -0.289 19694
4947 1 11 . 1 1 59 59 ARG CA C 59 55.580 55.580 53.994 1.586 19694
4948 1 11 . 1 1 59 59 ARG CB C 59 33.460 33.460 33.527 -0.067 19694
4949 1 11 . 1 1 59 59 ARG H H 59 7.980 7.980 7.364 0.616 19694
4950 1 11 . 1 1 60 60 HIS N N 60 118.420 118.420 117.732 0.688 19694
4951 1 11 . 1 1 60 60 HIS HA H 60 5.270 5.270 5.681 -0.411 19694
4952 1 11 . 1 1 60 60 HIS CA C 60 55.010 55.010 55.257 -0.247 19694
4953 1 11 . 1 1 60 60 HIS CB C 60 32.380 32.380 33.417 -1.038 19694
4954 1 11 . 1 1 60 60 HIS H H 60 8.350 8.350 8.115 0.235 19694
4955 1 11 . 1 1 61 61 TRP N N 61 119.990 119.990 118.105 1.885 19694
4956 1 11 . 1 1 61 61 TRP HA H 61 5.930 5.930 4.806 1.124 19694
4957 1 11 . 1 1 61 61 TRP CA C 61 57.400 57.400 57.133 0.267 19694
4958 1 11 . 1 1 61 61 TRP CB C 61 35.380 35.380 34.321 1.059 19694
4959 1 11 . 1 1 61 61 TRP H H 61 9.310 9.310 9.301 0.009 19694
4960 1 11 . 1 1 62 62 HIS N N 62 117.270 117.270 120.307 -3.037 19694
4961 1 11 . 1 1 62 62 HIS HA H 62 4.600 4.600 4.756 -0.156 19694
4962 1 11 . 1 1 62 62 HIS CA C 62 59.210 59.210 57.259 1.951 19694
4963 1 11 . 1 1 62 62 HIS CB C 62 31.200 31.200 30.575 0.625 19694
4964 1 11 . 1 1 62 62 HIS H H 62 8.430 8.430 9.183 -0.753 19694
4965 1 11 . 1 1 63 63 GLU N N 63 124.640 124.640 127.944 -3.304 19694
4966 1 11 . 1 1 63 63 GLU HA H 63 3.827 3.827 3.990 -0.163 19694
4967 1 11 . 1 1 63 63 GLU CA C 63 61.020 61.020 59.481 1.539 19694
4968 1 11 . 1 1 63 63 GLU CB C 63 30.310 30.310 29.528 0.782 19694
4969 1 11 . 1 1 63 63 GLU H H 63 9.040 9.040 8.212 0.828 19694
4970 1 11 . 1 1 64 64 ALA N N 64 117.050 117.050 117.861 -0.811 19694
4971 1 11 . 1 1 64 64 ALA HA H 64 4.230 4.230 4.310 -0.080 19694
4972 1 11 . 1 1 64 64 ALA CA C 64 54.000 54.000 52.926 1.074 19694
4973 1 11 . 1 1 64 64 ALA CB C 64 18.880 18.880 18.886 -0.006 19694
4974 1 11 . 1 1 64 64 ALA H H 64 8.680 8.680 8.202 0.478 19694
4975 1 11 . 1 1 65 65 CYS N N 65 115.380 115.380 117.303 -1.923 19694
4976 1 11 . 1 1 65 65 CYS HA H 65 4.295 4.295 4.012 0.283 19694
4977 1 11 . 1 1 65 65 CYS CA C 65 59.850 59.850 60.146 -0.296 19694
4978 1 11 . 1 1 65 65 CYS CB C 65 32.840 32.840 27.258 5.582 19694
4979 1 11 . 1 1 65 65 CYS H H 65 7.490 7.490 8.030 -0.540 19694
4980 1 11 . 1 1 66 66 PHE N N 66 122.020 122.020 123.177 -1.157 19694
4981 1 11 . 1 1 66 66 PHE HA H 66 3.890 3.890 4.010 -0.120 19694
4982 1 11 . 1 1 66 66 PHE CA C 66 57.010 57.010 58.616 -1.606 19694
4983 1 11 . 1 1 66 66 PHE CB C 66 38.070 38.070 38.210 -0.140 19694
4984 1 11 . 1 1 66 66 PHE H H 66 7.110 7.110 7.698 -0.588 19694
4985 1 11 . 1 1 67 67 HIS N N 67 121.280 121.280 122.058 -0.778 19694
4986 1 11 . 1 1 67 67 HIS HA H 67 4.720 4.720 5.308 -0.588 19694
4987 1 11 . 1 1 67 67 HIS CA C 67 52.730 52.730 52.776 -0.046 19694
4988 1 11 . 1 1 67 67 HIS CB C 67 32.230 32.230 30.846 1.384 19694
4989 1 11 . 1 1 67 67 HIS H H 67 7.380 7.380 8.106 -0.726 19694
4990 1 11 . 1 1 68 68 CYS N N 68 121.590 121.590 118.766 2.824 19694
4991 1 11 . 1 1 68 68 CYS HA H 68 3.960 3.960 4.889 -0.929 19694
4992 1 11 . 1 1 68 68 CYS CA C 68 59.790 59.790 57.914 1.876 19694
4993 1 11 . 1 1 68 68 CYS CB C 68 31.200 31.200 29.315 1.885 19694
4994 1 11 . 1 1 68 68 CYS H H 68 8.530 8.530 8.281 0.249 19694
4995 1 11 . 1 1 69 69 SER N N 69 126.530 126.530 120.167 6.363 19694
4996 1 11 . 1 1 69 69 SER HA H 69 4.310 4.310 4.068 0.242 19694
4997 1 11 . 1 1 69 69 SER CA C 69 61.760 61.760 60.794 0.966 19694
4998 1 11 . 1 1 69 69 SER CB C 69 64.040 64.040 63.290 0.750 19694
4999 1 11 . 1 1 69 69 SER H H 69 9.460 9.460 8.779 0.681 19694
5000 1 11 . 1 1 70 70 GLN N N 70 122.370 122.370 117.717 4.653 19694
5001 1 11 . 1 1 70 70 GLN HA H 70 4.510 4.510 4.420 0.090 19694
5002 1 11 . 1 1 70 70 GLN CA C 70 57.840 57.840 57.213 0.627 19694
5003 1 11 . 1 1 70 70 GLN CB C 70 30.430 30.430 29.516 0.914 19694
5004 1 11 . 1 1 70 70 GLN H H 70 8.980 8.980 7.803 1.177 19694
5005 1 11 . 1 1 71 71 CYS N N 71 118.860 118.860 116.585 2.275 19694
5006 1 11 . 1 1 71 71 CYS HA H 71 4.720 4.720 4.753 -0.033 19694
5007 1 11 . 1 1 71 71 CYS CA C 71 59.770 59.770 58.476 1.294 19694
5008 1 11 . 1 1 71 71 CYS CB C 71 31.910 31.910 27.873 4.037 19694
5009 1 11 . 1 1 71 71 CYS H H 71 8.220 8.220 7.755 0.465 19694
5010 1 11 . 1 1 72 72 ARG N N 72 114.380 114.380 115.569 -1.189 19694
5011 1 11 . 1 1 72 72 ARG HA H 72 3.965 3.965 3.903 0.062 19694
5012 1 11 . 1 1 72 72 ARG CA C 72 58.030 58.030 57.230 0.800 19694
5013 1 11 . 1 1 72 72 ARG CB C 72 27.720 27.720 27.089 0.631 19694
5014 1 11 . 1 1 72 72 ARG H H 72 7.380 7.380 7.825 -0.445 19694
5015 1 11 . 1 1 73 73 ASN N N 73 121.480 121.480 117.123 4.357 19694
5016 1 11 . 1 1 73 73 ASN HA H 73 4.630 4.630 4.713 -0.083 19694
5017 1 11 . 1 1 73 73 ASN CA C 73 54.110 54.110 53.170 0.939 19694
5018 1 11 . 1 1 73 73 ASN CB C 73 38.870 38.870 39.817 -0.947 19694
5019 1 11 . 1 1 73 73 ASN H H 73 8.722 8.722 8.009 0.713 19694
5020 1 11 . 1 1 74 74 SER N N 74 114.710 114.710 118.045 -3.335 19694
5021 1 11 . 1 1 74 74 SER HA H 74 4.060 4.060 4.864 -0.804 19694
5022 1 11 . 1 1 74 74 SER CA C 74 59.357 59.357 58.085 1.272 19694
5023 1 11 . 1 1 74 74 SER CB C 74 63.300 63.300 63.178 0.122 19694
5024 1 11 . 1 1 74 74 SER H H 74 8.690 8.690 8.510 0.180 19694
5025 1 11 . 1 1 75 75 LEU N N 75 125.757 125.757 127.905 -2.148 19694
5026 1 11 . 1 1 75 75 LEU HA H 75 4.280 4.280 4.340 -0.060 19694
5027 1 11 . 1 1 75 75 LEU CA C 75 53.510 53.510 54.658 -1.148 19694
5028 1 11 . 1 1 75 75 LEU CB C 75 42.200 42.200 42.210 -0.010 19694
5029 1 11 . 1 1 75 75 LEU H H 75 7.970 7.970 8.080 -0.110 19694
5030 1 11 . 1 1 76 76 VAL N N 76 120.860 120.860 123.898 -3.038 19694
5031 1 11 . 1 1 76 76 VAL HA H 76 3.570 3.570 3.895 -0.325 19694
5032 1 11 . 1 1 76 76 VAL CA C 76 65.420 65.420 60.818 4.602 19694
5033 1 11 . 1 1 76 76 VAL CB C 76 31.540 31.540 35.532 -3.992 19694
5034 1 11 . 1 1 76 76 VAL H H 76 7.830 7.830 8.029 -0.199 19694
5035 1 11 . 1 1 77 77 ASP N N 77 122.360 122.360 123.218 -0.858 19694
5036 1 11 . 1 1 77 77 ASP HA H 77 4.230 4.230 4.483 -0.253 19694
5037 1 11 . 1 1 77 77 ASP CA C 77 56.200 56.200 55.782 0.417 19694
5038 1 11 . 1 1 77 77 ASP CB C 77 39.380 39.380 40.855 -1.475 19694
5039 1 11 . 1 1 77 77 ASP H H 77 8.910 8.910 8.406 0.504 19694
5040 1 11 . 1 1 78 78 LYS N N 78 118.100 118.100 118.410 -0.310 19694
5041 1 11 . 1 1 78 78 LYS HA H 78 4.870 4.870 4.637 0.233 19694
5042 1 11 . 1 1 78 78 LYS CA C 78 56.960 56.960 53.700 3.260 19694
5043 1 11 . 1 1 78 78 LYS CB C 78 34.680 34.680 33.740 0.940 19694
5044 1 11 . 1 1 78 78 LYS H H 78 7.660 7.660 7.625 0.035 19694
5045 1 11 . 1 1 79 79 PRO HA H 79 4.460 4.460 4.238 0.222 19694
5046 1 11 . 1 1 79 79 PRO CA C 79 62.520 62.520 62.954 -0.434 19694
5047 1 11 . 1 1 79 79 PRO CB C 79 32.160 32.160 31.855 0.305 19694
5048 1 11 . 1 1 80 80 PHE N N 80 114.050 114.050 117.189 -3.139 19694
5049 1 11 . 1 1 80 80 PHE HA H 80 4.910 4.910 5.117 -0.207 19694
5050 1 11 . 1 1 80 80 PHE CA C 80 56.060 56.060 55.085 0.975 19694
5051 1 11 . 1 1 80 80 PHE CB C 80 42.410 42.410 42.037 0.373 19694
5052 1 11 . 1 1 80 80 PHE H H 80 7.510 7.510 7.214 0.296 19694
5053 1 11 . 1 1 81 81 ALA N N 81 123.290 123.290 123.933 -0.643 19694
5054 1 11 . 1 1 81 81 ALA HA H 81 4.310 4.310 4.383 -0.073 19694
5055 1 11 . 1 1 81 81 ALA CA C 81 50.450 50.450 50.394 0.056 19694
5056 1 11 . 1 1 81 81 ALA CB C 81 21.920 21.920 19.046 2.874 19694
5057 1 11 . 1 1 81 81 ALA H H 81 9.030 9.030 9.045 -0.015 19694
5058 1 11 . 1 1 82 82 ALA N N 82 122.490 122.490 128.695 -6.205 19694
5059 1 11 . 1 1 82 82 ALA HA H 82 5.110 5.110 4.388 0.722 19694
5060 1 11 . 1 1 82 82 ALA CA C 82 51.100 51.100 51.928 -0.828 19694
5061 1 11 . 1 1 82 82 ALA CB C 82 21.130 21.130 18.834 2.296 19694
5062 1 11 . 1 1 82 82 ALA H H 82 8.240 8.240 8.611 -0.371 19694
5063 1 11 . 1 1 83 83 LYS N N 83 123.580 123.580 125.917 -2.337 19694
5064 1 11 . 1 1 83 83 LYS HA H 83 4.490 4.490 4.452 0.038 19694
5065 1 11 . 1 1 83 83 LYS CA C 83 55.800 55.800 55.594 0.205 19694
5066 1 11 . 1 1 83 83 LYS CB C 83 34.720 34.720 34.096 0.624 19694
5067 1 11 . 1 1 83 83 LYS H H 83 8.400 8.400 8.368 0.032 19694
5068 1 11 . 1 1 84 84 GLU N N 84 125.470 125.470 120.280 5.190 19694
5069 1 11 . 1 1 84 84 GLU HA H 84 3.820 3.820 4.117 -0.297 19694
5070 1 11 . 1 1 84 84 GLU CA C 84 58.620 58.620 59.247 -0.627 19694
5071 1 11 . 1 1 84 84 GLU CB C 84 27.210 27.210 29.590 -2.380 19694
5072 1 11 . 1 1 84 84 GLU H H 84 9.320 9.320 8.748 0.572 19694
5073 1 11 . 1 1 85 85 ASP N N 85 118.550 118.550 114.268 4.282 19694
5074 1 11 . 1 1 85 85 ASP HA H 85 4.600 4.600 4.765 -0.165 19694
5075 1 11 . 1 1 85 85 ASP CA C 85 55.400 55.400 53.755 1.645 19694
5076 1 11 . 1 1 85 85 ASP CB C 85 40.400 40.400 42.143 -1.743 19694
5077 1 11 . 1 1 85 85 ASP H H 85 8.730 8.730 8.343 0.387 19694
5078 1 11 . 1 1 86 86 GLN N N 86 119.050 119.050 117.201 1.849 19694
5079 1 11 . 1 1 86 86 GLN HA H 86 4.540 4.540 4.676 -0.136 19694
5080 1 11 . 1 1 86 86 GLN CA C 86 55.100 55.100 53.983 1.117 19694
5081 1 11 . 1 1 86 86 GLN CB C 86 31.110 31.110 31.971 -0.861 19694
5082 1 11 . 1 1 86 86 GLN H H 86 8.170 8.170 7.585 0.585 19694
5083 1 11 . 1 1 87 87 LEU N N 87 123.110 123.110 121.243 1.867 19694
5084 1 11 . 1 1 87 87 LEU HA H 87 4.620 4.620 5.178 -0.558 19694
5085 1 11 . 1 1 87 87 LEU CA C 87 54.520 54.520 53.995 0.525 19694
5086 1 11 . 1 1 87 87 LEU CB C 87 42.700 42.700 44.611 -1.911 19694
5087 1 11 . 1 1 87 87 LEU H H 87 8.490 8.490 8.477 0.013 19694
5088 1 11 . 1 1 88 88 LEU N N 88 123.690 123.690 120.052 3.638 19694
5089 1 11 . 1 1 88 88 LEU HA H 88 5.880 5.880 4.934 0.946 19694
5090 1 11 . 1 1 88 88 LEU CA C 88 53.340 53.340 52.838 0.502 19694
5091 1 11 . 1 1 88 88 LEU CB C 88 47.190 47.190 47.810 -0.620 19694
5092 1 11 . 1 1 88 88 LEU H H 88 8.930 8.930 8.369 0.561 19694
5093 1 11 . 1 1 89 89 CYS N N 89 122.270 122.270 119.205 3.065 19694
5094 1 11 . 1 1 89 89 CYS HA H 89 4.780 4.780 4.774 0.006 19694
5095 1 11 . 1 1 89 89 CYS CA C 89 57.640 57.640 58.951 -1.311 19694
5096 1 11 . 1 1 89 89 CYS CB C 89 30.940 30.940 27.798 3.142 19694
5097 1 11 . 1 1 89 89 CYS H H 89 9.430 9.430 9.013 0.417 19694
5098 1 11 . 1 1 90 90 THR N N 90 110.620 110.620 117.711 -7.091 19694
5099 1 11 . 1 1 90 90 THR HA H 90 3.900 3.900 3.970 -0.070 19694
5100 1 11 . 1 1 90 90 THR CA C 90 65.460 65.460 66.108 -0.648 19694
5101 1 11 . 1 1 90 90 THR CB C 90 68.670 68.670 68.728 -0.058 19694
5102 1 11 . 1 1 90 90 THR H H 90 8.410 8.410 9.044 -0.634 19694
5103 1 11 . 1 1 91 91 ASP N N 91 123.470 123.470 120.725 2.745 19694
5104 1 11 . 1 1 91 91 ASP HA H 91 4.490 4.490 4.623 -0.133 19694
5105 1 11 . 1 1 91 91 ASP CA C 91 57.810 57.810 57.475 0.335 19694
5106 1 11 . 1 1 91 91 ASP CB C 91 41.160 41.160 40.677 0.483 19694
5107 1 11 . 1 1 91 91 ASP H H 91 8.150 8.150 8.532 -0.382 19694
5108 1 11 . 1 1 92 92 CYS N N 92 123.800 123.800 119.325 4.475 19694
5109 1 11 . 1 1 92 92 CYS HA H 92 3.970 3.970 4.431 -0.461 19694
5110 1 11 . 1 1 92 92 CYS CA C 92 64.100 64.100 61.384 2.716 19694
5111 1 11 . 1 1 92 92 CYS CB C 92 30.090 30.090 26.565 3.525 19694
5112 1 11 . 1 1 92 92 CYS H H 92 8.580 8.580 8.073 0.507 19694
5113 1 11 . 1 1 93 93 TYR N N 93 120.730 120.730 121.553 -0.823 19694
5114 1 11 . 1 1 93 93 TYR HA H 93 4.140 4.140 4.225 -0.085 19694
5115 1 11 . 1 1 93 93 TYR CA C 93 60.380 60.380 61.333 -0.953 19694
5116 1 11 . 1 1 93 93 TYR CB C 93 39.300 39.300 38.455 0.845 19694
5117 1 11 . 1 1 93 93 TYR H H 93 8.540 8.540 9.085 -0.545 19694
5118 1 11 . 1 1 94 94 SER N N 94 115.010 115.010 113.005 2.005 19694
5119 1 11 . 1 1 94 94 SER HA H 94 4.220 4.220 4.137 0.083 19694
5120 1 11 . 1 1 94 94 SER CA C 94 59.300 59.300 60.819 -1.519 19694
5121 1 11 . 1 1 94 94 SER CB C 94 63.660 63.660 62.730 0.930 19694
5122 1 11 . 1 1 94 94 SER H H 94 7.750 7.750 8.071 -0.321 19694
5123 1 11 . 1 1 95 95 ASN N N 95 119.820 119.820 119.930 -0.110 19694
5124 1 11 . 1 1 95 95 ASN HA H 95 4.510 4.510 4.558 -0.048 19694
5125 1 11 . 1 1 95 95 ASN CA C 95 53.880 53.880 55.761 -1.881 19694
5126 1 11 . 1 1 95 95 ASN CB C 95 39.300 39.300 38.833 0.467 19694
5127 1 11 . 1 1 95 95 ASN H H 95 7.780 7.780 7.706 0.074 19694
5128 1 11 . 1 1 96 96 GLU N N 96 119.820 119.820 117.531 2.289 19694
5129 1 11 . 1 1 96 96 GLU HA H 96 4.096 4.096 4.206 -0.110 19694
5130 1 11 . 1 1 96 96 GLU CA C 96 56.910 56.910 57.060 -0.151 19694
5131 1 11 . 1 1 96 96 GLU CB C 96 30.220 30.220 29.018 1.202 19694
5132 1 11 . 1 1 96 96 GLU H H 96 7.950 7.950 7.848 0.102 19694
5133 1 11 . 1 1 97 97 TYR N N 97 120.370 120.370 121.109 -0.739 19694
5134 1 11 . 1 1 97 97 TYR HA H 97 4.620 4.620 3.935 0.685 19694
5135 1 11 . 1 1 97 97 TYR CA C 97 57.700 57.700 59.524 -1.824 19694
5136 1 11 . 1 1 97 97 TYR CB C 97 38.710 38.710 38.402 0.308 19694
5137 1 11 . 1 1 97 97 TYR H H 97 8.070 8.070 8.443 -0.373 19694
5138 1 12 . 1 1 2 2 THR N N 2 113.570 113.570 116.771 -3.201 19694
5139 1 12 . 1 1 2 2 THR HA H 2 4.240 4.240 4.343 -0.103 19694
5140 1 12 . 1 1 2 2 THR CA C 2 62.130 62.130 63.201 -1.071 19694
5141 1 12 . 1 1 2 2 THR CB C 2 69.250 69.250 69.168 0.082 19694
5142 1 12 . 1 1 2 2 THR H H 2 8.090 8.090 8.157 -0.067 19694
5143 1 12 . 1 1 3 3 GLU N N 3 122.880 122.880 120.247 2.633 19694
5144 1 12 . 1 1 3 3 GLU HA H 3 4.280 4.280 4.575 -0.295 19694
5145 1 12 . 1 1 3 3 GLU CA C 3 56.860 56.860 55.208 1.652 19694
5146 1 12 . 1 1 3 3 GLU CB C 3 30.570 30.570 30.729 -0.159 19694
5147 1 12 . 1 1 3 3 GLU H H 3 8.280 8.280 7.967 0.313 19694
5148 1 12 . 1 1 4 4 ARG N N 4 121.330 121.330 119.820 1.510 19694
5149 1 12 . 1 1 4 4 ARG HA H 4 4.300 4.300 4.632 -0.332 19694
5150 1 12 . 1 1 4 4 ARG CA C 4 55.870 55.870 55.130 0.740 19694
5151 1 12 . 1 1 4 4 ARG CB C 4 31.640 31.640 31.077 0.563 19694
5152 1 12 . 1 1 4 4 ARG H H 4 8.280 8.280 8.585 -0.305 19694
5153 1 12 . 1 1 5 5 PHE N N 5 125.490 125.490 125.279 0.211 19694
5154 1 12 . 1 1 5 5 PHE HA H 5 4.610 4.610 4.539 0.071 19694
5155 1 12 . 1 1 5 5 PHE CA C 5 56.380 56.380 56.458 -0.078 19694
5156 1 12 . 1 1 5 5 PHE CB C 5 39.560 39.560 39.394 0.166 19694
5157 1 12 . 1 1 5 5 PHE H H 5 8.290 8.290 8.861 -0.571 19694
5158 1 12 . 1 1 6 6 ASP N N 6 123.260 123.260 121.552 1.708 19694
5159 1 12 . 1 1 6 6 ASP HA H 6 5.045 5.045 4.847 0.198 19694
5160 1 12 . 1 1 6 6 ASP CA C 6 52.180 52.180 53.244 -1.064 19694
5161 1 12 . 1 1 6 6 ASP CB C 6 44.210 44.210 44.469 -0.259 19694
5162 1 12 . 1 1 6 6 ASP H H 6 7.940 7.940 7.573 0.367 19694
5163 1 12 . 1 1 7 7 CYS N N 7 121.440 121.440 122.939 -1.499 19694
5164 1 12 . 1 1 7 7 CYS HA H 7 3.960 3.960 4.447 -0.487 19694
5165 1 12 . 1 1 7 7 CYS CA C 7 59.820 59.820 59.621 0.199 19694
5166 1 12 . 1 1 7 7 CYS CB C 7 30.950 30.950 26.245 4.705 19694
5167 1 12 . 1 1 7 7 CYS H H 7 8.700 8.700 8.625 0.075 19694
5168 1 12 . 1 1 8 8 HIS N N 8 129.390 129.390 129.710 -0.320 19694
5169 1 12 . 1 1 8 8 HIS HA H 8 4.200 4.200 4.198 0.002 19694
5170 1 12 . 1 1 8 8 HIS CA C 8 58.240 58.240 59.284 -1.044 19694
5171 1 12 . 1 1 8 8 HIS CB C 8 29.480 29.480 30.147 -0.667 19694
5172 1 12 . 1 1 8 8 HIS H H 8 9.160 9.160 9.644 -0.484 19694
5173 1 12 . 1 1 9 9 HIS N N 9 118.740 118.740 117.410 1.330 19694
5174 1 12 . 1 1 9 9 HIS HA H 9 4.880 4.880 4.353 0.527 19694
5175 1 12 . 1 1 9 9 HIS CA C 9 58.680 58.680 57.267 1.413 19694
5176 1 12 . 1 1 9 9 HIS CB C 9 31.040 31.040 30.150 0.890 19694
5177 1 12 . 1 1 9 9 HIS H H 9 9.270 9.270 8.019 1.251 19694
5178 1 12 . 1 1 10 10 CYS N N 10 118.600 118.600 118.615 -0.015 19694
5179 1 12 . 1 1 10 10 CYS HA H 10 4.600 4.600 4.303 0.297 19694
5180 1 12 . 1 1 10 10 CYS CA C 10 59.600 59.600 59.496 0.104 19694
5181 1 12 . 1 1 10 10 CYS CB C 10 32.330 32.330 28.073 4.258 19694
5182 1 12 . 1 1 10 10 CYS H H 10 8.550 8.550 8.019 0.531 19694
5183 1 12 . 1 1 11 11 ASN N N 11 116.220 116.220 117.043 -0.823 19694
5184 1 12 . 1 1 11 11 ASN HA H 11 4.410 4.410 4.454 -0.044 19694
5185 1 12 . 1 1 11 11 ASN CA C 11 55.640 55.640 54.433 1.207 19694
5186 1 12 . 1 1 11 11 ASN CB C 11 38.200 38.200 35.924 2.276 19694
5187 1 12 . 1 1 11 11 ASN H H 11 7.690 7.690 8.861 -1.171 19694
5188 1 12 . 1 1 12 12 GLU N N 12 120.330 120.330 118.006 2.324 19694
5189 1 12 . 1 1 12 12 GLU HA H 12 4.220 4.220 4.538 -0.318 19694
5190 1 12 . 1 1 12 12 GLU CA C 12 56.700 56.700 54.812 1.888 19694
5191 1 12 . 1 1 12 12 GLU CB C 12 30.910 30.910 30.684 0.226 19694
5192 1 12 . 1 1 12 12 GLU H H 12 8.210 8.210 7.769 0.441 19694
5193 1 12 . 1 1 13 13 SER N N 13 116.190 116.190 120.195 -4.005 19694
5194 1 12 . 1 1 13 13 SER HA H 13 4.060 4.060 4.356 -0.296 19694
5195 1 12 . 1 1 13 13 SER CA C 13 59.350 59.350 58.661 0.689 19694
5196 1 12 . 1 1 13 13 SER CB C 13 63.820 63.820 63.632 0.188 19694
5197 1 12 . 1 1 13 13 SER H H 13 8.520 8.520 8.699 -0.179 19694
5198 1 12 . 1 1 14 14 LEU N N 14 126.060 126.060 126.240 -0.180 19694
5199 1 12 . 1 1 14 14 LEU HA H 14 4.310 4.310 4.350 -0.040 19694
5200 1 12 . 1 1 14 14 LEU CA C 14 54.100 54.100 55.970 -1.870 19694
5201 1 12 . 1 1 14 14 LEU CB C 14 42.200 42.200 41.666 0.534 19694
5202 1 12 . 1 1 14 14 LEU H H 14 8.910 8.910 7.731 1.179 19694
5203 1 12 . 1 1 15 15 PHE N N 15 120.660 120.660 120.955 -0.295 19694
5204 1 12 . 1 1 15 15 PHE HA H 15 4.480 4.480 4.607 -0.127 19694
5205 1 12 . 1 1 15 15 PHE CA C 15 60.400 60.400 56.152 4.248 19694
5206 1 12 . 1 1 15 15 PHE CB C 15 38.130 38.130 37.984 0.145 19694
5207 1 12 . 1 1 15 15 PHE H H 15 7.820 7.820 8.526 -0.706 19694
5208 1 12 . 1 1 16 16 GLY N N 16 114.730 114.730 110.949 3.781 19694
5209 1 12 . 1 1 16 16 GLY CA C 16 45.900 45.900 45.798 0.102 19694
5210 1 12 . 1 1 16 16 GLY H H 16 8.860 8.860 8.801 0.059 19694
5211 1 12 . 1 1 17 17 LYS N N 17 119.580 119.580 120.184 -0.604 19694
5212 1 12 . 1 1 17 17 LYS HA H 17 4.480 4.480 4.513 -0.033 19694
5213 1 12 . 1 1 17 17 LYS CA C 17 54.460 54.460 54.457 0.003 19694
5214 1 12 . 1 1 17 17 LYS CB C 17 35.800 35.800 34.307 1.492 19694
5215 1 12 . 1 1 17 17 LYS H H 17 8.030 8.030 7.242 0.788 19694
5216 1 12 . 1 1 18 18 LYS N N 18 120.330 120.330 122.238 -1.908 19694
5217 1 12 . 1 1 18 18 LYS HA H 18 4.280 4.280 4.316 -0.036 19694
5218 1 12 . 1 1 18 18 LYS CA C 18 56.800 56.800 57.442 -0.642 19694
5219 1 12 . 1 1 18 18 LYS CB C 18 33.010 33.010 32.757 0.253 19694
5220 1 12 . 1 1 18 18 LYS H H 18 8.190 8.190 8.458 -0.268 19694
5221 1 12 . 1 1 19 19 TYR N N 19 117.500 117.500 115.201 2.299 19694
5222 1 12 . 1 1 19 19 TYR HA H 19 5.240 5.240 4.836 0.404 19694
5223 1 12 . 1 1 19 19 TYR CA C 19 55.340 55.340 56.302 -0.962 19694
5224 1 12 . 1 1 19 19 TYR CB C 19 42.850 42.850 40.304 2.546 19694
5225 1 12 . 1 1 19 19 TYR H H 19 7.610 7.610 7.863 -0.253 19694
5226 1 12 . 1 1 20 20 ILE N N 20 121.430 121.430 121.836 -0.406 19694
5227 1 12 . 1 1 20 20 ILE HA H 20 4.137 4.137 4.258 -0.121 19694
5228 1 12 . 1 1 20 20 ILE CA C 20 60.010 60.010 60.138 -0.128 19694
5229 1 12 . 1 1 20 20 ILE CB C 20 41.570 41.570 40.594 0.976 19694
5230 1 12 . 1 1 20 20 ILE H H 20 9.350 9.350 8.239 1.111 19694
5231 1 12 . 1 1 21 21 LEU N N 21 126.720 126.720 126.205 0.515 19694
5232 1 12 . 1 1 21 21 LEU HA H 21 5.090 5.090 4.770 0.320 19694
5233 1 12 . 1 1 21 21 LEU CA C 21 54.020 54.020 53.957 0.063 19694
5234 1 12 . 1 1 21 21 LEU CB C 21 43.720 43.720 40.761 2.959 19694
5235 1 12 . 1 1 21 21 LEU H H 21 8.530 8.530 8.510 0.020 19694
5236 1 12 . 1 1 22 22 ARG N N 22 123.930 123.930 125.138 -1.208 19694
5237 1 12 . 1 1 22 22 ARG HA H 22 4.440 4.440 4.502 -0.062 19694
5238 1 12 . 1 1 22 22 ARG CA C 22 55.600 55.600 54.003 1.597 19694
5239 1 12 . 1 1 22 22 ARG CB C 22 32.280 32.280 32.515 -0.235 19694
5240 1 12 . 1 1 22 22 ARG H H 22 9.080 9.080 8.877 0.203 19694
5241 1 12 . 1 1 23 23 GLU N N 23 128.500 128.500 124.164 4.336 19694
5242 1 12 . 1 1 23 23 GLU HA H 23 3.840 3.840 3.934 -0.094 19694
5243 1 12 . 1 1 23 23 GLU CA C 23 58.030 58.030 57.342 0.688 19694
5244 1 12 . 1 1 23 23 GLU CB C 23 27.200 27.200 27.837 -0.637 19694
5245 1 12 . 1 1 23 23 GLU H H 23 9.610 9.610 9.030 0.580 19694
5246 1 12 . 1 1 24 24 GLU N N 24 110.300 110.300 112.893 -2.593 19694
5247 1 12 . 1 1 24 24 GLU HA H 24 3.780 3.780 3.894 -0.114 19694
5248 1 12 . 1 1 24 24 GLU CA C 24 58.320 58.320 57.404 0.916 19694
5249 1 12 . 1 1 24 24 GLU CB C 24 28.220 28.220 27.557 0.663 19694
5250 1 12 . 1 1 24 24 GLU H H 24 8.660 8.660 8.774 -0.114 19694
5251 1 12 . 1 1 25 25 SER N N 25 117.700 117.700 113.435 4.265 19694
5252 1 12 . 1 1 25 25 SER HA H 25 4.890 4.890 4.777 0.113 19694
5253 1 12 . 1 1 25 25 SER CA C 25 56.540 56.540 55.276 1.264 19694
5254 1 12 . 1 1 25 25 SER CB C 25 64.720 64.720 65.129 -0.409 19694
5255 1 12 . 1 1 25 25 SER H H 25 7.900 7.900 7.741 0.159 19694
5256 1 12 . 1 1 26 26 PRO HA H 26 4.995 4.995 4.851 0.144 19694
5257 1 12 . 1 1 26 26 PRO CA C 26 61.750 61.750 62.985 -1.235 19694
5258 1 12 . 1 1 26 26 PRO CB C 26 32.660 32.660 31.826 0.834 19694
5259 1 12 . 1 1 27 27 TYR N N 27 118.100 118.100 123.553 -5.453 19694
5260 1 12 . 1 1 27 27 TYR HA H 27 5.910 5.910 4.979 0.931 19694
5261 1 12 . 1 1 27 27 TYR CA C 27 56.830 56.830 54.897 1.933 19694
5262 1 12 . 1 1 27 27 TYR CB C 27 42.810 42.810 42.520 0.290 19694
5263 1 12 . 1 1 27 27 TYR H H 27 9.040 9.040 8.716 0.324 19694
5264 1 12 . 1 1 28 28 CYS N N 28 122.230 122.230 119.158 3.072 19694
5265 1 12 . 1 1 28 28 CYS HA H 28 4.850 4.850 4.723 0.127 19694
5266 1 12 . 1 1 28 28 CYS CA C 28 58.110 58.110 58.065 0.045 19694
5267 1 12 . 1 1 28 28 CYS CB C 28 30.530 30.530 29.153 1.377 19694
5268 1 12 . 1 1 28 28 CYS H H 28 9.850 9.850 8.355 1.495 19694
5269 1 12 . 1 1 29 29 VAL N N 29 118.200 118.200 123.264 -5.064 19694
5270 1 12 . 1 1 29 29 VAL HA H 29 3.650 3.650 3.642 0.008 19694
5271 1 12 . 1 1 29 29 VAL CA C 29 67.400 67.400 66.658 0.742 19694
5272 1 12 . 1 1 29 29 VAL CB C 29 31.860 31.860 31.552 0.308 19694
5273 1 12 . 1 1 29 29 VAL H H 29 8.430 8.430 8.937 -0.507 19694
5274 1 12 . 1 1 30 30 VAL N N 30 119.570 119.570 118.699 0.871 19694
5275 1 12 . 1 1 30 30 VAL HA H 30 3.860 3.860 3.535 0.325 19694
5276 1 12 . 1 1 30 30 VAL CA C 30 66.450 66.450 66.027 0.423 19694
5277 1 12 . 1 1 30 30 VAL CB C 30 31.540 31.540 31.180 0.360 19694
5278 1 12 . 1 1 30 30 VAL H H 30 7.700 7.700 8.168 -0.468 19694
5279 1 12 . 1 1 31 31 CYS N N 31 125.890 125.890 119.215 6.675 19694
5280 1 12 . 1 1 31 31 CYS HA H 31 3.830 3.830 3.881 -0.051 19694
5281 1 12 . 1 1 31 31 CYS CA C 31 65.850 65.850 64.264 1.586 19694
5282 1 12 . 1 1 31 31 CYS CB C 31 29.510 29.510 25.483 4.027 19694
5283 1 12 . 1 1 31 31 CYS H H 31 9.050 9.050 7.662 1.388 19694
5284 1 12 . 1 1 32 32 PHE N N 32 119.000 119.000 119.316 -0.316 19694
5285 1 12 . 1 1 32 32 PHE HA H 32 3.780 3.780 3.681 0.099 19694
5286 1 12 . 1 1 32 32 PHE CA C 32 62.610 62.610 61.755 0.855 19694
5287 1 12 . 1 1 32 32 PHE CB C 32 39.920 39.920 39.027 0.893 19694
5288 1 12 . 1 1 32 32 PHE H H 32 9.080 9.080 7.883 1.197 19694
5289 1 12 . 1 1 33 33 GLU N N 33 117.470 117.470 118.205 -0.735 19694
5290 1 12 . 1 1 33 33 GLU HA H 33 3.760 3.760 4.053 -0.293 19694
5291 1 12 . 1 1 33 33 GLU CA C 33 59.210 59.210 59.421 -0.211 19694
5292 1 12 . 1 1 33 33 GLU CB C 33 29.480 29.480 29.230 0.250 19694
5293 1 12 . 1 1 33 33 GLU H H 33 8.510 8.510 8.248 0.262 19694
5294 1 12 . 1 1 34 34 THR N N 34 114.140 114.140 115.447 -1.307 19694
5295 1 12 . 1 1 34 34 THR HA H 34 3.730 3.730 3.896 -0.166 19694
5296 1 12 . 1 1 34 34 THR CA C 34 65.890 65.890 66.075 -0.185 19694
5297 1 12 . 1 1 34 34 THR CB C 34 69.210 69.210 68.730 0.480 19694
5298 1 12 . 1 1 34 34 THR H H 34 7.880 7.880 8.302 -0.422 19694
5299 1 12 . 1 1 35 35 LEU N N 35 117.980 117.980 118.855 -0.875 19694
5300 1 12 . 1 1 35 35 LEU HA H 35 3.650 3.650 3.949 -0.299 19694
5301 1 12 . 1 1 35 35 LEU CA C 35 56.860 56.860 57.242 -0.382 19694
5302 1 12 . 1 1 35 35 LEU CB C 35 41.870 41.870 41.812 0.058 19694
5303 1 12 . 1 1 35 35 LEU H H 35 7.660 7.660 7.739 -0.079 19694
5304 1 12 . 1 1 36 36 PHE N N 36 113.900 113.900 112.957 0.943 19694
5305 1 12 . 1 1 36 36 PHE HA H 36 4.597 4.597 4.469 0.128 19694
5306 1 12 . 1 1 36 36 PHE CA C 36 56.860 56.860 56.440 0.420 19694
5307 1 12 . 1 1 36 36 PHE CB C 36 40.570 40.570 38.275 2.295 19694
5308 1 12 . 1 1 36 36 PHE H H 36 7.730 7.730 6.685 1.045 19694
5309 1 12 . 1 1 37 37 ALA N N 37 121.920 121.920 123.209 -1.289 19694
5310 1 12 . 1 1 37 37 ALA HA H 37 4.070 4.070 4.114 -0.044 19694
5311 1 12 . 1 1 37 37 ALA CA C 37 52.900 52.900 52.307 0.593 19694
5312 1 12 . 1 1 37 37 ALA CB C 37 19.770 19.770 19.472 0.298 19694
5313 1 12 . 1 1 37 37 ALA H H 37 7.090 7.090 7.787 -0.697 19694
5314 1 12 . 1 1 38 38 ASN N N 38 119.230 119.230 119.426 -0.196 19694
5315 1 12 . 1 1 38 38 ASN HA H 38 4.450 4.450 4.647 -0.197 19694
5316 1 12 . 1 1 38 38 ASN CA C 38 52.850 52.850 52.683 0.167 19694
5317 1 12 . 1 1 38 38 ASN CB C 38 38.950 38.950 39.980 -1.030 19694
5318 1 12 . 1 1 38 38 ASN H H 38 8.790 8.790 8.478 0.312 19694
5319 1 12 . 1 1 39 39 THR N N 39 116.330 116.330 115.975 0.355 19694
5320 1 12 . 1 1 39 39 THR HA H 39 3.990 3.990 4.457 -0.467 19694
5321 1 12 . 1 1 39 39 THR CA C 39 62.130 62.130 62.970 -0.840 19694
5322 1 12 . 1 1 39 39 THR CB C 39 69.920 69.920 69.604 0.316 19694
5323 1 12 . 1 1 39 39 THR H H 39 8.540 8.540 8.144 0.396 19694
5324 1 12 . 1 1 40 40 CYS N N 40 126.950 126.950 128.261 -1.311 19694
5325 1 12 . 1 1 40 40 CYS HA H 40 4.300 4.300 4.461 -0.161 19694
5326 1 12 . 1 1 40 40 CYS CA C 40 58.350 58.350 57.170 1.180 19694
5327 1 12 . 1 1 40 40 CYS CB C 40 31.600 31.600 26.645 4.955 19694
5328 1 12 . 1 1 40 40 CYS H H 40 7.940 7.940 8.457 -0.517 19694
5329 1 12 . 1 1 41 41 GLU N N 41 130.560 130.560 127.623 2.937 19694
5330 1 12 . 1 1 41 41 GLU HA H 41 3.690 3.690 3.838 -0.148 19694
5331 1 12 . 1 1 41 41 GLU CA C 41 58.600 58.600 59.138 -0.538 19694
5332 1 12 . 1 1 41 41 GLU CB C 41 30.460 30.460 29.419 1.041 19694
5333 1 12 . 1 1 41 41 GLU H H 41 8.810 8.810 8.652 0.158 19694
5334 1 12 . 1 1 42 42 GLU N N 42 119.680 119.680 118.294 1.386 19694
5335 1 12 . 1 1 42 42 GLU HA H 42 4.570 4.570 4.347 0.223 19694
5336 1 12 . 1 1 42 42 GLU CA C 42 58.000 58.000 58.136 -0.136 19694
5337 1 12 . 1 1 42 42 GLU CB C 42 31.680 31.680 30.555 1.125 19694
5338 1 12 . 1 1 42 42 GLU H H 42 8.500 8.500 8.119 0.381 19694
5339 1 12 . 1 1 43 43 CYS N N 43 115.600 115.600 116.383 -0.783 19694
5340 1 12 . 1 1 43 43 CYS HA H 43 5.010 5.010 4.559 0.451 19694
5341 1 12 . 1 1 43 43 CYS CA C 43 58.810 58.810 60.150 -1.340 19694
5342 1 12 . 1 1 43 43 CYS CB C 43 31.580 31.580 29.261 2.319 19694
5343 1 12 . 1 1 43 43 CYS H H 43 8.120 8.120 7.955 0.165 19694
5344 1 12 . 1 1 44 44 GLY N N 44 112.100 112.100 106.966 5.134 19694
5345 1 12 . 1 1 44 44 GLY CA C 44 46.420 46.420 45.371 1.049 19694
5346 1 12 . 1 1 44 44 GLY H H 44 7.900 7.900 8.615 -0.715 19694
5347 1 12 . 1 1 45 45 LYS N N 45 121.210 121.210 121.859 -0.649 19694
5348 1 12 . 1 1 45 45 LYS HA H 45 4.840 4.840 4.743 0.097 19694
5349 1 12 . 1 1 45 45 LYS CA C 45 54.360 54.360 52.637 1.723 19694
5350 1 12 . 1 1 45 45 LYS CB C 45 32.430 32.430 32.352 0.078 19694
5351 1 12 . 1 1 45 45 LYS H H 45 8.180 8.180 7.849 0.331 19694
5352 1 12 . 1 1 46 46 PRO HA H 46 4.477 4.477 4.558 -0.081 19694
5353 1 12 . 1 1 46 46 PRO CA C 46 62.700 62.700 63.028 -0.328 19694
5354 1 12 . 1 1 46 46 PRO CB C 46 32.490 32.490 32.053 0.437 19694
5355 1 12 . 1 1 47 47 ILE N N 47 125.280 125.280 123.099 2.181 19694
5356 1 12 . 1 1 47 47 ILE HA H 47 3.830 3.830 4.273 -0.443 19694
5357 1 12 . 1 1 47 47 ILE CA C 47 61.040 61.040 60.745 0.295 19694
5358 1 12 . 1 1 47 47 ILE CB C 47 37.440 37.440 37.679 -0.239 19694
5359 1 12 . 1 1 47 47 ILE H H 47 8.540 8.540 8.863 -0.323 19694
5360 1 12 . 1 1 48 48 GLY N N 48 114.120 114.120 113.543 0.577 19694
5361 1 12 . 1 1 48 48 GLY CA C 48 45.240 45.240 44.644 0.596 19694
5362 1 12 . 1 1 48 48 GLY H H 48 8.660 8.660 8.469 0.191 19694
5363 1 12 . 1 1 49 49 CYS N N 49 117.140 117.140 123.080 -5.940 19694
5364 1 12 . 1 1 49 49 CYS HA H 49 4.280 4.280 4.289 -0.009 19694
5365 1 12 . 1 1 49 49 CYS CA C 49 60.880 60.880 60.321 0.559 19694
5366 1 12 . 1 1 49 49 CYS CB C 49 27.650 27.650 27.491 0.159 19694
5367 1 12 . 1 1 49 49 CYS H H 49 9.210 9.210 9.220 -0.010 19694
5368 1 12 . 1 1 50 50 ASP N N 50 119.300 119.300 119.562 -0.262 19694
5369 1 12 . 1 1 50 50 ASP HA H 50 4.620 4.620 4.592 0.028 19694
5370 1 12 . 1 1 50 50 ASP CA C 50 54.160 54.160 54.524 -0.364 19694
5371 1 12 . 1 1 50 50 ASP CB C 50 40.380 40.380 39.257 1.123 19694
5372 1 12 . 1 1 50 50 ASP H H 50 8.800 8.800 8.483 0.317 19694
5373 1 12 . 1 1 51 51 CYS N N 51 118.150 118.150 116.777 1.373 19694
5374 1 12 . 1 1 51 51 CYS HA H 51 4.620 4.620 4.626 -0.006 19694
5375 1 12 . 1 1 51 51 CYS CA C 51 58.030 58.030 57.356 0.674 19694
5376 1 12 . 1 1 51 51 CYS CB C 51 30.090 30.090 31.585 -1.495 19694
5377 1 12 . 1 1 51 51 CYS H H 51 7.590 7.590 7.398 0.192 19694
5378 1 12 . 1 1 52 52 LYS N N 52 123.800 123.800 122.973 0.827 19694
5379 1 12 . 1 1 52 52 LYS HA H 52 4.180 4.180 4.362 -0.182 19694
5380 1 12 . 1 1 52 52 LYS CA C 52 57.240 57.240 55.666 1.574 19694
5381 1 12 . 1 1 52 52 LYS CB C 52 33.030 33.030 30.906 2.124 19694
5382 1 12 . 1 1 52 52 LYS H H 52 8.600 8.600 8.566 0.034 19694
5383 1 12 . 1 1 53 53 ASP N N 53 124.900 124.900 123.685 1.215 19694
5384 1 12 . 1 1 53 53 ASP HA H 53 4.230 4.230 4.694 -0.464 19694
5385 1 12 . 1 1 53 53 ASP CA C 53 53.130 53.130 53.003 0.127 19694
5386 1 12 . 1 1 53 53 ASP CB C 53 42.230 42.230 40.468 1.762 19694
5387 1 12 . 1 1 53 53 ASP H H 53 8.250 8.250 8.321 -0.071 19694
5388 1 12 . 1 1 54 54 LEU N N 54 130.160 130.160 124.840 5.320 19694
5389 1 12 . 1 1 54 54 LEU HA H 54 4.440 4.440 4.574 -0.134 19694
5390 1 12 . 1 1 54 54 LEU CA C 54 53.340 53.340 55.171 -1.831 19694
5391 1 12 . 1 1 54 54 LEU CB C 54 41.170 41.170 43.109 -1.939 19694
5392 1 12 . 1 1 54 54 LEU H H 54 8.670 8.670 8.917 -0.247 19694
5393 1 12 . 1 1 55 55 SER N N 55 113.820 113.820 121.711 -7.891 19694
5394 1 12 . 1 1 55 55 SER HA H 55 5.580 5.580 5.202 0.378 19694
5395 1 12 . 1 1 55 55 SER CA C 55 55.850 55.850 57.221 -1.371 19694
5396 1 12 . 1 1 55 55 SER CB C 55 67.300 67.300 64.615 2.685 19694
5397 1 12 . 1 1 55 55 SER H H 55 8.160 8.160 8.605 -0.445 19694
5398 1 12 . 1 1 56 56 TYR N N 56 122.610 122.610 125.568 -2.958 19694
5399 1 12 . 1 1 56 56 TYR HA H 56 4.620 4.620 4.645 -0.025 19694
5400 1 12 . 1 1 56 56 TYR CA C 56 58.810 58.810 58.320 0.490 19694
5401 1 12 . 1 1 56 56 TYR CB C 56 41.000 41.000 42.700 -1.700 19694
5402 1 12 . 1 1 56 56 TYR H H 56 8.450 8.450 9.074 -0.624 19694
5403 1 12 . 1 1 57 57 LYS N N 57 126.020 126.020 128.746 -2.726 19694
5404 1 12 . 1 1 57 57 LYS HA H 57 3.470 3.470 3.864 -0.394 19694
5405 1 12 . 1 1 57 57 LYS CA C 57 58.100 58.100 57.431 0.668 19694
5406 1 12 . 1 1 57 57 LYS CB C 57 29.480 29.480 32.014 -2.534 19694
5407 1 12 . 1 1 57 57 LYS H H 57 8.920 8.920 8.632 0.288 19694
5408 1 12 . 1 1 58 58 ASP HA H 58 3.830 3.830 4.218 -0.388 19694
5409 1 12 . 1 1 58 58 ASP CA C 58 54.900 54.900 55.405 -0.505 19694
5410 1 12 . 1 1 58 58 ASP CB C 58 40.080 40.080 40.642 -0.562 19694
5411 1 12 . 1 1 58 58 ASP H H 58 8.400 8.400 8.554 -0.154 19694
5412 1 12 . 1 1 59 59 ARG N N 59 121.190 121.190 115.971 5.219 19694
5413 1 12 . 1 1 59 59 ARG HA H 59 4.250 4.250 4.532 -0.282 19694
5414 1 12 . 1 1 59 59 ARG CA C 59 55.580 55.580 54.093 1.486 19694
5415 1 12 . 1 1 59 59 ARG CB C 59 33.460 33.460 33.398 0.062 19694
5416 1 12 . 1 1 59 59 ARG H H 59 7.980 7.980 7.866 0.114 19694
5417 1 12 . 1 1 60 60 HIS N N 60 118.420 118.420 117.734 0.686 19694
5418 1 12 . 1 1 60 60 HIS HA H 60 5.270 5.270 5.650 -0.380 19694
5419 1 12 . 1 1 60 60 HIS CA C 60 55.010 55.010 55.240 -0.230 19694
5420 1 12 . 1 1 60 60 HIS CB C 60 32.380 32.380 33.348 -0.968 19694
5421 1 12 . 1 1 60 60 HIS H H 60 8.350 8.350 8.112 0.238 19694
5422 1 12 . 1 1 61 61 TRP N N 61 119.990 119.990 118.346 1.644 19694
5423 1 12 . 1 1 61 61 TRP HA H 61 5.930 5.930 4.792 1.138 19694
5424 1 12 . 1 1 61 61 TRP CA C 61 57.400 57.400 57.133 0.267 19694
5425 1 12 . 1 1 61 61 TRP CB C 61 35.380 35.380 34.223 1.157 19694
5426 1 12 . 1 1 61 61 TRP H H 61 9.310 9.310 9.325 -0.015 19694
5427 1 12 . 1 1 62 62 HIS N N 62 117.270 117.270 121.460 -4.190 19694
5428 1 12 . 1 1 62 62 HIS HA H 62 4.600 4.600 4.819 -0.219 19694
5429 1 12 . 1 1 62 62 HIS CA C 62 59.210 59.210 57.509 1.701 19694
5430 1 12 . 1 1 62 62 HIS CB C 62 31.200 31.200 30.520 0.680 19694
5431 1 12 . 1 1 62 62 HIS H H 62 8.430 8.430 9.140 -0.710 19694
5432 1 12 . 1 1 63 63 GLU N N 63 124.640 124.640 128.801 -4.161 19694
5433 1 12 . 1 1 63 63 GLU HA H 63 3.827 3.827 3.970 -0.143 19694
5434 1 12 . 1 1 63 63 GLU CA C 63 61.020 61.020 59.652 1.368 19694
5435 1 12 . 1 1 63 63 GLU CB C 63 30.310 30.310 29.708 0.602 19694
5436 1 12 . 1 1 63 63 GLU H H 63 9.040 9.040 8.424 0.616 19694
5437 1 12 . 1 1 64 64 ALA N N 64 117.050 117.050 117.777 -0.727 19694
5438 1 12 . 1 1 64 64 ALA HA H 64 4.230 4.230 4.213 0.017 19694
5439 1 12 . 1 1 64 64 ALA CA C 64 54.000 54.000 52.967 1.033 19694
5440 1 12 . 1 1 64 64 ALA CB C 64 18.880 18.880 19.048 -0.168 19694
5441 1 12 . 1 1 64 64 ALA H H 64 8.680 8.680 8.296 0.384 19694
5442 1 12 . 1 1 65 65 CYS N N 65 115.380 115.380 116.994 -1.614 19694
5443 1 12 . 1 1 65 65 CYS HA H 65 4.295 4.295 3.962 0.333 19694
5444 1 12 . 1 1 65 65 CYS CA C 65 59.850 59.850 60.167 -0.317 19694
5445 1 12 . 1 1 65 65 CYS CB C 65 32.840 32.840 27.168 5.672 19694
5446 1 12 . 1 1 65 65 CYS H H 65 7.490 7.490 8.125 -0.635 19694
5447 1 12 . 1 1 66 66 PHE N N 66 122.020 122.020 123.045 -1.025 19694
5448 1 12 . 1 1 66 66 PHE HA H 66 3.890 3.890 3.947 -0.057 19694
5449 1 12 . 1 1 66 66 PHE CA C 66 57.010 57.010 58.675 -1.665 19694
5450 1 12 . 1 1 66 66 PHE CB C 66 38.070 38.070 38.207 -0.137 19694
5451 1 12 . 1 1 66 66 PHE H H 66 7.110 7.110 7.593 -0.483 19694
5452 1 12 . 1 1 67 67 HIS N N 67 121.280 121.280 122.136 -0.856 19694
5453 1 12 . 1 1 67 67 HIS HA H 67 4.720 4.720 5.189 -0.469 19694
5454 1 12 . 1 1 67 67 HIS CA C 67 52.730 52.730 52.917 -0.187 19694
5455 1 12 . 1 1 67 67 HIS CB C 67 32.230 32.230 30.708 1.522 19694
5456 1 12 . 1 1 67 67 HIS H H 67 7.380 7.380 8.073 -0.693 19694
5457 1 12 . 1 1 68 68 CYS N N 68 121.590 121.590 118.643 2.947 19694
5458 1 12 . 1 1 68 68 CYS HA H 68 3.960 3.960 4.886 -0.926 19694
5459 1 12 . 1 1 68 68 CYS CA C 68 59.790 59.790 57.856 1.934 19694
5460 1 12 . 1 1 68 68 CYS CB C 68 31.200 31.200 29.324 1.876 19694
5461 1 12 . 1 1 68 68 CYS H H 68 8.530 8.530 8.302 0.228 19694
5462 1 12 . 1 1 69 69 SER N N 69 126.530 126.530 120.026 6.504 19694
5463 1 12 . 1 1 69 69 SER HA H 69 4.310 4.310 3.960 0.350 19694
5464 1 12 . 1 1 69 69 SER CA C 69 61.760 61.760 60.829 0.931 19694
5465 1 12 . 1 1 69 69 SER CB C 69 64.040 64.040 62.992 1.048 19694
5466 1 12 . 1 1 69 69 SER H H 69 9.460 9.460 8.645 0.815 19694
5467 1 12 . 1 1 70 70 GLN N N 70 122.370 122.370 118.455 3.915 19694
5468 1 12 . 1 1 70 70 GLN HA H 70 4.510 4.510 4.351 0.159 19694
5469 1 12 . 1 1 70 70 GLN CA C 70 57.840 57.840 57.412 0.428 19694
5470 1 12 . 1 1 70 70 GLN CB C 70 30.430 30.430 29.356 1.074 19694
5471 1 12 . 1 1 70 70 GLN H H 70 8.980 8.980 7.895 1.085 19694
5472 1 12 . 1 1 71 71 CYS N N 71 118.860 118.860 115.632 3.228 19694
5473 1 12 . 1 1 71 71 CYS HA H 71 4.720 4.720 4.733 -0.013 19694
5474 1 12 . 1 1 71 71 CYS CA C 71 59.770 59.770 58.398 1.372 19694
5475 1 12 . 1 1 71 71 CYS CB C 71 31.910 31.910 28.291 3.619 19694
5476 1 12 . 1 1 71 71 CYS H H 71 8.220 8.220 7.669 0.551 19694
5477 1 12 . 1 1 72 72 ARG N N 72 114.380 114.380 115.729 -1.349 19694
5478 1 12 . 1 1 72 72 ARG HA H 72 3.965 3.965 3.831 0.134 19694
5479 1 12 . 1 1 72 72 ARG CA C 72 58.030 58.030 57.249 0.781 19694
5480 1 12 . 1 1 72 72 ARG CB C 72 27.720 27.720 27.037 0.683 19694
5481 1 12 . 1 1 72 72 ARG H H 72 7.380 7.380 7.779 -0.399 19694
5482 1 12 . 1 1 73 73 ASN N N 73 121.480 121.480 116.386 5.094 19694
5483 1 12 . 1 1 73 73 ASN HA H 73 4.630 4.630 4.656 -0.026 19694
5484 1 12 . 1 1 73 73 ASN CA C 73 54.110 54.110 53.993 0.117 19694
5485 1 12 . 1 1 73 73 ASN CB C 73 38.870 38.870 39.626 -0.756 19694
5486 1 12 . 1 1 73 73 ASN H H 73 8.722 8.722 8.167 0.555 19694
5487 1 12 . 1 1 74 74 SER N N 74 114.710 114.710 117.722 -3.012 19694
5488 1 12 . 1 1 74 74 SER HA H 74 4.060 4.060 4.800 -0.740 19694
5489 1 12 . 1 1 74 74 SER CA C 74 59.357 59.357 58.107 1.250 19694
5490 1 12 . 1 1 74 74 SER CB C 74 63.300 63.300 62.655 0.645 19694
5491 1 12 . 1 1 74 74 SER H H 74 8.690 8.690 8.504 0.186 19694
5492 1 12 . 1 1 75 75 LEU N N 75 125.757 125.757 128.058 -2.301 19694
5493 1 12 . 1 1 75 75 LEU HA H 75 4.280 4.280 4.258 0.022 19694
5494 1 12 . 1 1 75 75 LEU CA C 75 53.510 53.510 54.820 -1.310 19694
5495 1 12 . 1 1 75 75 LEU CB C 75 42.200 42.200 41.781 0.419 19694
5496 1 12 . 1 1 75 75 LEU H H 75 7.970 7.970 7.998 -0.028 19694
5497 1 12 . 1 1 76 76 VAL N N 76 120.860 120.860 123.893 -3.033 19694
5498 1 12 . 1 1 76 76 VAL HA H 76 3.570 3.570 3.883 -0.313 19694
5499 1 12 . 1 1 76 76 VAL CA C 76 65.420 65.420 60.748 4.672 19694
5500 1 12 . 1 1 76 76 VAL CB C 76 31.540 31.540 35.327 -3.787 19694
5501 1 12 . 1 1 76 76 VAL H H 76 7.830 7.830 8.005 -0.175 19694
5502 1 12 . 1 1 77 77 ASP N N 77 122.360 122.360 121.643 0.717 19694
5503 1 12 . 1 1 77 77 ASP HA H 77 4.230 4.230 4.426 -0.196 19694
5504 1 12 . 1 1 77 77 ASP CA C 77 56.200 56.200 55.756 0.444 19694
5505 1 12 . 1 1 77 77 ASP CB C 77 39.380 39.380 40.389 -1.009 19694
5506 1 12 . 1 1 77 77 ASP H H 77 8.910 8.910 8.438 0.472 19694
5507 1 12 . 1 1 78 78 LYS N N 78 118.100 118.100 118.951 -0.851 19694
5508 1 12 . 1 1 78 78 LYS HA H 78 4.870 4.870 4.616 0.254 19694
5509 1 12 . 1 1 78 78 LYS CA C 78 56.960 56.960 53.452 3.508 19694
5510 1 12 . 1 1 78 78 LYS CB C 78 34.680 34.680 33.891 0.789 19694
5511 1 12 . 1 1 78 78 LYS H H 78 7.660 7.660 7.593 0.067 19694
5512 1 12 . 1 1 79 79 PRO HA H 79 4.460 4.460 4.227 0.233 19694
5513 1 12 . 1 1 79 79 PRO CA C 79 62.520 62.520 62.909 -0.389 19694
5514 1 12 . 1 1 79 79 PRO CB C 79 32.160 32.160 31.906 0.254 19694
5515 1 12 . 1 1 80 80 PHE N N 80 114.050 114.050 116.969 -2.919 19694
5516 1 12 . 1 1 80 80 PHE HA H 80 4.910 4.910 5.047 -0.137 19694
5517 1 12 . 1 1 80 80 PHE CA C 80 56.060 56.060 55.092 0.968 19694
5518 1 12 . 1 1 80 80 PHE CB C 80 42.410 42.410 41.920 0.490 19694
5519 1 12 . 1 1 80 80 PHE H H 80 7.510 7.510 7.192 0.318 19694
5520 1 12 . 1 1 81 81 ALA N N 81 123.290 123.290 123.619 -0.329 19694
5521 1 12 . 1 1 81 81 ALA HA H 81 4.310 4.310 4.367 -0.057 19694
5522 1 12 . 1 1 81 81 ALA CA C 81 50.450 50.450 50.411 0.039 19694
5523 1 12 . 1 1 81 81 ALA CB C 81 21.920 21.920 18.920 3.000 19694
5524 1 12 . 1 1 81 81 ALA H H 81 9.030 9.030 8.874 0.156 19694
5525 1 12 . 1 1 82 82 ALA N N 82 122.490 122.490 129.051 -6.561 19694
5526 1 12 . 1 1 82 82 ALA HA H 82 5.110 5.110 4.395 0.715 19694
5527 1 12 . 1 1 82 82 ALA CA C 82 51.100 51.100 51.811 -0.711 19694
5528 1 12 . 1 1 82 82 ALA CB C 82 21.130 21.130 18.842 2.288 19694
5529 1 12 . 1 1 82 82 ALA H H 82 8.240 8.240 8.620 -0.380 19694
5530 1 12 . 1 1 83 83 LYS N N 83 123.580 123.580 125.979 -2.399 19694
5531 1 12 . 1 1 83 83 LYS HA H 83 4.490 4.490 4.516 -0.026 19694
5532 1 12 . 1 1 83 83 LYS CA C 83 55.800 55.800 55.386 0.414 19694
5533 1 12 . 1 1 83 83 LYS CB C 83 34.720 34.720 34.135 0.585 19694
5534 1 12 . 1 1 83 83 LYS H H 83 8.400 8.400 8.218 0.182 19694
5535 1 12 . 1 1 84 84 GLU N N 84 125.470 125.470 120.690 4.780 19694
5536 1 12 . 1 1 84 84 GLU HA H 84 3.820 3.820 4.116 -0.296 19694
5537 1 12 . 1 1 84 84 GLU CA C 84 58.620 58.620 59.009 -0.389 19694
5538 1 12 . 1 1 84 84 GLU CB C 84 27.210 27.210 29.745 -2.535 19694
5539 1 12 . 1 1 84 84 GLU H H 84 9.320 9.320 8.776 0.544 19694
5540 1 12 . 1 1 85 85 ASP N N 85 118.550 118.550 114.081 4.469 19694
5541 1 12 . 1 1 85 85 ASP HA H 85 4.600 4.600 4.766 -0.166 19694
5542 1 12 . 1 1 85 85 ASP CA C 85 55.400 55.400 54.090 1.310 19694
5543 1 12 . 1 1 85 85 ASP CB C 85 40.400 40.400 41.918 -1.518 19694
5544 1 12 . 1 1 85 85 ASP H H 85 8.730 8.730 8.201 0.529 19694
5545 1 12 . 1 1 86 86 GLN N N 86 119.050 119.050 116.672 2.378 19694
5546 1 12 . 1 1 86 86 GLN HA H 86 4.540 4.540 4.666 -0.126 19694
5547 1 12 . 1 1 86 86 GLN CA C 86 55.100 55.100 53.856 1.244 19694
5548 1 12 . 1 1 86 86 GLN CB C 86 31.110 31.110 31.872 -0.762 19694
5549 1 12 . 1 1 86 86 GLN H H 86 8.170 8.170 7.575 0.595 19694
5550 1 12 . 1 1 87 87 LEU N N 87 123.110 123.110 121.344 1.766 19694
5551 1 12 . 1 1 87 87 LEU HA H 87 4.620 4.620 5.171 -0.551 19694
5552 1 12 . 1 1 87 87 LEU CA C 87 54.520 54.520 54.024 0.496 19694
5553 1 12 . 1 1 87 87 LEU CB C 87 42.700 42.700 44.491 -1.791 19694
5554 1 12 . 1 1 87 87 LEU H H 87 8.490 8.490 8.493 -0.003 19694
5555 1 12 . 1 1 88 88 LEU N N 88 123.690 123.690 120.206 3.484 19694
5556 1 12 . 1 1 88 88 LEU HA H 88 5.880 5.880 4.942 0.938 19694
5557 1 12 . 1 1 88 88 LEU CA C 88 53.340 53.340 52.777 0.563 19694
5558 1 12 . 1 1 88 88 LEU CB C 88 47.190 47.190 47.771 -0.581 19694
5559 1 12 . 1 1 88 88 LEU H H 88 8.930 8.930 8.337 0.593 19694
5560 1 12 . 1 1 89 89 CYS N N 89 122.270 122.270 119.004 3.266 19694
5561 1 12 . 1 1 89 89 CYS HA H 89 4.780 4.780 4.850 -0.070 19694
5562 1 12 . 1 1 89 89 CYS CA C 89 57.640 57.640 59.190 -1.550 19694
5563 1 12 . 1 1 89 89 CYS CB C 89 30.940 30.940 27.985 2.955 19694
5564 1 12 . 1 1 89 89 CYS H H 89 9.430 9.430 9.066 0.364 19694
5565 1 12 . 1 1 90 90 THR N N 90 110.620 110.620 115.943 -5.323 19694
5566 1 12 . 1 1 90 90 THR HA H 90 3.900 3.900 3.953 -0.053 19694
5567 1 12 . 1 1 90 90 THR CA C 90 65.460 65.460 65.644 -0.184 19694
5568 1 12 . 1 1 90 90 THR CB C 90 68.670 68.670 68.828 -0.158 19694
5569 1 12 . 1 1 90 90 THR H H 90 8.410 8.410 8.883 -0.473 19694
5570 1 12 . 1 1 91 91 ASP N N 91 123.470 123.470 122.144 1.326 19694
5571 1 12 . 1 1 91 91 ASP HA H 91 4.490 4.490 4.638 -0.148 19694
5572 1 12 . 1 1 91 91 ASP CA C 91 57.810 57.810 56.353 1.457 19694
5573 1 12 . 1 1 91 91 ASP CB C 91 41.160 41.160 39.854 1.306 19694
5574 1 12 . 1 1 91 91 ASP H H 91 8.150 8.150 8.307 -0.157 19694
5575 1 12 . 1 1 92 92 CYS N N 92 123.800 123.800 120.008 3.792 19694
5576 1 12 . 1 1 92 92 CYS HA H 92 3.970 3.970 4.269 -0.299 19694
5577 1 12 . 1 1 92 92 CYS CA C 92 64.100 64.100 61.854 2.246 19694
5578 1 12 . 1 1 92 92 CYS CB C 92 30.090 30.090 25.896 4.194 19694
5579 1 12 . 1 1 92 92 CYS H H 92 8.580 8.580 7.573 1.007 19694
5580 1 12 . 1 1 93 93 TYR N N 93 120.730 120.730 121.353 -0.623 19694
5581 1 12 . 1 1 93 93 TYR HA H 93 4.140 4.140 4.070 0.070 19694
5582 1 12 . 1 1 93 93 TYR CA C 93 60.380 60.380 61.650 -1.270 19694
5583 1 12 . 1 1 93 93 TYR CB C 93 39.300 39.300 38.489 0.811 19694
5584 1 12 . 1 1 93 93 TYR H H 93 8.540 8.540 9.119 -0.579 19694
5585 1 12 . 1 1 94 94 SER N N 94 115.010 115.010 113.739 1.271 19694
5586 1 12 . 1 1 94 94 SER HA H 94 4.220 4.220 4.139 0.081 19694
5587 1 12 . 1 1 94 94 SER CA C 94 59.300 59.300 61.476 -2.176 19694
5588 1 12 . 1 1 94 94 SER CB C 94 63.660 63.660 62.177 1.483 19694
5589 1 12 . 1 1 94 94 SER H H 94 7.750 7.750 8.211 -0.461 19694
5590 1 12 . 1 1 95 95 ASN N N 95 119.820 119.820 118.803 1.017 19694
5591 1 12 . 1 1 95 95 ASN HA H 95 4.510 4.510 4.606 -0.096 19694
5592 1 12 . 1 1 95 95 ASN CA C 95 53.880 53.880 55.307 -1.427 19694
5593 1 12 . 1 1 95 95 ASN CB C 95 39.300 39.300 38.844 0.456 19694
5594 1 12 . 1 1 95 95 ASN H H 95 7.780 7.780 7.854 -0.074 19694
5595 1 12 . 1 1 96 96 GLU N N 96 119.820 119.820 118.337 1.483 19694
5596 1 12 . 1 1 96 96 GLU HA H 96 4.096 4.096 4.166 -0.070 19694
5597 1 12 . 1 1 96 96 GLU CA C 96 56.910 56.910 57.488 -0.578 19694
5598 1 12 . 1 1 96 96 GLU CB C 96 30.220 30.220 29.373 0.847 19694
5599 1 12 . 1 1 96 96 GLU H H 96 7.950 7.950 7.848 0.102 19694
5600 1 12 . 1 1 97 97 TYR N N 97 120.370 120.370 119.775 0.595 19694
5601 1 12 . 1 1 97 97 TYR HA H 97 4.620 4.620 4.229 0.391 19694
5602 1 12 . 1 1 97 97 TYR CA C 97 57.700 57.700 58.576 -0.876 19694
5603 1 12 . 1 1 97 97 TYR CB C 97 38.710 38.710 38.656 0.054 19694
5604 1 12 . 1 1 97 97 TYR H H 97 8.070 8.070 8.313 -0.243 19694
5605 1 13 . 1 1 2 2 THR N N 2 113.570 113.570 116.323 -2.753 19694
5606 1 13 . 1 1 2 2 THR HA H 2 4.240 4.240 4.326 -0.086 19694
5607 1 13 . 1 1 2 2 THR CA C 2 62.130 62.130 63.113 -0.983 19694
5608 1 13 . 1 1 2 2 THR CB C 2 69.250 69.250 69.174 0.076 19694
5609 1 13 . 1 1 2 2 THR H H 2 8.090 8.090 8.194 -0.104 19694
5610 1 13 . 1 1 3 3 GLU N N 3 122.880 122.880 120.721 2.159 19694
5611 1 13 . 1 1 3 3 GLU HA H 3 4.280 4.280 4.207 0.073 19694
5612 1 13 . 1 1 3 3 GLU CA C 3 56.860 56.860 56.559 0.301 19694
5613 1 13 . 1 1 3 3 GLU CB C 3 30.570 30.570 30.295 0.275 19694
5614 1 13 . 1 1 3 3 GLU H H 3 8.280 8.280 8.105 0.175 19694
5615 1 13 . 1 1 4 4 ARG N N 4 121.330 121.330 119.509 1.821 19694
5616 1 13 . 1 1 4 4 ARG HA H 4 4.300 4.300 4.550 -0.250 19694
5617 1 13 . 1 1 4 4 ARG CA C 4 55.870 55.870 55.225 0.645 19694
5618 1 13 . 1 1 4 4 ARG CB C 4 31.640 31.640 30.719 0.921 19694
5619 1 13 . 1 1 4 4 ARG H H 4 8.280 8.280 8.553 -0.273 19694
5620 1 13 . 1 1 5 5 PHE N N 5 125.490 125.490 124.620 0.870 19694
5621 1 13 . 1 1 5 5 PHE HA H 5 4.610 4.610 4.598 0.012 19694
5622 1 13 . 1 1 5 5 PHE CA C 5 56.380 56.380 56.393 -0.013 19694
5623 1 13 . 1 1 5 5 PHE CB C 5 39.560 39.560 39.600 -0.040 19694
5624 1 13 . 1 1 5 5 PHE H H 5 8.290 8.290 8.746 -0.456 19694
5625 1 13 . 1 1 6 6 ASP N N 6 123.260 123.260 121.776 1.484 19694
5626 1 13 . 1 1 6 6 ASP HA H 6 5.045 5.045 4.787 0.258 19694
5627 1 13 . 1 1 6 6 ASP CA C 6 52.180 52.180 52.926 -0.746 19694
5628 1 13 . 1 1 6 6 ASP CB C 6 44.210 44.210 44.581 -0.372 19694
5629 1 13 . 1 1 6 6 ASP H H 6 7.940 7.940 7.620 0.320 19694
5630 1 13 . 1 1 7 7 CYS N N 7 121.440 121.440 122.659 -1.219 19694
5631 1 13 . 1 1 7 7 CYS HA H 7 3.960 3.960 4.453 -0.493 19694
5632 1 13 . 1 1 7 7 CYS CA C 7 59.820 59.820 59.500 0.320 19694
5633 1 13 . 1 1 7 7 CYS CB C 7 30.950 30.950 26.147 4.803 19694
5634 1 13 . 1 1 7 7 CYS H H 7 8.700 8.700 8.585 0.115 19694
5635 1 13 . 1 1 8 8 HIS N N 8 129.390 129.390 129.618 -0.228 19694
5636 1 13 . 1 1 8 8 HIS HA H 8 4.200 4.200 4.242 -0.042 19694
5637 1 13 . 1 1 8 8 HIS CA C 8 58.240 58.240 59.591 -1.351 19694
5638 1 13 . 1 1 8 8 HIS CB C 8 29.480 29.480 30.142 -0.662 19694
5639 1 13 . 1 1 8 8 HIS H H 8 9.160 9.160 9.608 -0.448 19694
5640 1 13 . 1 1 9 9 HIS N N 9 118.740 118.740 116.791 1.949 19694
5641 1 13 . 1 1 9 9 HIS HA H 9 4.880 4.880 4.516 0.364 19694
5642 1 13 . 1 1 9 9 HIS CA C 9 58.680 58.680 57.268 1.412 19694
5643 1 13 . 1 1 9 9 HIS CB C 9 31.040 31.040 30.108 0.933 19694
5644 1 13 . 1 1 9 9 HIS H H 9 9.270 9.270 8.064 1.206 19694
5645 1 13 . 1 1 10 10 CYS N N 10 118.600 118.600 118.567 0.033 19694
5646 1 13 . 1 1 10 10 CYS HA H 10 4.600 4.600 4.311 0.289 19694
5647 1 13 . 1 1 10 10 CYS CA C 10 59.600 59.600 59.513 0.087 19694
5648 1 13 . 1 1 10 10 CYS CB C 10 32.330 32.330 28.085 4.245 19694
5649 1 13 . 1 1 10 10 CYS H H 10 8.550 8.550 8.029 0.521 19694
5650 1 13 . 1 1 11 11 ASN N N 11 116.220 116.220 116.913 -0.693 19694
5651 1 13 . 1 1 11 11 ASN HA H 11 4.410 4.410 4.415 -0.005 19694
5652 1 13 . 1 1 11 11 ASN CA C 11 55.640 55.640 54.355 1.285 19694
5653 1 13 . 1 1 11 11 ASN CB C 11 38.200 38.200 35.779 2.421 19694
5654 1 13 . 1 1 11 11 ASN H H 11 7.690 7.690 8.846 -1.156 19694
5655 1 13 . 1 1 12 12 GLU N N 12 120.330 120.330 117.915 2.415 19694
5656 1 13 . 1 1 12 12 GLU HA H 12 4.220 4.220 4.513 -0.293 19694
5657 1 13 . 1 1 12 12 GLU CA C 12 56.700 56.700 54.716 1.984 19694
5658 1 13 . 1 1 12 12 GLU CB C 12 30.910 30.910 31.012 -0.102 19694
5659 1 13 . 1 1 12 12 GLU H H 12 8.210 8.210 7.810 0.400 19694
5660 1 13 . 1 1 13 13 SER N N 13 116.190 116.190 119.661 -3.471 19694
5661 1 13 . 1 1 13 13 SER HA H 13 4.060 4.060 4.519 -0.459 19694
5662 1 13 . 1 1 13 13 SER CA C 13 59.350 59.350 59.207 0.143 19694
5663 1 13 . 1 1 13 13 SER CB C 13 63.820 63.820 63.438 0.382 19694
5664 1 13 . 1 1 13 13 SER H H 13 8.520 8.520 8.664 -0.144 19694
5665 1 13 . 1 1 14 14 LEU N N 14 126.060 126.060 124.795 1.265 19694
5666 1 13 . 1 1 14 14 LEU HA H 14 4.310 4.310 4.332 -0.022 19694
5667 1 13 . 1 1 14 14 LEU CA C 14 54.100 54.100 55.569 -1.469 19694
5668 1 13 . 1 1 14 14 LEU CB C 14 42.200 42.200 41.614 0.586 19694
5669 1 13 . 1 1 14 14 LEU H H 14 8.910 8.910 7.728 1.182 19694
5670 1 13 . 1 1 15 15 PHE N N 15 120.660 120.660 121.120 -0.460 19694
5671 1 13 . 1 1 15 15 PHE HA H 15 4.480 4.480 4.608 -0.128 19694
5672 1 13 . 1 1 15 15 PHE CA C 15 60.400 60.400 56.402 3.998 19694
5673 1 13 . 1 1 15 15 PHE CB C 15 38.130 38.130 37.919 0.211 19694
5674 1 13 . 1 1 15 15 PHE H H 15 7.820 7.820 8.547 -0.727 19694
5675 1 13 . 1 1 16 16 GLY N N 16 114.730 114.730 110.968 3.762 19694
5676 1 13 . 1 1 16 16 GLY CA C 16 45.900 45.900 45.778 0.122 19694
5677 1 13 . 1 1 16 16 GLY H H 16 8.860 8.860 8.814 0.046 19694
5678 1 13 . 1 1 17 17 LYS N N 17 119.580 119.580 120.109 -0.529 19694
5679 1 13 . 1 1 17 17 LYS HA H 17 4.480 4.480 4.504 -0.024 19694
5680 1 13 . 1 1 17 17 LYS CA C 17 54.460 54.460 54.438 0.022 19694
5681 1 13 . 1 1 17 17 LYS CB C 17 35.800 35.800 34.255 1.544 19694
5682 1 13 . 1 1 17 17 LYS H H 17 8.030 8.030 7.225 0.805 19694
5683 1 13 . 1 1 18 18 LYS N N 18 120.330 120.330 122.373 -2.043 19694
5684 1 13 . 1 1 18 18 LYS HA H 18 4.280 4.280 4.320 -0.040 19694
5685 1 13 . 1 1 18 18 LYS CA C 18 56.800 56.800 57.443 -0.643 19694
5686 1 13 . 1 1 18 18 LYS CB C 18 33.010 33.010 32.842 0.168 19694
5687 1 13 . 1 1 18 18 LYS H H 18 8.190 8.190 8.468 -0.278 19694
5688 1 13 . 1 1 19 19 TYR N N 19 117.500 117.500 115.343 2.157 19694
5689 1 13 . 1 1 19 19 TYR HA H 19 5.240 5.240 4.856 0.384 19694
5690 1 13 . 1 1 19 19 TYR CA C 19 55.340 55.340 56.288 -0.948 19694
5691 1 13 . 1 1 19 19 TYR CB C 19 42.850 42.850 40.333 2.517 19694
5692 1 13 . 1 1 19 19 TYR H H 19 7.610 7.610 7.912 -0.302 19694
5693 1 13 . 1 1 20 20 ILE N N 20 121.430 121.430 121.865 -0.435 19694
5694 1 13 . 1 1 20 20 ILE HA H 20 4.137 4.137 4.242 -0.105 19694
5695 1 13 . 1 1 20 20 ILE CA C 20 60.010 60.010 60.114 -0.104 19694
5696 1 13 . 1 1 20 20 ILE CB C 20 41.570 41.570 40.605 0.965 19694
5697 1 13 . 1 1 20 20 ILE H H 20 9.350 9.350 8.228 1.122 19694
5698 1 13 . 1 1 21 21 LEU N N 21 126.720 126.720 126.076 0.644 19694
5699 1 13 . 1 1 21 21 LEU HA H 21 5.090 5.090 4.759 0.331 19694
5700 1 13 . 1 1 21 21 LEU CA C 21 54.020 54.020 53.939 0.081 19694
5701 1 13 . 1 1 21 21 LEU CB C 21 43.720 43.720 40.797 2.923 19694
5702 1 13 . 1 1 21 21 LEU H H 21 8.530 8.530 8.501 0.029 19694
5703 1 13 . 1 1 22 22 ARG N N 22 123.930 123.930 125.396 -1.466 19694
5704 1 13 . 1 1 22 22 ARG HA H 22 4.440 4.440 4.514 -0.074 19694
5705 1 13 . 1 1 22 22 ARG CA C 22 55.600 55.600 53.896 1.704 19694
5706 1 13 . 1 1 22 22 ARG CB C 22 32.280 32.280 32.556 -0.276 19694
5707 1 13 . 1 1 22 22 ARG H H 22 9.080 9.080 8.880 0.200 19694
5708 1 13 . 1 1 23 23 GLU N N 23 128.500 128.500 124.434 4.066 19694
5709 1 13 . 1 1 23 23 GLU HA H 23 3.840 3.840 3.923 -0.083 19694
5710 1 13 . 1 1 23 23 GLU CA C 23 58.030 58.030 57.614 0.416 19694
5711 1 13 . 1 1 23 23 GLU CB C 23 27.200 27.200 28.267 -1.067 19694
5712 1 13 . 1 1 23 23 GLU H H 23 9.610 9.610 9.083 0.527 19694
5713 1 13 . 1 1 24 24 GLU N N 24 110.300 110.300 113.869 -3.569 19694
5714 1 13 . 1 1 24 24 GLU HA H 24 3.780 3.780 3.997 -0.217 19694
5715 1 13 . 1 1 24 24 GLU CA C 24 58.320 58.320 57.479 0.841 19694
5716 1 13 . 1 1 24 24 GLU CB C 24 28.220 28.220 27.674 0.545 19694
5717 1 13 . 1 1 24 24 GLU H H 24 8.660 8.660 8.809 -0.149 19694
5718 1 13 . 1 1 25 25 SER N N 25 117.700 117.700 113.162 4.538 19694
5719 1 13 . 1 1 25 25 SER HA H 25 4.890 4.890 4.777 0.113 19694
5720 1 13 . 1 1 25 25 SER CA C 25 56.540 56.540 55.980 0.560 19694
5721 1 13 . 1 1 25 25 SER CB C 25 64.720 64.720 64.727 -0.007 19694
5722 1 13 . 1 1 25 25 SER H H 25 7.900 7.900 7.729 0.171 19694
5723 1 13 . 1 1 26 26 PRO HA H 26 4.995 4.995 4.863 0.132 19694
5724 1 13 . 1 1 26 26 PRO CA C 26 61.750 61.750 63.071 -1.321 19694
5725 1 13 . 1 1 26 26 PRO CB C 26 32.660 32.660 31.731 0.929 19694
5726 1 13 . 1 1 27 27 TYR N N 27 118.100 118.100 123.626 -5.526 19694
5727 1 13 . 1 1 27 27 TYR HA H 27 5.910 5.910 4.984 0.926 19694
5728 1 13 . 1 1 27 27 TYR CA C 27 56.830 56.830 54.873 1.957 19694
5729 1 13 . 1 1 27 27 TYR CB C 27 42.810 42.810 42.486 0.324 19694
5730 1 13 . 1 1 27 27 TYR H H 27 9.040 9.040 8.679 0.361 19694
5731 1 13 . 1 1 28 28 CYS N N 28 122.230 122.230 119.270 2.960 19694
5732 1 13 . 1 1 28 28 CYS HA H 28 4.850 4.850 4.721 0.129 19694
5733 1 13 . 1 1 28 28 CYS CA C 28 58.110 58.110 58.094 0.016 19694
5734 1 13 . 1 1 28 28 CYS CB C 28 30.530 30.530 29.147 1.383 19694
5735 1 13 . 1 1 28 28 CYS H H 28 9.850 9.850 8.374 1.476 19694
5736 1 13 . 1 1 29 29 VAL N N 29 118.200 118.200 123.253 -5.053 19694
5737 1 13 . 1 1 29 29 VAL HA H 29 3.650 3.650 3.644 0.006 19694
5738 1 13 . 1 1 29 29 VAL CA C 29 67.400 67.400 66.697 0.703 19694
5739 1 13 . 1 1 29 29 VAL CB C 29 31.860 31.860 31.523 0.337 19694
5740 1 13 . 1 1 29 29 VAL H H 29 8.430 8.430 8.947 -0.517 19694
5741 1 13 . 1 1 30 30 VAL N N 30 119.570 119.570 118.800 0.770 19694
5742 1 13 . 1 1 30 30 VAL HA H 30 3.860 3.860 3.538 0.322 19694
5743 1 13 . 1 1 30 30 VAL CA C 30 66.450 66.450 66.049 0.401 19694
5744 1 13 . 1 1 30 30 VAL CB C 30 31.540 31.540 31.181 0.359 19694
5745 1 13 . 1 1 30 30 VAL H H 30 7.700 7.700 8.187 -0.487 19694
5746 1 13 . 1 1 31 31 CYS N N 31 125.890 125.890 119.205 6.685 19694
5747 1 13 . 1 1 31 31 CYS HA H 31 3.830 3.830 3.890 -0.060 19694
5748 1 13 . 1 1 31 31 CYS CA C 31 65.850 65.850 64.283 1.567 19694
5749 1 13 . 1 1 31 31 CYS CB C 31 29.510 29.510 25.497 4.013 19694
5750 1 13 . 1 1 31 31 CYS H H 31 9.050 9.050 7.671 1.379 19694
5751 1 13 . 1 1 32 32 PHE N N 32 119.000 119.000 119.355 -0.355 19694
5752 1 13 . 1 1 32 32 PHE HA H 32 3.780 3.780 3.689 0.091 19694
5753 1 13 . 1 1 32 32 PHE CA C 32 62.610 62.610 61.760 0.850 19694
5754 1 13 . 1 1 32 32 PHE CB C 32 39.920 39.920 39.035 0.885 19694
5755 1 13 . 1 1 32 32 PHE H H 32 9.080 9.080 7.887 1.193 19694
5756 1 13 . 1 1 33 33 GLU N N 33 117.470 117.470 117.998 -0.528 19694
5757 1 13 . 1 1 33 33 GLU HA H 33 3.760 3.760 4.067 -0.307 19694
5758 1 13 . 1 1 33 33 GLU CA C 33 59.210 59.210 59.439 -0.229 19694
5759 1 13 . 1 1 33 33 GLU CB C 33 29.480 29.480 29.209 0.271 19694
5760 1 13 . 1 1 33 33 GLU H H 33 8.510 8.510 8.308 0.202 19694
5761 1 13 . 1 1 34 34 THR N N 34 114.140 114.140 115.295 -1.155 19694
5762 1 13 . 1 1 34 34 THR HA H 34 3.730 3.730 3.974 -0.244 19694
5763 1 13 . 1 1 34 34 THR CA C 34 65.890 65.890 65.526 0.364 19694
5764 1 13 . 1 1 34 34 THR CB C 34 69.210 69.210 68.612 0.598 19694
5765 1 13 . 1 1 34 34 THR H H 34 7.880 7.880 8.341 -0.461 19694
5766 1 13 . 1 1 35 35 LEU N N 35 117.980 117.980 118.804 -0.824 19694
5767 1 13 . 1 1 35 35 LEU HA H 35 3.650 3.650 3.925 -0.275 19694
5768 1 13 . 1 1 35 35 LEU CA C 35 56.860 56.860 57.239 -0.379 19694
5769 1 13 . 1 1 35 35 LEU CB C 35 41.870 41.870 41.751 0.119 19694
5770 1 13 . 1 1 35 35 LEU H H 35 7.660 7.660 7.770 -0.110 19694
5771 1 13 . 1 1 36 36 PHE N N 36 113.900 113.900 113.986 -0.086 19694
5772 1 13 . 1 1 36 36 PHE HA H 36 4.597 4.597 4.428 0.169 19694
5773 1 13 . 1 1 36 36 PHE CA C 36 56.860 56.860 56.361 0.499 19694
5774 1 13 . 1 1 36 36 PHE CB C 36 40.570 40.570 38.230 2.340 19694
5775 1 13 . 1 1 36 36 PHE H H 36 7.730 7.730 6.695 1.035 19694
5776 1 13 . 1 1 37 37 ALA N N 37 121.920 121.920 123.021 -1.101 19694
5777 1 13 . 1 1 37 37 ALA HA H 37 4.070 4.070 4.062 0.008 19694
5778 1 13 . 1 1 37 37 ALA CA C 37 52.900 52.900 52.293 0.607 19694
5779 1 13 . 1 1 37 37 ALA CB C 37 19.770 19.770 19.777 -0.007 19694
5780 1 13 . 1 1 37 37 ALA H H 37 7.090 7.090 7.801 -0.711 19694
5781 1 13 . 1 1 38 38 ASN N N 38 119.230 119.230 119.158 0.072 19694
5782 1 13 . 1 1 38 38 ASN HA H 38 4.450 4.450 4.671 -0.221 19694
5783 1 13 . 1 1 38 38 ASN CA C 38 52.850 52.850 52.521 0.329 19694
5784 1 13 . 1 1 38 38 ASN CB C 38 38.950 38.950 40.146 -1.196 19694
5785 1 13 . 1 1 38 38 ASN H H 38 8.790 8.790 8.356 0.434 19694
5786 1 13 . 1 1 39 39 THR N N 39 116.330 116.330 115.405 0.925 19694
5787 1 13 . 1 1 39 39 THR HA H 39 3.990 3.990 4.424 -0.434 19694
5788 1 13 . 1 1 39 39 THR CA C 39 62.130 62.130 62.544 -0.414 19694
5789 1 13 . 1 1 39 39 THR CB C 39 69.920 69.920 69.885 0.035 19694
5790 1 13 . 1 1 39 39 THR H H 39 8.540 8.540 8.258 0.282 19694
5791 1 13 . 1 1 40 40 CYS N N 40 126.950 126.950 127.929 -0.979 19694
5792 1 13 . 1 1 40 40 CYS HA H 40 4.300 4.300 4.485 -0.185 19694
5793 1 13 . 1 1 40 40 CYS CA C 40 58.350 58.350 57.027 1.323 19694
5794 1 13 . 1 1 40 40 CYS CB C 40 31.600 31.600 26.674 4.926 19694
5795 1 13 . 1 1 40 40 CYS H H 40 7.940 7.940 8.543 -0.603 19694
5796 1 13 . 1 1 41 41 GLU N N 41 130.560 130.560 127.568 2.992 19694
5797 1 13 . 1 1 41 41 GLU HA H 41 3.690 3.690 3.838 -0.148 19694
5798 1 13 . 1 1 41 41 GLU CA C 41 58.600 58.600 59.140 -0.540 19694
5799 1 13 . 1 1 41 41 GLU CB C 41 30.460 30.460 29.414 1.046 19694
5800 1 13 . 1 1 41 41 GLU H H 41 8.810 8.810 8.665 0.145 19694
5801 1 13 . 1 1 42 42 GLU N N 42 119.680 119.680 118.322 1.358 19694
5802 1 13 . 1 1 42 42 GLU HA H 42 4.570 4.570 4.344 0.226 19694
5803 1 13 . 1 1 42 42 GLU CA C 42 58.000 58.000 58.170 -0.170 19694
5804 1 13 . 1 1 42 42 GLU CB C 42 31.680 31.680 30.533 1.147 19694
5805 1 13 . 1 1 42 42 GLU H H 42 8.500 8.500 8.122 0.378 19694
5806 1 13 . 1 1 43 43 CYS N N 43 115.600 115.600 116.359 -0.759 19694
5807 1 13 . 1 1 43 43 CYS HA H 43 5.010 5.010 4.566 0.444 19694
5808 1 13 . 1 1 43 43 CYS CA C 43 58.810 58.810 60.130 -1.320 19694
5809 1 13 . 1 1 43 43 CYS CB C 43 31.580 31.580 29.271 2.309 19694
5810 1 13 . 1 1 43 43 CYS H H 43 8.120 8.120 7.958 0.162 19694
5811 1 13 . 1 1 44 44 GLY N N 44 112.100 112.100 107.880 4.220 19694
5812 1 13 . 1 1 44 44 GLY CA C 44 46.420 46.420 45.243 1.177 19694
5813 1 13 . 1 1 44 44 GLY H H 44 7.900 7.900 8.603 -0.703 19694
5814 1 13 . 1 1 45 45 LYS N N 45 121.210 121.210 121.651 -0.441 19694
5815 1 13 . 1 1 45 45 LYS HA H 45 4.840 4.840 4.648 0.192 19694
5816 1 13 . 1 1 45 45 LYS CA C 45 54.360 54.360 53.094 1.266 19694
5817 1 13 . 1 1 45 45 LYS CB C 45 32.430 32.430 32.946 -0.516 19694
5818 1 13 . 1 1 45 45 LYS H H 45 8.180 8.180 7.866 0.314 19694
5819 1 13 . 1 1 46 46 PRO HA H 46 4.477 4.477 4.517 -0.040 19694
5820 1 13 . 1 1 46 46 PRO CA C 46 62.700 62.700 63.032 -0.332 19694
5821 1 13 . 1 1 46 46 PRO CB C 46 32.490 32.490 32.078 0.412 19694
5822 1 13 . 1 1 47 47 ILE N N 47 125.280 125.280 122.934 2.346 19694
5823 1 13 . 1 1 47 47 ILE HA H 47 3.830 3.830 4.290 -0.460 19694
5824 1 13 . 1 1 47 47 ILE CA C 47 61.040 61.040 60.662 0.378 19694
5825 1 13 . 1 1 47 47 ILE CB C 47 37.440 37.440 37.797 -0.358 19694
5826 1 13 . 1 1 47 47 ILE H H 47 8.540 8.540 8.874 -0.334 19694
5827 1 13 . 1 1 48 48 GLY N N 48 114.120 114.120 113.416 0.704 19694
5828 1 13 . 1 1 48 48 GLY CA C 48 45.240 45.240 44.982 0.258 19694
5829 1 13 . 1 1 48 48 GLY H H 48 8.660 8.660 8.474 0.186 19694
5830 1 13 . 1 1 49 49 CYS N N 49 117.140 117.140 119.702 -2.562 19694
5831 1 13 . 1 1 49 49 CYS HA H 49 4.280 4.280 4.293 -0.013 19694
5832 1 13 . 1 1 49 49 CYS CA C 49 60.880 60.880 60.111 0.769 19694
5833 1 13 . 1 1 49 49 CYS CB C 49 27.650 27.650 27.503 0.147 19694
5834 1 13 . 1 1 49 49 CYS H H 49 9.210 9.210 9.621 -0.411 19694
5835 1 13 . 1 1 50 50 ASP N N 50 119.300 119.300 119.954 -0.654 19694
5836 1 13 . 1 1 50 50 ASP HA H 50 4.620 4.620 4.648 -0.028 19694
5837 1 13 . 1 1 50 50 ASP CA C 50 54.160 54.160 54.618 -0.458 19694
5838 1 13 . 1 1 50 50 ASP CB C 50 40.380 40.380 40.023 0.357 19694
5839 1 13 . 1 1 50 50 ASP H H 50 8.800 8.800 8.334 0.466 19694
5840 1 13 . 1 1 51 51 CYS N N 51 118.150 118.150 116.509 1.641 19694
5841 1 13 . 1 1 51 51 CYS HA H 51 4.620 4.620 4.691 -0.071 19694
5842 1 13 . 1 1 51 51 CYS CA C 51 58.030 58.030 56.816 1.214 19694
5843 1 13 . 1 1 51 51 CYS CB C 51 30.090 30.090 31.591 -1.501 19694
5844 1 13 . 1 1 51 51 CYS H H 51 7.590 7.590 7.348 0.242 19694
5845 1 13 . 1 1 52 52 LYS N N 52 123.800 123.800 122.885 0.915 19694
5846 1 13 . 1 1 52 52 LYS HA H 52 4.180 4.180 4.356 -0.176 19694
5847 1 13 . 1 1 52 52 LYS CA C 52 57.240 57.240 56.070 1.170 19694
5848 1 13 . 1 1 52 52 LYS CB C 52 33.030 33.030 31.124 1.906 19694
5849 1 13 . 1 1 52 52 LYS H H 52 8.600 8.600 8.588 0.012 19694
5850 1 13 . 1 1 53 53 ASP N N 53 124.900 124.900 123.854 1.046 19694
5851 1 13 . 1 1 53 53 ASP HA H 53 4.230 4.230 4.692 -0.462 19694
5852 1 13 . 1 1 53 53 ASP CA C 53 53.130 53.130 52.869 0.261 19694
5853 1 13 . 1 1 53 53 ASP CB C 53 42.230 42.230 40.421 1.809 19694
5854 1 13 . 1 1 53 53 ASP H H 53 8.250 8.250 8.334 -0.084 19694
5855 1 13 . 1 1 54 54 LEU N N 54 130.160 130.160 125.081 5.079 19694
5856 1 13 . 1 1 54 54 LEU HA H 54 4.440 4.440 4.525 -0.085 19694
5857 1 13 . 1 1 54 54 LEU CA C 54 53.340 53.340 55.650 -2.309 19694
5858 1 13 . 1 1 54 54 LEU CB C 54 41.170 41.170 43.162 -1.992 19694
5859 1 13 . 1 1 54 54 LEU H H 54 8.670 8.670 8.798 -0.128 19694
5860 1 13 . 1 1 55 55 SER N N 55 113.820 113.820 121.820 -8.000 19694
5861 1 13 . 1 1 55 55 SER HA H 55 5.580 5.580 5.361 0.219 19694
5862 1 13 . 1 1 55 55 SER CA C 55 55.850 55.850 56.539 -0.689 19694
5863 1 13 . 1 1 55 55 SER CB C 55 67.300 67.300 64.249 3.051 19694
5864 1 13 . 1 1 55 55 SER H H 55 8.160 8.160 8.559 -0.399 19694
5865 1 13 . 1 1 56 56 TYR N N 56 122.610 122.610 125.972 -3.362 19694
5866 1 13 . 1 1 56 56 TYR HA H 56 4.620 4.620 4.613 0.007 19694
5867 1 13 . 1 1 56 56 TYR CA C 56 58.810 58.810 58.617 0.193 19694
5868 1 13 . 1 1 56 56 TYR CB C 56 41.000 41.000 42.413 -1.413 19694
5869 1 13 . 1 1 56 56 TYR H H 56 8.450 8.450 8.593 -0.143 19694
5870 1 13 . 1 1 57 57 LYS N N 57 126.020 126.020 127.019 -0.999 19694
5871 1 13 . 1 1 57 57 LYS HA H 57 3.470 3.470 3.922 -0.452 19694
5872 1 13 . 1 1 57 57 LYS CA C 57 58.100 58.100 57.676 0.424 19694
5873 1 13 . 1 1 57 57 LYS CB C 57 29.480 29.480 31.841 -2.361 19694
5874 1 13 . 1 1 57 57 LYS H H 57 8.920 8.920 8.781 0.139 19694
5875 1 13 . 1 1 58 58 ASP HA H 58 3.830 3.830 4.217 -0.387 19694
5876 1 13 . 1 1 58 58 ASP CA C 58 54.900 54.900 55.376 -0.476 19694
5877 1 13 . 1 1 58 58 ASP CB C 58 40.080 40.080 40.579 -0.499 19694
5878 1 13 . 1 1 58 58 ASP H H 58 8.400 8.400 8.514 -0.114 19694
5879 1 13 . 1 1 59 59 ARG N N 59 121.190 121.190 115.990 5.200 19694
5880 1 13 . 1 1 59 59 ARG HA H 59 4.250 4.250 4.482 -0.232 19694
5881 1 13 . 1 1 59 59 ARG CA C 59 55.580 55.580 54.001 1.579 19694
5882 1 13 . 1 1 59 59 ARG CB C 59 33.460 33.460 33.414 0.046 19694
5883 1 13 . 1 1 59 59 ARG H H 59 7.980 7.980 7.934 0.046 19694
5884 1 13 . 1 1 60 60 HIS N N 60 118.420 118.420 117.794 0.626 19694
5885 1 13 . 1 1 60 60 HIS HA H 60 5.270 5.270 5.635 -0.365 19694
5886 1 13 . 1 1 60 60 HIS CA C 60 55.010 55.010 55.254 -0.244 19694
5887 1 13 . 1 1 60 60 HIS CB C 60 32.380 32.380 33.331 -0.951 19694
5888 1 13 . 1 1 60 60 HIS H H 60 8.350 8.350 8.076 0.274 19694
5889 1 13 . 1 1 61 61 TRP N N 61 119.990 119.990 118.322 1.668 19694
5890 1 13 . 1 1 61 61 TRP HA H 61 5.930 5.930 4.785 1.145 19694
5891 1 13 . 1 1 61 61 TRP CA C 61 57.400 57.400 57.108 0.292 19694
5892 1 13 . 1 1 61 61 TRP CB C 61 35.380 35.380 34.201 1.179 19694
5893 1 13 . 1 1 61 61 TRP H H 61 9.310 9.310 9.303 0.007 19694
5894 1 13 . 1 1 62 62 HIS N N 62 117.270 117.270 121.412 -4.142 19694
5895 1 13 . 1 1 62 62 HIS HA H 62 4.600 4.600 4.817 -0.217 19694
5896 1 13 . 1 1 62 62 HIS CA C 62 59.210 59.210 57.470 1.740 19694
5897 1 13 . 1 1 62 62 HIS CB C 62 31.200 31.200 30.430 0.770 19694
5898 1 13 . 1 1 62 62 HIS H H 62 8.430 8.430 9.135 -0.705 19694
5899 1 13 . 1 1 63 63 GLU N N 63 124.640 124.640 128.571 -3.931 19694
5900 1 13 . 1 1 63 63 GLU HA H 63 3.827 3.827 3.925 -0.098 19694
5901 1 13 . 1 1 63 63 GLU CA C 63 61.020 61.020 59.768 1.252 19694
5902 1 13 . 1 1 63 63 GLU CB C 63 30.310 30.310 29.816 0.494 19694
5903 1 13 . 1 1 63 63 GLU H H 63 9.040 9.040 8.128 0.912 19694
5904 1 13 . 1 1 64 64 ALA N N 64 117.050 117.050 117.530 -0.480 19694
5905 1 13 . 1 1 64 64 ALA HA H 64 4.230 4.230 4.358 -0.128 19694
5906 1 13 . 1 1 64 64 ALA CA C 64 54.000 54.000 53.162 0.838 19694
5907 1 13 . 1 1 64 64 ALA CB C 64 18.880 18.880 18.623 0.257 19694
5908 1 13 . 1 1 64 64 ALA H H 64 8.680 8.680 8.302 0.378 19694
5909 1 13 . 1 1 65 65 CYS N N 65 115.380 115.380 117.203 -1.823 19694
5910 1 13 . 1 1 65 65 CYS HA H 65 4.295 4.295 4.075 0.220 19694
5911 1 13 . 1 1 65 65 CYS CA C 65 59.850 59.850 60.314 -0.464 19694
5912 1 13 . 1 1 65 65 CYS CB C 65 32.840 32.840 26.652 6.188 19694
5913 1 13 . 1 1 65 65 CYS H H 65 7.490 7.490 8.258 -0.768 19694
5914 1 13 . 1 1 66 66 PHE N N 66 122.020 122.020 123.066 -1.046 19694
5915 1 13 . 1 1 66 66 PHE HA H 66 3.890 3.890 3.868 0.022 19694
5916 1 13 . 1 1 66 66 PHE CA C 66 57.010 57.010 58.503 -1.493 19694
5917 1 13 . 1 1 66 66 PHE CB C 66 38.070 38.070 38.194 -0.124 19694
5918 1 13 . 1 1 66 66 PHE H H 66 7.110 7.110 7.541 -0.431 19694
5919 1 13 . 1 1 67 67 HIS N N 67 121.280 121.280 121.985 -0.705 19694
5920 1 13 . 1 1 67 67 HIS HA H 67 4.720 4.720 5.288 -0.568 19694
5921 1 13 . 1 1 67 67 HIS CA C 67 52.730 52.730 52.782 -0.052 19694
5922 1 13 . 1 1 67 67 HIS CB C 67 32.230 32.230 30.806 1.424 19694
5923 1 13 . 1 1 67 67 HIS H H 67 7.380 7.380 7.807 -0.427 19694
5924 1 13 . 1 1 68 68 CYS N N 68 121.590 121.590 118.795 2.795 19694
5925 1 13 . 1 1 68 68 CYS HA H 68 3.960 3.960 4.941 -0.981 19694
5926 1 13 . 1 1 68 68 CYS CA C 68 59.790 59.790 57.874 1.916 19694
5927 1 13 . 1 1 68 68 CYS CB C 68 31.200 31.200 29.325 1.875 19694
5928 1 13 . 1 1 68 68 CYS H H 68 8.530 8.530 8.275 0.255 19694
5929 1 13 . 1 1 69 69 SER N N 69 126.530 126.530 119.965 6.565 19694
5930 1 13 . 1 1 69 69 SER HA H 69 4.310 4.310 4.003 0.307 19694
5931 1 13 . 1 1 69 69 SER CA C 69 61.760 61.760 60.809 0.951 19694
5932 1 13 . 1 1 69 69 SER CB C 69 64.040 64.040 63.109 0.931 19694
5933 1 13 . 1 1 69 69 SER H H 69 9.460 9.460 8.704 0.756 19694
5934 1 13 . 1 1 70 70 GLN N N 70 122.370 122.370 118.460 3.910 19694
5935 1 13 . 1 1 70 70 GLN HA H 70 4.510 4.510 4.453 0.057 19694
5936 1 13 . 1 1 70 70 GLN CA C 70 57.840 57.840 57.386 0.454 19694
5937 1 13 . 1 1 70 70 GLN CB C 70 30.430 30.430 29.545 0.885 19694
5938 1 13 . 1 1 70 70 GLN H H 70 8.980 8.980 7.820 1.160 19694
5939 1 13 . 1 1 71 71 CYS N N 71 118.860 118.860 115.867 2.993 19694
5940 1 13 . 1 1 71 71 CYS HA H 71 4.720 4.720 4.661 0.059 19694
5941 1 13 . 1 1 71 71 CYS CA C 71 59.770 59.770 58.285 1.485 19694
5942 1 13 . 1 1 71 71 CYS CB C 71 31.910 31.910 27.646 4.264 19694
5943 1 13 . 1 1 71 71 CYS H H 71 8.220 8.220 7.729 0.491 19694
5944 1 13 . 1 1 72 72 ARG N N 72 114.380 114.380 115.506 -1.126 19694
5945 1 13 . 1 1 72 72 ARG HA H 72 3.965 3.965 3.821 0.144 19694
5946 1 13 . 1 1 72 72 ARG CA C 72 58.030 58.030 57.194 0.836 19694
5947 1 13 . 1 1 72 72 ARG CB C 72 27.720 27.720 27.330 0.390 19694
5948 1 13 . 1 1 72 72 ARG H H 72 7.380 7.380 7.819 -0.439 19694
5949 1 13 . 1 1 73 73 ASN N N 73 121.480 121.480 116.494 4.986 19694
5950 1 13 . 1 1 73 73 ASN HA H 73 4.630 4.630 4.639 -0.009 19694
5951 1 13 . 1 1 73 73 ASN CA C 73 54.110 54.110 53.752 0.359 19694
5952 1 13 . 1 1 73 73 ASN CB C 73 38.870 38.870 39.599 -0.729 19694
5953 1 13 . 1 1 73 73 ASN H H 73 8.722 8.722 8.025 0.697 19694
5954 1 13 . 1 1 74 74 SER N N 74 114.710 114.710 118.149 -3.439 19694
5955 1 13 . 1 1 74 74 SER HA H 74 4.060 4.060 4.796 -0.736 19694
5956 1 13 . 1 1 74 74 SER CA C 74 59.357 59.357 58.447 0.910 19694
5957 1 13 . 1 1 74 74 SER CB C 74 63.300 63.300 63.024 0.276 19694
5958 1 13 . 1 1 74 74 SER H H 74 8.690 8.690 8.502 0.188 19694
5959 1 13 . 1 1 75 75 LEU N N 75 125.757 125.757 127.518 -1.761 19694
5960 1 13 . 1 1 75 75 LEU HA H 75 4.280 4.280 4.290 -0.010 19694
5961 1 13 . 1 1 75 75 LEU CA C 75 53.510 53.510 54.793 -1.283 19694
5962 1 13 . 1 1 75 75 LEU CB C 75 42.200 42.200 41.778 0.422 19694
5963 1 13 . 1 1 75 75 LEU H H 75 7.970 7.970 8.129 -0.159 19694
5964 1 13 . 1 1 76 76 VAL N N 76 120.860 120.860 124.777 -3.917 19694
5965 1 13 . 1 1 76 76 VAL HA H 76 3.570 3.570 3.827 -0.257 19694
5966 1 13 . 1 1 76 76 VAL CA C 76 65.420 65.420 60.874 4.546 19694
5967 1 13 . 1 1 76 76 VAL CB C 76 31.540 31.540 34.738 -3.198 19694
5968 1 13 . 1 1 76 76 VAL H H 76 7.830 7.830 7.986 -0.156 19694
5969 1 13 . 1 1 77 77 ASP N N 77 122.360 122.360 124.177 -1.817 19694
5970 1 13 . 1 1 77 77 ASP HA H 77 4.230 4.230 4.458 -0.228 19694
5971 1 13 . 1 1 77 77 ASP CA C 77 56.200 56.200 55.866 0.334 19694
5972 1 13 . 1 1 77 77 ASP CB C 77 39.380 39.380 40.919 -1.539 19694
5973 1 13 . 1 1 77 77 ASP H H 77 8.910 8.910 8.305 0.605 19694
5974 1 13 . 1 1 78 78 LYS N N 78 118.100 118.100 118.243 -0.143 19694
5975 1 13 . 1 1 78 78 LYS HA H 78 4.870 4.870 4.643 0.227 19694
5976 1 13 . 1 1 78 78 LYS CA C 78 56.960 56.960 53.767 3.193 19694
5977 1 13 . 1 1 78 78 LYS CB C 78 34.680 34.680 33.579 1.101 19694
5978 1 13 . 1 1 78 78 LYS H H 78 7.660 7.660 7.593 0.067 19694
5979 1 13 . 1 1 79 79 PRO HA H 79 4.460 4.460 4.181 0.279 19694
5980 1 13 . 1 1 79 79 PRO CA C 79 62.520 62.520 62.920 -0.401 19694
5981 1 13 . 1 1 79 79 PRO CB C 79 32.160 32.160 31.869 0.291 19694
5982 1 13 . 1 1 80 80 PHE N N 80 114.050 114.050 117.510 -3.460 19694
5983 1 13 . 1 1 80 80 PHE HA H 80 4.910 4.910 4.996 -0.086 19694
5984 1 13 . 1 1 80 80 PHE CA C 80 56.060 56.060 55.421 0.639 19694
5985 1 13 . 1 1 80 80 PHE CB C 80 42.410 42.410 41.300 1.110 19694
5986 1 13 . 1 1 80 80 PHE H H 80 7.510 7.510 7.343 0.167 19694
5987 1 13 . 1 1 81 81 ALA N N 81 123.290 123.290 123.813 -0.523 19694
5988 1 13 . 1 1 81 81 ALA HA H 81 4.310 4.310 4.405 -0.095 19694
5989 1 13 . 1 1 81 81 ALA CA C 81 50.450 50.450 50.419 0.032 19694
5990 1 13 . 1 1 81 81 ALA CB C 81 21.920 21.920 19.053 2.866 19694
5991 1 13 . 1 1 81 81 ALA H H 81 9.030 9.030 9.050 -0.020 19694
5992 1 13 . 1 1 82 82 ALA N N 82 122.490 122.490 129.287 -6.797 19694
5993 1 13 . 1 1 82 82 ALA HA H 82 5.110 5.110 4.393 0.717 19694
5994 1 13 . 1 1 82 82 ALA CA C 82 51.100 51.100 51.689 -0.589 19694
5995 1 13 . 1 1 82 82 ALA CB C 82 21.130 21.130 18.800 2.330 19694
5996 1 13 . 1 1 82 82 ALA H H 82 8.240 8.240 8.668 -0.428 19694
5997 1 13 . 1 1 83 83 LYS N N 83 123.580 123.580 125.928 -2.348 19694
5998 1 13 . 1 1 83 83 LYS HA H 83 4.490 4.490 4.497 -0.007 19694
5999 1 13 . 1 1 83 83 LYS CA C 83 55.800 55.800 55.270 0.530 19694
6000 1 13 . 1 1 83 83 LYS CB C 83 34.720 34.720 34.131 0.589 19694
6001 1 13 . 1 1 83 83 LYS H H 83 8.400 8.400 8.287 0.113 19694
6002 1 13 . 1 1 84 84 GLU N N 84 125.470 125.470 120.350 5.120 19694
6003 1 13 . 1 1 84 84 GLU HA H 84 3.820 3.820 4.121 -0.301 19694
6004 1 13 . 1 1 84 84 GLU CA C 84 58.620 58.620 58.966 -0.346 19694
6005 1 13 . 1 1 84 84 GLU CB C 84 27.210 27.210 29.726 -2.516 19694
6006 1 13 . 1 1 84 84 GLU H H 84 9.320 9.320 8.794 0.526 19694
6007 1 13 . 1 1 85 85 ASP N N 85 118.550 118.550 114.452 4.098 19694
6008 1 13 . 1 1 85 85 ASP HA H 85 4.600 4.600 4.794 -0.194 19694
6009 1 13 . 1 1 85 85 ASP CA C 85 55.400 55.400 53.926 1.474 19694
6010 1 13 . 1 1 85 85 ASP CB C 85 40.400 40.400 42.175 -1.775 19694
6011 1 13 . 1 1 85 85 ASP H H 85 8.730 8.730 8.361 0.369 19694
6012 1 13 . 1 1 86 86 GLN N N 86 119.050 119.050 117.444 1.606 19694
6013 1 13 . 1 1 86 86 GLN HA H 86 4.540 4.540 4.698 -0.158 19694
6014 1 13 . 1 1 86 86 GLN CA C 86 55.100 55.100 54.043 1.057 19694
6015 1 13 . 1 1 86 86 GLN CB C 86 31.110 31.110 32.042 -0.932 19694
6016 1 13 . 1 1 86 86 GLN H H 86 8.170 8.170 7.586 0.584 19694
6017 1 13 . 1 1 87 87 LEU N N 87 123.110 123.110 121.341 1.769 19694
6018 1 13 . 1 1 87 87 LEU HA H 87 4.620 4.620 5.220 -0.600 19694
6019 1 13 . 1 1 87 87 LEU CA C 87 54.520 54.520 54.001 0.519 19694
6020 1 13 . 1 1 87 87 LEU CB C 87 42.700 42.700 44.592 -1.892 19694
6021 1 13 . 1 1 87 87 LEU H H 87 8.490 8.490 8.518 -0.028 19694
6022 1 13 . 1 1 88 88 LEU N N 88 123.690 123.690 120.179 3.511 19694
6023 1 13 . 1 1 88 88 LEU HA H 88 5.880 5.880 4.948 0.932 19694
6024 1 13 . 1 1 88 88 LEU CA C 88 53.340 53.340 52.814 0.526 19694
6025 1 13 . 1 1 88 88 LEU CB C 88 47.190 47.190 47.805 -0.615 19694
6026 1 13 . 1 1 88 88 LEU H H 88 8.930 8.930 8.367 0.563 19694
6027 1 13 . 1 1 89 89 CYS N N 89 122.270 122.270 118.548 3.722 19694
6028 1 13 . 1 1 89 89 CYS HA H 89 4.780 4.780 4.775 0.005 19694
6029 1 13 . 1 1 89 89 CYS CA C 89 57.640 57.640 59.087 -1.447 19694
6030 1 13 . 1 1 89 89 CYS CB C 89 30.940 30.940 27.676 3.264 19694
6031 1 13 . 1 1 89 89 CYS H H 89 9.430 9.430 9.105 0.325 19694
6032 1 13 . 1 1 90 90 THR N N 90 110.620 110.620 116.858 -6.238 19694
6033 1 13 . 1 1 90 90 THR HA H 90 3.900 3.900 3.990 -0.090 19694
6034 1 13 . 1 1 90 90 THR CA C 90 65.460 65.460 66.001 -0.541 19694
6035 1 13 . 1 1 90 90 THR CB C 90 68.670 68.670 68.982 -0.312 19694
6036 1 13 . 1 1 90 90 THR H H 90 8.410 8.410 9.072 -0.662 19694
6037 1 13 . 1 1 91 91 ASP N N 91 123.470 123.470 121.758 1.712 19694
6038 1 13 . 1 1 91 91 ASP HA H 91 4.490 4.490 4.635 -0.145 19694
6039 1 13 . 1 1 91 91 ASP CA C 91 57.810 57.810 56.868 0.942 19694
6040 1 13 . 1 1 91 91 ASP CB C 91 41.160 41.160 40.228 0.932 19694
6041 1 13 . 1 1 91 91 ASP H H 91 8.150 8.150 8.402 -0.252 19694
6042 1 13 . 1 1 92 92 CYS N N 92 123.800 123.800 119.192 4.608 19694
6043 1 13 . 1 1 92 92 CYS HA H 92 3.970 3.970 4.241 -0.271 19694
6044 1 13 . 1 1 92 92 CYS CA C 92 64.100 64.100 61.313 2.787 19694
6045 1 13 . 1 1 92 92 CYS CB C 92 30.090 30.090 25.720 4.370 19694
6046 1 13 . 1 1 92 92 CYS H H 92 8.580 8.580 7.470 1.110 19694
6047 1 13 . 1 1 93 93 TYR N N 93 120.730 120.730 120.763 -0.033 19694
6048 1 13 . 1 1 93 93 TYR HA H 93 4.140 4.140 4.067 0.073 19694
6049 1 13 . 1 1 93 93 TYR CA C 93 60.380 60.380 61.113 -0.733 19694
6050 1 13 . 1 1 93 93 TYR CB C 93 39.300 39.300 38.220 1.080 19694
6051 1 13 . 1 1 93 93 TYR H H 93 8.540 8.540 9.144 -0.604 19694
6052 1 13 . 1 1 94 94 SER N N 94 115.010 115.010 113.517 1.493 19694
6053 1 13 . 1 1 94 94 SER HA H 94 4.220 4.220 4.060 0.160 19694
6054 1 13 . 1 1 94 94 SER CA C 94 59.300 59.300 61.477 -2.176 19694
6055 1 13 . 1 1 94 94 SER CB C 94 63.660 63.660 62.737 0.923 19694
6056 1 13 . 1 1 94 94 SER H H 94 7.750 7.750 8.130 -0.380 19694
6057 1 13 . 1 1 95 95 ASN N N 95 119.820 119.820 118.430 1.390 19694
6058 1 13 . 1 1 95 95 ASN HA H 95 4.510 4.510 4.589 -0.079 19694
6059 1 13 . 1 1 95 95 ASN CA C 95 53.880 53.880 55.257 -1.377 19694
6060 1 13 . 1 1 95 95 ASN CB C 95 39.300 39.300 38.688 0.612 19694
6061 1 13 . 1 1 95 95 ASN H H 95 7.780 7.780 7.866 -0.086 19694
6062 1 13 . 1 1 96 96 GLU N N 96 119.820 119.820 118.017 1.803 19694
6063 1 13 . 1 1 96 96 GLU HA H 96 4.096 4.096 4.096 -0.000 19694
6064 1 13 . 1 1 96 96 GLU CA C 96 56.910 56.910 57.702 -0.792 19694
6065 1 13 . 1 1 96 96 GLU CB C 96 30.220 30.220 29.978 0.242 19694
6066 1 13 . 1 1 96 96 GLU H H 96 7.950 7.950 8.048 -0.098 19694
6067 1 13 . 1 1 97 97 TYR N N 97 120.370 120.370 120.498 -0.128 19694
6068 1 13 . 1 1 97 97 TYR HA H 97 4.620 4.620 4.192 0.428 19694
6069 1 13 . 1 1 97 97 TYR CA C 97 57.700 57.700 59.419 -1.718 19694
6070 1 13 . 1 1 97 97 TYR CB C 97 38.710 38.710 38.774 -0.064 19694
6071 1 13 . 1 1 97 97 TYR H H 97 8.070 8.070 8.202 -0.132 19694
6072 1 14 . 1 1 2 2 THR N N 2 113.570 113.570 115.970 -2.400 19694
6073 1 14 . 1 1 2 2 THR HA H 2 4.240 4.240 4.332 -0.092 19694
6074 1 14 . 1 1 2 2 THR CA C 2 62.130 62.130 62.523 -0.393 19694
6075 1 14 . 1 1 2 2 THR CB C 2 69.250 69.250 69.268 -0.018 19694
6076 1 14 . 1 1 2 2 THR H H 2 8.090 8.090 8.229 -0.139 19694
6077 1 14 . 1 1 3 3 GLU N N 3 122.880 122.880 121.443 1.437 19694
6078 1 14 . 1 1 3 3 GLU HA H 3 4.280 4.280 4.254 0.026 19694
6079 1 14 . 1 1 3 3 GLU CA C 3 56.860 56.860 56.224 0.636 19694
6080 1 14 . 1 1 3 3 GLU CB C 3 30.570 30.570 30.285 0.285 19694
6081 1 14 . 1 1 3 3 GLU H H 3 8.280 8.280 8.095 0.185 19694
6082 1 14 . 1 1 4 4 ARG N N 4 121.330 121.330 119.833 1.497 19694
6083 1 14 . 1 1 4 4 ARG HA H 4 4.300 4.300 4.552 -0.252 19694
6084 1 14 . 1 1 4 4 ARG CA C 4 55.870 55.870 55.333 0.537 19694
6085 1 14 . 1 1 4 4 ARG CB C 4 31.640 31.640 30.936 0.705 19694
6086 1 14 . 1 1 4 4 ARG H H 4 8.280 8.280 8.554 -0.274 19694
6087 1 14 . 1 1 5 5 PHE N N 5 125.490 125.490 123.881 1.609 19694
6088 1 14 . 1 1 5 5 PHE HA H 5 4.610 4.610 4.650 -0.040 19694
6089 1 14 . 1 1 5 5 PHE CA C 5 56.380 56.380 56.672 -0.292 19694
6090 1 14 . 1 1 5 5 PHE CB C 5 39.560 39.560 40.015 -0.455 19694
6091 1 14 . 1 1 5 5 PHE H H 5 8.290 8.290 8.701 -0.411 19694
6092 1 14 . 1 1 6 6 ASP N N 6 123.260 123.260 121.376 1.884 19694
6093 1 14 . 1 1 6 6 ASP HA H 6 5.045 5.045 4.880 0.165 19694
6094 1 14 . 1 1 6 6 ASP CA C 6 52.180 52.180 53.167 -0.987 19694
6095 1 14 . 1 1 6 6 ASP CB C 6 44.210 44.210 44.311 -0.101 19694
6096 1 14 . 1 1 6 6 ASP H H 6 7.940 7.940 7.593 0.347 19694
6097 1 14 . 1 1 7 7 CYS N N 7 121.440 121.440 122.957 -1.517 19694
6098 1 14 . 1 1 7 7 CYS HA H 7 3.960 3.960 4.506 -0.546 19694
6099 1 14 . 1 1 7 7 CYS CA C 7 59.820 59.820 59.677 0.143 19694
6100 1 14 . 1 1 7 7 CYS CB C 7 30.950 30.950 26.167 4.783 19694
6101 1 14 . 1 1 7 7 CYS H H 7 8.700 8.700 8.516 0.184 19694
6102 1 14 . 1 1 8 8 HIS N N 8 129.390 129.390 129.494 -0.104 19694
6103 1 14 . 1 1 8 8 HIS HA H 8 4.200 4.200 4.223 -0.023 19694
6104 1 14 . 1 1 8 8 HIS CA C 8 58.240 58.240 59.658 -1.418 19694
6105 1 14 . 1 1 8 8 HIS CB C 8 29.480 29.480 30.130 -0.650 19694
6106 1 14 . 1 1 8 8 HIS H H 8 9.160 9.160 9.576 -0.416 19694
6107 1 14 . 1 1 9 9 HIS N N 9 118.740 118.740 116.902 1.838 19694
6108 1 14 . 1 1 9 9 HIS HA H 9 4.880 4.880 4.564 0.316 19694
6109 1 14 . 1 1 9 9 HIS CA C 9 58.680 58.680 57.118 1.562 19694
6110 1 14 . 1 1 9 9 HIS CB C 9 31.040 31.040 30.283 0.757 19694
6111 1 14 . 1 1 9 9 HIS H H 9 9.270 9.270 8.066 1.204 19694
6112 1 14 . 1 1 10 10 CYS N N 10 118.600 118.600 117.517 1.083 19694
6113 1 14 . 1 1 10 10 CYS HA H 10 4.600 4.600 4.434 0.166 19694
6114 1 14 . 1 1 10 10 CYS CA C 10 59.600 59.600 59.216 0.384 19694
6115 1 14 . 1 1 10 10 CYS CB C 10 32.330 32.330 27.988 4.342 19694
6116 1 14 . 1 1 10 10 CYS H H 10 8.550 8.550 7.899 0.651 19694
6117 1 14 . 1 1 11 11 ASN N N 11 116.220 116.220 117.087 -0.867 19694
6118 1 14 . 1 1 11 11 ASN HA H 11 4.410 4.410 4.358 0.052 19694
6119 1 14 . 1 1 11 11 ASN CA C 11 55.640 55.640 54.466 1.174 19694
6120 1 14 . 1 1 11 11 ASN CB C 11 38.200 38.200 36.441 1.759 19694
6121 1 14 . 1 1 11 11 ASN H H 11 7.690 7.690 8.706 -1.016 19694
6122 1 14 . 1 1 12 12 GLU N N 12 120.330 120.330 118.162 2.168 19694
6123 1 14 . 1 1 12 12 GLU HA H 12 4.220 4.220 4.573 -0.353 19694
6124 1 14 . 1 1 12 12 GLU CA C 12 56.700 56.700 54.800 1.899 19694
6125 1 14 . 1 1 12 12 GLU CB C 12 30.910 30.910 31.145 -0.235 19694
6126 1 14 . 1 1 12 12 GLU H H 12 8.210 8.210 7.688 0.522 19694
6127 1 14 . 1 1 13 13 SER N N 13 116.190 116.190 120.062 -3.872 19694
6128 1 14 . 1 1 13 13 SER HA H 13 4.060 4.060 4.390 -0.330 19694
6129 1 14 . 1 1 13 13 SER CA C 13 59.350 59.350 58.963 0.387 19694
6130 1 14 . 1 1 13 13 SER CB C 13 63.820 63.820 63.613 0.207 19694
6131 1 14 . 1 1 13 13 SER H H 13 8.520 8.520 8.618 -0.098 19694
6132 1 14 . 1 1 14 14 LEU N N 14 126.060 126.060 124.983 1.077 19694
6133 1 14 . 1 1 14 14 LEU HA H 14 4.310 4.310 4.338 -0.028 19694
6134 1 14 . 1 1 14 14 LEU CA C 14 54.100 54.100 55.560 -1.460 19694
6135 1 14 . 1 1 14 14 LEU CB C 14 42.200 42.200 41.706 0.494 19694
6136 1 14 . 1 1 14 14 LEU H H 14 8.910 8.910 7.752 1.158 19694
6137 1 14 . 1 1 15 15 PHE N N 15 120.660 120.660 121.308 -0.648 19694
6138 1 14 . 1 1 15 15 PHE HA H 15 4.480 4.480 4.603 -0.123 19694
6139 1 14 . 1 1 15 15 PHE CA C 15 60.400 60.400 56.615 3.785 19694
6140 1 14 . 1 1 15 15 PHE CB C 15 38.130 38.130 38.042 0.088 19694
6141 1 14 . 1 1 15 15 PHE H H 15 7.820 7.820 8.569 -0.749 19694
6142 1 14 . 1 1 16 16 GLY N N 16 114.730 114.730 110.951 3.779 19694
6143 1 14 . 1 1 16 16 GLY CA C 16 45.900 45.900 45.799 0.101 19694
6144 1 14 . 1 1 16 16 GLY H H 16 8.860 8.860 8.807 0.053 19694
6145 1 14 . 1 1 17 17 LYS N N 17 119.580 119.580 119.796 -0.216 19694
6146 1 14 . 1 1 17 17 LYS HA H 17 4.480 4.480 4.467 0.013 19694
6147 1 14 . 1 1 17 17 LYS CA C 17 54.460 54.460 54.529 -0.069 19694
6148 1 14 . 1 1 17 17 LYS CB C 17 35.800 35.800 33.990 1.810 19694
6149 1 14 . 1 1 17 17 LYS H H 17 8.030 8.030 7.250 0.780 19694
6150 1 14 . 1 1 18 18 LYS N N 18 120.330 120.330 121.996 -1.666 19694
6151 1 14 . 1 1 18 18 LYS HA H 18 4.280 4.280 4.332 -0.052 19694
6152 1 14 . 1 1 18 18 LYS CA C 18 56.800 56.800 57.511 -0.711 19694
6153 1 14 . 1 1 18 18 LYS CB C 18 33.010 33.010 33.065 -0.055 19694
6154 1 14 . 1 1 18 18 LYS H H 18 8.190 8.190 8.555 -0.365 19694
6155 1 14 . 1 1 19 19 TYR N N 19 117.500 117.500 114.439 3.061 19694
6156 1 14 . 1 1 19 19 TYR HA H 19 5.240 5.240 4.803 0.437 19694
6157 1 14 . 1 1 19 19 TYR CA C 19 55.340 55.340 56.430 -1.090 19694
6158 1 14 . 1 1 19 19 TYR CB C 19 42.850 42.850 40.261 2.589 19694
6159 1 14 . 1 1 19 19 TYR H H 19 7.610 7.610 7.929 -0.319 19694
6160 1 14 . 1 1 20 20 ILE N N 20 121.430 121.430 121.891 -0.461 19694
6161 1 14 . 1 1 20 20 ILE HA H 20 4.137 4.137 4.237 -0.100 19694
6162 1 14 . 1 1 20 20 ILE CA C 20 60.010 60.010 60.096 -0.087 19694
6163 1 14 . 1 1 20 20 ILE CB C 20 41.570 41.570 40.638 0.932 19694
6164 1 14 . 1 1 20 20 ILE H H 20 9.350 9.350 8.227 1.123 19694
6165 1 14 . 1 1 21 21 LEU N N 21 126.720 126.720 125.977 0.743 19694
6166 1 14 . 1 1 21 21 LEU HA H 21 5.090 5.090 4.755 0.335 19694
6167 1 14 . 1 1 21 21 LEU CA C 21 54.020 54.020 53.929 0.091 19694
6168 1 14 . 1 1 21 21 LEU CB C 21 43.720 43.720 40.837 2.883 19694
6169 1 14 . 1 1 21 21 LEU H H 21 8.530 8.530 8.495 0.035 19694
6170 1 14 . 1 1 22 22 ARG N N 22 123.930 123.930 126.111 -2.181 19694
6171 1 14 . 1 1 22 22 ARG HA H 22 4.440 4.440 4.498 -0.058 19694
6172 1 14 . 1 1 22 22 ARG CA C 22 55.600 55.600 54.117 1.483 19694
6173 1 14 . 1 1 22 22 ARG CB C 22 32.280 32.280 32.564 -0.284 19694
6174 1 14 . 1 1 22 22 ARG H H 22 9.080 9.080 8.842 0.238 19694
6175 1 14 . 1 1 23 23 GLU N N 23 128.500 128.500 124.773 3.727 19694
6176 1 14 . 1 1 23 23 GLU HA H 23 3.840 3.840 3.970 -0.130 19694
6177 1 14 . 1 1 23 23 GLU CA C 23 58.030 58.030 57.891 0.139 19694
6178 1 14 . 1 1 23 23 GLU CB C 23 27.200 27.200 27.799 -0.599 19694
6179 1 14 . 1 1 23 23 GLU H H 23 9.610 9.610 9.034 0.576 19694
6180 1 14 . 1 1 24 24 GLU N N 24 110.300 110.300 113.401 -3.101 19694
6181 1 14 . 1 1 24 24 GLU HA H 24 3.780 3.780 3.951 -0.171 19694
6182 1 14 . 1 1 24 24 GLU CA C 24 58.320 58.320 57.248 1.073 19694
6183 1 14 . 1 1 24 24 GLU CB C 24 28.220 28.220 27.674 0.545 19694
6184 1 14 . 1 1 24 24 GLU H H 24 8.660 8.660 8.701 -0.041 19694
6185 1 14 . 1 1 25 25 SER N N 25 117.700 117.700 113.232 4.468 19694
6186 1 14 . 1 1 25 25 SER HA H 25 4.890 4.890 4.774 0.116 19694
6187 1 14 . 1 1 25 25 SER CA C 25 56.540 56.540 55.493 1.047 19694
6188 1 14 . 1 1 25 25 SER CB C 25 64.720 64.720 65.116 -0.396 19694
6189 1 14 . 1 1 25 25 SER H H 25 7.900 7.900 7.748 0.152 19694
6190 1 14 . 1 1 26 26 PRO HA H 26 4.995 4.995 4.827 0.168 19694
6191 1 14 . 1 1 26 26 PRO CA C 26 61.750 61.750 62.998 -1.248 19694
6192 1 14 . 1 1 26 26 PRO CB C 26 32.660 32.660 31.769 0.891 19694
6193 1 14 . 1 1 27 27 TYR N N 27 118.100 118.100 123.550 -5.450 19694
6194 1 14 . 1 1 27 27 TYR HA H 27 5.910 5.910 4.982 0.928 19694
6195 1 14 . 1 1 27 27 TYR CA C 27 56.830 56.830 54.814 2.016 19694
6196 1 14 . 1 1 27 27 TYR CB C 27 42.810 42.810 42.484 0.326 19694
6197 1 14 . 1 1 27 27 TYR H H 27 9.040 9.040 8.614 0.426 19694
6198 1 14 . 1 1 28 28 CYS N N 28 122.230 122.230 118.997 3.233 19694
6199 1 14 . 1 1 28 28 CYS HA H 28 4.850 4.850 4.661 0.189 19694
6200 1 14 . 1 1 28 28 CYS CA C 28 58.110 58.110 58.492 -0.382 19694
6201 1 14 . 1 1 28 28 CYS CB C 28 30.530 30.530 29.069 1.461 19694
6202 1 14 . 1 1 28 28 CYS H H 28 9.850 9.850 8.342 1.508 19694
6203 1 14 . 1 1 29 29 VAL N N 29 118.200 118.200 122.745 -4.545 19694
6204 1 14 . 1 1 29 29 VAL HA H 29 3.650 3.650 3.763 -0.113 19694
6205 1 14 . 1 1 29 29 VAL CA C 29 67.400 67.400 66.881 0.519 19694
6206 1 14 . 1 1 29 29 VAL CB C 29 31.860 31.860 31.449 0.411 19694
6207 1 14 . 1 1 29 29 VAL H H 29 8.430 8.430 8.925 -0.495 19694
6208 1 14 . 1 1 30 30 VAL N N 30 119.570 119.570 118.847 0.723 19694
6209 1 14 . 1 1 30 30 VAL HA H 30 3.860 3.860 3.601 0.259 19694
6210 1 14 . 1 1 30 30 VAL CA C 30 66.450 66.450 66.618 -0.168 19694
6211 1 14 . 1 1 30 30 VAL CB C 30 31.540 31.540 31.030 0.510 19694
6212 1 14 . 1 1 30 30 VAL H H 30 7.700 7.700 7.874 -0.174 19694
6213 1 14 . 1 1 31 31 CYS N N 31 125.890 125.890 119.308 6.582 19694
6214 1 14 . 1 1 31 31 CYS HA H 31 3.830 3.830 3.892 -0.062 19694
6215 1 14 . 1 1 31 31 CYS CA C 31 65.850 65.850 64.380 1.470 19694
6216 1 14 . 1 1 31 31 CYS CB C 31 29.510 29.510 25.587 3.923 19694
6217 1 14 . 1 1 31 31 CYS H H 31 9.050 9.050 7.602 1.448 19694
6218 1 14 . 1 1 32 32 PHE N N 32 119.000 119.000 119.340 -0.340 19694
6219 1 14 . 1 1 32 32 PHE HA H 32 3.780 3.780 3.669 0.111 19694
6220 1 14 . 1 1 32 32 PHE CA C 32 62.610 62.610 61.703 0.907 19694
6221 1 14 . 1 1 32 32 PHE CB C 32 39.920 39.920 39.045 0.875 19694
6222 1 14 . 1 1 32 32 PHE H H 32 9.080 9.080 7.900 1.180 19694
6223 1 14 . 1 1 33 33 GLU N N 33 117.470 117.470 118.299 -0.829 19694
6224 1 14 . 1 1 33 33 GLU HA H 33 3.760 3.760 4.093 -0.333 19694
6225 1 14 . 1 1 33 33 GLU CA C 33 59.210 59.210 59.428 -0.219 19694
6226 1 14 . 1 1 33 33 GLU CB C 33 29.480 29.480 29.192 0.288 19694
6227 1 14 . 1 1 33 33 GLU H H 33 8.510 8.510 8.308 0.202 19694
6228 1 14 . 1 1 34 34 THR N N 34 114.140 114.140 115.630 -1.490 19694
6229 1 14 . 1 1 34 34 THR HA H 34 3.730 3.730 3.941 -0.211 19694
6230 1 14 . 1 1 34 34 THR CA C 34 65.890 65.890 65.902 -0.012 19694
6231 1 14 . 1 1 34 34 THR CB C 34 69.210 69.210 68.713 0.497 19694
6232 1 14 . 1 1 34 34 THR H H 34 7.880 7.880 8.333 -0.453 19694
6233 1 14 . 1 1 35 35 LEU N N 35 117.980 117.980 118.651 -0.671 19694
6234 1 14 . 1 1 35 35 LEU HA H 35 3.650 3.650 3.953 -0.303 19694
6235 1 14 . 1 1 35 35 LEU CA C 35 56.860 56.860 57.153 -0.292 19694
6236 1 14 . 1 1 35 35 LEU CB C 35 41.870 41.870 41.682 0.188 19694
6237 1 14 . 1 1 35 35 LEU H H 35 7.660 7.660 7.705 -0.045 19694
6238 1 14 . 1 1 36 36 PHE N N 36 113.900 113.900 113.992 -0.092 19694
6239 1 14 . 1 1 36 36 PHE HA H 36 4.597 4.597 4.420 0.177 19694
6240 1 14 . 1 1 36 36 PHE CA C 36 56.860 56.860 56.255 0.605 19694
6241 1 14 . 1 1 36 36 PHE CB C 36 40.570 40.570 38.235 2.335 19694
6242 1 14 . 1 1 36 36 PHE H H 36 7.730 7.730 6.678 1.052 19694
6243 1 14 . 1 1 37 37 ALA N N 37 121.920 121.920 123.037 -1.117 19694
6244 1 14 . 1 1 37 37 ALA HA H 37 4.070 4.070 4.043 0.027 19694
6245 1 14 . 1 1 37 37 ALA CA C 37 52.900 52.900 52.366 0.534 19694
6246 1 14 . 1 1 37 37 ALA CB C 37 19.770 19.770 19.760 0.010 19694
6247 1 14 . 1 1 37 37 ALA H H 37 7.090 7.090 7.794 -0.704 19694
6248 1 14 . 1 1 38 38 ASN N N 38 119.230 119.230 119.056 0.174 19694
6249 1 14 . 1 1 38 38 ASN HA H 38 4.450 4.450 4.659 -0.209 19694
6250 1 14 . 1 1 38 38 ASN CA C 38 52.850 52.850 52.170 0.680 19694
6251 1 14 . 1 1 38 38 ASN CB C 38 38.950 38.950 40.071 -1.121 19694
6252 1 14 . 1 1 38 38 ASN H H 38 8.790 8.790 8.348 0.442 19694
6253 1 14 . 1 1 39 39 THR N N 39 116.330 116.330 115.777 0.553 19694
6254 1 14 . 1 1 39 39 THR HA H 39 3.990 3.990 4.436 -0.446 19694
6255 1 14 . 1 1 39 39 THR CA C 39 62.130 62.130 62.531 -0.401 19694
6256 1 14 . 1 1 39 39 THR CB C 39 69.920 69.920 69.602 0.318 19694
6257 1 14 . 1 1 39 39 THR H H 39 8.540 8.540 8.247 0.293 19694
6258 1 14 . 1 1 40 40 CYS N N 40 126.950 126.950 127.733 -0.783 19694
6259 1 14 . 1 1 40 40 CYS HA H 40 4.300 4.300 4.464 -0.164 19694
6260 1 14 . 1 1 40 40 CYS CA C 40 58.350 58.350 56.835 1.515 19694
6261 1 14 . 1 1 40 40 CYS CB C 40 31.600 31.600 26.746 4.854 19694
6262 1 14 . 1 1 40 40 CYS H H 40 7.940 7.940 8.425 -0.485 19694
6263 1 14 . 1 1 41 41 GLU N N 41 130.560 130.560 127.531 3.029 19694
6264 1 14 . 1 1 41 41 GLU HA H 41 3.690 3.690 3.832 -0.142 19694
6265 1 14 . 1 1 41 41 GLU CA C 41 58.600 58.600 59.133 -0.533 19694
6266 1 14 . 1 1 41 41 GLU CB C 41 30.460 30.460 29.402 1.058 19694
6267 1 14 . 1 1 41 41 GLU H H 41 8.810 8.810 8.653 0.157 19694
6268 1 14 . 1 1 42 42 GLU N N 42 119.680 119.680 117.991 1.689 19694
6269 1 14 . 1 1 42 42 GLU HA H 42 4.570 4.570 4.392 0.178 19694
6270 1 14 . 1 1 42 42 GLU CA C 42 58.000 58.000 57.843 0.157 19694
6271 1 14 . 1 1 42 42 GLU CB C 42 31.680 31.680 30.663 1.017 19694
6272 1 14 . 1 1 42 42 GLU H H 42 8.500 8.500 8.116 0.384 19694
6273 1 14 . 1 1 43 43 CYS N N 43 115.600 115.600 116.792 -1.192 19694
6274 1 14 . 1 1 43 43 CYS HA H 43 5.010 5.010 4.522 0.488 19694
6275 1 14 . 1 1 43 43 CYS CA C 43 58.810 58.810 60.088 -1.278 19694
6276 1 14 . 1 1 43 43 CYS CB C 43 31.580 31.580 28.975 2.605 19694
6277 1 14 . 1 1 43 43 CYS H H 43 8.120 8.120 8.033 0.087 19694
6278 1 14 . 1 1 44 44 GLY N N 44 112.100 112.100 108.041 4.059 19694
6279 1 14 . 1 1 44 44 GLY CA C 44 46.420 46.420 45.474 0.946 19694
6280 1 14 . 1 1 44 44 GLY H H 44 7.900 7.900 8.607 -0.707 19694
6281 1 14 . 1 1 45 45 LYS N N 45 121.210 121.210 121.532 -0.322 19694
6282 1 14 . 1 1 45 45 LYS HA H 45 4.840 4.840 4.675 0.165 19694
6283 1 14 . 1 1 45 45 LYS CA C 45 54.360 54.360 53.048 1.312 19694
6284 1 14 . 1 1 45 45 LYS CB C 45 32.430 32.430 33.081 -0.651 19694
6285 1 14 . 1 1 45 45 LYS H H 45 8.180 8.180 7.902 0.278 19694
6286 1 14 . 1 1 46 46 PRO HA H 46 4.477 4.477 4.518 -0.041 19694
6287 1 14 . 1 1 46 46 PRO CA C 46 62.700 62.700 63.047 -0.346 19694
6288 1 14 . 1 1 46 46 PRO CB C 46 32.490 32.490 32.039 0.451 19694
6289 1 14 . 1 1 47 47 ILE N N 47 125.280 125.280 123.158 2.122 19694
6290 1 14 . 1 1 47 47 ILE HA H 47 3.830 3.830 4.284 -0.454 19694
6291 1 14 . 1 1 47 47 ILE CA C 47 61.040 61.040 60.837 0.203 19694
6292 1 14 . 1 1 47 47 ILE CB C 47 37.440 37.440 37.540 -0.100 19694
6293 1 14 . 1 1 47 47 ILE H H 47 8.540 8.540 8.868 -0.328 19694
6294 1 14 . 1 1 48 48 GLY N N 48 114.120 114.120 113.341 0.779 19694
6295 1 14 . 1 1 48 48 GLY CA C 48 45.240 45.240 44.543 0.697 19694
6296 1 14 . 1 1 48 48 GLY H H 48 8.660 8.660 8.469 0.191 19694
6297 1 14 . 1 1 49 49 CYS N N 49 117.140 117.140 118.699 -1.559 19694
6298 1 14 . 1 1 49 49 CYS HA H 49 4.280 4.280 4.241 0.039 19694
6299 1 14 . 1 1 49 49 CYS CA C 49 60.880 60.880 60.603 0.277 19694
6300 1 14 . 1 1 49 49 CYS CB C 49 27.650 27.650 28.267 -0.617 19694
6301 1 14 . 1 1 49 49 CYS H H 49 9.210 9.210 8.749 0.461 19694
6302 1 14 . 1 1 50 50 ASP N N 50 119.300 119.300 120.552 -1.252 19694
6303 1 14 . 1 1 50 50 ASP HA H 50 4.620 4.620 4.695 -0.075 19694
6304 1 14 . 1 1 50 50 ASP CA C 50 54.160 54.160 55.035 -0.875 19694
6305 1 14 . 1 1 50 50 ASP CB C 50 40.380 40.380 39.767 0.613 19694
6306 1 14 . 1 1 50 50 ASP H H 50 8.800 8.800 8.530 0.270 19694
6307 1 14 . 1 1 51 51 CYS N N 51 118.150 118.150 116.942 1.208 19694
6308 1 14 . 1 1 51 51 CYS HA H 51 4.620 4.620 4.673 -0.053 19694
6309 1 14 . 1 1 51 51 CYS CA C 51 58.030 58.030 56.744 1.286 19694
6310 1 14 . 1 1 51 51 CYS CB C 51 30.090 30.090 31.980 -1.890 19694
6311 1 14 . 1 1 51 51 CYS H H 51 7.590 7.590 7.441 0.149 19694
6312 1 14 . 1 1 52 52 LYS N N 52 123.800 123.800 123.353 0.447 19694
6313 1 14 . 1 1 52 52 LYS HA H 52 4.180 4.180 4.330 -0.150 19694
6314 1 14 . 1 1 52 52 LYS CA C 52 57.240 57.240 56.194 1.046 19694
6315 1 14 . 1 1 52 52 LYS CB C 52 33.030 33.030 31.338 1.692 19694
6316 1 14 . 1 1 52 52 LYS H H 52 8.600 8.600 8.614 -0.014 19694
6317 1 14 . 1 1 53 53 ASP N N 53 124.900 124.900 123.951 0.949 19694
6318 1 14 . 1 1 53 53 ASP HA H 53 4.230 4.230 4.657 -0.427 19694
6319 1 14 . 1 1 53 53 ASP CA C 53 53.130 53.130 53.538 -0.408 19694
6320 1 14 . 1 1 53 53 ASP CB C 53 42.230 42.230 40.718 1.512 19694
6321 1 14 . 1 1 53 53 ASP H H 53 8.250 8.250 8.443 -0.193 19694
6322 1 14 . 1 1 54 54 LEU N N 54 130.160 130.160 125.819 4.341 19694
6323 1 14 . 1 1 54 54 LEU HA H 54 4.440 4.440 4.580 -0.140 19694
6324 1 14 . 1 1 54 54 LEU CA C 54 53.340 53.340 55.303 -1.964 19694
6325 1 14 . 1 1 54 54 LEU CB C 54 41.170 41.170 43.011 -1.841 19694
6326 1 14 . 1 1 54 54 LEU H H 54 8.670 8.670 8.915 -0.245 19694
6327 1 14 . 1 1 55 55 SER N N 55 113.820 113.820 120.497 -6.677 19694
6328 1 14 . 1 1 55 55 SER HA H 55 5.580 5.580 5.204 0.376 19694
6329 1 14 . 1 1 55 55 SER CA C 55 55.850 55.850 56.100 -0.250 19694
6330 1 14 . 1 1 55 55 SER CB C 55 67.300 67.300 64.425 2.875 19694
6331 1 14 . 1 1 55 55 SER H H 55 8.160 8.160 8.492 -0.332 19694
6332 1 14 . 1 1 56 56 TYR N N 56 122.610 122.610 126.445 -3.835 19694
6333 1 14 . 1 1 56 56 TYR HA H 56 4.620 4.620 4.633 -0.013 19694
6334 1 14 . 1 1 56 56 TYR CA C 56 58.810 58.810 58.785 0.025 19694
6335 1 14 . 1 1 56 56 TYR CB C 56 41.000 41.000 42.000 -1.000 19694
6336 1 14 . 1 1 56 56 TYR H H 56 8.450 8.450 8.709 -0.259 19694
6337 1 14 . 1 1 57 57 LYS N N 57 126.020 126.020 127.624 -1.604 19694
6338 1 14 . 1 1 57 57 LYS HA H 57 3.470 3.470 3.925 -0.455 19694
6339 1 14 . 1 1 57 57 LYS CA C 57 58.100 58.100 57.638 0.462 19694
6340 1 14 . 1 1 57 57 LYS CB C 57 29.480 29.480 31.879 -2.399 19694
6341 1 14 . 1 1 57 57 LYS H H 57 8.920 8.920 8.803 0.117 19694
6342 1 14 . 1 1 58 58 ASP HA H 58 3.830 3.830 4.229 -0.399 19694
6343 1 14 . 1 1 58 58 ASP CA C 58 54.900 54.900 55.305 -0.405 19694
6344 1 14 . 1 1 58 58 ASP CB C 58 40.080 40.080 40.529 -0.448 19694
6345 1 14 . 1 1 58 58 ASP H H 58 8.400 8.400 8.562 -0.162 19694
6346 1 14 . 1 1 59 59 ARG N N 59 121.190 121.190 116.164 5.026 19694
6347 1 14 . 1 1 59 59 ARG HA H 59 4.250 4.250 4.530 -0.280 19694
6348 1 14 . 1 1 59 59 ARG CA C 59 55.580 55.580 54.159 1.421 19694
6349 1 14 . 1 1 59 59 ARG CB C 59 33.460 33.460 33.486 -0.026 19694
6350 1 14 . 1 1 59 59 ARG H H 59 7.980 7.980 7.957 0.023 19694
6351 1 14 . 1 1 60 60 HIS N N 60 118.420 118.420 117.751 0.669 19694
6352 1 14 . 1 1 60 60 HIS HA H 60 5.270 5.270 5.670 -0.400 19694
6353 1 14 . 1 1 60 60 HIS CA C 60 55.010 55.010 55.254 -0.244 19694
6354 1 14 . 1 1 60 60 HIS CB C 60 32.380 32.380 33.302 -0.922 19694
6355 1 14 . 1 1 60 60 HIS H H 60 8.350 8.350 8.141 0.209 19694
6356 1 14 . 1 1 61 61 TRP N N 61 119.990 119.990 118.199 1.791 19694
6357 1 14 . 1 1 61 61 TRP HA H 61 5.930 5.930 4.785 1.145 19694
6358 1 14 . 1 1 61 61 TRP CA C 61 57.400 57.400 57.126 0.274 19694
6359 1 14 . 1 1 61 61 TRP CB C 61 35.380 35.380 34.197 1.183 19694
6360 1 14 . 1 1 61 61 TRP H H 61 9.310 9.310 9.236 0.074 19694
6361 1 14 . 1 1 62 62 HIS N N 62 117.270 117.270 121.578 -4.308 19694
6362 1 14 . 1 1 62 62 HIS HA H 62 4.600 4.600 4.820 -0.220 19694
6363 1 14 . 1 1 62 62 HIS CA C 62 59.210 59.210 57.503 1.707 19694
6364 1 14 . 1 1 62 62 HIS CB C 62 31.200 31.200 30.435 0.765 19694
6365 1 14 . 1 1 62 62 HIS H H 62 8.430 8.430 9.143 -0.713 19694
6366 1 14 . 1 1 63 63 GLU N N 63 124.640 124.640 128.287 -3.647 19694
6367 1 14 . 1 1 63 63 GLU HA H 63 3.827 3.827 3.949 -0.122 19694
6368 1 14 . 1 1 63 63 GLU CA C 63 61.020 61.020 59.270 1.750 19694
6369 1 14 . 1 1 63 63 GLU CB C 63 30.310 30.310 29.803 0.507 19694
6370 1 14 . 1 1 63 63 GLU H H 63 9.040 9.040 8.156 0.884 19694
6371 1 14 . 1 1 64 64 ALA N N 64 117.050 117.050 117.828 -0.778 19694
6372 1 14 . 1 1 64 64 ALA HA H 64 4.230 4.230 4.303 -0.073 19694
6373 1 14 . 1 1 64 64 ALA CA C 64 54.000 54.000 52.931 1.069 19694
6374 1 14 . 1 1 64 64 ALA CB C 64 18.880 18.880 18.983 -0.103 19694
6375 1 14 . 1 1 64 64 ALA H H 64 8.680 8.680 8.167 0.513 19694
6376 1 14 . 1 1 65 65 CYS N N 65 115.380 115.380 117.100 -1.720 19694
6377 1 14 . 1 1 65 65 CYS HA H 65 4.295 4.295 4.021 0.274 19694
6378 1 14 . 1 1 65 65 CYS CA C 65 59.850 59.850 60.156 -0.306 19694
6379 1 14 . 1 1 65 65 CYS CB C 65 32.840 32.840 26.919 5.920 19694
6380 1 14 . 1 1 65 65 CYS H H 65 7.490 7.490 8.150 -0.660 19694
6381 1 14 . 1 1 66 66 PHE N N 66 122.020 122.020 123.098 -1.078 19694
6382 1 14 . 1 1 66 66 PHE HA H 66 3.890 3.890 3.919 -0.029 19694
6383 1 14 . 1 1 66 66 PHE CA C 66 57.010 57.010 58.564 -1.554 19694
6384 1 14 . 1 1 66 66 PHE CB C 66 38.070 38.070 38.189 -0.119 19694
6385 1 14 . 1 1 66 66 PHE H H 66 7.110 7.110 7.569 -0.459 19694
6386 1 14 . 1 1 67 67 HIS N N 67 121.280 121.280 122.020 -0.740 19694
6387 1 14 . 1 1 67 67 HIS HA H 67 4.720 4.720 5.284 -0.564 19694
6388 1 14 . 1 1 67 67 HIS CA C 67 52.730 52.730 52.749 -0.019 19694
6389 1 14 . 1 1 67 67 HIS CB C 67 32.230 32.230 30.789 1.441 19694
6390 1 14 . 1 1 67 67 HIS H H 67 7.380 7.380 7.963 -0.583 19694
6391 1 14 . 1 1 68 68 CYS N N 68 121.590 121.590 118.758 2.832 19694
6392 1 14 . 1 1 68 68 CYS HA H 68 3.960 3.960 4.918 -0.958 19694
6393 1 14 . 1 1 68 68 CYS CA C 68 59.790 59.790 57.870 1.920 19694
6394 1 14 . 1 1 68 68 CYS CB C 68 31.200 31.200 29.280 1.920 19694
6395 1 14 . 1 1 68 68 CYS H H 68 8.530 8.530 8.354 0.176 19694
6396 1 14 . 1 1 69 69 SER N N 69 126.530 126.530 120.366 6.164 19694
6397 1 14 . 1 1 69 69 SER HA H 69 4.310 4.310 4.023 0.287 19694
6398 1 14 . 1 1 69 69 SER CA C 69 61.760 61.760 60.763 0.997 19694
6399 1 14 . 1 1 69 69 SER CB C 69 64.040 64.040 63.201 0.839 19694
6400 1 14 . 1 1 69 69 SER H H 69 9.460 9.460 8.725 0.735 19694
6401 1 14 . 1 1 70 70 GLN N N 70 122.370 122.370 117.505 4.865 19694
6402 1 14 . 1 1 70 70 GLN HA H 70 4.510 4.510 4.494 0.016 19694
6403 1 14 . 1 1 70 70 GLN CA C 70 57.840 57.840 56.982 0.858 19694
6404 1 14 . 1 1 70 70 GLN CB C 70 30.430 30.430 29.981 0.449 19694
6405 1 14 . 1 1 70 70 GLN H H 70 8.980 8.980 7.805 1.175 19694
6406 1 14 . 1 1 71 71 CYS N N 71 118.860 118.860 116.926 1.934 19694
6407 1 14 . 1 1 71 71 CYS HA H 71 4.720 4.720 4.691 0.029 19694
6408 1 14 . 1 1 71 71 CYS CA C 71 59.770 59.770 58.263 1.508 19694
6409 1 14 . 1 1 71 71 CYS CB C 71 31.910 31.910 27.944 3.966 19694
6410 1 14 . 1 1 71 71 CYS H H 71 8.220 8.220 7.752 0.468 19694
6411 1 14 . 1 1 72 72 ARG N N 72 114.380 114.380 115.752 -1.372 19694
6412 1 14 . 1 1 72 72 ARG HA H 72 3.965 3.965 3.849 0.116 19694
6413 1 14 . 1 1 72 72 ARG CA C 72 58.030 58.030 57.251 0.779 19694
6414 1 14 . 1 1 72 72 ARG CB C 72 27.720 27.720 27.661 0.059 19694
6415 1 14 . 1 1 72 72 ARG H H 72 7.380 7.380 7.794 -0.414 19694
6416 1 14 . 1 1 73 73 ASN N N 73 121.480 121.480 116.310 5.170 19694
6417 1 14 . 1 1 73 73 ASN HA H 73 4.630 4.630 4.664 -0.034 19694
6418 1 14 . 1 1 73 73 ASN CA C 73 54.110 54.110 53.844 0.266 19694
6419 1 14 . 1 1 73 73 ASN CB C 73 38.870 38.870 39.720 -0.850 19694
6420 1 14 . 1 1 73 73 ASN H H 73 8.722 8.722 8.035 0.687 19694
6421 1 14 . 1 1 74 74 SER N N 74 114.710 114.710 117.682 -2.972 19694
6422 1 14 . 1 1 74 74 SER HA H 74 4.060 4.060 4.883 -0.823 19694
6423 1 14 . 1 1 74 74 SER CA C 74 59.357 59.357 58.373 0.984 19694
6424 1 14 . 1 1 74 74 SER CB C 74 63.300 63.300 63.224 0.076 19694
6425 1 14 . 1 1 74 74 SER H H 74 8.690 8.690 8.513 0.177 19694
6426 1 14 . 1 1 75 75 LEU N N 75 125.757 125.757 128.506 -2.749 19694
6427 1 14 . 1 1 75 75 LEU HA H 75 4.280 4.280 4.275 0.005 19694
6428 1 14 . 1 1 75 75 LEU CA C 75 53.510 53.510 54.753 -1.243 19694
6429 1 14 . 1 1 75 75 LEU CB C 75 42.200 42.200 41.700 0.500 19694
6430 1 14 . 1 1 75 75 LEU H H 75 7.970 7.970 8.061 -0.091 19694
6431 1 14 . 1 1 76 76 VAL N N 76 120.860 120.860 124.536 -3.676 19694
6432 1 14 . 1 1 76 76 VAL HA H 76 3.570 3.570 3.850 -0.280 19694
6433 1 14 . 1 1 76 76 VAL CA C 76 65.420 65.420 60.876 4.544 19694
6434 1 14 . 1 1 76 76 VAL CB C 76 31.540 31.540 35.173 -3.633 19694
6435 1 14 . 1 1 76 76 VAL H H 76 7.830 7.830 7.978 -0.148 19694
6436 1 14 . 1 1 77 77 ASP N N 77 122.360 122.360 123.444 -1.084 19694
6437 1 14 . 1 1 77 77 ASP HA H 77 4.230 4.230 4.459 -0.229 19694
6438 1 14 . 1 1 77 77 ASP CA C 77 56.200 56.200 55.853 0.347 19694
6439 1 14 . 1 1 77 77 ASP CB C 77 39.380 39.380 40.956 -1.576 19694
6440 1 14 . 1 1 77 77 ASP H H 77 8.910 8.910 8.388 0.522 19694
6441 1 14 . 1 1 78 78 LYS N N 78 118.100 118.100 118.363 -0.263 19694
6442 1 14 . 1 1 78 78 LYS HA H 78 4.870 4.870 4.639 0.231 19694
6443 1 14 . 1 1 78 78 LYS CA C 78 56.960 56.960 53.640 3.320 19694
6444 1 14 . 1 1 78 78 LYS CB C 78 34.680 34.680 33.789 0.890 19694
6445 1 14 . 1 1 78 78 LYS H H 78 7.660 7.660 7.605 0.055 19694
6446 1 14 . 1 1 79 79 PRO HA H 79 4.460 4.460 4.214 0.246 19694
6447 1 14 . 1 1 79 79 PRO CA C 79 62.520 62.520 62.956 -0.436 19694
6448 1 14 . 1 1 79 79 PRO CB C 79 32.160 32.160 31.869 0.291 19694
6449 1 14 . 1 1 80 80 PHE N N 80 114.050 114.050 117.007 -2.957 19694
6450 1 14 . 1 1 80 80 PHE HA H 80 4.910 4.910 5.089 -0.179 19694
6451 1 14 . 1 1 80 80 PHE CA C 80 56.060 56.060 55.054 1.006 19694
6452 1 14 . 1 1 80 80 PHE CB C 80 42.410 42.410 42.025 0.385 19694
6453 1 14 . 1 1 80 80 PHE H H 80 7.510 7.510 7.184 0.326 19694
6454 1 14 . 1 1 81 81 ALA N N 81 123.290 123.290 123.856 -0.566 19694
6455 1 14 . 1 1 81 81 ALA HA H 81 4.310 4.310 4.352 -0.042 19694
6456 1 14 . 1 1 81 81 ALA CA C 81 50.450 50.450 50.360 0.090 19694
6457 1 14 . 1 1 81 81 ALA CB C 81 21.920 21.920 18.969 2.951 19694
6458 1 14 . 1 1 81 81 ALA H H 81 9.030 9.030 9.019 0.011 19694
6459 1 14 . 1 1 82 82 ALA N N 82 122.490 122.490 128.706 -6.216 19694
6460 1 14 . 1 1 82 82 ALA HA H 82 5.110 5.110 4.392 0.718 19694
6461 1 14 . 1 1 82 82 ALA CA C 82 51.100 51.100 51.929 -0.829 19694
6462 1 14 . 1 1 82 82 ALA CB C 82 21.130 21.130 18.830 2.300 19694
6463 1 14 . 1 1 82 82 ALA H H 82 8.240 8.240 8.600 -0.360 19694
6464 1 14 . 1 1 83 83 LYS N N 83 123.580 123.580 126.004 -2.424 19694
6465 1 14 . 1 1 83 83 LYS HA H 83 4.490 4.490 4.501 -0.011 19694
6466 1 14 . 1 1 83 83 LYS CA C 83 55.800 55.800 55.383 0.417 19694
6467 1 14 . 1 1 83 83 LYS CB C 83 34.720 34.720 34.101 0.619 19694
6468 1 14 . 1 1 83 83 LYS H H 83 8.400 8.400 8.279 0.121 19694
6469 1 14 . 1 1 84 84 GLU N N 84 125.470 125.470 120.367 5.103 19694
6470 1 14 . 1 1 84 84 GLU HA H 84 3.820 3.820 4.125 -0.305 19694
6471 1 14 . 1 1 84 84 GLU CA C 84 58.620 58.620 58.977 -0.357 19694
6472 1 14 . 1 1 84 84 GLU CB C 84 27.210 27.210 29.722 -2.512 19694
6473 1 14 . 1 1 84 84 GLU H H 84 9.320 9.320 8.792 0.528 19694
6474 1 14 . 1 1 85 85 ASP N N 85 118.550 118.550 114.413 4.137 19694
6475 1 14 . 1 1 85 85 ASP HA H 85 4.600 4.600 4.796 -0.196 19694
6476 1 14 . 1 1 85 85 ASP CA C 85 55.400 55.400 53.869 1.531 19694
6477 1 14 . 1 1 85 85 ASP CB C 85 40.400 40.400 42.092 -1.692 19694
6478 1 14 . 1 1 85 85 ASP H H 85 8.730 8.730 8.374 0.356 19694
6479 1 14 . 1 1 86 86 GLN N N 86 119.050 119.050 117.291 1.759 19694
6480 1 14 . 1 1 86 86 GLN HA H 86 4.540 4.540 4.691 -0.151 19694
6481 1 14 . 1 1 86 86 GLN CA C 86 55.100 55.100 53.950 1.150 19694
6482 1 14 . 1 1 86 86 GLN CB C 86 31.110 31.110 31.895 -0.785 19694
6483 1 14 . 1 1 86 86 GLN H H 86 8.170 8.170 7.591 0.579 19694
6484 1 14 . 1 1 87 87 LEU N N 87 123.110 123.110 121.359 1.751 19694
6485 1 14 . 1 1 87 87 LEU HA H 87 4.620 4.620 5.194 -0.574 19694
6486 1 14 . 1 1 87 87 LEU CA C 87 54.520 54.520 54.012 0.508 19694
6487 1 14 . 1 1 87 87 LEU CB C 87 42.700 42.700 44.557 -1.857 19694
6488 1 14 . 1 1 87 87 LEU H H 87 8.490 8.490 8.508 -0.018 19694
6489 1 14 . 1 1 88 88 LEU N N 88 123.690 123.690 120.192 3.498 19694
6490 1 14 . 1 1 88 88 LEU HA H 88 5.880 5.880 4.945 0.935 19694
6491 1 14 . 1 1 88 88 LEU CA C 88 53.340 53.340 52.813 0.527 19694
6492 1 14 . 1 1 88 88 LEU CB C 88 47.190 47.190 47.802 -0.612 19694
6493 1 14 . 1 1 88 88 LEU H H 88 8.930 8.930 8.423 0.507 19694
6494 1 14 . 1 1 89 89 CYS N N 89 122.270 122.270 119.233 3.037 19694
6495 1 14 . 1 1 89 89 CYS HA H 89 4.780 4.780 4.760 0.020 19694
6496 1 14 . 1 1 89 89 CYS CA C 89 57.640 57.640 58.942 -1.302 19694
6497 1 14 . 1 1 89 89 CYS CB C 89 30.940 30.940 27.811 3.129 19694
6498 1 14 . 1 1 89 89 CYS H H 89 9.430 9.430 9.059 0.371 19694
6499 1 14 . 1 1 90 90 THR N N 90 110.620 110.620 117.415 -6.795 19694
6500 1 14 . 1 1 90 90 THR HA H 90 3.900 3.900 3.957 -0.057 19694
6501 1 14 . 1 1 90 90 THR CA C 90 65.460 65.460 66.271 -0.811 19694
6502 1 14 . 1 1 90 90 THR CB C 90 68.670 68.670 68.776 -0.106 19694
6503 1 14 . 1 1 90 90 THR H H 90 8.410 8.410 9.043 -0.633 19694
6504 1 14 . 1 1 91 91 ASP N N 91 123.470 123.470 121.664 1.806 19694
6505 1 14 . 1 1 91 91 ASP HA H 91 4.490 4.490 4.643 -0.153 19694
6506 1 14 . 1 1 91 91 ASP CA C 91 57.810 57.810 57.271 0.539 19694
6507 1 14 . 1 1 91 91 ASP CB C 91 41.160 41.160 40.507 0.653 19694
6508 1 14 . 1 1 91 91 ASP H H 91 8.150 8.150 8.482 -0.332 19694
6509 1 14 . 1 1 92 92 CYS N N 92 123.800 123.800 119.717 4.083 19694
6510 1 14 . 1 1 92 92 CYS HA H 92 3.970 3.970 4.356 -0.386 19694
6511 1 14 . 1 1 92 92 CYS CA C 92 64.100 64.100 61.510 2.590 19694
6512 1 14 . 1 1 92 92 CYS CB C 92 30.090 30.090 26.227 3.863 19694
6513 1 14 . 1 1 92 92 CYS H H 92 8.580 8.580 7.871 0.709 19694
6514 1 14 . 1 1 93 93 TYR N N 93 120.730 120.730 120.847 -0.117 19694
6515 1 14 . 1 1 93 93 TYR HA H 93 4.140 4.140 4.095 0.045 19694
6516 1 14 . 1 1 93 93 TYR CA C 93 60.380 60.380 61.329 -0.949 19694
6517 1 14 . 1 1 93 93 TYR CB C 93 39.300 39.300 38.386 0.914 19694
6518 1 14 . 1 1 93 93 TYR H H 93 8.540 8.540 9.168 -0.628 19694
6519 1 14 . 1 1 94 94 SER N N 94 115.010 115.010 113.193 1.817 19694
6520 1 14 . 1 1 94 94 SER HA H 94 4.220 4.220 4.231 -0.011 19694
6521 1 14 . 1 1 94 94 SER CA C 94 59.300 59.300 61.095 -1.795 19694
6522 1 14 . 1 1 94 94 SER CB C 94 63.660 63.660 62.565 1.095 19694
6523 1 14 . 1 1 94 94 SER H H 94 7.750 7.750 8.106 -0.356 19694
6524 1 14 . 1 1 95 95 ASN N N 95 119.820 119.820 118.908 0.912 19694
6525 1 14 . 1 1 95 95 ASN HA H 95 4.510 4.510 4.606 -0.096 19694
6526 1 14 . 1 1 95 95 ASN CA C 95 53.880 53.880 55.191 -1.311 19694
6527 1 14 . 1 1 95 95 ASN CB C 95 39.300 39.300 39.178 0.122 19694
6528 1 14 . 1 1 95 95 ASN H H 95 7.780 7.780 7.897 -0.117 19694
6529 1 14 . 1 1 96 96 GLU N N 96 119.820 119.820 116.905 2.915 19694
6530 1 14 . 1 1 96 96 GLU HA H 96 4.096 4.096 4.210 -0.114 19694
6531 1 14 . 1 1 96 96 GLU CA C 96 56.910 56.910 57.604 -0.694 19694
6532 1 14 . 1 1 96 96 GLU CB C 96 30.220 30.220 29.442 0.778 19694
6533 1 14 . 1 1 96 96 GLU H H 96 7.950 7.950 7.572 0.378 19694
6534 1 14 . 1 1 97 97 TYR N N 97 120.370 120.370 121.459 -1.089 19694
6535 1 14 . 1 1 97 97 TYR HA H 97 4.620 4.620 3.970 0.650 19694
6536 1 14 . 1 1 97 97 TYR CA C 97 57.700 57.700 60.050 -2.350 19694
6537 1 14 . 1 1 97 97 TYR CB C 97 38.710 38.710 38.432 0.278 19694
6538 1 14 . 1 1 97 97 TYR H H 97 8.070 8.070 8.456 -0.386 19694
6539 1 15 . 1 1 2 2 THR N N 2 113.570 113.570 116.159 -2.589 19694
6540 1 15 . 1 1 2 2 THR HA H 2 4.240 4.240 4.307 -0.067 19694
6541 1 15 . 1 1 2 2 THR CA C 2 62.130 62.130 62.666 -0.536 19694
6542 1 15 . 1 1 2 2 THR CB C 2 69.250 69.250 69.287 -0.037 19694
6543 1 15 . 1 1 2 2 THR H H 2 8.090 8.090 8.071 0.019 19694
6544 1 15 . 1 1 3 3 GLU N N 3 122.880 122.880 120.556 2.324 19694
6545 1 15 . 1 1 3 3 GLU HA H 3 4.280 4.280 4.238 0.042 19694
6546 1 15 . 1 1 3 3 GLU CA C 3 56.860 56.860 56.365 0.495 19694
6547 1 15 . 1 1 3 3 GLU CB C 3 30.570 30.570 30.282 0.288 19694
6548 1 15 . 1 1 3 3 GLU H H 3 8.280 8.280 8.049 0.231 19694
6549 1 15 . 1 1 4 4 ARG N N 4 121.330 121.330 119.541 1.789 19694
6550 1 15 . 1 1 4 4 ARG HA H 4 4.300 4.300 4.557 -0.257 19694
6551 1 15 . 1 1 4 4 ARG CA C 4 55.870 55.870 55.154 0.716 19694
6552 1 15 . 1 1 4 4 ARG CB C 4 31.640 31.640 30.710 0.930 19694
6553 1 15 . 1 1 4 4 ARG H H 4 8.280 8.280 8.549 -0.269 19694
6554 1 15 . 1 1 5 5 PHE N N 5 125.490 125.490 124.720 0.770 19694
6555 1 15 . 1 1 5 5 PHE HA H 5 4.610 4.610 4.622 -0.012 19694
6556 1 15 . 1 1 5 5 PHE CA C 5 56.380 56.380 56.556 -0.176 19694
6557 1 15 . 1 1 5 5 PHE CB C 5 39.560 39.560 39.757 -0.197 19694
6558 1 15 . 1 1 5 5 PHE H H 5 8.290 8.290 8.756 -0.466 19694
6559 1 15 . 1 1 6 6 ASP N N 6 123.260 123.260 121.402 1.858 19694
6560 1 15 . 1 1 6 6 ASP HA H 6 5.045 5.045 4.810 0.235 19694
6561 1 15 . 1 1 6 6 ASP CA C 6 52.180 52.180 53.222 -1.042 19694
6562 1 15 . 1 1 6 6 ASP CB C 6 44.210 44.210 44.417 -0.207 19694
6563 1 15 . 1 1 6 6 ASP H H 6 7.940 7.940 7.639 0.301 19694
6564 1 15 . 1 1 7 7 CYS N N 7 121.440 121.440 122.877 -1.437 19694
6565 1 15 . 1 1 7 7 CYS HA H 7 3.960 3.960 4.455 -0.495 19694
6566 1 15 . 1 1 7 7 CYS CA C 7 59.820 59.820 59.603 0.217 19694
6567 1 15 . 1 1 7 7 CYS CB C 7 30.950 30.950 26.244 4.705 19694
6568 1 15 . 1 1 7 7 CYS H H 7 8.700 8.700 8.617 0.083 19694
6569 1 15 . 1 1 8 8 HIS N N 8 129.390 129.390 129.785 -0.395 19694
6570 1 15 . 1 1 8 8 HIS HA H 8 4.200 4.200 4.208 -0.008 19694
6571 1 15 . 1 1 8 8 HIS CA C 8 58.240 58.240 59.390 -1.150 19694
6572 1 15 . 1 1 8 8 HIS CB C 8 29.480 29.480 30.145 -0.665 19694
6573 1 15 . 1 1 8 8 HIS H H 8 9.160 9.160 9.651 -0.491 19694
6574 1 15 . 1 1 9 9 HIS N N 9 118.740 118.740 117.433 1.307 19694
6575 1 15 . 1 1 9 9 HIS HA H 9 4.880 4.880 4.354 0.526 19694
6576 1 15 . 1 1 9 9 HIS CA C 9 58.680 58.680 57.296 1.384 19694
6577 1 15 . 1 1 9 9 HIS CB C 9 31.040 31.040 30.131 0.909 19694
6578 1 15 . 1 1 9 9 HIS H H 9 9.270 9.270 8.026 1.244 19694
6579 1 15 . 1 1 10 10 CYS N N 10 118.600 118.600 118.512 0.088 19694
6580 1 15 . 1 1 10 10 CYS HA H 10 4.600 4.600 4.301 0.299 19694
6581 1 15 . 1 1 10 10 CYS CA C 10 59.600 59.600 59.497 0.103 19694
6582 1 15 . 1 1 10 10 CYS CB C 10 32.330 32.330 28.092 4.238 19694
6583 1 15 . 1 1 10 10 CYS H H 10 8.550 8.550 8.011 0.539 19694
6584 1 15 . 1 1 11 11 ASN N N 11 116.220 116.220 116.932 -0.712 19694
6585 1 15 . 1 1 11 11 ASN HA H 11 4.410 4.410 4.450 -0.040 19694
6586 1 15 . 1 1 11 11 ASN CA C 11 55.640 55.640 54.378 1.262 19694
6587 1 15 . 1 1 11 11 ASN CB C 11 38.200 38.200 35.806 2.394 19694
6588 1 15 . 1 1 11 11 ASN H H 11 7.690 7.690 8.847 -1.157 19694
6589 1 15 . 1 1 12 12 GLU N N 12 120.330 120.330 117.720 2.610 19694
6590 1 15 . 1 1 12 12 GLU HA H 12 4.220 4.220 4.478 -0.258 19694
6591 1 15 . 1 1 12 12 GLU CA C 12 56.700 56.700 54.760 1.940 19694
6592 1 15 . 1 1 12 12 GLU CB C 12 30.910 30.910 30.924 -0.014 19694
6593 1 15 . 1 1 12 12 GLU H H 12 8.210 8.210 7.723 0.487 19694
6594 1 15 . 1 1 13 13 SER N N 13 116.190 116.190 120.028 -3.838 19694
6595 1 15 . 1 1 13 13 SER HA H 13 4.060 4.060 4.355 -0.295 19694
6596 1 15 . 1 1 13 13 SER CA C 13 59.350 59.350 59.021 0.329 19694
6597 1 15 . 1 1 13 13 SER CB C 13 63.820 63.820 63.531 0.289 19694
6598 1 15 . 1 1 13 13 SER H H 13 8.520 8.520 8.673 -0.153 19694
6599 1 15 . 1 1 14 14 LEU N N 14 126.060 126.060 126.808 -0.748 19694
6600 1 15 . 1 1 14 14 LEU HA H 14 4.310 4.310 4.330 -0.020 19694
6601 1 15 . 1 1 14 14 LEU CA C 14 54.100 54.100 55.765 -1.665 19694
6602 1 15 . 1 1 14 14 LEU CB C 14 42.200 42.200 41.353 0.847 19694
6603 1 15 . 1 1 14 14 LEU H H 14 8.910 8.910 7.723 1.187 19694
6604 1 15 . 1 1 15 15 PHE N N 15 120.660 120.660 121.093 -0.433 19694
6605 1 15 . 1 1 15 15 PHE HA H 15 4.480 4.480 4.622 -0.142 19694
6606 1 15 . 1 1 15 15 PHE CA C 15 60.400 60.400 56.333 4.067 19694
6607 1 15 . 1 1 15 15 PHE CB C 15 38.130 38.130 37.990 0.140 19694
6608 1 15 . 1 1 15 15 PHE H H 15 7.820 7.820 8.637 -0.817 19694
6609 1 15 . 1 1 16 16 GLY N N 16 114.730 114.730 110.938 3.792 19694
6610 1 15 . 1 1 16 16 GLY CA C 16 45.900 45.900 45.812 0.088 19694
6611 1 15 . 1 1 16 16 GLY H H 16 8.860 8.860 8.800 0.060 19694
6612 1 15 . 1 1 17 17 LYS N N 17 119.580 119.580 119.774 -0.194 19694
6613 1 15 . 1 1 17 17 LYS HA H 17 4.480 4.480 4.461 0.019 19694
6614 1 15 . 1 1 17 17 LYS CA C 17 54.460 54.460 54.522 -0.062 19694
6615 1 15 . 1 1 17 17 LYS CB C 17 35.800 35.800 33.950 1.850 19694
6616 1 15 . 1 1 17 17 LYS H H 17 8.030 8.030 7.241 0.789 19694
6617 1 15 . 1 1 18 18 LYS N N 18 120.330 120.330 121.576 -1.246 19694
6618 1 15 . 1 1 18 18 LYS HA H 18 4.280 4.280 4.345 -0.065 19694
6619 1 15 . 1 1 18 18 LYS CA C 18 56.800 56.800 57.350 -0.550 19694
6620 1 15 . 1 1 18 18 LYS CB C 18 33.010 33.010 33.023 -0.013 19694
6621 1 15 . 1 1 18 18 LYS H H 18 8.190 8.190 8.570 -0.380 19694
6622 1 15 . 1 1 19 19 TYR N N 19 117.500 117.500 114.195 3.305 19694
6623 1 15 . 1 1 19 19 TYR HA H 19 5.240 5.240 4.799 0.441 19694
6624 1 15 . 1 1 19 19 TYR CA C 19 55.340 55.340 56.381 -1.041 19694
6625 1 15 . 1 1 19 19 TYR CB C 19 42.850 42.850 40.222 2.628 19694
6626 1 15 . 1 1 19 19 TYR H H 19 7.610 7.610 7.926 -0.316 19694
6627 1 15 . 1 1 20 20 ILE N N 20 121.430 121.430 121.838 -0.408 19694
6628 1 15 . 1 1 20 20 ILE HA H 20 4.137 4.137 4.248 -0.111 19694
6629 1 15 . 1 1 20 20 ILE CA C 20 60.010 60.010 60.109 -0.099 19694
6630 1 15 . 1 1 20 20 ILE CB C 20 41.570 41.570 40.621 0.949 19694
6631 1 15 . 1 1 20 20 ILE H H 20 9.350 9.350 8.225 1.125 19694
6632 1 15 . 1 1 21 21 LEU N N 21 126.720 126.720 126.064 0.656 19694
6633 1 15 . 1 1 21 21 LEU HA H 21 5.090 5.090 4.767 0.323 19694
6634 1 15 . 1 1 21 21 LEU CA C 21 54.020 54.020 53.949 0.071 19694
6635 1 15 . 1 1 21 21 LEU CB C 21 43.720 43.720 40.819 2.901 19694
6636 1 15 . 1 1 21 21 LEU H H 21 8.530 8.530 8.502 0.028 19694
6637 1 15 . 1 1 22 22 ARG N N 22 123.930 123.930 125.306 -1.376 19694
6638 1 15 . 1 1 22 22 ARG HA H 22 4.440 4.440 4.554 -0.114 19694
6639 1 15 . 1 1 22 22 ARG CA C 22 55.600 55.600 53.755 1.845 19694
6640 1 15 . 1 1 22 22 ARG CB C 22 32.280 32.280 32.820 -0.540 19694
6641 1 15 . 1 1 22 22 ARG H H 22 9.080 9.080 8.893 0.187 19694
6642 1 15 . 1 1 23 23 GLU N N 23 128.500 128.500 124.900 3.600 19694
6643 1 15 . 1 1 23 23 GLU HA H 23 3.840 3.840 3.991 -0.151 19694
6644 1 15 . 1 1 23 23 GLU CA C 23 58.030 58.030 57.692 0.338 19694
6645 1 15 . 1 1 23 23 GLU CB C 23 27.200 27.200 28.210 -1.010 19694
6646 1 15 . 1 1 23 23 GLU H H 23 9.610 9.610 9.041 0.569 19694
6647 1 15 . 1 1 24 24 GLU N N 24 110.300 110.300 113.183 -2.883 19694
6648 1 15 . 1 1 24 24 GLU HA H 24 3.780 3.780 3.982 -0.202 19694
6649 1 15 . 1 1 24 24 GLU CA C 24 58.320 58.320 57.286 1.034 19694
6650 1 15 . 1 1 24 24 GLU CB C 24 28.220 28.220 28.155 0.065 19694
6651 1 15 . 1 1 24 24 GLU H H 24 8.660 8.660 8.583 0.077 19694
6652 1 15 . 1 1 25 25 SER N N 25 117.700 117.700 112.829 4.871 19694
6653 1 15 . 1 1 25 25 SER HA H 25 4.890 4.890 4.778 0.112 19694
6654 1 15 . 1 1 25 25 SER CA C 25 56.540 56.540 56.274 0.266 19694
6655 1 15 . 1 1 25 25 SER CB C 25 64.720 64.720 65.178 -0.458 19694
6656 1 15 . 1 1 25 25 SER H H 25 7.900 7.900 7.911 -0.011 19694
6657 1 15 . 1 1 26 26 PRO HA H 26 4.995 4.995 4.875 0.120 19694
6658 1 15 . 1 1 26 26 PRO CA C 26 61.750 61.750 63.108 -1.358 19694
6659 1 15 . 1 1 26 26 PRO CB C 26 32.660 32.660 31.572 1.088 19694
6660 1 15 . 1 1 27 27 TYR N N 27 118.100 118.100 123.654 -5.554 19694
6661 1 15 . 1 1 27 27 TYR HA H 27 5.910 5.910 4.983 0.927 19694
6662 1 15 . 1 1 27 27 TYR CA C 27 56.830 56.830 54.910 1.920 19694
6663 1 15 . 1 1 27 27 TYR CB C 27 42.810 42.810 42.514 0.296 19694
6664 1 15 . 1 1 27 27 TYR H H 27 9.040 9.040 8.721 0.319 19694
6665 1 15 . 1 1 28 28 CYS N N 28 122.230 122.230 119.469 2.761 19694
6666 1 15 . 1 1 28 28 CYS HA H 28 4.850 4.850 4.687 0.163 19694
6667 1 15 . 1 1 28 28 CYS CA C 28 58.110 58.110 58.356 -0.246 19694
6668 1 15 . 1 1 28 28 CYS CB C 28 30.530 30.530 29.227 1.303 19694
6669 1 15 . 1 1 28 28 CYS H H 28 9.850 9.850 8.362 1.488 19694
6670 1 15 . 1 1 29 29 VAL N N 29 118.200 118.200 122.116 -3.916 19694
6671 1 15 . 1 1 29 29 VAL HA H 29 3.650 3.650 3.810 -0.160 19694
6672 1 15 . 1 1 29 29 VAL CA C 29 67.400 67.400 66.591 0.809 19694
6673 1 15 . 1 1 29 29 VAL CB C 29 31.860 31.860 31.047 0.813 19694
6674 1 15 . 1 1 29 29 VAL H H 29 8.430 8.430 8.996 -0.566 19694
6675 1 15 . 1 1 30 30 VAL N N 30 119.570 119.570 118.421 1.149 19694
6676 1 15 . 1 1 30 30 VAL HA H 30 3.860 3.860 3.639 0.221 19694
6677 1 15 . 1 1 30 30 VAL CA C 30 66.450 66.450 66.187 0.263 19694
6678 1 15 . 1 1 30 30 VAL CB C 30 31.540 31.540 30.444 1.096 19694
6679 1 15 . 1 1 30 30 VAL H H 30 7.700 7.700 7.978 -0.278 19694
6680 1 15 . 1 1 31 31 CYS N N 31 125.890 125.890 119.590 6.300 19694
6681 1 15 . 1 1 31 31 CYS HA H 31 3.830 3.830 3.906 -0.076 19694
6682 1 15 . 1 1 31 31 CYS CA C 31 65.850 65.850 64.337 1.513 19694
6683 1 15 . 1 1 31 31 CYS CB C 31 29.510 29.510 25.518 3.992 19694
6684 1 15 . 1 1 31 31 CYS H H 31 9.050 9.050 7.656 1.394 19694
6685 1 15 . 1 1 32 32 PHE N N 32 119.000 119.000 119.393 -0.393 19694
6686 1 15 . 1 1 32 32 PHE HA H 32 3.780 3.780 3.702 0.078 19694
6687 1 15 . 1 1 32 32 PHE CA C 32 62.610 62.610 61.770 0.840 19694
6688 1 15 . 1 1 32 32 PHE CB C 32 39.920 39.920 39.040 0.880 19694
6689 1 15 . 1 1 32 32 PHE H H 32 9.080 9.080 7.897 1.183 19694
6690 1 15 . 1 1 33 33 GLU N N 33 117.470 117.470 118.336 -0.866 19694
6691 1 15 . 1 1 33 33 GLU HA H 33 3.760 3.760 4.055 -0.295 19694
6692 1 15 . 1 1 33 33 GLU CA C 33 59.210 59.210 59.486 -0.276 19694
6693 1 15 . 1 1 33 33 GLU CB C 33 29.480 29.480 29.210 0.270 19694
6694 1 15 . 1 1 33 33 GLU H H 33 8.510 8.510 8.487 0.023 19694
6695 1 15 . 1 1 34 34 THR N N 34 114.140 114.140 116.271 -2.131 19694
6696 1 15 . 1 1 34 34 THR HA H 34 3.730 3.730 3.911 -0.181 19694
6697 1 15 . 1 1 34 34 THR CA C 34 65.890 65.890 66.284 -0.394 19694
6698 1 15 . 1 1 34 34 THR CB C 34 69.210 69.210 68.722 0.488 19694
6699 1 15 . 1 1 34 34 THR H H 34 7.880 7.880 8.344 -0.464 19694
6700 1 15 . 1 1 35 35 LEU N N 35 117.980 117.980 118.637 -0.657 19694
6701 1 15 . 1 1 35 35 LEU HA H 35 3.650 3.650 3.966 -0.316 19694
6702 1 15 . 1 1 35 35 LEU CA C 35 56.860 56.860 57.205 -0.345 19694
6703 1 15 . 1 1 35 35 LEU CB C 35 41.870 41.870 41.768 0.102 19694
6704 1 15 . 1 1 35 35 LEU H H 35 7.660 7.660 7.775 -0.115 19694
6705 1 15 . 1 1 36 36 PHE N N 36 113.900 113.900 113.929 -0.029 19694
6706 1 15 . 1 1 36 36 PHE HA H 36 4.597 4.597 4.434 0.163 19694
6707 1 15 . 1 1 36 36 PHE CA C 36 56.860 56.860 56.333 0.527 19694
6708 1 15 . 1 1 36 36 PHE CB C 36 40.570 40.570 38.229 2.341 19694
6709 1 15 . 1 1 36 36 PHE H H 36 7.730 7.730 6.700 1.030 19694
6710 1 15 . 1 1 37 37 ALA N N 37 121.920 121.920 123.339 -1.419 19694
6711 1 15 . 1 1 37 37 ALA HA H 37 4.070 4.070 4.068 0.002 19694
6712 1 15 . 1 1 37 37 ALA CA C 37 52.900 52.900 52.529 0.372 19694
6713 1 15 . 1 1 37 37 ALA CB C 37 19.770 19.770 19.625 0.145 19694
6714 1 15 . 1 1 37 37 ALA H H 37 7.090 7.090 7.899 -0.809 19694
6715 1 15 . 1 1 38 38 ASN N N 38 119.230 119.230 119.350 -0.120 19694
6716 1 15 . 1 1 38 38 ASN HA H 38 4.450 4.450 4.703 -0.253 19694
6717 1 15 . 1 1 38 38 ASN CA C 38 52.850 52.850 52.469 0.381 19694
6718 1 15 . 1 1 38 38 ASN CB C 38 38.950 38.950 40.238 -1.288 19694
6719 1 15 . 1 1 38 38 ASN H H 38 8.790 8.790 8.289 0.501 19694
6720 1 15 . 1 1 39 39 THR N N 39 116.330 116.330 115.673 0.657 19694
6721 1 15 . 1 1 39 39 THR HA H 39 3.990 3.990 4.297 -0.307 19694
6722 1 15 . 1 1 39 39 THR CA C 39 62.130 62.130 62.590 -0.460 19694
6723 1 15 . 1 1 39 39 THR CB C 39 69.920 69.920 69.760 0.160 19694
6724 1 15 . 1 1 39 39 THR H H 39 8.540 8.540 8.280 0.260 19694
6725 1 15 . 1 1 40 40 CYS N N 40 126.950 126.950 128.258 -1.308 19694
6726 1 15 . 1 1 40 40 CYS HA H 40 4.300 4.300 4.439 -0.139 19694
6727 1 15 . 1 1 40 40 CYS CA C 40 58.350 58.350 57.216 1.134 19694
6728 1 15 . 1 1 40 40 CYS CB C 40 31.600 31.600 26.593 5.007 19694
6729 1 15 . 1 1 40 40 CYS H H 40 7.940 7.940 8.550 -0.610 19694
6730 1 15 . 1 1 41 41 GLU N N 41 130.560 130.560 127.601 2.959 19694
6731 1 15 . 1 1 41 41 GLU HA H 41 3.690 3.690 3.840 -0.150 19694
6732 1 15 . 1 1 41 41 GLU CA C 41 58.600 58.600 59.124 -0.524 19694
6733 1 15 . 1 1 41 41 GLU CB C 41 30.460 30.460 29.420 1.040 19694
6734 1 15 . 1 1 41 41 GLU H H 41 8.810 8.810 8.672 0.138 19694
6735 1 15 . 1 1 42 42 GLU N N 42 119.680 119.680 118.293 1.387 19694
6736 1 15 . 1 1 42 42 GLU HA H 42 4.570 4.570 4.338 0.232 19694
6737 1 15 . 1 1 42 42 GLU CA C 42 58.000 58.000 58.116 -0.116 19694
6738 1 15 . 1 1 42 42 GLU CB C 42 31.680 31.680 30.578 1.102 19694
6739 1 15 . 1 1 42 42 GLU H H 42 8.500 8.500 8.095 0.405 19694
6740 1 15 . 1 1 43 43 CYS N N 43 115.600 115.600 116.397 -0.797 19694
6741 1 15 . 1 1 43 43 CYS HA H 43 5.010 5.010 4.555 0.455 19694
6742 1 15 . 1 1 43 43 CYS CA C 43 58.810 58.810 60.157 -1.347 19694
6743 1 15 . 1 1 43 43 CYS CB C 43 31.580 31.580 29.216 2.364 19694
6744 1 15 . 1 1 43 43 CYS H H 43 8.120 8.120 7.968 0.152 19694
6745 1 15 . 1 1 44 44 GLY N N 44 112.100 112.100 107.159 4.941 19694
6746 1 15 . 1 1 44 44 GLY CA C 44 46.420 46.420 45.283 1.137 19694
6747 1 15 . 1 1 44 44 GLY H H 44 7.900 7.900 8.568 -0.668 19694
6748 1 15 . 1 1 45 45 LYS N N 45 121.210 121.210 121.500 -0.290 19694
6749 1 15 . 1 1 45 45 LYS HA H 45 4.840 4.840 4.748 0.092 19694
6750 1 15 . 1 1 45 45 LYS CA C 45 54.360 54.360 52.749 1.611 19694
6751 1 15 . 1 1 45 45 LYS CB C 45 32.430 32.430 32.356 0.074 19694
6752 1 15 . 1 1 45 45 LYS H H 45 8.180 8.180 7.917 0.263 19694
6753 1 15 . 1 1 46 46 PRO HA H 46 4.477 4.477 4.598 -0.121 19694
6754 1 15 . 1 1 46 46 PRO CA C 46 62.700 62.700 63.044 -0.344 19694
6755 1 15 . 1 1 46 46 PRO CB C 46 32.490 32.490 31.993 0.497 19694
6756 1 15 . 1 1 47 47 ILE N N 47 125.280 125.280 123.153 2.127 19694
6757 1 15 . 1 1 47 47 ILE HA H 47 3.830 3.830 4.318 -0.488 19694
6758 1 15 . 1 1 47 47 ILE CA C 47 61.040 61.040 60.739 0.301 19694
6759 1 15 . 1 1 47 47 ILE CB C 47 37.440 37.440 37.761 -0.321 19694
6760 1 15 . 1 1 47 47 ILE H H 47 8.540 8.540 8.882 -0.342 19694
6761 1 15 . 1 1 48 48 GLY N N 48 114.120 114.120 114.040 0.080 19694
6762 1 15 . 1 1 48 48 GLY CA C 48 45.240 45.240 45.091 0.149 19694
6763 1 15 . 1 1 48 48 GLY H H 48 8.660 8.660 8.590 0.070 19694
6764 1 15 . 1 1 49 49 CYS N N 49 117.140 117.140 122.467 -5.327 19694
6765 1 15 . 1 1 49 49 CYS HA H 49 4.280 4.280 4.361 -0.081 19694
6766 1 15 . 1 1 49 49 CYS CA C 49 60.880 60.880 59.418 1.462 19694
6767 1 15 . 1 1 49 49 CYS CB C 49 27.650 27.650 27.857 -0.207 19694
6768 1 15 . 1 1 49 49 CYS H H 49 9.210 9.210 9.482 -0.272 19694
6769 1 15 . 1 1 50 50 ASP N N 50 119.300 119.300 120.097 -0.797 19694
6770 1 15 . 1 1 50 50 ASP HA H 50 4.620 4.620 4.592 0.028 19694
6771 1 15 . 1 1 50 50 ASP CA C 50 54.160 54.160 56.221 -2.061 19694
6772 1 15 . 1 1 50 50 ASP CB C 50 40.380 40.380 40.863 -0.483 19694
6773 1 15 . 1 1 50 50 ASP H H 50 8.800 8.800 8.106 0.694 19694
6774 1 15 . 1 1 51 51 CYS N N 51 118.150 118.150 117.613 0.537 19694
6775 1 15 . 1 1 51 51 CYS HA H 51 4.620 4.620 4.774 -0.154 19694
6776 1 15 . 1 1 51 51 CYS CA C 51 58.030 58.030 56.807 1.223 19694
6777 1 15 . 1 1 51 51 CYS CB C 51 30.090 30.090 31.284 -1.194 19694
6778 1 15 . 1 1 51 51 CYS H H 51 7.590 7.590 7.557 0.033 19694
6779 1 15 . 1 1 52 52 LYS N N 52 123.800 123.800 121.804 1.996 19694
6780 1 15 . 1 1 52 52 LYS HA H 52 4.180 4.180 4.292 -0.112 19694
6781 1 15 . 1 1 52 52 LYS CA C 52 57.240 57.240 56.697 0.543 19694
6782 1 15 . 1 1 52 52 LYS CB C 52 33.030 33.030 31.915 1.115 19694
6783 1 15 . 1 1 52 52 LYS H H 52 8.600 8.600 8.426 0.174 19694
6784 1 15 . 1 1 53 53 ASP N N 53 124.900 124.900 123.823 1.077 19694
6785 1 15 . 1 1 53 53 ASP HA H 53 4.230 4.230 4.781 -0.551 19694
6786 1 15 . 1 1 53 53 ASP CA C 53 53.130 53.130 52.828 0.302 19694
6787 1 15 . 1 1 53 53 ASP CB C 53 42.230 42.230 41.435 0.795 19694
6788 1 15 . 1 1 53 53 ASP H H 53 8.250 8.250 8.456 -0.206 19694
6789 1 15 . 1 1 54 54 LEU N N 54 130.160 130.160 126.235 3.925 19694
6790 1 15 . 1 1 54 54 LEU HA H 54 4.440 4.440 4.702 -0.262 19694
6791 1 15 . 1 1 54 54 LEU CA C 54 53.340 53.340 55.120 -1.780 19694
6792 1 15 . 1 1 54 54 LEU CB C 54 41.170 41.170 43.475 -2.305 19694
6793 1 15 . 1 1 54 54 LEU H H 54 8.670 8.670 8.971 -0.301 19694
6794 1 15 . 1 1 55 55 SER N N 55 113.820 113.820 121.749 -7.929 19694
6795 1 15 . 1 1 55 55 SER HA H 55 5.580 5.580 5.136 0.444 19694
6796 1 15 . 1 1 55 55 SER CA C 55 55.850 55.850 56.073 -0.223 19694
6797 1 15 . 1 1 55 55 SER CB C 55 67.300 67.300 64.274 3.026 19694
6798 1 15 . 1 1 55 55 SER H H 55 8.160 8.160 8.546 -0.386 19694
6799 1 15 . 1 1 56 56 TYR N N 56 122.610 122.610 125.924 -3.314 19694
6800 1 15 . 1 1 56 56 TYR HA H 56 4.620 4.620 4.618 0.002 19694
6801 1 15 . 1 1 56 56 TYR CA C 56 58.810 58.810 58.716 0.094 19694
6802 1 15 . 1 1 56 56 TYR CB C 56 41.000 41.000 42.256 -1.256 19694
6803 1 15 . 1 1 56 56 TYR H H 56 8.450 8.450 8.788 -0.338 19694
6804 1 15 . 1 1 57 57 LYS N N 57 126.020 126.020 129.061 -3.041 19694
6805 1 15 . 1 1 57 57 LYS HA H 57 3.470 3.470 3.920 -0.450 19694
6806 1 15 . 1 1 57 57 LYS CA C 57 58.100 58.100 57.126 0.974 19694
6807 1 15 . 1 1 57 57 LYS CB C 57 29.480 29.480 32.148 -2.668 19694
6808 1 15 . 1 1 57 57 LYS H H 57 8.920 8.920 8.595 0.325 19694
6809 1 15 . 1 1 58 58 ASP HA H 58 3.830 3.830 4.203 -0.373 19694
6810 1 15 . 1 1 58 58 ASP CA C 58 54.900 54.900 55.311 -0.411 19694
6811 1 15 . 1 1 58 58 ASP CB C 58 40.080 40.080 40.499 -0.419 19694
6812 1 15 . 1 1 58 58 ASP H H 58 8.400 8.400 8.624 -0.224 19694
6813 1 15 . 1 1 59 59 ARG N N 59 121.190 121.190 116.068 5.122 19694
6814 1 15 . 1 1 59 59 ARG HA H 59 4.250 4.250 4.477 -0.227 19694
6815 1 15 . 1 1 59 59 ARG CA C 59 55.580 55.580 54.167 1.413 19694
6816 1 15 . 1 1 59 59 ARG CB C 59 33.460 33.460 33.544 -0.084 19694
6817 1 15 . 1 1 59 59 ARG H H 59 7.980 7.980 7.332 0.648 19694
6818 1 15 . 1 1 60 60 HIS N N 60 118.420 118.420 117.672 0.748 19694
6819 1 15 . 1 1 60 60 HIS HA H 60 5.270 5.270 5.649 -0.379 19694
6820 1 15 . 1 1 60 60 HIS CA C 60 55.010 55.010 55.128 -0.118 19694
6821 1 15 . 1 1 60 60 HIS CB C 60 32.380 32.380 33.331 -0.951 19694
6822 1 15 . 1 1 60 60 HIS H H 60 8.350 8.350 8.101 0.249 19694
6823 1 15 . 1 1 61 61 TRP N N 61 119.990 119.990 118.274 1.716 19694
6824 1 15 . 1 1 61 61 TRP HA H 61 5.930 5.930 4.793 1.137 19694
6825 1 15 . 1 1 61 61 TRP CA C 61 57.400 57.400 57.124 0.276 19694
6826 1 15 . 1 1 61 61 TRP CB C 61 35.380 35.380 34.256 1.124 19694
6827 1 15 . 1 1 61 61 TRP H H 61 9.310 9.310 9.281 0.029 19694
6828 1 15 . 1 1 62 62 HIS N N 62 117.270 117.270 120.463 -3.193 19694
6829 1 15 . 1 1 62 62 HIS HA H 62 4.600 4.600 4.931 -0.331 19694
6830 1 15 . 1 1 62 62 HIS CA C 62 59.210 59.210 56.922 2.288 19694
6831 1 15 . 1 1 62 62 HIS CB C 62 31.200 31.200 30.408 0.792 19694
6832 1 15 . 1 1 62 62 HIS H H 62 8.430 8.430 9.081 -0.651 19694
6833 1 15 . 1 1 63 63 GLU N N 63 124.640 124.640 127.746 -3.106 19694
6834 1 15 . 1 1 63 63 GLU HA H 63 3.827 3.827 3.984 -0.157 19694
6835 1 15 . 1 1 63 63 GLU CA C 63 61.020 61.020 59.477 1.543 19694
6836 1 15 . 1 1 63 63 GLU CB C 63 30.310 30.310 29.503 0.807 19694
6837 1 15 . 1 1 63 63 GLU H H 63 9.040 9.040 8.679 0.361 19694
6838 1 15 . 1 1 64 64 ALA N N 64 117.050 117.050 117.531 -0.481 19694
6839 1 15 . 1 1 64 64 ALA HA H 64 4.230 4.230 4.307 -0.077 19694
6840 1 15 . 1 1 64 64 ALA CA C 64 54.000 54.000 53.034 0.966 19694
6841 1 15 . 1 1 64 64 ALA CB C 64 18.880 18.880 19.091 -0.211 19694
6842 1 15 . 1 1 64 64 ALA H H 64 8.680 8.680 8.170 0.510 19694
6843 1 15 . 1 1 65 65 CYS N N 65 115.380 115.380 116.600 -1.220 19694
6844 1 15 . 1 1 65 65 CYS HA H 65 4.295 4.295 4.015 0.280 19694
6845 1 15 . 1 1 65 65 CYS CA C 65 59.850 59.850 60.200 -0.350 19694
6846 1 15 . 1 1 65 65 CYS CB C 65 32.840 32.840 26.884 5.956 19694
6847 1 15 . 1 1 65 65 CYS H H 65 7.490 7.490 8.104 -0.614 19694
6848 1 15 . 1 1 66 66 PHE N N 66 122.020 122.020 123.217 -1.197 19694
6849 1 15 . 1 1 66 66 PHE HA H 66 3.890 3.890 3.927 -0.037 19694
6850 1 15 . 1 1 66 66 PHE CA C 66 57.010 57.010 58.535 -1.525 19694
6851 1 15 . 1 1 66 66 PHE CB C 66 38.070 38.070 38.141 -0.071 19694
6852 1 15 . 1 1 66 66 PHE H H 66 7.110 7.110 7.656 -0.546 19694
6853 1 15 . 1 1 67 67 HIS N N 67 121.280 121.280 121.997 -0.717 19694
6854 1 15 . 1 1 67 67 HIS HA H 67 4.720 4.720 5.299 -0.579 19694
6855 1 15 . 1 1 67 67 HIS CA C 67 52.730 52.730 52.741 -0.011 19694
6856 1 15 . 1 1 67 67 HIS CB C 67 32.230 32.230 30.823 1.407 19694
6857 1 15 . 1 1 67 67 HIS H H 67 7.380 7.380 7.974 -0.594 19694
6858 1 15 . 1 1 68 68 CYS N N 68 121.590 121.590 118.764 2.826 19694
6859 1 15 . 1 1 68 68 CYS HA H 68 3.960 3.960 4.923 -0.963 19694
6860 1 15 . 1 1 68 68 CYS CA C 68 59.790 59.790 57.894 1.896 19694
6861 1 15 . 1 1 68 68 CYS CB C 68 31.200 31.200 29.568 1.632 19694
6862 1 15 . 1 1 68 68 CYS H H 68 8.530 8.530 8.291 0.239 19694
6863 1 15 . 1 1 69 69 SER N N 69 126.530 126.530 120.640 5.890 19694
6864 1 15 . 1 1 69 69 SER HA H 69 4.310 4.310 4.115 0.195 19694
6865 1 15 . 1 1 69 69 SER CA C 69 61.760 61.760 60.698 1.062 19694
6866 1 15 . 1 1 69 69 SER CB C 69 64.040 64.040 63.065 0.975 19694
6867 1 15 . 1 1 69 69 SER H H 69 9.460 9.460 8.721 0.739 19694
6868 1 15 . 1 1 70 70 GLN N N 70 122.370 122.370 119.086 3.284 19694
6869 1 15 . 1 1 70 70 GLN HA H 70 4.510 4.510 4.345 0.165 19694
6870 1 15 . 1 1 70 70 GLN CA C 70 57.840 57.840 57.063 0.777 19694
6871 1 15 . 1 1 70 70 GLN CB C 70 30.430 30.430 29.578 0.852 19694
6872 1 15 . 1 1 70 70 GLN H H 70 8.980 8.980 8.040 0.940 19694
6873 1 15 . 1 1 71 71 CYS N N 71 118.860 118.860 116.342 2.518 19694
6874 1 15 . 1 1 71 71 CYS HA H 71 4.720 4.720 4.775 -0.055 19694
6875 1 15 . 1 1 71 71 CYS CA C 71 59.770 59.770 58.168 1.602 19694
6876 1 15 . 1 1 71 71 CYS CB C 71 31.910 31.910 27.887 4.024 19694
6877 1 15 . 1 1 71 71 CYS H H 71 8.220 8.220 7.745 0.475 19694
6878 1 15 . 1 1 72 72 ARG N N 72 114.380 114.380 118.784 -4.404 19694
6879 1 15 . 1 1 72 72 ARG HA H 72 3.965 3.965 3.813 0.152 19694
6880 1 15 . 1 1 72 72 ARG CA C 72 58.030 58.030 57.282 0.748 19694
6881 1 15 . 1 1 72 72 ARG CB C 72 27.720 27.720 28.548 -0.828 19694
6882 1 15 . 1 1 72 72 ARG H H 72 7.380 7.380 7.821 -0.441 19694
6883 1 15 . 1 1 73 73 ASN N N 73 121.480 121.480 115.690 5.790 19694
6884 1 15 . 1 1 73 73 ASN HA H 73 4.630 4.630 4.658 -0.028 19694
6885 1 15 . 1 1 73 73 ASN CA C 73 54.110 54.110 54.157 -0.047 19694
6886 1 15 . 1 1 73 73 ASN CB C 73 38.870 38.870 39.584 -0.714 19694
6887 1 15 . 1 1 73 73 ASN H H 73 8.722 8.722 8.176 0.546 19694
6888 1 15 . 1 1 74 74 SER N N 74 114.710 114.710 117.705 -2.995 19694
6889 1 15 . 1 1 74 74 SER HA H 74 4.060 4.060 4.814 -0.754 19694
6890 1 15 . 1 1 74 74 SER CA C 74 59.357 59.357 58.101 1.256 19694
6891 1 15 . 1 1 74 74 SER CB C 74 63.300 63.300 62.677 0.623 19694
6892 1 15 . 1 1 74 74 SER H H 74 8.690 8.690 8.506 0.184 19694
6893 1 15 . 1 1 75 75 LEU N N 75 125.757 125.757 127.233 -1.476 19694
6894 1 15 . 1 1 75 75 LEU HA H 75 4.280 4.280 4.378 -0.098 19694
6895 1 15 . 1 1 75 75 LEU CA C 75 53.510 53.510 54.839 -1.329 19694
6896 1 15 . 1 1 75 75 LEU CB C 75 42.200 42.200 42.206 -0.006 19694
6897 1 15 . 1 1 75 75 LEU H H 75 7.970 7.970 7.993 -0.023 19694
6898 1 15 . 1 1 76 76 VAL N N 76 120.860 120.860 123.637 -2.777 19694
6899 1 15 . 1 1 76 76 VAL HA H 76 3.570 3.570 3.863 -0.293 19694
6900 1 15 . 1 1 76 76 VAL CA C 76 65.420 65.420 60.819 4.601 19694
6901 1 15 . 1 1 76 76 VAL CB C 76 31.540 31.540 35.738 -4.198 19694
6902 1 15 . 1 1 76 76 VAL H H 76 7.830 7.830 7.926 -0.096 19694
6903 1 15 . 1 1 77 77 ASP N N 77 122.360 122.360 122.574 -0.214 19694
6904 1 15 . 1 1 77 77 ASP HA H 77 4.230 4.230 4.498 -0.268 19694
6905 1 15 . 1 1 77 77 ASP CA C 77 56.200 56.200 55.743 0.457 19694
6906 1 15 . 1 1 77 77 ASP CB C 77 39.380 39.380 40.951 -1.571 19694
6907 1 15 . 1 1 77 77 ASP H H 77 8.910 8.910 8.424 0.486 19694
6908 1 15 . 1 1 78 78 LYS N N 78 118.100 118.100 118.409 -0.309 19694
6909 1 15 . 1 1 78 78 LYS HA H 78 4.870 4.870 4.637 0.233 19694
6910 1 15 . 1 1 78 78 LYS CA C 78 56.960 56.960 53.715 3.245 19694
6911 1 15 . 1 1 78 78 LYS CB C 78 34.680 34.680 33.748 0.932 19694
6912 1 15 . 1 1 78 78 LYS H H 78 7.660 7.660 7.622 0.038 19694
6913 1 15 . 1 1 79 79 PRO HA H 79 4.460 4.460 4.231 0.229 19694
6914 1 15 . 1 1 79 79 PRO CA C 79 62.520 62.520 62.943 -0.423 19694
6915 1 15 . 1 1 79 79 PRO CB C 79 32.160 32.160 31.868 0.292 19694
6916 1 15 . 1 1 80 80 PHE N N 80 114.050 114.050 117.061 -3.011 19694
6917 1 15 . 1 1 80 80 PHE HA H 80 4.910 4.910 5.066 -0.156 19694
6918 1 15 . 1 1 80 80 PHE CA C 80 56.060 56.060 55.084 0.976 19694
6919 1 15 . 1 1 80 80 PHE CB C 80 42.410 42.410 41.942 0.468 19694
6920 1 15 . 1 1 80 80 PHE H H 80 7.510 7.510 7.199 0.311 19694
6921 1 15 . 1 1 81 81 ALA N N 81 123.290 123.290 123.810 -0.520 19694
6922 1 15 . 1 1 81 81 ALA HA H 81 4.310 4.310 4.345 -0.035 19694
6923 1 15 . 1 1 81 81 ALA CA C 81 50.450 50.450 50.380 0.070 19694
6924 1 15 . 1 1 81 81 ALA CB C 81 21.920 21.920 18.925 2.995 19694
6925 1 15 . 1 1 81 81 ALA H H 81 9.030 9.030 8.963 0.067 19694
6926 1 15 . 1 1 82 82 ALA N N 82 122.490 122.490 129.103 -6.613 19694
6927 1 15 . 1 1 82 82 ALA HA H 82 5.110 5.110 4.382 0.728 19694
6928 1 15 . 1 1 82 82 ALA CA C 82 51.100 51.100 51.744 -0.644 19694
6929 1 15 . 1 1 82 82 ALA CB C 82 21.130 21.130 18.821 2.309 19694
6930 1 15 . 1 1 82 82 ALA H H 82 8.240 8.240 8.622 -0.382 19694
6931 1 15 . 1 1 83 83 LYS N N 83 123.580 123.580 126.021 -2.441 19694
6932 1 15 . 1 1 83 83 LYS HA H 83 4.490 4.490 4.537 -0.047 19694
6933 1 15 . 1 1 83 83 LYS CA C 83 55.800 55.800 55.305 0.495 19694
6934 1 15 . 1 1 83 83 LYS CB C 83 34.720 34.720 34.144 0.576 19694
6935 1 15 . 1 1 83 83 LYS H H 83 8.400 8.400 8.209 0.191 19694
6936 1 15 . 1 1 84 84 GLU N N 84 125.470 125.470 120.319 5.151 19694
6937 1 15 . 1 1 84 84 GLU HA H 84 3.820 3.820 4.124 -0.304 19694
6938 1 15 . 1 1 84 84 GLU CA C 84 58.620 58.620 58.967 -0.347 19694
6939 1 15 . 1 1 84 84 GLU CB C 84 27.210 27.210 29.724 -2.514 19694
6940 1 15 . 1 1 84 84 GLU H H 84 9.320 9.320 8.806 0.514 19694
6941 1 15 . 1 1 85 85 ASP N N 85 118.550 118.550 114.501 4.049 19694
6942 1 15 . 1 1 85 85 ASP HA H 85 4.600 4.600 4.792 -0.192 19694
6943 1 15 . 1 1 85 85 ASP CA C 85 55.400 55.400 53.885 1.515 19694
6944 1 15 . 1 1 85 85 ASP CB C 85 40.400 40.400 42.159 -1.759 19694
6945 1 15 . 1 1 85 85 ASP H H 85 8.730 8.730 8.377 0.353 19694
6946 1 15 . 1 1 86 86 GLN N N 86 119.050 119.050 117.385 1.665 19694
6947 1 15 . 1 1 86 86 GLN HA H 86 4.540 4.540 4.690 -0.150 19694
6948 1 15 . 1 1 86 86 GLN CA C 86 55.100 55.100 54.009 1.091 19694
6949 1 15 . 1 1 86 86 GLN CB C 86 31.110 31.110 32.012 -0.902 19694
6950 1 15 . 1 1 86 86 GLN H H 86 8.170 8.170 7.584 0.586 19694
6951 1 15 . 1 1 87 87 LEU N N 87 123.110 123.110 121.284 1.826 19694
6952 1 15 . 1 1 87 87 LEU HA H 87 4.620 4.620 5.197 -0.577 19694
6953 1 15 . 1 1 87 87 LEU CA C 87 54.520 54.520 54.009 0.511 19694
6954 1 15 . 1 1 87 87 LEU CB C 87 42.700 42.700 44.598 -1.898 19694
6955 1 15 . 1 1 87 87 LEU H H 87 8.490 8.490 8.504 -0.014 19694
6956 1 15 . 1 1 88 88 LEU N N 88 123.690 123.690 120.086 3.604 19694
6957 1 15 . 1 1 88 88 LEU HA H 88 5.880 5.880 4.947 0.933 19694
6958 1 15 . 1 1 88 88 LEU CA C 88 53.340 53.340 52.810 0.529 19694
6959 1 15 . 1 1 88 88 LEU CB C 88 47.190 47.190 47.814 -0.624 19694
6960 1 15 . 1 1 88 88 LEU H H 88 8.930 8.930 8.374 0.556 19694
6961 1 15 . 1 1 89 89 CYS N N 89 122.270 122.270 118.490 3.780 19694
6962 1 15 . 1 1 89 89 CYS HA H 89 4.780 4.780 4.779 0.001 19694
6963 1 15 . 1 1 89 89 CYS CA C 89 57.640 57.640 59.038 -1.398 19694
6964 1 15 . 1 1 89 89 CYS CB C 89 30.940 30.940 27.664 3.276 19694
6965 1 15 . 1 1 89 89 CYS H H 89 9.430 9.430 9.069 0.361 19694
6966 1 15 . 1 1 90 90 THR N N 90 110.620 110.620 116.825 -6.205 19694
6967 1 15 . 1 1 90 90 THR HA H 90 3.900 3.900 3.968 -0.068 19694
6968 1 15 . 1 1 90 90 THR CA C 90 65.460 65.460 65.916 -0.456 19694
6969 1 15 . 1 1 90 90 THR CB C 90 68.670 68.670 68.921 -0.251 19694
6970 1 15 . 1 1 90 90 THR H H 90 8.410 8.410 9.069 -0.659 19694
6971 1 15 . 1 1 91 91 ASP N N 91 123.470 123.470 121.108 2.362 19694
6972 1 15 . 1 1 91 91 ASP HA H 91 4.490 4.490 4.635 -0.145 19694
6973 1 15 . 1 1 91 91 ASP CA C 91 57.810 57.810 57.108 0.702 19694
6974 1 15 . 1 1 91 91 ASP CB C 91 41.160 41.160 40.455 0.705 19694
6975 1 15 . 1 1 91 91 ASP H H 91 8.150 8.150 8.425 -0.275 19694
6976 1 15 . 1 1 92 92 CYS N N 92 123.800 123.800 119.699 4.101 19694
6977 1 15 . 1 1 92 92 CYS HA H 92 3.970 3.970 4.243 -0.273 19694
6978 1 15 . 1 1 92 92 CYS CA C 92 64.100 64.100 61.308 2.792 19694
6979 1 15 . 1 1 92 92 CYS CB C 92 30.090 30.090 25.629 4.461 19694
6980 1 15 . 1 1 92 92 CYS H H 92 8.580 8.580 7.951 0.629 19694
6981 1 15 . 1 1 93 93 TYR N N 93 120.730 120.730 120.854 -0.124 19694
6982 1 15 . 1 1 93 93 TYR HA H 93 4.140 4.140 4.064 0.076 19694
6983 1 15 . 1 1 93 93 TYR CA C 93 60.380 60.380 61.292 -0.912 19694
6984 1 15 . 1 1 93 93 TYR CB C 93 39.300 39.300 38.291 1.009 19694
6985 1 15 . 1 1 93 93 TYR H H 93 8.540 8.540 9.116 -0.576 19694
6986 1 15 . 1 1 94 94 SER N N 94 115.010 115.010 112.913 2.097 19694
6987 1 15 . 1 1 94 94 SER HA H 94 4.220 4.220 4.228 -0.008 19694
6988 1 15 . 1 1 94 94 SER CA C 94 59.300 59.300 60.907 -1.607 19694
6989 1 15 . 1 1 94 94 SER CB C 94 63.660 63.660 62.521 1.139 19694
6990 1 15 . 1 1 94 94 SER H H 94 7.750 7.750 8.065 -0.315 19694
6991 1 15 . 1 1 95 95 ASN N N 95 119.820 119.820 119.878 -0.058 19694
6992 1 15 . 1 1 95 95 ASN HA H 95 4.510 4.510 4.615 -0.105 19694
6993 1 15 . 1 1 95 95 ASN CA C 95 53.880 53.880 55.485 -1.605 19694
6994 1 15 . 1 1 95 95 ASN CB C 95 39.300 39.300 38.996 0.304 19694
6995 1 15 . 1 1 95 95 ASN H H 95 7.780 7.780 7.981 -0.201 19694
6996 1 15 . 1 1 96 96 GLU N N 96 119.820 119.820 117.180 2.640 19694
6997 1 15 . 1 1 96 96 GLU HA H 96 4.096 4.096 4.236 -0.140 19694
6998 1 15 . 1 1 96 96 GLU CA C 96 56.910 56.910 56.829 0.081 19694
6999 1 15 . 1 1 96 96 GLU CB C 96 30.220 30.220 29.521 0.699 19694
7000 1 15 . 1 1 96 96 GLU H H 96 7.950 7.950 7.785 0.165 19694
7001 1 15 . 1 1 97 97 TYR N N 97 120.370 120.370 121.509 -1.139 19694
7002 1 15 . 1 1 97 97 TYR HA H 97 4.620 4.620 3.974 0.645 19694
7003 1 15 . 1 1 97 97 TYR CA C 97 57.700 57.700 59.844 -2.144 19694
7004 1 15 . 1 1 97 97 TYR CB C 97 38.710 38.710 38.189 0.521 19694
7005 1 15 . 1 1 97 97 TYR H H 97 8.070 8.070 8.501 -0.431 19694
7006 1 16 . 1 1 2 2 THR N N 2 113.570 113.570 115.856 -2.286 19694
7007 1 16 . 1 1 2 2 THR HA H 2 4.240 4.240 4.315 -0.075 19694
7008 1 16 . 1 1 2 2 THR CA C 2 62.130 62.130 62.463 -0.333 19694
7009 1 16 . 1 1 2 2 THR CB C 2 69.250 69.250 68.995 0.256 19694
7010 1 16 . 1 1 2 2 THR H H 2 8.090 8.090 8.072 0.018 19694
7011 1 16 . 1 1 3 3 GLU N N 3 122.880 122.880 120.497 2.383 19694
7012 1 16 . 1 1 3 3 GLU HA H 3 4.280 4.280 4.218 0.062 19694
7013 1 16 . 1 1 3 3 GLU CA C 3 56.860 56.860 56.483 0.376 19694
7014 1 16 . 1 1 3 3 GLU CB C 3 30.570 30.570 30.255 0.315 19694
7015 1 16 . 1 1 3 3 GLU H H 3 8.280 8.280 8.075 0.205 19694
7016 1 16 . 1 1 4 4 ARG N N 4 121.330 121.330 119.412 1.918 19694
7017 1 16 . 1 1 4 4 ARG HA H 4 4.300 4.300 4.560 -0.260 19694
7018 1 16 . 1 1 4 4 ARG CA C 4 55.870 55.870 55.139 0.731 19694
7019 1 16 . 1 1 4 4 ARG CB C 4 31.640 31.640 30.713 0.927 19694
7020 1 16 . 1 1 4 4 ARG H H 4 8.280 8.280 8.552 -0.272 19694
7021 1 16 . 1 1 5 5 PHE N N 5 125.490 125.490 125.383 0.107 19694
7022 1 16 . 1 1 5 5 PHE HA H 5 4.610 4.610 4.543 0.067 19694
7023 1 16 . 1 1 5 5 PHE CA C 5 56.380 56.380 56.237 0.143 19694
7024 1 16 . 1 1 5 5 PHE CB C 5 39.560 39.560 39.395 0.165 19694
7025 1 16 . 1 1 5 5 PHE H H 5 8.290 8.290 8.781 -0.491 19694
7026 1 16 . 1 1 6 6 ASP N N 6 123.260 123.260 121.663 1.597 19694
7027 1 16 . 1 1 6 6 ASP HA H 6 5.045 5.045 4.815 0.230 19694
7028 1 16 . 1 1 6 6 ASP CA C 6 52.180 52.180 53.143 -0.963 19694
7029 1 16 . 1 1 6 6 ASP CB C 6 44.210 44.210 44.977 -0.767 19694
7030 1 16 . 1 1 6 6 ASP H H 6 7.940 7.940 7.598 0.342 19694
7031 1 16 . 1 1 7 7 CYS N N 7 121.440 121.440 122.881 -1.441 19694
7032 1 16 . 1 1 7 7 CYS HA H 7 3.960 3.960 4.405 -0.445 19694
7033 1 16 . 1 1 7 7 CYS CA C 7 59.820 59.820 59.514 0.306 19694
7034 1 16 . 1 1 7 7 CYS CB C 7 30.950 30.950 26.289 4.661 19694
7035 1 16 . 1 1 7 7 CYS H H 7 8.700 8.700 8.659 0.041 19694
7036 1 16 . 1 1 8 8 HIS N N 8 129.390 129.390 129.918 -0.528 19694
7037 1 16 . 1 1 8 8 HIS HA H 8 4.200 4.200 4.217 -0.017 19694
7038 1 16 . 1 1 8 8 HIS CA C 8 58.240 58.240 59.651 -1.411 19694
7039 1 16 . 1 1 8 8 HIS CB C 8 29.480 29.480 30.093 -0.613 19694
7040 1 16 . 1 1 8 8 HIS H H 8 9.160 9.160 9.628 -0.468 19694
7041 1 16 . 1 1 9 9 HIS N N 9 118.740 118.740 117.601 1.139 19694
7042 1 16 . 1 1 9 9 HIS HA H 9 4.880 4.880 4.449 0.431 19694
7043 1 16 . 1 1 9 9 HIS CA C 9 58.680 58.680 57.175 1.506 19694
7044 1 16 . 1 1 9 9 HIS CB C 9 31.040 31.040 30.388 0.652 19694
7045 1 16 . 1 1 9 9 HIS H H 9 9.270 9.270 8.043 1.227 19694
7046 1 16 . 1 1 10 10 CYS N N 10 118.600 118.600 117.080 1.520 19694
7047 1 16 . 1 1 10 10 CYS HA H 10 4.600 4.600 4.422 0.178 19694
7048 1 16 . 1 1 10 10 CYS CA C 10 59.600 59.600 58.999 0.601 19694
7049 1 16 . 1 1 10 10 CYS CB C 10 32.330 32.330 27.829 4.501 19694
7050 1 16 . 1 1 10 10 CYS H H 10 8.550 8.550 7.797 0.753 19694
7051 1 16 . 1 1 11 11 ASN N N 11 116.220 116.220 118.169 -1.949 19694
7052 1 16 . 1 1 11 11 ASN HA H 11 4.410 4.410 4.399 0.011 19694
7053 1 16 . 1 1 11 11 ASN CA C 11 55.640 55.640 54.422 1.218 19694
7054 1 16 . 1 1 11 11 ASN CB C 11 38.200 38.200 37.267 0.934 19694
7055 1 16 . 1 1 11 11 ASN H H 11 7.690 7.690 8.645 -0.955 19694
7056 1 16 . 1 1 12 12 GLU N N 12 120.330 120.330 117.056 3.274 19694
7057 1 16 . 1 1 12 12 GLU HA H 12 4.220 4.220 4.467 -0.247 19694
7058 1 16 . 1 1 12 12 GLU CA C 12 56.700 56.700 55.160 1.540 19694
7059 1 16 . 1 1 12 12 GLU CB C 12 30.910 30.910 30.799 0.111 19694
7060 1 16 . 1 1 12 12 GLU H H 12 8.210 8.210 7.786 0.424 19694
7061 1 16 . 1 1 13 13 SER N N 13 116.190 116.190 119.762 -3.572 19694
7062 1 16 . 1 1 13 13 SER HA H 13 4.060 4.060 4.500 -0.440 19694
7063 1 16 . 1 1 13 13 SER CA C 13 59.350 59.350 58.812 0.538 19694
7064 1 16 . 1 1 13 13 SER CB C 13 63.820 63.820 63.473 0.347 19694
7065 1 16 . 1 1 13 13 SER H H 13 8.520 8.520 8.696 -0.176 19694
7066 1 16 . 1 1 14 14 LEU N N 14 126.060 126.060 124.635 1.425 19694
7067 1 16 . 1 1 14 14 LEU HA H 14 4.310 4.310 4.345 -0.035 19694
7068 1 16 . 1 1 14 14 LEU CA C 14 54.100 54.100 55.788 -1.688 19694
7069 1 16 . 1 1 14 14 LEU CB C 14 42.200 42.200 41.322 0.878 19694
7070 1 16 . 1 1 14 14 LEU H H 14 8.910 8.910 7.722 1.188 19694
7071 1 16 . 1 1 15 15 PHE N N 15 120.660 120.660 121.358 -0.698 19694
7072 1 16 . 1 1 15 15 PHE HA H 15 4.480 4.480 4.605 -0.125 19694
7073 1 16 . 1 1 15 15 PHE CA C 15 60.400 60.400 56.148 4.253 19694
7074 1 16 . 1 1 15 15 PHE CB C 15 38.130 38.130 37.734 0.396 19694
7075 1 16 . 1 1 15 15 PHE H H 15 7.820 7.820 8.700 -0.880 19694
7076 1 16 . 1 1 16 16 GLY N N 16 114.730 114.730 110.351 4.379 19694
7077 1 16 . 1 1 16 16 GLY CA C 16 45.900 45.900 45.958 -0.058 19694
7078 1 16 . 1 1 16 16 GLY H H 16 8.860 8.860 8.527 0.333 19694
7079 1 16 . 1 1 17 17 LYS N N 17 119.580 119.580 120.185 -0.605 19694
7080 1 16 . 1 1 17 17 LYS HA H 17 4.480 4.480 4.511 -0.031 19694
7081 1 16 . 1 1 17 17 LYS CA C 17 54.460 54.460 54.444 0.016 19694
7082 1 16 . 1 1 17 17 LYS CB C 17 35.800 35.800 34.303 1.497 19694
7083 1 16 . 1 1 17 17 LYS H H 17 8.030 8.030 7.233 0.797 19694
7084 1 16 . 1 1 18 18 LYS N N 18 120.330 120.330 122.195 -1.865 19694
7085 1 16 . 1 1 18 18 LYS HA H 18 4.280 4.280 4.312 -0.032 19694
7086 1 16 . 1 1 18 18 LYS CA C 18 56.800 56.800 57.443 -0.643 19694
7087 1 16 . 1 1 18 18 LYS CB C 18 33.010 33.010 32.758 0.252 19694
7088 1 16 . 1 1 18 18 LYS H H 18 8.190 8.190 8.460 -0.270 19694
7089 1 16 . 1 1 19 19 TYR N N 19 117.500 117.500 115.302 2.198 19694
7090 1 16 . 1 1 19 19 TYR HA H 19 5.240 5.240 4.844 0.396 19694
7091 1 16 . 1 1 19 19 TYR CA C 19 55.340 55.340 56.313 -0.973 19694
7092 1 16 . 1 1 19 19 TYR CB C 19 42.850 42.850 40.308 2.542 19694
7093 1 16 . 1 1 19 19 TYR H H 19 7.610 7.610 7.896 -0.286 19694
7094 1 16 . 1 1 20 20 ILE N N 20 121.430 121.430 121.886 -0.456 19694
7095 1 16 . 1 1 20 20 ILE HA H 20 4.137 4.137 4.250 -0.113 19694
7096 1 16 . 1 1 20 20 ILE CA C 20 60.010 60.010 60.135 -0.125 19694
7097 1 16 . 1 1 20 20 ILE CB C 20 41.570 41.570 40.598 0.972 19694
7098 1 16 . 1 1 20 20 ILE H H 20 9.350 9.350 8.245 1.105 19694
7099 1 16 . 1 1 21 21 LEU N N 21 126.720 126.720 126.161 0.559 19694
7100 1 16 . 1 1 21 21 LEU HA H 21 5.090 5.090 4.755 0.335 19694
7101 1 16 . 1 1 21 21 LEU CA C 21 54.020 54.020 53.950 0.070 19694
7102 1 16 . 1 1 21 21 LEU CB C 21 43.720 43.720 40.759 2.961 19694
7103 1 16 . 1 1 21 21 LEU H H 21 8.530 8.530 8.515 0.015 19694
7104 1 16 . 1 1 22 22 ARG N N 22 123.930 123.930 125.441 -1.511 19694
7105 1 16 . 1 1 22 22 ARG HA H 22 4.440 4.440 4.531 -0.091 19694
7106 1 16 . 1 1 22 22 ARG CA C 22 55.600 55.600 54.194 1.406 19694
7107 1 16 . 1 1 22 22 ARG CB C 22 32.280 32.280 32.627 -0.347 19694
7108 1 16 . 1 1 22 22 ARG H H 22 9.080 9.080 8.863 0.217 19694
7109 1 16 . 1 1 23 23 GLU N N 23 128.500 128.500 124.744 3.756 19694
7110 1 16 . 1 1 23 23 GLU HA H 23 3.840 3.840 3.950 -0.110 19694
7111 1 16 . 1 1 23 23 GLU CA C 23 58.030 58.030 57.706 0.324 19694
7112 1 16 . 1 1 23 23 GLU CB C 23 27.200 27.200 27.864 -0.664 19694
7113 1 16 . 1 1 23 23 GLU H H 23 9.610 9.610 9.018 0.592 19694
7114 1 16 . 1 1 24 24 GLU N N 24 110.300 110.300 113.438 -3.138 19694
7115 1 16 . 1 1 24 24 GLU HA H 24 3.780 3.780 3.937 -0.157 19694
7116 1 16 . 1 1 24 24 GLU CA C 24 58.320 58.320 57.261 1.059 19694
7117 1 16 . 1 1 24 24 GLU CB C 24 28.220 28.220 28.710 -0.490 19694
7118 1 16 . 1 1 24 24 GLU H H 24 8.660 8.660 8.621 0.039 19694
7119 1 16 . 1 1 25 25 SER N N 25 117.700 117.700 112.758 4.942 19694
7120 1 16 . 1 1 25 25 SER HA H 25 4.890 4.890 4.778 0.112 19694
7121 1 16 . 1 1 25 25 SER CA C 25 56.540 56.540 56.058 0.482 19694
7122 1 16 . 1 1 25 25 SER CB C 25 64.720 64.720 65.031 -0.311 19694
7123 1 16 . 1 1 25 25 SER H H 25 7.900 7.900 7.775 0.125 19694
7124 1 16 . 1 1 26 26 PRO HA H 26 4.995 4.995 4.868 0.127 19694
7125 1 16 . 1 1 26 26 PRO CA C 26 61.750 61.750 63.080 -1.330 19694
7126 1 16 . 1 1 26 26 PRO CB C 26 32.660 32.660 31.603 1.057 19694
7127 1 16 . 1 1 27 27 TYR N N 27 118.100 118.100 123.653 -5.553 19694
7128 1 16 . 1 1 27 27 TYR HA H 27 5.910 5.910 4.981 0.929 19694
7129 1 16 . 1 1 27 27 TYR CA C 27 56.830 56.830 54.858 1.972 19694
7130 1 16 . 1 1 27 27 TYR CB C 27 42.810 42.810 42.514 0.296 19694
7131 1 16 . 1 1 27 27 TYR H H 27 9.040 9.040 8.659 0.381 19694
7132 1 16 . 1 1 28 28 CYS N N 28 122.230 122.230 118.935 3.295 19694
7133 1 16 . 1 1 28 28 CYS HA H 28 4.850 4.850 4.665 0.185 19694
7134 1 16 . 1 1 28 28 CYS CA C 28 58.110 58.110 58.469 -0.359 19694
7135 1 16 . 1 1 28 28 CYS CB C 28 30.530 30.530 29.094 1.436 19694
7136 1 16 . 1 1 28 28 CYS H H 28 9.850 9.850 8.320 1.530 19694
7137 1 16 . 1 1 29 29 VAL N N 29 118.200 118.200 122.662 -4.462 19694
7138 1 16 . 1 1 29 29 VAL HA H 29 3.650 3.650 3.766 -0.116 19694
7139 1 16 . 1 1 29 29 VAL CA C 29 67.400 67.400 66.859 0.541 19694
7140 1 16 . 1 1 29 29 VAL CB C 29 31.860 31.860 31.468 0.392 19694
7141 1 16 . 1 1 29 29 VAL H H 29 8.430 8.430 8.909 -0.479 19694
7142 1 16 . 1 1 30 30 VAL N N 30 119.570 119.570 118.752 0.818 19694
7143 1 16 . 1 1 30 30 VAL HA H 30 3.860 3.860 3.603 0.257 19694
7144 1 16 . 1 1 30 30 VAL CA C 30 66.450 66.450 66.639 -0.189 19694
7145 1 16 . 1 1 30 30 VAL CB C 30 31.540 31.540 31.035 0.505 19694
7146 1 16 . 1 1 30 30 VAL H H 30 7.700 7.700 7.882 -0.182 19694
7147 1 16 . 1 1 31 31 CYS N N 31 125.890 125.890 119.307 6.583 19694
7148 1 16 . 1 1 31 31 CYS HA H 31 3.830 3.830 3.887 -0.057 19694
7149 1 16 . 1 1 31 31 CYS CA C 31 65.850 65.850 64.353 1.497 19694
7150 1 16 . 1 1 31 31 CYS CB C 31 29.510 29.510 25.569 3.941 19694
7151 1 16 . 1 1 31 31 CYS H H 31 9.050 9.050 7.595 1.455 19694
7152 1 16 . 1 1 32 32 PHE N N 32 119.000 119.000 119.318 -0.318 19694
7153 1 16 . 1 1 32 32 PHE HA H 32 3.780 3.780 3.669 0.111 19694
7154 1 16 . 1 1 32 32 PHE CA C 32 62.610 62.610 61.776 0.834 19694
7155 1 16 . 1 1 32 32 PHE CB C 32 39.920 39.920 39.033 0.887 19694
7156 1 16 . 1 1 32 32 PHE H H 32 9.080 9.080 7.892 1.188 19694
7157 1 16 . 1 1 33 33 GLU N N 33 117.470 117.470 118.131 -0.661 19694
7158 1 16 . 1 1 33 33 GLU HA H 33 3.760 3.760 4.048 -0.288 19694
7159 1 16 . 1 1 33 33 GLU CA C 33 59.210 59.210 59.380 -0.170 19694
7160 1 16 . 1 1 33 33 GLU CB C 33 29.480 29.480 29.233 0.247 19694
7161 1 16 . 1 1 33 33 GLU H H 33 8.510 8.510 8.157 0.353 19694
7162 1 16 . 1 1 34 34 THR N N 34 114.140 114.140 115.407 -1.267 19694
7163 1 16 . 1 1 34 34 THR HA H 34 3.730 3.730 3.898 -0.168 19694
7164 1 16 . 1 1 34 34 THR CA C 34 65.890 65.890 66.083 -0.193 19694
7165 1 16 . 1 1 34 34 THR CB C 34 69.210 69.210 68.730 0.480 19694
7166 1 16 . 1 1 34 34 THR H H 34 7.880 7.880 8.286 -0.406 19694
7167 1 16 . 1 1 35 35 LEU N N 35 117.980 117.980 118.753 -0.773 19694
7168 1 16 . 1 1 35 35 LEU HA H 35 3.650 3.650 3.960 -0.310 19694
7169 1 16 . 1 1 35 35 LEU CA C 35 56.860 56.860 57.226 -0.366 19694
7170 1 16 . 1 1 35 35 LEU CB C 35 41.870 41.870 41.846 0.024 19694
7171 1 16 . 1 1 35 35 LEU H H 35 7.660 7.660 7.721 -0.061 19694
7172 1 16 . 1 1 36 36 PHE N N 36 113.900 113.900 112.964 0.936 19694
7173 1 16 . 1 1 36 36 PHE HA H 36 4.597 4.597 4.465 0.132 19694
7174 1 16 . 1 1 36 36 PHE CA C 36 56.860 56.860 56.411 0.449 19694
7175 1 16 . 1 1 36 36 PHE CB C 36 40.570 40.570 38.192 2.378 19694
7176 1 16 . 1 1 36 36 PHE H H 36 7.730 7.730 6.649 1.081 19694
7177 1 16 . 1 1 37 37 ALA N N 37 121.920 121.920 123.004 -1.084 19694
7178 1 16 . 1 1 37 37 ALA HA H 37 4.070 4.070 4.056 0.014 19694
7179 1 16 . 1 1 37 37 ALA CA C 37 52.900 52.900 52.362 0.538 19694
7180 1 16 . 1 1 37 37 ALA CB C 37 19.770 19.770 19.704 0.066 19694
7181 1 16 . 1 1 37 37 ALA H H 37 7.090 7.090 7.809 -0.719 19694
7182 1 16 . 1 1 38 38 ASN N N 38 119.230 119.230 118.857 0.373 19694
7183 1 16 . 1 1 38 38 ASN HA H 38 4.450 4.450 4.643 -0.193 19694
7184 1 16 . 1 1 38 38 ASN CA C 38 52.850 52.850 52.661 0.189 19694
7185 1 16 . 1 1 38 38 ASN CB C 38 38.950 38.950 39.987 -1.038 19694
7186 1 16 . 1 1 38 38 ASN H H 38 8.790 8.790 8.376 0.414 19694
7187 1 16 . 1 1 39 39 THR N N 39 116.330 116.330 115.462 0.868 19694
7188 1 16 . 1 1 39 39 THR HA H 39 3.990 3.990 4.309 -0.319 19694
7189 1 16 . 1 1 39 39 THR CA C 39 62.130 62.130 62.336 -0.206 19694
7190 1 16 . 1 1 39 39 THR CB C 39 69.920 69.920 69.915 0.005 19694
7191 1 16 . 1 1 39 39 THR H H 39 8.540 8.540 8.231 0.309 19694
7192 1 16 . 1 1 40 40 CYS N N 40 126.950 126.950 128.174 -1.224 19694
7193 1 16 . 1 1 40 40 CYS HA H 40 4.300 4.300 4.446 -0.146 19694
7194 1 16 . 1 1 40 40 CYS CA C 40 58.350 58.350 57.154 1.196 19694
7195 1 16 . 1 1 40 40 CYS CB C 40 31.600 31.600 26.531 5.069 19694
7196 1 16 . 1 1 40 40 CYS H H 40 7.940 7.940 8.561 -0.621 19694
7197 1 16 . 1 1 41 41 GLU N N 41 130.560 130.560 127.610 2.950 19694
7198 1 16 . 1 1 41 41 GLU HA H 41 3.690 3.690 3.831 -0.141 19694
7199 1 16 . 1 1 41 41 GLU CA C 41 58.600 58.600 59.135 -0.535 19694
7200 1 16 . 1 1 41 41 GLU CB C 41 30.460 30.460 29.422 1.038 19694
7201 1 16 . 1 1 41 41 GLU H H 41 8.810 8.810 8.625 0.185 19694
7202 1 16 . 1 1 42 42 GLU N N 42 119.680 119.680 118.359 1.321 19694
7203 1 16 . 1 1 42 42 GLU HA H 42 4.570 4.570 4.334 0.236 19694
7204 1 16 . 1 1 42 42 GLU CA C 42 58.000 58.000 58.026 -0.026 19694
7205 1 16 . 1 1 42 42 GLU CB C 42 31.680 31.680 30.575 1.105 19694
7206 1 16 . 1 1 42 42 GLU H H 42 8.500 8.500 8.107 0.393 19694
7207 1 16 . 1 1 43 43 CYS N N 43 115.600 115.600 116.856 -1.256 19694
7208 1 16 . 1 1 43 43 CYS HA H 43 5.010 5.010 4.512 0.498 19694
7209 1 16 . 1 1 43 43 CYS CA C 43 58.810 58.810 59.875 -1.065 19694
7210 1 16 . 1 1 43 43 CYS CB C 43 31.580 31.580 28.507 3.073 19694
7211 1 16 . 1 1 43 43 CYS H H 43 8.120 8.120 8.096 0.024 19694
7212 1 16 . 1 1 44 44 GLY N N 44 112.100 112.100 107.461 4.639 19694
7213 1 16 . 1 1 44 44 GLY CA C 44 46.420 46.420 45.348 1.072 19694
7214 1 16 . 1 1 44 44 GLY H H 44 7.900 7.900 8.695 -0.795 19694
7215 1 16 . 1 1 45 45 LYS N N 45 121.210 121.210 120.749 0.461 19694
7216 1 16 . 1 1 45 45 LYS HA H 45 4.840 4.840 4.694 0.146 19694
7217 1 16 . 1 1 45 45 LYS CA C 45 54.360 54.360 53.043 1.317 19694
7218 1 16 . 1 1 45 45 LYS CB C 45 32.430 32.430 32.776 -0.346 19694
7219 1 16 . 1 1 45 45 LYS H H 45 8.180 8.180 7.829 0.351 19694
7220 1 16 . 1 1 46 46 PRO HA H 46 4.477 4.477 4.533 -0.056 19694
7221 1 16 . 1 1 46 46 PRO CA C 46 62.700 62.700 63.017 -0.317 19694
7222 1 16 . 1 1 46 46 PRO CB C 46 32.490 32.490 31.974 0.516 19694
7223 1 16 . 1 1 47 47 ILE N N 47 125.280 125.280 122.940 2.340 19694
7224 1 16 . 1 1 47 47 ILE HA H 47 3.830 3.830 4.308 -0.478 19694
7225 1 16 . 1 1 47 47 ILE CA C 47 61.040 61.040 60.779 0.262 19694
7226 1 16 . 1 1 47 47 ILE CB C 47 37.440 37.440 37.650 -0.210 19694
7227 1 16 . 1 1 47 47 ILE H H 47 8.540 8.540 8.860 -0.320 19694
7228 1 16 . 1 1 48 48 GLY N N 48 114.120 114.120 113.790 0.330 19694
7229 1 16 . 1 1 48 48 GLY CA C 48 45.240 45.240 44.463 0.777 19694
7230 1 16 . 1 1 48 48 GLY H H 48 8.660 8.660 8.469 0.191 19694
7231 1 16 . 1 1 49 49 CYS N N 49 117.140 117.140 117.015 0.125 19694
7232 1 16 . 1 1 49 49 CYS HA H 49 4.280 4.280 4.379 -0.099 19694
7233 1 16 . 1 1 49 49 CYS CA C 49 60.880 60.880 58.017 2.863 19694
7234 1 16 . 1 1 49 49 CYS CB C 49 27.650 27.650 27.283 0.367 19694
7235 1 16 . 1 1 49 49 CYS H H 49 9.210 9.210 8.468 0.742 19694
7236 1 16 . 1 1 50 50 ASP N N 50 119.300 119.300 120.762 -1.462 19694
7237 1 16 . 1 1 50 50 ASP HA H 50 4.620 4.620 4.642 -0.022 19694
7238 1 16 . 1 1 50 50 ASP CA C 50 54.160 54.160 54.840 -0.680 19694
7239 1 16 . 1 1 50 50 ASP CB C 50 40.380 40.380 40.203 0.177 19694
7240 1 16 . 1 1 50 50 ASP H H 50 8.800 8.800 8.497 0.303 19694
7241 1 16 . 1 1 51 51 CYS N N 51 118.150 118.150 117.173 0.977 19694
7242 1 16 . 1 1 51 51 CYS HA H 51 4.620 4.620 4.618 0.002 19694
7243 1 16 . 1 1 51 51 CYS CA C 51 58.030 58.030 57.959 0.071 19694
7244 1 16 . 1 1 51 51 CYS CB C 51 30.090 30.090 31.462 -1.371 19694
7245 1 16 . 1 1 51 51 CYS H H 51 7.590 7.590 7.291 0.299 19694
7246 1 16 . 1 1 52 52 LYS N N 52 123.800 123.800 124.500 -0.700 19694
7247 1 16 . 1 1 52 52 LYS HA H 52 4.180 4.180 4.210 -0.030 19694
7248 1 16 . 1 1 52 52 LYS CA C 52 57.240 57.240 57.014 0.226 19694
7249 1 16 . 1 1 52 52 LYS CB C 52 33.030 33.030 32.169 0.861 19694
7250 1 16 . 1 1 52 52 LYS H H 52 8.600 8.600 8.701 -0.101 19694
7251 1 16 . 1 1 53 53 ASP N N 53 124.900 124.900 126.666 -1.766 19694
7252 1 16 . 1 1 53 53 ASP HA H 53 4.230 4.230 4.641 -0.411 19694
7253 1 16 . 1 1 53 53 ASP CA C 53 53.130 53.130 53.706 -0.576 19694
7254 1 16 . 1 1 53 53 ASP CB C 53 42.230 42.230 41.226 1.004 19694
7255 1 16 . 1 1 53 53 ASP H H 53 8.250 8.250 8.230 0.020 19694
7256 1 16 . 1 1 54 54 LEU N N 54 130.160 130.160 127.032 3.128 19694
7257 1 16 . 1 1 54 54 LEU HA H 54 4.440 4.440 4.511 -0.071 19694
7258 1 16 . 1 1 54 54 LEU CA C 54 53.340 53.340 55.684 -2.344 19694
7259 1 16 . 1 1 54 54 LEU CB C 54 41.170 41.170 42.865 -1.695 19694
7260 1 16 . 1 1 54 54 LEU H H 54 8.670 8.670 8.908 -0.238 19694
7261 1 16 . 1 1 55 55 SER N N 55 113.820 113.820 120.329 -6.509 19694
7262 1 16 . 1 1 55 55 SER HA H 55 5.580 5.580 5.095 0.485 19694
7263 1 16 . 1 1 55 55 SER CA C 55 55.850 55.850 56.513 -0.663 19694
7264 1 16 . 1 1 55 55 SER CB C 55 67.300 67.300 64.612 2.688 19694
7265 1 16 . 1 1 55 55 SER H H 55 8.160 8.160 8.236 -0.076 19694
7266 1 16 . 1 1 56 56 TYR N N 56 122.610 122.610 125.769 -3.159 19694
7267 1 16 . 1 1 56 56 TYR HA H 56 4.620 4.620 4.637 -0.017 19694
7268 1 16 . 1 1 56 56 TYR CA C 56 58.810 58.810 58.552 0.258 19694
7269 1 16 . 1 1 56 56 TYR CB C 56 41.000 41.000 42.552 -1.552 19694
7270 1 16 . 1 1 56 56 TYR H H 56 8.450 8.450 8.953 -0.503 19694
7271 1 16 . 1 1 57 57 LYS N N 57 126.020 126.020 129.162 -3.142 19694
7272 1 16 . 1 1 57 57 LYS HA H 57 3.470 3.470 3.871 -0.401 19694
7273 1 16 . 1 1 57 57 LYS CA C 57 58.100 58.100 57.549 0.551 19694
7274 1 16 . 1 1 57 57 LYS CB C 57 29.480 29.480 32.029 -2.549 19694
7275 1 16 . 1 1 57 57 LYS H H 57 8.920 8.920 8.754 0.166 19694
7276 1 16 . 1 1 58 58 ASP HA H 58 3.830 3.830 4.211 -0.381 19694
7277 1 16 . 1 1 58 58 ASP CA C 58 54.900 54.900 55.395 -0.494 19694
7278 1 16 . 1 1 58 58 ASP CB C 58 40.080 40.080 40.856 -0.776 19694
7279 1 16 . 1 1 58 58 ASP H H 58 8.400 8.400 8.480 -0.080 19694
7280 1 16 . 1 1 59 59 ARG N N 59 121.190 121.190 115.884 5.306 19694
7281 1 16 . 1 1 59 59 ARG HA H 59 4.250 4.250 4.574 -0.324 19694
7282 1 16 . 1 1 59 59 ARG CA C 59 55.580 55.580 54.282 1.298 19694
7283 1 16 . 1 1 59 59 ARG CB C 59 33.460 33.460 33.574 -0.114 19694
7284 1 16 . 1 1 59 59 ARG H H 59 7.980 7.980 7.867 0.113 19694
7285 1 16 . 1 1 60 60 HIS N N 60 118.420 118.420 117.599 0.821 19694
7286 1 16 . 1 1 60 60 HIS HA H 60 5.270 5.270 5.649 -0.379 19694
7287 1 16 . 1 1 60 60 HIS CA C 60 55.010 55.010 55.188 -0.178 19694
7288 1 16 . 1 1 60 60 HIS CB C 60 32.380 32.380 33.436 -1.056 19694
7289 1 16 . 1 1 60 60 HIS H H 60 8.350 8.350 8.134 0.216 19694
7290 1 16 . 1 1 61 61 TRP N N 61 119.990 119.990 118.283 1.707 19694
7291 1 16 . 1 1 61 61 TRP HA H 61 5.930 5.930 4.787 1.143 19694
7292 1 16 . 1 1 61 61 TRP CA C 61 57.400 57.400 57.142 0.258 19694
7293 1 16 . 1 1 61 61 TRP CB C 61 35.380 35.380 34.216 1.164 19694
7294 1 16 . 1 1 61 61 TRP H H 61 9.310 9.310 9.405 -0.095 19694
7295 1 16 . 1 1 62 62 HIS N N 62 117.270 117.270 121.383 -4.113 19694
7296 1 16 . 1 1 62 62 HIS HA H 62 4.600 4.600 4.668 -0.068 19694
7297 1 16 . 1 1 62 62 HIS CA C 62 59.210 59.210 57.670 1.540 19694
7298 1 16 . 1 1 62 62 HIS CB C 62 31.200 31.200 30.595 0.605 19694
7299 1 16 . 1 1 62 62 HIS H H 62 8.430 8.430 9.183 -0.753 19694
7300 1 16 . 1 1 63 63 GLU N N 63 124.640 124.640 128.871 -4.231 19694
7301 1 16 . 1 1 63 63 GLU HA H 63 3.827 3.827 3.991 -0.164 19694
7302 1 16 . 1 1 63 63 GLU CA C 63 61.020 61.020 59.783 1.237 19694
7303 1 16 . 1 1 63 63 GLU CB C 63 30.310 30.310 29.764 0.546 19694
7304 1 16 . 1 1 63 63 GLU H H 63 9.040 9.040 8.471 0.569 19694
7305 1 16 . 1 1 64 64 ALA N N 64 117.050 117.050 117.882 -0.832 19694
7306 1 16 . 1 1 64 64 ALA HA H 64 4.230 4.230 4.347 -0.117 19694
7307 1 16 . 1 1 64 64 ALA CA C 64 54.000 54.000 53.092 0.908 19694
7308 1 16 . 1 1 64 64 ALA CB C 64 18.880 18.880 18.991 -0.111 19694
7309 1 16 . 1 1 64 64 ALA H H 64 8.680 8.680 8.385 0.295 19694
7310 1 16 . 1 1 65 65 CYS N N 65 115.380 115.380 117.535 -2.155 19694
7311 1 16 . 1 1 65 65 CYS HA H 65 4.295 4.295 4.581 -0.286 19694
7312 1 16 . 1 1 65 65 CYS CA C 65 59.850 59.850 60.592 -0.742 19694
7313 1 16 . 1 1 65 65 CYS CB C 65 32.840 32.840 27.518 5.322 19694
7314 1 16 . 1 1 65 65 CYS H H 65 7.490 7.490 8.327 -0.837 19694
7315 1 16 . 1 1 66 66 PHE N N 66 122.020 122.020 122.916 -0.896 19694
7316 1 16 . 1 1 66 66 PHE HA H 66 3.890 3.890 3.857 0.033 19694
7317 1 16 . 1 1 66 66 PHE CA C 66 57.010 57.010 58.617 -1.607 19694
7318 1 16 . 1 1 66 66 PHE CB C 66 38.070 38.070 37.984 0.086 19694
7319 1 16 . 1 1 66 66 PHE H H 66 7.110 7.110 7.705 -0.595 19694
7320 1 16 . 1 1 67 67 HIS N N 67 121.280 121.280 121.093 0.187 19694
7321 1 16 . 1 1 67 67 HIS HA H 67 4.720 4.720 5.283 -0.563 19694
7322 1 16 . 1 1 67 67 HIS CA C 67 52.730 52.730 53.748 -1.018 19694
7323 1 16 . 1 1 67 67 HIS CB C 67 32.230 32.230 31.859 0.371 19694
7324 1 16 . 1 1 67 67 HIS H H 67 7.380 7.380 7.055 0.325 19694
7325 1 16 . 1 1 68 68 CYS N N 68 121.590 121.590 118.978 2.612 19694
7326 1 16 . 1 1 68 68 CYS HA H 68 3.960 3.960 4.922 -0.962 19694
7327 1 16 . 1 1 68 68 CYS CA C 68 59.790 59.790 58.088 1.702 19694
7328 1 16 . 1 1 68 68 CYS CB C 68 31.200 31.200 29.836 1.364 19694
7329 1 16 . 1 1 68 68 CYS H H 68 8.530 8.530 8.470 0.060 19694
7330 1 16 . 1 1 69 69 SER N N 69 126.530 126.530 120.186 6.344 19694
7331 1 16 . 1 1 69 69 SER HA H 69 4.310 4.310 4.319 -0.009 19694
7332 1 16 . 1 1 69 69 SER CA C 69 61.760 61.760 61.538 0.222 19694
7333 1 16 . 1 1 69 69 SER CB C 69 64.040 64.040 63.448 0.592 19694
7334 1 16 . 1 1 69 69 SER H H 69 9.460 9.460 8.713 0.747 19694
7335 1 16 . 1 1 70 70 GLN N N 70 122.370 122.370 118.983 3.387 19694
7336 1 16 . 1 1 70 70 GLN HA H 70 4.510 4.510 4.426 0.084 19694
7337 1 16 . 1 1 70 70 GLN CA C 70 57.840 57.840 57.236 0.604 19694
7338 1 16 . 1 1 70 70 GLN CB C 70 30.430 30.430 29.308 1.122 19694
7339 1 16 . 1 1 70 70 GLN H H 70 8.980 8.980 7.876 1.104 19694
7340 1 16 . 1 1 71 71 CYS N N 71 118.860 118.860 116.104 2.756 19694
7341 1 16 . 1 1 71 71 CYS HA H 71 4.720 4.720 4.653 0.067 19694
7342 1 16 . 1 1 71 71 CYS CA C 71 59.770 59.770 58.325 1.445 19694
7343 1 16 . 1 1 71 71 CYS CB C 71 31.910 31.910 27.898 4.012 19694
7344 1 16 . 1 1 71 71 CYS H H 71 8.220 8.220 7.828 0.392 19694
7345 1 16 . 1 1 72 72 ARG N N 72 114.380 114.380 116.063 -1.683 19694
7346 1 16 . 1 1 72 72 ARG HA H 72 3.965 3.965 3.994 -0.029 19694
7347 1 16 . 1 1 72 72 ARG CA C 72 58.030 58.030 57.351 0.679 19694
7348 1 16 . 1 1 72 72 ARG CB C 72 27.720 27.720 27.891 -0.171 19694
7349 1 16 . 1 1 72 72 ARG H H 72 7.380 7.380 7.884 -0.504 19694
7350 1 16 . 1 1 73 73 ASN N N 73 121.480 121.480 116.139 5.341 19694
7351 1 16 . 1 1 73 73 ASN HA H 73 4.630 4.630 4.652 -0.022 19694
7352 1 16 . 1 1 73 73 ASN CA C 73 54.110 54.110 53.833 0.277 19694
7353 1 16 . 1 1 73 73 ASN CB C 73 38.870 38.870 39.691 -0.821 19694
7354 1 16 . 1 1 73 73 ASN H H 73 8.722 8.722 8.070 0.652 19694
7355 1 16 . 1 1 74 74 SER N N 74 114.710 114.710 117.852 -3.142 19694
7356 1 16 . 1 1 74 74 SER HA H 74 4.060 4.060 4.902 -0.842 19694
7357 1 16 . 1 1 74 74 SER CA C 74 59.357 59.357 58.122 1.235 19694
7358 1 16 . 1 1 74 74 SER CB C 74 63.300 63.300 63.299 0.001 19694
7359 1 16 . 1 1 74 74 SER H H 74 8.690 8.690 8.514 0.176 19694
7360 1 16 . 1 1 75 75 LEU N N 75 125.757 125.757 128.670 -2.913 19694
7361 1 16 . 1 1 75 75 LEU HA H 75 4.280 4.280 4.282 -0.002 19694
7362 1 16 . 1 1 75 75 LEU CA C 75 53.510 53.510 54.725 -1.215 19694
7363 1 16 . 1 1 75 75 LEU CB C 75 42.200 42.200 41.720 0.480 19694
7364 1 16 . 1 1 75 75 LEU H H 75 7.970 7.970 8.063 -0.093 19694
7365 1 16 . 1 1 76 76 VAL N N 76 120.860 120.860 124.745 -3.885 19694
7366 1 16 . 1 1 76 76 VAL HA H 76 3.570 3.570 3.846 -0.276 19694
7367 1 16 . 1 1 76 76 VAL CA C 76 65.420 65.420 60.858 4.562 19694
7368 1 16 . 1 1 76 76 VAL CB C 76 31.540 31.540 35.117 -3.577 19694
7369 1 16 . 1 1 76 76 VAL H H 76 7.830 7.830 7.971 -0.141 19694
7370 1 16 . 1 1 77 77 ASP N N 77 122.360 122.360 123.747 -1.387 19694
7371 1 16 . 1 1 77 77 ASP HA H 77 4.230 4.230 4.460 -0.230 19694
7372 1 16 . 1 1 77 77 ASP CA C 77 56.200 56.200 55.825 0.374 19694
7373 1 16 . 1 1 77 77 ASP CB C 77 39.380 39.380 40.899 -1.519 19694
7374 1 16 . 1 1 77 77 ASP H H 77 8.910 8.910 8.401 0.509 19694
7375 1 16 . 1 1 78 78 LYS N N 78 118.100 118.100 118.404 -0.304 19694
7376 1 16 . 1 1 78 78 LYS HA H 78 4.870 4.870 4.647 0.223 19694
7377 1 16 . 1 1 78 78 LYS CA C 78 56.960 56.960 53.643 3.317 19694
7378 1 16 . 1 1 78 78 LYS CB C 78 34.680 34.680 33.829 0.851 19694
7379 1 16 . 1 1 78 78 LYS H H 78 7.660 7.660 7.634 0.026 19694
7380 1 16 . 1 1 79 79 PRO HA H 79 4.460 4.460 4.207 0.253 19694
7381 1 16 . 1 1 79 79 PRO CA C 79 62.520 62.520 62.964 -0.444 19694
7382 1 16 . 1 1 79 79 PRO CB C 79 32.160 32.160 31.855 0.305 19694
7383 1 16 . 1 1 80 80 PHE N N 80 114.050 114.050 117.076 -3.026 19694
7384 1 16 . 1 1 80 80 PHE HA H 80 4.910 4.910 5.058 -0.148 19694
7385 1 16 . 1 1 80 80 PHE CA C 80 56.060 56.060 55.102 0.958 19694
7386 1 16 . 1 1 80 80 PHE CB C 80 42.410 42.410 41.861 0.548 19694
7387 1 16 . 1 1 80 80 PHE H H 80 7.510 7.510 7.175 0.335 19694
7388 1 16 . 1 1 81 81 ALA N N 81 123.290 123.290 123.713 -0.423 19694
7389 1 16 . 1 1 81 81 ALA HA H 81 4.310 4.310 4.373 -0.063 19694
7390 1 16 . 1 1 81 81 ALA CA C 81 50.450 50.450 50.366 0.084 19694
7391 1 16 . 1 1 81 81 ALA CB C 81 21.920 21.920 19.071 2.849 19694
7392 1 16 . 1 1 81 81 ALA H H 81 9.030 9.030 9.046 -0.016 19694
7393 1 16 . 1 1 82 82 ALA N N 82 122.490 122.490 129.225 -6.735 19694
7394 1 16 . 1 1 82 82 ALA HA H 82 5.110 5.110 4.363 0.747 19694
7395 1 16 . 1 1 82 82 ALA CA C 82 51.100 51.100 51.606 -0.506 19694
7396 1 16 . 1 1 82 82 ALA CB C 82 21.130 21.130 18.827 2.303 19694
7397 1 16 . 1 1 82 82 ALA H H 82 8.240 8.240 8.645 -0.405 19694
7398 1 16 . 1 1 83 83 LYS N N 83 123.580 123.580 125.404 -1.824 19694
7399 1 16 . 1 1 83 83 LYS HA H 83 4.490 4.490 4.519 -0.029 19694
7400 1 16 . 1 1 83 83 LYS CA C 83 55.800 55.800 55.335 0.465 19694
7401 1 16 . 1 1 83 83 LYS CB C 83 34.720 34.720 34.054 0.666 19694
7402 1 16 . 1 1 83 83 LYS H H 83 8.400 8.400 8.309 0.091 19694
7403 1 16 . 1 1 84 84 GLU N N 84 125.470 125.470 120.515 4.955 19694
7404 1 16 . 1 1 84 84 GLU HA H 84 3.820 3.820 4.126 -0.306 19694
7405 1 16 . 1 1 84 84 GLU CA C 84 58.620 58.620 59.190 -0.570 19694
7406 1 16 . 1 1 84 84 GLU CB C 84 27.210 27.210 29.638 -2.428 19694
7407 1 16 . 1 1 84 84 GLU H H 84 9.320 9.320 8.757 0.563 19694
7408 1 16 . 1 1 85 85 ASP N N 85 118.550 118.550 114.788 3.762 19694
7409 1 16 . 1 1 85 85 ASP HA H 85 4.600 4.600 4.801 -0.201 19694
7410 1 16 . 1 1 85 85 ASP CA C 85 55.400 55.400 53.804 1.596 19694
7411 1 16 . 1 1 85 85 ASP CB C 85 40.400 40.400 42.149 -1.749 19694
7412 1 16 . 1 1 85 85 ASP H H 85 8.730 8.730 8.432 0.298 19694
7413 1 16 . 1 1 86 86 GLN N N 86 119.050 119.050 117.200 1.850 19694
7414 1 16 . 1 1 86 86 GLN HA H 86 4.540 4.540 4.658 -0.118 19694
7415 1 16 . 1 1 86 86 GLN CA C 86 55.100 55.100 54.006 1.094 19694
7416 1 16 . 1 1 86 86 GLN CB C 86 31.110 31.110 32.068 -0.958 19694
7417 1 16 . 1 1 86 86 GLN H H 86 8.170 8.170 7.573 0.597 19694
7418 1 16 . 1 1 87 87 LEU N N 87 123.110 123.110 121.209 1.901 19694
7419 1 16 . 1 1 87 87 LEU HA H 87 4.620 4.620 5.160 -0.540 19694
7420 1 16 . 1 1 87 87 LEU CA C 87 54.520 54.520 53.939 0.581 19694
7421 1 16 . 1 1 87 87 LEU CB C 87 42.700 42.700 44.520 -1.820 19694
7422 1 16 . 1 1 87 87 LEU H H 87 8.490 8.490 8.462 0.028 19694
7423 1 16 . 1 1 88 88 LEU N N 88 123.690 123.690 120.066 3.624 19694
7424 1 16 . 1 1 88 88 LEU HA H 88 5.880 5.880 4.961 0.919 19694
7425 1 16 . 1 1 88 88 LEU CA C 88 53.340 53.340 52.846 0.494 19694
7426 1 16 . 1 1 88 88 LEU CB C 88 47.190 47.190 47.838 -0.648 19694
7427 1 16 . 1 1 88 88 LEU H H 88 8.930 8.930 8.394 0.536 19694
7428 1 16 . 1 1 89 89 CYS N N 89 122.270 122.270 119.182 3.088 19694
7429 1 16 . 1 1 89 89 CYS HA H 89 4.780 4.780 4.853 -0.073 19694
7430 1 16 . 1 1 89 89 CYS CA C 89 57.640 57.640 59.384 -1.744 19694
7431 1 16 . 1 1 89 89 CYS CB C 89 30.940 30.940 27.877 3.063 19694
7432 1 16 . 1 1 89 89 CYS H H 89 9.430 9.430 9.079 0.351 19694
7433 1 16 . 1 1 90 90 THR N N 90 110.620 110.620 117.432 -6.812 19694
7434 1 16 . 1 1 90 90 THR HA H 90 3.900 3.900 3.940 -0.040 19694
7435 1 16 . 1 1 90 90 THR CA C 90 65.460 65.460 65.665 -0.205 19694
7436 1 16 . 1 1 90 90 THR CB C 90 68.670 68.670 68.734 -0.064 19694
7437 1 16 . 1 1 90 90 THR H H 90 8.410 8.410 8.882 -0.472 19694
7438 1 16 . 1 1 91 91 ASP N N 91 123.470 123.470 120.366 3.104 19694
7439 1 16 . 1 1 91 91 ASP HA H 91 4.490 4.490 4.612 -0.122 19694
7440 1 16 . 1 1 91 91 ASP CA C 91 57.810 57.810 57.466 0.344 19694
7441 1 16 . 1 1 91 91 ASP CB C 91 41.160 41.160 40.576 0.584 19694
7442 1 16 . 1 1 91 91 ASP H H 91 8.150 8.150 8.442 -0.292 19694
7443 1 16 . 1 1 92 92 CYS N N 92 123.800 123.800 119.449 4.351 19694
7444 1 16 . 1 1 92 92 CYS HA H 92 3.970 3.970 4.401 -0.431 19694
7445 1 16 . 1 1 92 92 CYS CA C 92 64.100 64.100 61.282 2.818 19694
7446 1 16 . 1 1 92 92 CYS CB C 92 30.090 30.090 26.383 3.707 19694
7447 1 16 . 1 1 92 92 CYS H H 92 8.580 8.580 7.983 0.597 19694
7448 1 16 . 1 1 93 93 TYR N N 93 120.730 120.730 121.416 -0.686 19694
7449 1 16 . 1 1 93 93 TYR HA H 93 4.140 4.140 4.292 -0.152 19694
7450 1 16 . 1 1 93 93 TYR CA C 93 60.380 60.380 61.057 -0.677 19694
7451 1 16 . 1 1 93 93 TYR CB C 93 39.300 39.300 38.819 0.481 19694
7452 1 16 . 1 1 93 93 TYR H H 93 8.540 8.540 9.077 -0.537 19694
7453 1 16 . 1 1 94 94 SER N N 94 115.010 115.010 113.182 1.828 19694
7454 1 16 . 1 1 94 94 SER HA H 94 4.220 4.220 4.205 0.015 19694
7455 1 16 . 1 1 94 94 SER CA C 94 59.300 59.300 61.761 -2.461 19694
7456 1 16 . 1 1 94 94 SER CB C 94 63.660 63.660 62.597 1.063 19694
7457 1 16 . 1 1 94 94 SER H H 94 7.750 7.750 7.983 -0.233 19694
7458 1 16 . 1 1 95 95 ASN N N 95 119.820 119.820 119.362 0.458 19694
7459 1 16 . 1 1 95 95 ASN HA H 95 4.510 4.510 4.622 -0.112 19694
7460 1 16 . 1 1 95 95 ASN CA C 95 53.880 53.880 55.146 -1.266 19694
7461 1 16 . 1 1 95 95 ASN CB C 95 39.300 39.300 38.811 0.489 19694
7462 1 16 . 1 1 95 95 ASN H H 95 7.780 7.780 7.767 0.013 19694
7463 1 16 . 1 1 96 96 GLU N N 96 119.820 119.820 117.219 2.601 19694
7464 1 16 . 1 1 96 96 GLU HA H 96 4.096 4.096 4.289 -0.193 19694
7465 1 16 . 1 1 96 96 GLU CA C 96 56.910 56.910 56.891 0.019 19694
7466 1 16 . 1 1 96 96 GLU CB C 96 30.220 30.220 29.565 0.655 19694
7467 1 16 . 1 1 96 96 GLU H H 96 7.950 7.950 7.468 0.482 19694
7468 1 16 . 1 1 97 97 TYR N N 97 120.370 120.370 122.274 -1.904 19694
7469 1 16 . 1 1 97 97 TYR HA H 97 4.620 4.620 3.878 0.742 19694
7470 1 16 . 1 1 97 97 TYR CA C 97 57.700 57.700 60.906 -3.206 19694
7471 1 16 . 1 1 97 97 TYR CB C 97 38.710 38.710 38.365 0.345 19694
7472 1 16 . 1 1 97 97 TYR H H 97 8.070 8.070 8.367 -0.297 19694
7473 1 17 . 1 1 2 2 THR N N 2 113.570 113.570 115.939 -2.369 19694
7474 1 17 . 1 1 2 2 THR HA H 2 4.240 4.240 4.143 0.097 19694
7475 1 17 . 1 1 2 2 THR CA C 2 62.130 62.130 63.551 -1.421 19694
7476 1 17 . 1 1 2 2 THR CB C 2 69.250 69.250 69.141 0.109 19694
7477 1 17 . 1 1 2 2 THR H H 2 8.090 8.090 8.063 0.027 19694
7478 1 17 . 1 1 3 3 GLU N N 3 122.880 122.880 120.171 2.709 19694
7479 1 17 . 1 1 3 3 GLU HA H 3 4.280 4.280 4.168 0.112 19694
7480 1 17 . 1 1 3 3 GLU CA C 3 56.860 56.860 56.662 0.198 19694
7481 1 17 . 1 1 3 3 GLU CB C 3 30.570 30.570 30.175 0.395 19694
7482 1 17 . 1 1 3 3 GLU H H 3 8.280 8.280 8.062 0.218 19694
7483 1 17 . 1 1 4 4 ARG N N 4 121.330 121.330 119.279 2.051 19694
7484 1 17 . 1 1 4 4 ARG HA H 4 4.300 4.300 4.531 -0.231 19694
7485 1 17 . 1 1 4 4 ARG CA C 4 55.870 55.870 55.194 0.676 19694
7486 1 17 . 1 1 4 4 ARG CB C 4 31.640 31.640 30.852 0.788 19694
7487 1 17 . 1 1 4 4 ARG H H 4 8.280 8.280 8.516 -0.236 19694
7488 1 17 . 1 1 5 5 PHE N N 5 125.490 125.490 124.999 0.491 19694
7489 1 17 . 1 1 5 5 PHE HA H 5 4.610 4.610 4.584 0.026 19694
7490 1 17 . 1 1 5 5 PHE CA C 5 56.380 56.380 56.442 -0.062 19694
7491 1 17 . 1 1 5 5 PHE CB C 5 39.560 39.560 39.691 -0.131 19694
7492 1 17 . 1 1 5 5 PHE H H 5 8.290 8.290 8.727 -0.437 19694
7493 1 17 . 1 1 6 6 ASP N N 6 123.260 123.260 121.314 1.946 19694
7494 1 17 . 1 1 6 6 ASP HA H 6 5.045 5.045 4.819 0.226 19694
7495 1 17 . 1 1 6 6 ASP CA C 6 52.180 52.180 53.230 -1.050 19694
7496 1 17 . 1 1 6 6 ASP CB C 6 44.210 44.210 44.485 -0.275 19694
7497 1 17 . 1 1 6 6 ASP H H 6 7.940 7.940 7.618 0.322 19694
7498 1 17 . 1 1 7 7 CYS N N 7 121.440 121.440 122.830 -1.390 19694
7499 1 17 . 1 1 7 7 CYS HA H 7 3.960 3.960 4.473 -0.513 19694
7500 1 17 . 1 1 7 7 CYS CA C 7 59.820 59.820 59.572 0.248 19694
7501 1 17 . 1 1 7 7 CYS CB C 7 30.950 30.950 26.244 4.706 19694
7502 1 17 . 1 1 7 7 CYS H H 7 8.700 8.700 8.561 0.139 19694
7503 1 17 . 1 1 8 8 HIS N N 8 129.390 129.390 129.858 -0.468 19694
7504 1 17 . 1 1 8 8 HIS HA H 8 4.200 4.200 4.209 -0.009 19694
7505 1 17 . 1 1 8 8 HIS CA C 8 58.240 58.240 59.624 -1.384 19694
7506 1 17 . 1 1 8 8 HIS CB C 8 29.480 29.480 30.110 -0.630 19694
7507 1 17 . 1 1 8 8 HIS H H 8 9.160 9.160 9.621 -0.461 19694
7508 1 17 . 1 1 9 9 HIS N N 9 118.740 118.740 117.562 1.178 19694
7509 1 17 . 1 1 9 9 HIS HA H 9 4.880 4.880 4.428 0.452 19694
7510 1 17 . 1 1 9 9 HIS CA C 9 58.680 58.680 57.075 1.605 19694
7511 1 17 . 1 1 9 9 HIS CB C 9 31.040 31.040 30.345 0.695 19694
7512 1 17 . 1 1 9 9 HIS H H 9 9.270 9.270 8.008 1.262 19694
7513 1 17 . 1 1 10 10 CYS N N 10 118.600 118.600 117.645 0.955 19694
7514 1 17 . 1 1 10 10 CYS HA H 10 4.600 4.600 4.384 0.216 19694
7515 1 17 . 1 1 10 10 CYS CA C 10 59.600 59.600 59.249 0.351 19694
7516 1 17 . 1 1 10 10 CYS CB C 10 32.330 32.330 27.849 4.481 19694
7517 1 17 . 1 1 10 10 CYS H H 10 8.550 8.550 7.869 0.681 19694
7518 1 17 . 1 1 11 11 ASN N N 11 116.220 116.220 117.037 -0.817 19694
7519 1 17 . 1 1 11 11 ASN HA H 11 4.410 4.410 4.376 0.034 19694
7520 1 17 . 1 1 11 11 ASN CA C 11 55.640 55.640 54.474 1.166 19694
7521 1 17 . 1 1 11 11 ASN CB C 11 38.200 38.200 36.461 1.740 19694
7522 1 17 . 1 1 11 11 ASN H H 11 7.690 7.690 8.761 -1.071 19694
7523 1 17 . 1 1 12 12 GLU N N 12 120.330 120.330 117.685 2.645 19694
7524 1 17 . 1 1 12 12 GLU HA H 12 4.220 4.220 4.545 -0.325 19694
7525 1 17 . 1 1 12 12 GLU CA C 12 56.700 56.700 54.569 2.131 19694
7526 1 17 . 1 1 12 12 GLU CB C 12 30.910 30.910 31.175 -0.265 19694
7527 1 17 . 1 1 12 12 GLU H H 12 8.210 8.210 7.608 0.602 19694
7528 1 17 . 1 1 13 13 SER N N 13 116.190 116.190 119.556 -3.366 19694
7529 1 17 . 1 1 13 13 SER HA H 13 4.060 4.060 4.362 -0.302 19694
7530 1 17 . 1 1 13 13 SER CA C 13 59.350 59.350 58.501 0.849 19694
7531 1 17 . 1 1 13 13 SER CB C 13 63.820 63.820 63.623 0.197 19694
7532 1 17 . 1 1 13 13 SER H H 13 8.520 8.520 8.661 -0.141 19694
7533 1 17 . 1 1 14 14 LEU N N 14 126.060 126.060 126.549 -0.489 19694
7534 1 17 . 1 1 14 14 LEU HA H 14 4.310 4.310 4.362 -0.052 19694
7535 1 17 . 1 1 14 14 LEU CA C 14 54.100 54.100 55.861 -1.761 19694
7536 1 17 . 1 1 14 14 LEU CB C 14 42.200 42.200 41.733 0.467 19694
7537 1 17 . 1 1 14 14 LEU H H 14 8.910 8.910 7.774 1.136 19694
7538 1 17 . 1 1 15 15 PHE N N 15 120.660 120.660 120.900 -0.240 19694
7539 1 17 . 1 1 15 15 PHE HA H 15 4.480 4.480 4.609 -0.129 19694
7540 1 17 . 1 1 15 15 PHE CA C 15 60.400 60.400 56.132 4.268 19694
7541 1 17 . 1 1 15 15 PHE CB C 15 38.130 38.130 37.983 0.147 19694
7542 1 17 . 1 1 15 15 PHE H H 15 7.820 7.820 8.515 -0.695 19694
7543 1 17 . 1 1 16 16 GLY N N 16 114.730 114.730 110.943 3.787 19694
7544 1 17 . 1 1 16 16 GLY CA C 16 45.900 45.900 45.804 0.096 19694
7545 1 17 . 1 1 16 16 GLY H H 16 8.860 8.860 8.804 0.056 19694
7546 1 17 . 1 1 17 17 LYS N N 17 119.580 119.580 119.917 -0.337 19694
7547 1 17 . 1 1 17 17 LYS HA H 17 4.480 4.480 4.502 -0.022 19694
7548 1 17 . 1 1 17 17 LYS CA C 17 54.460 54.460 54.419 0.041 19694
7549 1 17 . 1 1 17 17 LYS CB C 17 35.800 35.800 34.099 1.700 19694
7550 1 17 . 1 1 17 17 LYS H H 17 8.030 8.030 7.196 0.834 19694
7551 1 17 . 1 1 18 18 LYS N N 18 120.330 120.330 123.288 -2.958 19694
7552 1 17 . 1 1 18 18 LYS HA H 18 4.280 4.280 4.305 -0.025 19694
7553 1 17 . 1 1 18 18 LYS CA C 18 56.800 56.800 57.738 -0.938 19694
7554 1 17 . 1 1 18 18 LYS CB C 18 33.010 33.010 33.172 -0.162 19694
7555 1 17 . 1 1 18 18 LYS H H 18 8.190 8.190 8.521 -0.331 19694
7556 1 17 . 1 1 19 19 TYR N N 19 117.500 117.500 115.775 1.725 19694
7557 1 17 . 1 1 19 19 TYR HA H 19 5.240 5.240 4.813 0.427 19694
7558 1 17 . 1 1 19 19 TYR CA C 19 55.340 55.340 56.230 -0.890 19694
7559 1 17 . 1 1 19 19 TYR CB C 19 42.850 42.850 40.353 2.497 19694
7560 1 17 . 1 1 19 19 TYR H H 19 7.610 7.610 7.863 -0.253 19694
7561 1 17 . 1 1 20 20 ILE N N 20 121.430 121.430 121.726 -0.296 19694
7562 1 17 . 1 1 20 20 ILE HA H 20 4.137 4.137 4.254 -0.117 19694
7563 1 17 . 1 1 20 20 ILE CA C 20 60.010 60.010 60.117 -0.107 19694
7564 1 17 . 1 1 20 20 ILE CB C 20 41.570 41.570 40.732 0.838 19694
7565 1 17 . 1 1 20 20 ILE H H 20 9.350 9.350 8.197 1.153 19694
7566 1 17 . 1 1 21 21 LEU N N 21 126.720 126.720 126.066 0.654 19694
7567 1 17 . 1 1 21 21 LEU HA H 21 5.090 5.090 4.765 0.325 19694
7568 1 17 . 1 1 21 21 LEU CA C 21 54.020 54.020 53.920 0.100 19694
7569 1 17 . 1 1 21 21 LEU CB C 21 43.720 43.720 40.834 2.886 19694
7570 1 17 . 1 1 21 21 LEU H H 21 8.530 8.530 8.510 0.020 19694
7571 1 17 . 1 1 22 22 ARG N N 22 123.930 123.930 126.216 -2.286 19694
7572 1 17 . 1 1 22 22 ARG HA H 22 4.440 4.440 4.488 -0.048 19694
7573 1 17 . 1 1 22 22 ARG CA C 22 55.600 55.600 54.360 1.240 19694
7574 1 17 . 1 1 22 22 ARG CB C 22 32.280 32.280 32.250 0.030 19694
7575 1 17 . 1 1 22 22 ARG H H 22 9.080 9.080 8.880 0.200 19694
7576 1 17 . 1 1 23 23 GLU N N 23 128.500 128.500 123.427 5.073 19694
7577 1 17 . 1 1 23 23 GLU HA H 23 3.840 3.840 3.919 -0.079 19694
7578 1 17 . 1 1 23 23 GLU CA C 23 58.030 58.030 57.917 0.113 19694
7579 1 17 . 1 1 23 23 GLU CB C 23 27.200 27.200 27.767 -0.567 19694
7580 1 17 . 1 1 23 23 GLU H H 23 9.610 9.610 8.970 0.640 19694
7581 1 17 . 1 1 24 24 GLU N N 24 110.300 110.300 113.224 -2.924 19694
7582 1 17 . 1 1 24 24 GLU HA H 24 3.780 3.780 3.976 -0.196 19694
7583 1 17 . 1 1 24 24 GLU CA C 24 58.320 58.320 57.385 0.935 19694
7584 1 17 . 1 1 24 24 GLU CB C 24 28.220 28.220 28.433 -0.213 19694
7585 1 17 . 1 1 24 24 GLU H H 24 8.660 8.660 8.695 -0.035 19694
7586 1 17 . 1 1 25 25 SER N N 25 117.700 117.700 112.875 4.825 19694
7587 1 17 . 1 1 25 25 SER HA H 25 4.890 4.890 4.782 0.108 19694
7588 1 17 . 1 1 25 25 SER CA C 25 56.540 56.540 55.709 0.831 19694
7589 1 17 . 1 1 25 25 SER CB C 25 64.720 64.720 64.548 0.172 19694
7590 1 17 . 1 1 25 25 SER H H 25 7.900 7.900 7.752 0.148 19694
7591 1 17 . 1 1 26 26 PRO HA H 26 4.995 4.995 4.874 0.121 19694
7592 1 17 . 1 1 26 26 PRO CA C 26 61.750 61.750 63.097 -1.347 19694
7593 1 17 . 1 1 26 26 PRO CB C 26 32.660 32.660 31.649 1.011 19694
7594 1 17 . 1 1 27 27 TYR N N 27 118.100 118.100 123.564 -5.464 19694
7595 1 17 . 1 1 27 27 TYR HA H 27 5.910 5.910 4.983 0.927 19694
7596 1 17 . 1 1 27 27 TYR CA C 27 56.830 56.830 54.857 1.973 19694
7597 1 17 . 1 1 27 27 TYR CB C 27 42.810 42.810 42.531 0.279 19694
7598 1 17 . 1 1 27 27 TYR H H 27 9.040 9.040 8.748 0.292 19694
7599 1 17 . 1 1 28 28 CYS N N 28 122.230 122.230 118.878 3.352 19694
7600 1 17 . 1 1 28 28 CYS HA H 28 4.850 4.850 4.678 0.172 19694
7601 1 17 . 1 1 28 28 CYS CA C 28 58.110 58.110 58.414 -0.305 19694
7602 1 17 . 1 1 28 28 CYS CB C 28 30.530 30.530 29.132 1.398 19694
7603 1 17 . 1 1 28 28 CYS H H 28 9.850 9.850 8.313 1.537 19694
7604 1 17 . 1 1 29 29 VAL N N 29 118.200 118.200 123.418 -5.218 19694
7605 1 17 . 1 1 29 29 VAL HA H 29 3.650 3.650 3.661 -0.011 19694
7606 1 17 . 1 1 29 29 VAL CA C 29 67.400 67.400 67.165 0.235 19694
7607 1 17 . 1 1 29 29 VAL CB C 29 31.860 31.860 31.514 0.346 19694
7608 1 17 . 1 1 29 29 VAL H H 29 8.430 8.430 8.996 -0.566 19694
7609 1 17 . 1 1 30 30 VAL N N 30 119.570 119.570 118.419 1.151 19694
7610 1 17 . 1 1 30 30 VAL HA H 30 3.860 3.860 3.526 0.334 19694
7611 1 17 . 1 1 30 30 VAL CA C 30 66.450 66.450 66.118 0.332 19694
7612 1 17 . 1 1 30 30 VAL CB C 30 31.540 31.540 31.129 0.411 19694
7613 1 17 . 1 1 30 30 VAL H H 30 7.700 7.700 8.138 -0.438 19694
7614 1 17 . 1 1 31 31 CYS N N 31 125.890 125.890 119.221 6.669 19694
7615 1 17 . 1 1 31 31 CYS HA H 31 3.830 3.830 3.884 -0.054 19694
7616 1 17 . 1 1 31 31 CYS CA C 31 65.850 65.850 64.217 1.633 19694
7617 1 17 . 1 1 31 31 CYS CB C 31 29.510 29.510 25.470 4.040 19694
7618 1 17 . 1 1 31 31 CYS H H 31 9.050 9.050 7.652 1.398 19694
7619 1 17 . 1 1 32 32 PHE N N 32 119.000 119.000 119.281 -0.281 19694
7620 1 17 . 1 1 32 32 PHE HA H 32 3.780 3.780 3.675 0.105 19694
7621 1 17 . 1 1 32 32 PHE CA C 32 62.610 62.610 61.802 0.808 19694
7622 1 17 . 1 1 32 32 PHE CB C 32 39.920 39.920 39.023 0.897 19694
7623 1 17 . 1 1 32 32 PHE H H 32 9.080 9.080 7.866 1.214 19694
7624 1 17 . 1 1 33 33 GLU N N 33 117.470 117.470 117.748 -0.278 19694
7625 1 17 . 1 1 33 33 GLU HA H 33 3.760 3.760 4.069 -0.309 19694
7626 1 17 . 1 1 33 33 GLU CA C 33 59.210 59.210 59.449 -0.239 19694
7627 1 17 . 1 1 33 33 GLU CB C 33 29.480 29.480 29.229 0.251 19694
7628 1 17 . 1 1 33 33 GLU H H 33 8.510 8.510 8.037 0.473 19694
7629 1 17 . 1 1 34 34 THR N N 34 114.140 114.140 115.670 -1.530 19694
7630 1 17 . 1 1 34 34 THR HA H 34 3.730 3.730 3.936 -0.206 19694
7631 1 17 . 1 1 34 34 THR CA C 34 65.890 65.890 66.015 -0.125 19694
7632 1 17 . 1 1 34 34 THR CB C 34 69.210 69.210 68.709 0.501 19694
7633 1 17 . 1 1 34 34 THR H H 34 7.880 7.880 8.249 -0.369 19694
7634 1 17 . 1 1 35 35 LEU N N 35 117.980 117.980 118.613 -0.633 19694
7635 1 17 . 1 1 35 35 LEU HA H 35 3.650 3.650 3.946 -0.296 19694
7636 1 17 . 1 1 35 35 LEU CA C 35 56.860 56.860 57.207 -0.347 19694
7637 1 17 . 1 1 35 35 LEU CB C 35 41.870 41.870 41.699 0.171 19694
7638 1 17 . 1 1 35 35 LEU H H 35 7.660 7.660 7.729 -0.069 19694
7639 1 17 . 1 1 36 36 PHE N N 36 113.900 113.900 114.007 -0.107 19694
7640 1 17 . 1 1 36 36 PHE HA H 36 4.597 4.597 4.414 0.183 19694
7641 1 17 . 1 1 36 36 PHE CA C 36 56.860 56.860 56.376 0.484 19694
7642 1 17 . 1 1 36 36 PHE CB C 36 40.570 40.570 38.241 2.329 19694
7643 1 17 . 1 1 36 36 PHE H H 36 7.730 7.730 6.633 1.097 19694
7644 1 17 . 1 1 37 37 ALA N N 37 121.920 121.920 123.259 -1.339 19694
7645 1 17 . 1 1 37 37 ALA HA H 37 4.070 4.070 4.107 -0.037 19694
7646 1 17 . 1 1 37 37 ALA CA C 37 52.900 52.900 52.299 0.601 19694
7647 1 17 . 1 1 37 37 ALA CB C 37 19.770 19.770 19.771 -0.001 19694
7648 1 17 . 1 1 37 37 ALA H H 37 7.090 7.090 7.892 -0.802 19694
7649 1 17 . 1 1 38 38 ASN N N 38 119.230 119.230 118.921 0.309 19694
7650 1 17 . 1 1 38 38 ASN HA H 38 4.450 4.450 4.665 -0.215 19694
7651 1 17 . 1 1 38 38 ASN CA C 38 52.850 52.850 52.570 0.280 19694
7652 1 17 . 1 1 38 38 ASN CB C 38 38.950 38.950 40.348 -1.398 19694
7653 1 17 . 1 1 38 38 ASN H H 38 8.790 8.790 8.289 0.501 19694
7654 1 17 . 1 1 39 39 THR N N 39 116.330 116.330 115.855 0.475 19694
7655 1 17 . 1 1 39 39 THR HA H 39 3.990 3.990 4.306 -0.316 19694
7656 1 17 . 1 1 39 39 THR CA C 39 62.130 62.130 63.115 -0.985 19694
7657 1 17 . 1 1 39 39 THR CB C 39 69.920 69.920 69.519 0.401 19694
7658 1 17 . 1 1 39 39 THR H H 39 8.540 8.540 8.207 0.333 19694
7659 1 17 . 1 1 40 40 CYS N N 40 126.950 126.950 128.378 -1.428 19694
7660 1 17 . 1 1 40 40 CYS HA H 40 4.300 4.300 4.441 -0.141 19694
7661 1 17 . 1 1 40 40 CYS CA C 40 58.350 58.350 57.243 1.107 19694
7662 1 17 . 1 1 40 40 CYS CB C 40 31.600 31.600 26.671 4.929 19694
7663 1 17 . 1 1 40 40 CYS H H 40 7.940 7.940 8.448 -0.508 19694
7664 1 17 . 1 1 41 41 GLU N N 41 130.560 130.560 127.596 2.964 19694
7665 1 17 . 1 1 41 41 GLU HA H 41 3.690 3.690 3.851 -0.161 19694
7666 1 17 . 1 1 41 41 GLU CA C 41 58.600 58.600 59.140 -0.540 19694
7667 1 17 . 1 1 41 41 GLU CB C 41 30.460 30.460 29.465 0.995 19694
7668 1 17 . 1 1 41 41 GLU H H 41 8.810 8.810 8.656 0.154 19694
7669 1 17 . 1 1 42 42 GLU N N 42 119.680 119.680 118.442 1.238 19694
7670 1 17 . 1 1 42 42 GLU HA H 42 4.570 4.570 4.343 0.227 19694
7671 1 17 . 1 1 42 42 GLU CA C 42 58.000 58.000 58.150 -0.150 19694
7672 1 17 . 1 1 42 42 GLU CB C 42 31.680 31.680 30.524 1.156 19694
7673 1 17 . 1 1 42 42 GLU H H 42 8.500 8.500 8.116 0.384 19694
7674 1 17 . 1 1 43 43 CYS N N 43 115.600 115.600 116.172 -0.572 19694
7675 1 17 . 1 1 43 43 CYS HA H 43 5.010 5.010 4.587 0.423 19694
7676 1 17 . 1 1 43 43 CYS CA C 43 58.810 58.810 60.029 -1.218 19694
7677 1 17 . 1 1 43 43 CYS CB C 43 31.580 31.580 28.971 2.609 19694
7678 1 17 . 1 1 43 43 CYS H H 43 8.120 8.120 8.082 0.038 19694
7679 1 17 . 1 1 44 44 GLY N N 44 112.100 112.100 106.717 5.383 19694
7680 1 17 . 1 1 44 44 GLY CA C 44 46.420 46.420 45.266 1.154 19694
7681 1 17 . 1 1 44 44 GLY H H 44 7.900 7.900 8.548 -0.648 19694
7682 1 17 . 1 1 45 45 LYS N N 45 121.210 121.210 121.822 -0.612 19694
7683 1 17 . 1 1 45 45 LYS HA H 45 4.840 4.840 4.668 0.172 19694
7684 1 17 . 1 1 45 45 LYS CA C 45 54.360 54.360 52.771 1.589 19694
7685 1 17 . 1 1 45 45 LYS CB C 45 32.430 32.430 32.909 -0.479 19694
7686 1 17 . 1 1 45 45 LYS H H 45 8.180 8.180 7.841 0.339 19694
7687 1 17 . 1 1 46 46 PRO HA H 46 4.477 4.477 4.521 -0.044 19694
7688 1 17 . 1 1 46 46 PRO CA C 46 62.700 62.700 63.042 -0.342 19694
7689 1 17 . 1 1 46 46 PRO CB C 46 32.490 32.490 32.045 0.445 19694
7690 1 17 . 1 1 47 47 ILE N N 47 125.280 125.280 123.239 2.041 19694
7691 1 17 . 1 1 47 47 ILE HA H 47 3.830 3.830 4.295 -0.465 19694
7692 1 17 . 1 1 47 47 ILE CA C 47 61.040 61.040 60.661 0.379 19694
7693 1 17 . 1 1 47 47 ILE CB C 47 37.440 37.440 37.671 -0.231 19694
7694 1 17 . 1 1 47 47 ILE H H 47 8.540 8.540 8.922 -0.382 19694
7695 1 17 . 1 1 48 48 GLY N N 48 114.120 114.120 114.331 -0.211 19694
7696 1 17 . 1 1 48 48 GLY CA C 48 45.240 45.240 45.179 0.061 19694
7697 1 17 . 1 1 48 48 GLY H H 48 8.660 8.660 8.575 0.085 19694
7698 1 17 . 1 1 49 49 CYS N N 49 117.140 117.140 123.643 -6.503 19694
7699 1 17 . 1 1 49 49 CYS HA H 49 4.280 4.280 4.227 0.053 19694
7700 1 17 . 1 1 49 49 CYS CA C 49 60.880 60.880 60.284 0.596 19694
7701 1 17 . 1 1 49 49 CYS CB C 49 27.650 27.650 27.073 0.577 19694
7702 1 17 . 1 1 49 49 CYS H H 49 9.210 9.210 8.629 0.581 19694
7703 1 17 . 1 1 50 50 ASP N N 50 119.300 119.300 120.026 -0.726 19694
7704 1 17 . 1 1 50 50 ASP HA H 50 4.620 4.620 4.698 -0.078 19694
7705 1 17 . 1 1 50 50 ASP CA C 50 54.160 54.160 55.633 -1.473 19694
7706 1 17 . 1 1 50 50 ASP CB C 50 40.380 40.380 40.115 0.265 19694
7707 1 17 . 1 1 50 50 ASP H H 50 8.800 8.800 8.280 0.520 19694
7708 1 17 . 1 1 51 51 CYS N N 51 118.150 118.150 117.089 1.061 19694
7709 1 17 . 1 1 51 51 CYS HA H 51 4.620 4.620 4.741 -0.121 19694
7710 1 17 . 1 1 51 51 CYS CA C 51 58.030 58.030 57.209 0.821 19694
7711 1 17 . 1 1 51 51 CYS CB C 51 30.090 30.090 31.409 -1.319 19694
7712 1 17 . 1 1 51 51 CYS H H 51 7.590 7.590 7.238 0.352 19694
7713 1 17 . 1 1 52 52 LYS N N 52 123.800 123.800 122.996 0.804 19694
7714 1 17 . 1 1 52 52 LYS HA H 52 4.180 4.180 4.259 -0.079 19694
7715 1 17 . 1 1 52 52 LYS CA C 52 57.240 57.240 56.517 0.723 19694
7716 1 17 . 1 1 52 52 LYS CB C 52 33.030 33.030 31.180 1.850 19694
7717 1 17 . 1 1 52 52 LYS H H 52 8.600 8.600 8.542 0.058 19694
7718 1 17 . 1 1 53 53 ASP N N 53 124.900 124.900 122.880 2.020 19694
7719 1 17 . 1 1 53 53 ASP HA H 53 4.230 4.230 4.706 -0.476 19694
7720 1 17 . 1 1 53 53 ASP CA C 53 53.130 53.130 52.964 0.166 19694
7721 1 17 . 1 1 53 53 ASP CB C 53 42.230 42.230 40.774 1.456 19694
7722 1 17 . 1 1 53 53 ASP H H 53 8.250 8.250 8.239 0.011 19694
7723 1 17 . 1 1 54 54 LEU N N 54 130.160 130.160 125.125 5.035 19694
7724 1 17 . 1 1 54 54 LEU HA H 54 4.440 4.440 4.534 -0.094 19694
7725 1 17 . 1 1 54 54 LEU CA C 54 53.340 53.340 55.511 -2.171 19694
7726 1 17 . 1 1 54 54 LEU CB C 54 41.170 41.170 42.787 -1.617 19694
7727 1 17 . 1 1 54 54 LEU H H 54 8.670 8.670 8.860 -0.190 19694
7728 1 17 . 1 1 55 55 SER N N 55 113.820 113.820 121.188 -7.368 19694
7729 1 17 . 1 1 55 55 SER HA H 55 5.580 5.580 5.063 0.517 19694
7730 1 17 . 1 1 55 55 SER CA C 55 55.850 55.850 56.617 -0.767 19694
7731 1 17 . 1 1 55 55 SER CB C 55 67.300 67.300 64.644 2.656 19694
7732 1 17 . 1 1 55 55 SER H H 55 8.160 8.160 8.398 -0.238 19694
7733 1 17 . 1 1 56 56 TYR N N 56 122.610 122.610 126.305 -3.695 19694
7734 1 17 . 1 1 56 56 TYR HA H 56 4.620 4.620 4.630 -0.010 19694
7735 1 17 . 1 1 56 56 TYR CA C 56 58.810 58.810 58.727 0.083 19694
7736 1 17 . 1 1 56 56 TYR CB C 56 41.000 41.000 41.777 -0.777 19694
7737 1 17 . 1 1 56 56 TYR H H 56 8.450 8.450 8.684 -0.234 19694
7738 1 17 . 1 1 57 57 LYS N N 57 126.020 126.020 129.074 -3.054 19694
7739 1 17 . 1 1 57 57 LYS HA H 57 3.470 3.470 3.914 -0.444 19694
7740 1 17 . 1 1 57 57 LYS CA C 57 58.100 58.100 57.127 0.973 19694
7741 1 17 . 1 1 57 57 LYS CB C 57 29.480 29.480 32.095 -2.615 19694
7742 1 17 . 1 1 57 57 LYS H H 57 8.920 8.920 8.575 0.345 19694
7743 1 17 . 1 1 58 58 ASP HA H 58 3.830 3.830 4.248 -0.418 19694
7744 1 17 . 1 1 58 58 ASP CA C 58 54.900 54.900 55.287 -0.387 19694
7745 1 17 . 1 1 58 58 ASP CB C 58 40.080 40.080 40.503 -0.423 19694
7746 1 17 . 1 1 58 58 ASP H H 58 8.400 8.400 8.632 -0.232 19694
7747 1 17 . 1 1 59 59 ARG N N 59 121.190 121.190 116.776 4.414 19694
7748 1 17 . 1 1 59 59 ARG HA H 59 4.250 4.250 4.400 -0.150 19694
7749 1 17 . 1 1 59 59 ARG CA C 59 55.580 55.580 54.174 1.406 19694
7750 1 17 . 1 1 59 59 ARG CB C 59 33.460 33.460 33.253 0.207 19694
7751 1 17 . 1 1 59 59 ARG H H 59 7.980 7.980 7.349 0.631 19694
7752 1 17 . 1 1 60 60 HIS N N 60 118.420 118.420 117.594 0.826 19694
7753 1 17 . 1 1 60 60 HIS HA H 60 5.270 5.270 5.628 -0.358 19694
7754 1 17 . 1 1 60 60 HIS CA C 60 55.010 55.010 55.183 -0.173 19694
7755 1 17 . 1 1 60 60 HIS CB C 60 32.380 32.380 33.409 -1.029 19694
7756 1 17 . 1 1 60 60 HIS H H 60 8.350 8.350 8.133 0.217 19694
7757 1 17 . 1 1 61 61 TRP N N 61 119.990 119.990 118.219 1.771 19694
7758 1 17 . 1 1 61 61 TRP HA H 61 5.930 5.930 4.782 1.148 19694
7759 1 17 . 1 1 61 61 TRP CA C 61 57.400 57.400 57.117 0.283 19694
7760 1 17 . 1 1 61 61 TRP CB C 61 35.380 35.380 34.208 1.172 19694
7761 1 17 . 1 1 61 61 TRP H H 61 9.310 9.310 9.229 0.081 19694
7762 1 17 . 1 1 62 62 HIS N N 62 117.270 117.270 121.039 -3.769 19694
7763 1 17 . 1 1 62 62 HIS HA H 62 4.600 4.600 5.019 -0.419 19694
7764 1 17 . 1 1 62 62 HIS CA C 62 59.210 59.210 56.789 2.421 19694
7765 1 17 . 1 1 62 62 HIS CB C 62 31.200 31.200 30.235 0.965 19694
7766 1 17 . 1 1 62 62 HIS H H 62 8.430 8.430 9.104 -0.674 19694
7767 1 17 . 1 1 63 63 GLU N N 63 124.640 124.640 128.583 -3.943 19694
7768 1 17 . 1 1 63 63 GLU HA H 63 3.827 3.827 3.949 -0.122 19694
7769 1 17 . 1 1 63 63 GLU CA C 63 61.020 61.020 59.844 1.176 19694
7770 1 17 . 1 1 63 63 GLU CB C 63 30.310 30.310 29.472 0.838 19694
7771 1 17 . 1 1 63 63 GLU H H 63 9.040 9.040 8.635 0.405 19694
7772 1 17 . 1 1 64 64 ALA N N 64 117.050 117.050 118.230 -1.180 19694
7773 1 17 . 1 1 64 64 ALA HA H 64 4.230 4.230 4.270 -0.040 19694
7774 1 17 . 1 1 64 64 ALA CA C 64 54.000 54.000 52.981 1.019 19694
7775 1 17 . 1 1 64 64 ALA CB C 64 18.880 18.880 18.928 -0.048 19694
7776 1 17 . 1 1 64 64 ALA H H 64 8.680 8.680 8.266 0.414 19694
7777 1 17 . 1 1 65 65 CYS N N 65 115.380 115.380 117.276 -1.896 19694
7778 1 17 . 1 1 65 65 CYS HA H 65 4.295 4.295 4.023 0.272 19694
7779 1 17 . 1 1 65 65 CYS CA C 65 59.850 59.850 60.154 -0.305 19694
7780 1 17 . 1 1 65 65 CYS CB C 65 32.840 32.840 27.133 5.707 19694
7781 1 17 . 1 1 65 65 CYS H H 65 7.490 7.490 8.190 -0.700 19694
7782 1 17 . 1 1 66 66 PHE N N 66 122.020 122.020 123.083 -1.063 19694
7783 1 17 . 1 1 66 66 PHE HA H 66 3.890 3.890 3.986 -0.096 19694
7784 1 17 . 1 1 66 66 PHE CA C 66 57.010 57.010 58.603 -1.593 19694
7785 1 17 . 1 1 66 66 PHE CB C 66 38.070 38.070 38.254 -0.184 19694
7786 1 17 . 1 1 66 66 PHE H H 66 7.110 7.110 7.578 -0.468 19694
7787 1 17 . 1 1 67 67 HIS N N 67 121.280 121.280 121.930 -0.650 19694
7788 1 17 . 1 1 67 67 HIS HA H 67 4.720 4.720 5.307 -0.587 19694
7789 1 17 . 1 1 67 67 HIS CA C 67 52.730 52.730 53.002 -0.272 19694
7790 1 17 . 1 1 67 67 HIS CB C 67 32.230 32.230 31.036 1.194 19694
7791 1 17 . 1 1 67 67 HIS H H 67 7.380 7.380 8.078 -0.698 19694
7792 1 17 . 1 1 68 68 CYS N N 68 121.590 121.590 119.155 2.435 19694
7793 1 17 . 1 1 68 68 CYS HA H 68 3.960 3.960 4.757 -0.797 19694
7794 1 17 . 1 1 68 68 CYS CA C 68 59.790 59.790 57.858 1.931 19694
7795 1 17 . 1 1 68 68 CYS CB C 68 31.200 31.200 29.194 2.006 19694
7796 1 17 . 1 1 68 68 CYS H H 68 8.530 8.530 8.413 0.117 19694
7797 1 17 . 1 1 69 69 SER N N 69 126.530 126.530 120.020 6.510 19694
7798 1 17 . 1 1 69 69 SER HA H 69 4.310 4.310 4.073 0.237 19694
7799 1 17 . 1 1 69 69 SER CA C 69 61.760 61.760 60.704 1.056 19694
7800 1 17 . 1 1 69 69 SER CB C 69 64.040 64.040 63.328 0.712 19694
7801 1 17 . 1 1 69 69 SER H H 69 9.460 9.460 8.754 0.706 19694
7802 1 17 . 1 1 70 70 GLN N N 70 122.370 122.370 118.561 3.809 19694
7803 1 17 . 1 1 70 70 GLN HA H 70 4.510 4.510 4.440 0.070 19694
7804 1 17 . 1 1 70 70 GLN CA C 70 57.840 57.840 57.311 0.529 19694
7805 1 17 . 1 1 70 70 GLN CB C 70 30.430 30.430 29.940 0.490 19694
7806 1 17 . 1 1 70 70 GLN H H 70 8.980 8.980 7.830 1.150 19694
7807 1 17 . 1 1 71 71 CYS N N 71 118.860 118.860 116.814 2.046 19694
7808 1 17 . 1 1 71 71 CYS HA H 71 4.720 4.720 4.683 0.037 19694
7809 1 17 . 1 1 71 71 CYS CA C 71 59.770 59.770 58.298 1.472 19694
7810 1 17 . 1 1 71 71 CYS CB C 71 31.910 31.910 27.972 3.938 19694
7811 1 17 . 1 1 71 71 CYS H H 71 8.220 8.220 7.746 0.474 19694
7812 1 17 . 1 1 72 72 ARG N N 72 114.380 114.380 115.425 -1.045 19694
7813 1 17 . 1 1 72 72 ARG HA H 72 3.965 3.965 3.873 0.092 19694
7814 1 17 . 1 1 72 72 ARG CA C 72 58.030 58.030 57.261 0.769 19694
7815 1 17 . 1 1 72 72 ARG CB C 72 27.720 27.720 27.426 0.294 19694
7816 1 17 . 1 1 72 72 ARG H H 72 7.380 7.380 7.733 -0.353 19694
7817 1 17 . 1 1 73 73 ASN N N 73 121.480 121.480 115.948 5.532 19694
7818 1 17 . 1 1 73 73 ASN HA H 73 4.630 4.630 4.711 -0.081 19694
7819 1 17 . 1 1 73 73 ASN CA C 73 54.110 54.110 53.904 0.206 19694
7820 1 17 . 1 1 73 73 ASN CB C 73 38.870 38.870 39.617 -0.747 19694
7821 1 17 . 1 1 73 73 ASN H H 73 8.722 8.722 8.089 0.633 19694
7822 1 17 . 1 1 74 74 SER N N 74 114.710 114.710 117.604 -2.894 19694
7823 1 17 . 1 1 74 74 SER HA H 74 4.060 4.060 4.885 -0.825 19694
7824 1 17 . 1 1 74 74 SER CA C 74 59.357 59.357 58.281 1.076 19694
7825 1 17 . 1 1 74 74 SER CB C 74 63.300 63.300 62.925 0.375 19694
7826 1 17 . 1 1 74 74 SER H H 74 8.690 8.690 8.490 0.200 19694
7827 1 17 . 1 1 75 75 LEU N N 75 125.757 125.757 127.610 -1.853 19694
7828 1 17 . 1 1 75 75 LEU HA H 75 4.280 4.280 4.286 -0.006 19694
7829 1 17 . 1 1 75 75 LEU CA C 75 53.510 53.510 54.907 -1.397 19694
7830 1 17 . 1 1 75 75 LEU CB C 75 42.200 42.200 41.743 0.457 19694
7831 1 17 . 1 1 75 75 LEU H H 75 7.970 7.970 8.068 -0.098 19694
7832 1 17 . 1 1 76 76 VAL N N 76 120.860 120.860 124.641 -3.781 19694
7833 1 17 . 1 1 76 76 VAL HA H 76 3.570 3.570 3.859 -0.289 19694
7834 1 17 . 1 1 76 76 VAL CA C 76 65.420 65.420 60.782 4.638 19694
7835 1 17 . 1 1 76 76 VAL CB C 76 31.540 31.540 34.947 -3.406 19694
7836 1 17 . 1 1 76 76 VAL H H 76 7.830 7.830 7.903 -0.073 19694
7837 1 17 . 1 1 77 77 ASP N N 77 122.360 122.360 123.113 -0.753 19694
7838 1 17 . 1 1 77 77 ASP HA H 77 4.230 4.230 4.551 -0.321 19694
7839 1 17 . 1 1 77 77 ASP CA C 77 56.200 56.200 55.846 0.354 19694
7840 1 17 . 1 1 77 77 ASP CB C 77 39.380 39.380 40.982 -1.602 19694
7841 1 17 . 1 1 77 77 ASP H H 77 8.910 8.910 8.333 0.577 19694
7842 1 17 . 1 1 78 78 LYS N N 78 118.100 118.100 118.217 -0.117 19694
7843 1 17 . 1 1 78 78 LYS HA H 78 4.870 4.870 4.684 0.186 19694
7844 1 17 . 1 1 78 78 LYS CA C 78 56.960 56.960 53.747 3.213 19694
7845 1 17 . 1 1 78 78 LYS CB C 78 34.680 34.680 33.589 1.091 19694
7846 1 17 . 1 1 78 78 LYS H H 78 7.660 7.660 7.675 -0.015 19694
7847 1 17 . 1 1 79 79 PRO HA H 79 4.460 4.460 4.231 0.229 19694
7848 1 17 . 1 1 79 79 PRO CA C 79 62.520 62.520 62.921 -0.401 19694
7849 1 17 . 1 1 79 79 PRO CB C 79 32.160 32.160 31.743 0.417 19694
7850 1 17 . 1 1 80 80 PHE N N 80 114.050 114.050 117.077 -3.027 19694
7851 1 17 . 1 1 80 80 PHE HA H 80 4.910 4.910 5.070 -0.160 19694
7852 1 17 . 1 1 80 80 PHE CA C 80 56.060 56.060 55.108 0.952 19694
7853 1 17 . 1 1 80 80 PHE CB C 80 42.410 42.410 41.922 0.488 19694
7854 1 17 . 1 1 80 80 PHE H H 80 7.510 7.510 7.183 0.327 19694
7855 1 17 . 1 1 81 81 ALA N N 81 123.290 123.290 123.708 -0.418 19694
7856 1 17 . 1 1 81 81 ALA HA H 81 4.310 4.310 4.346 -0.036 19694
7857 1 17 . 1 1 81 81 ALA CA C 81 50.450 50.450 50.357 0.093 19694
7858 1 17 . 1 1 81 81 ALA CB C 81 21.920 21.920 18.985 2.936 19694
7859 1 17 . 1 1 81 81 ALA H H 81 9.030 9.030 9.034 -0.004 19694
7860 1 17 . 1 1 82 82 ALA N N 82 122.490 122.490 128.350 -5.860 19694
7861 1 17 . 1 1 82 82 ALA HA H 82 5.110 5.110 4.379 0.731 19694
7862 1 17 . 1 1 82 82 ALA CA C 82 51.100 51.100 51.926 -0.826 19694
7863 1 17 . 1 1 82 82 ALA CB C 82 21.130 21.130 18.776 2.354 19694
7864 1 17 . 1 1 82 82 ALA H H 82 8.240 8.240 8.578 -0.338 19694
7865 1 17 . 1 1 83 83 LYS N N 83 123.580 123.580 125.665 -2.085 19694
7866 1 17 . 1 1 83 83 LYS HA H 83 4.490 4.490 4.482 0.008 19694
7867 1 17 . 1 1 83 83 LYS CA C 83 55.800 55.800 55.375 0.425 19694
7868 1 17 . 1 1 83 83 LYS CB C 83 34.720 34.720 34.095 0.625 19694
7869 1 17 . 1 1 83 83 LYS H H 83 8.400 8.400 8.312 0.088 19694
7870 1 17 . 1 1 84 84 GLU N N 84 125.470 125.470 120.032 5.438 19694
7871 1 17 . 1 1 84 84 GLU HA H 84 3.820 3.820 4.134 -0.314 19694
7872 1 17 . 1 1 84 84 GLU CA C 84 58.620 58.620 59.111 -0.492 19694
7873 1 17 . 1 1 84 84 GLU CB C 84 27.210 27.210 29.653 -2.443 19694
7874 1 17 . 1 1 84 84 GLU H H 84 9.320 9.320 8.631 0.689 19694
7875 1 17 . 1 1 85 85 ASP N N 85 118.550 118.550 114.501 4.049 19694
7876 1 17 . 1 1 85 85 ASP HA H 85 4.600 4.600 4.788 -0.188 19694
7877 1 17 . 1 1 85 85 ASP CA C 85 55.400 55.400 54.041 1.359 19694
7878 1 17 . 1 1 85 85 ASP CB C 85 40.400 40.400 41.932 -1.532 19694
7879 1 17 . 1 1 85 85 ASP H H 85 8.730 8.730 8.305 0.425 19694
7880 1 17 . 1 1 86 86 GLN N N 86 119.050 119.050 116.740 2.310 19694
7881 1 17 . 1 1 86 86 GLN HA H 86 4.540 4.540 4.663 -0.123 19694
7882 1 17 . 1 1 86 86 GLN CA C 86 55.100 55.100 53.883 1.217 19694
7883 1 17 . 1 1 86 86 GLN CB C 86 31.110 31.110 31.850 -0.740 19694
7884 1 17 . 1 1 86 86 GLN H H 86 8.170 8.170 7.586 0.584 19694
7885 1 17 . 1 1 87 87 LEU N N 87 123.110 123.110 121.296 1.814 19694
7886 1 17 . 1 1 87 87 LEU HA H 87 4.620 4.620 5.212 -0.592 19694
7887 1 17 . 1 1 87 87 LEU CA C 87 54.520 54.520 53.987 0.533 19694
7888 1 17 . 1 1 87 87 LEU CB C 87 42.700 42.700 44.650 -1.950 19694
7889 1 17 . 1 1 87 87 LEU H H 87 8.490 8.490 8.475 0.015 19694
7890 1 17 . 1 1 88 88 LEU N N 88 123.690 123.690 120.111 3.579 19694
7891 1 17 . 1 1 88 88 LEU HA H 88 5.880 5.880 4.937 0.943 19694
7892 1 17 . 1 1 88 88 LEU CA C 88 53.340 53.340 52.807 0.533 19694
7893 1 17 . 1 1 88 88 LEU CB C 88 47.190 47.190 47.816 -0.626 19694
7894 1 17 . 1 1 88 88 LEU H H 88 8.930 8.930 8.338 0.592 19694
7895 1 17 . 1 1 89 89 CYS N N 89 122.270 122.270 118.552 3.718 19694
7896 1 17 . 1 1 89 89 CYS HA H 89 4.780 4.780 4.769 0.011 19694
7897 1 17 . 1 1 89 89 CYS CA C 89 57.640 57.640 59.029 -1.389 19694
7898 1 17 . 1 1 89 89 CYS CB C 89 30.940 30.940 27.670 3.270 19694
7899 1 17 . 1 1 89 89 CYS H H 89 9.430 9.430 9.089 0.341 19694
7900 1 17 . 1 1 90 90 THR N N 90 110.620 110.620 116.716 -6.096 19694
7901 1 17 . 1 1 90 90 THR HA H 90 3.900 3.900 3.989 -0.089 19694
7902 1 17 . 1 1 90 90 THR CA C 90 65.460 65.460 65.811 -0.351 19694
7903 1 17 . 1 1 90 90 THR CB C 90 68.670 68.670 68.947 -0.277 19694
7904 1 17 . 1 1 90 90 THR H H 90 8.410 8.410 9.012 -0.602 19694
7905 1 17 . 1 1 91 91 ASP N N 91 123.470 123.470 120.960 2.510 19694
7906 1 17 . 1 1 91 91 ASP HA H 91 4.490 4.490 4.651 -0.161 19694
7907 1 17 . 1 1 91 91 ASP CA C 91 57.810 57.810 57.334 0.477 19694
7908 1 17 . 1 1 91 91 ASP CB C 91 41.160 41.160 40.723 0.437 19694
7909 1 17 . 1 1 91 91 ASP H H 91 8.150 8.150 8.421 -0.271 19694
7910 1 17 . 1 1 92 92 CYS N N 92 123.800 123.800 119.589 4.211 19694
7911 1 17 . 1 1 92 92 CYS HA H 92 3.970 3.970 4.377 -0.407 19694
7912 1 17 . 1 1 92 92 CYS CA C 92 64.100 64.100 61.315 2.785 19694
7913 1 17 . 1 1 92 92 CYS CB C 92 30.090 30.090 26.314 3.776 19694
7914 1 17 . 1 1 92 92 CYS H H 92 8.580 8.580 7.917 0.663 19694
7915 1 17 . 1 1 93 93 TYR N N 93 120.730 120.730 120.982 -0.252 19694
7916 1 17 . 1 1 93 93 TYR HA H 93 4.140 4.140 4.090 0.050 19694
7917 1 17 . 1 1 93 93 TYR CA C 93 60.380 60.380 61.624 -1.244 19694
7918 1 17 . 1 1 93 93 TYR CB C 93 39.300 39.300 38.461 0.840 19694
7919 1 17 . 1 1 93 93 TYR H H 93 8.540 8.540 9.162 -0.622 19694
7920 1 17 . 1 1 94 94 SER N N 94 115.010 115.010 113.167 1.843 19694
7921 1 17 . 1 1 94 94 SER HA H 94 4.220 4.220 4.231 -0.011 19694
7922 1 17 . 1 1 94 94 SER CA C 94 59.300 59.300 61.672 -2.372 19694
7923 1 17 . 1 1 94 94 SER CB C 94 63.660 63.660 62.487 1.173 19694
7924 1 17 . 1 1 94 94 SER H H 94 7.750 7.750 8.099 -0.349 19694
7925 1 17 . 1 1 95 95 ASN N N 95 119.820 119.820 119.432 0.388 19694
7926 1 17 . 1 1 95 95 ASN HA H 95 4.510 4.510 4.586 -0.076 19694
7927 1 17 . 1 1 95 95 ASN CA C 95 53.880 53.880 55.572 -1.692 19694
7928 1 17 . 1 1 95 95 ASN CB C 95 39.300 39.300 39.047 0.253 19694
7929 1 17 . 1 1 95 95 ASN H H 95 7.780 7.780 7.782 -0.002 19694
7930 1 17 . 1 1 96 96 GLU N N 96 119.820 119.820 117.063 2.757 19694
7931 1 17 . 1 1 96 96 GLU HA H 96 4.096 4.096 4.169 -0.073 19694
7932 1 17 . 1 1 96 96 GLU CA C 96 56.910 56.910 56.926 -0.016 19694
7933 1 17 . 1 1 96 96 GLU CB C 96 30.220 30.220 29.659 0.561 19694
7934 1 17 . 1 1 96 96 GLU H H 96 7.950 7.950 7.738 0.212 19694
7935 1 17 . 1 1 97 97 TYR N N 97 120.370 120.370 120.623 -0.253 19694
7936 1 17 . 1 1 97 97 TYR HA H 97 4.620 4.620 4.065 0.555 19694
7937 1 17 . 1 1 97 97 TYR CA C 97 57.700 57.700 59.372 -1.672 19694
7938 1 17 . 1 1 97 97 TYR CB C 97 38.710 38.710 38.410 0.299 19694
7939 1 17 . 1 1 97 97 TYR H H 97 8.070 8.070 8.530 -0.460 19694
7940 1 18 . 1 1 2 2 THR N N 2 113.570 113.570 116.073 -2.503 19694
7941 1 18 . 1 1 2 2 THR HA H 2 4.240 4.240 4.548 -0.308 19694
7942 1 18 . 1 1 2 2 THR CA C 2 62.130 62.130 62.984 -0.854 19694
7943 1 18 . 1 1 2 2 THR CB C 2 69.250 69.250 69.230 0.020 19694
7944 1 18 . 1 1 2 2 THR H H 2 8.090 8.090 8.280 -0.190 19694
7945 1 18 . 1 1 3 3 GLU N N 3 122.880 122.880 121.225 1.655 19694
7946 1 18 . 1 1 3 3 GLU HA H 3 4.280 4.280 4.396 -0.116 19694
7947 1 18 . 1 1 3 3 GLU CA C 3 56.860 56.860 55.673 1.187 19694
7948 1 18 . 1 1 3 3 GLU CB C 3 30.570 30.570 30.526 0.044 19694
7949 1 18 . 1 1 3 3 GLU H H 3 8.280 8.280 8.007 0.273 19694
7950 1 18 . 1 1 4 4 ARG N N 4 121.330 121.330 119.293 2.037 19694
7951 1 18 . 1 1 4 4 ARG HA H 4 4.300 4.300 4.590 -0.290 19694
7952 1 18 . 1 1 4 4 ARG CA C 4 55.870 55.870 55.078 0.792 19694
7953 1 18 . 1 1 4 4 ARG CB C 4 31.640 31.640 30.895 0.745 19694
7954 1 18 . 1 1 4 4 ARG H H 4 8.280 8.280 8.528 -0.248 19694
7955 1 18 . 1 1 5 5 PHE N N 5 125.490 125.490 123.969 1.521 19694
7956 1 18 . 1 1 5 5 PHE HA H 5 4.610 4.610 4.598 0.012 19694
7957 1 18 . 1 1 5 5 PHE CA C 5 56.380 56.380 56.373 0.007 19694
7958 1 18 . 1 1 5 5 PHE CB C 5 39.560 39.560 39.657 -0.097 19694
7959 1 18 . 1 1 5 5 PHE H H 5 8.290 8.290 8.724 -0.434 19694
7960 1 18 . 1 1 6 6 ASP N N 6 123.260 123.260 121.809 1.451 19694
7961 1 18 . 1 1 6 6 ASP HA H 6 5.045 5.045 4.783 0.262 19694
7962 1 18 . 1 1 6 6 ASP CA C 6 52.180 52.180 52.897 -0.717 19694
7963 1 18 . 1 1 6 6 ASP CB C 6 44.210 44.210 44.511 -0.301 19694
7964 1 18 . 1 1 6 6 ASP H H 6 7.940 7.940 7.610 0.330 19694
7965 1 18 . 1 1 7 7 CYS N N 7 121.440 121.440 122.914 -1.474 19694
7966 1 18 . 1 1 7 7 CYS HA H 7 3.960 3.960 4.442 -0.482 19694
7967 1 18 . 1 1 7 7 CYS CA C 7 59.820 59.820 59.510 0.310 19694
7968 1 18 . 1 1 7 7 CYS CB C 7 30.950 30.950 26.133 4.817 19694
7969 1 18 . 1 1 7 7 CYS H H 7 8.700 8.700 8.594 0.106 19694
7970 1 18 . 1 1 8 8 HIS N N 8 129.390 129.390 129.491 -0.101 19694
7971 1 18 . 1 1 8 8 HIS HA H 8 4.200 4.200 4.206 -0.006 19694
7972 1 18 . 1 1 8 8 HIS CA C 8 58.240 58.240 59.642 -1.402 19694
7973 1 18 . 1 1 8 8 HIS CB C 8 29.480 29.480 30.130 -0.649 19694
7974 1 18 . 1 1 8 8 HIS H H 8 9.160 9.160 9.577 -0.417 19694
7975 1 18 . 1 1 9 9 HIS N N 9 118.740 118.740 116.907 1.833 19694
7976 1 18 . 1 1 9 9 HIS HA H 9 4.880 4.880 4.566 0.314 19694
7977 1 18 . 1 1 9 9 HIS CA C 9 58.680 58.680 57.105 1.575 19694
7978 1 18 . 1 1 9 9 HIS CB C 9 31.040 31.040 30.304 0.736 19694
7979 1 18 . 1 1 9 9 HIS H H 9 9.270 9.270 8.068 1.202 19694
7980 1 18 . 1 1 10 10 CYS N N 10 118.600 118.600 117.144 1.456 19694
7981 1 18 . 1 1 10 10 CYS HA H 10 4.600 4.600 4.422 0.178 19694
7982 1 18 . 1 1 10 10 CYS CA C 10 59.600 59.600 59.047 0.553 19694
7983 1 18 . 1 1 10 10 CYS CB C 10 32.330 32.330 27.791 4.539 19694
7984 1 18 . 1 1 10 10 CYS H H 10 8.550 8.550 7.821 0.729 19694
7985 1 18 . 1 1 11 11 ASN N N 11 116.220 116.220 118.068 -1.848 19694
7986 1 18 . 1 1 11 11 ASN HA H 11 4.410 4.410 4.383 0.026 19694
7987 1 18 . 1 1 11 11 ASN CA C 11 55.640 55.640 54.432 1.208 19694
7988 1 18 . 1 1 11 11 ASN CB C 11 38.200 38.200 37.258 0.943 19694
7989 1 18 . 1 1 11 11 ASN H H 11 7.690 7.690 8.658 -0.968 19694
7990 1 18 . 1 1 12 12 GLU N N 12 120.330 120.330 116.873 3.457 19694
7991 1 18 . 1 1 12 12 GLU HA H 12 4.220 4.220 4.497 -0.277 19694
7992 1 18 . 1 1 12 12 GLU CA C 12 56.700 56.700 55.081 1.619 19694
7993 1 18 . 1 1 12 12 GLU CB C 12 30.910 30.910 30.610 0.300 19694
7994 1 18 . 1 1 12 12 GLU H H 12 8.210 8.210 7.700 0.510 19694
7995 1 18 . 1 1 13 13 SER N N 13 116.190 116.190 119.895 -3.705 19694
7996 1 18 . 1 1 13 13 SER HA H 13 4.060 4.060 4.498 -0.438 19694
7997 1 18 . 1 1 13 13 SER CA C 13 59.350 59.350 58.449 0.901 19694
7998 1 18 . 1 1 13 13 SER CB C 13 63.820 63.820 63.607 0.213 19694
7999 1 18 . 1 1 13 13 SER H H 13 8.520 8.520 8.669 -0.149 19694
8000 1 18 . 1 1 14 14 LEU N N 14 126.060 126.060 126.469 -0.409 19694
8001 1 18 . 1 1 14 14 LEU HA H 14 4.310 4.310 4.350 -0.040 19694
8002 1 18 . 1 1 14 14 LEU CA C 14 54.100 54.100 55.883 -1.782 19694
8003 1 18 . 1 1 14 14 LEU CB C 14 42.200 42.200 41.702 0.498 19694
8004 1 18 . 1 1 14 14 LEU H H 14 8.910 8.910 7.737 1.173 19694
8005 1 18 . 1 1 15 15 PHE N N 15 120.660 120.660 120.915 -0.255 19694
8006 1 18 . 1 1 15 15 PHE HA H 15 4.480 4.480 4.609 -0.129 19694
8007 1 18 . 1 1 15 15 PHE CA C 15 60.400 60.400 56.139 4.261 19694
8008 1 18 . 1 1 15 15 PHE CB C 15 38.130 38.130 37.977 0.153 19694
8009 1 18 . 1 1 15 15 PHE H H 15 7.820 7.820 8.510 -0.690 19694
8010 1 18 . 1 1 16 16 GLY N N 16 114.730 114.730 110.925 3.805 19694
8011 1 18 . 1 1 16 16 GLY CA C 16 45.900 45.900 45.812 0.088 19694
8012 1 18 . 1 1 16 16 GLY H H 16 8.860 8.860 8.803 0.057 19694
8013 1 18 . 1 1 17 17 LYS N N 17 119.580 119.580 119.813 -0.233 19694
8014 1 18 . 1 1 17 17 LYS HA H 17 4.480 4.480 4.475 0.005 19694
8015 1 18 . 1 1 17 17 LYS CA C 17 54.460 54.460 54.548 -0.088 19694
8016 1 18 . 1 1 17 17 LYS CB C 17 35.800 35.800 33.995 1.805 19694
8017 1 18 . 1 1 17 17 LYS H H 17 8.030 8.030 7.260 0.770 19694
8018 1 18 . 1 1 18 18 LYS N N 18 120.330 120.330 122.046 -1.716 19694
8019 1 18 . 1 1 18 18 LYS HA H 18 4.280 4.280 4.332 -0.052 19694
8020 1 18 . 1 1 18 18 LYS CA C 18 56.800 56.800 57.539 -0.739 19694
8021 1 18 . 1 1 18 18 LYS CB C 18 33.010 33.010 33.047 -0.037 19694
8022 1 18 . 1 1 18 18 LYS H H 18 8.190 8.190 8.545 -0.355 19694
8023 1 18 . 1 1 19 19 TYR N N 19 117.500 117.500 114.409 3.091 19694
8024 1 18 . 1 1 19 19 TYR HA H 19 5.240 5.240 4.790 0.450 19694
8025 1 18 . 1 1 19 19 TYR CA C 19 55.340 55.340 56.403 -1.063 19694
8026 1 18 . 1 1 19 19 TYR CB C 19 42.850 42.850 40.233 2.617 19694
8027 1 18 . 1 1 19 19 TYR H H 19 7.610 7.610 7.894 -0.284 19694
8028 1 18 . 1 1 20 20 ILE N N 20 121.430 121.430 121.909 -0.479 19694
8029 1 18 . 1 1 20 20 ILE HA H 20 4.137 4.137 4.253 -0.116 19694
8030 1 18 . 1 1 20 20 ILE CA C 20 60.010 60.010 60.142 -0.133 19694
8031 1 18 . 1 1 20 20 ILE CB C 20 41.570 41.570 40.498 1.073 19694
8032 1 18 . 1 1 20 20 ILE H H 20 9.350 9.350 8.236 1.114 19694
8033 1 18 . 1 1 21 21 LEU N N 21 126.720 126.720 126.098 0.622 19694
8034 1 18 . 1 1 21 21 LEU HA H 21 5.090 5.090 4.772 0.318 19694
8035 1 18 . 1 1 21 21 LEU CA C 21 54.020 54.020 53.921 0.099 19694
8036 1 18 . 1 1 21 21 LEU CB C 21 43.720 43.720 40.861 2.859 19694
8037 1 18 . 1 1 21 21 LEU H H 21 8.530 8.530 8.508 0.022 19694
8038 1 18 . 1 1 22 22 ARG N N 22 123.930 123.930 125.516 -1.586 19694
8039 1 18 . 1 1 22 22 ARG HA H 22 4.440 4.440 4.517 -0.077 19694
8040 1 18 . 1 1 22 22 ARG CA C 22 55.600 55.600 54.160 1.440 19694
8041 1 18 . 1 1 22 22 ARG CB C 22 32.280 32.280 32.543 -0.263 19694
8042 1 18 . 1 1 22 22 ARG H H 22 9.080 9.080 8.858 0.222 19694
8043 1 18 . 1 1 23 23 GLU N N 23 128.500 128.500 124.784 3.716 19694
8044 1 18 . 1 1 23 23 GLU HA H 23 3.840 3.840 3.938 -0.098 19694
8045 1 18 . 1 1 23 23 GLU CA C 23 58.030 58.030 57.710 0.320 19694
8046 1 18 . 1 1 23 23 GLU CB C 23 27.200 27.200 27.846 -0.646 19694
8047 1 18 . 1 1 23 23 GLU H H 23 9.610 9.610 8.994 0.616 19694
8048 1 18 . 1 1 24 24 GLU N N 24 110.300 110.300 113.398 -3.098 19694
8049 1 18 . 1 1 24 24 GLU HA H 24 3.780 3.780 3.938 -0.158 19694
8050 1 18 . 1 1 24 24 GLU CA C 24 58.320 58.320 57.219 1.101 19694
8051 1 18 . 1 1 24 24 GLU CB C 24 28.220 28.220 28.198 0.022 19694
8052 1 18 . 1 1 24 24 GLU H H 24 8.660 8.660 8.656 0.004 19694
8053 1 18 . 1 1 25 25 SER N N 25 117.700 117.700 113.119 4.581 19694
8054 1 18 . 1 1 25 25 SER HA H 25 4.890 4.890 4.818 0.072 19694
8055 1 18 . 1 1 25 25 SER CA C 25 56.540 56.540 55.446 1.094 19694
8056 1 18 . 1 1 25 25 SER CB C 25 64.720 64.720 64.993 -0.273 19694
8057 1 18 . 1 1 25 25 SER H H 25 7.900 7.900 7.707 0.193 19694
8058 1 18 . 1 1 26 26 PRO HA H 26 4.995 4.995 4.842 0.153 19694
8059 1 18 . 1 1 26 26 PRO CA C 26 61.750 61.750 63.024 -1.274 19694
8060 1 18 . 1 1 26 26 PRO CB C 26 32.660 32.660 31.694 0.966 19694
8061 1 18 . 1 1 27 27 TYR N N 27 118.100 118.100 123.617 -5.517 19694
8062 1 18 . 1 1 27 27 TYR HA H 27 5.910 5.910 4.979 0.931 19694
8063 1 18 . 1 1 27 27 TYR CA C 27 56.830 56.830 54.846 1.984 19694
8064 1 18 . 1 1 27 27 TYR CB C 27 42.810 42.810 42.539 0.271 19694
8065 1 18 . 1 1 27 27 TYR H H 27 9.040 9.040 8.690 0.350 19694
8066 1 18 . 1 1 28 28 CYS N N 28 122.230 122.230 119.436 2.794 19694
8067 1 18 . 1 1 28 28 CYS HA H 28 4.850 4.850 4.677 0.173 19694
8068 1 18 . 1 1 28 28 CYS CA C 28 58.110 58.110 58.411 -0.301 19694
8069 1 18 . 1 1 28 28 CYS CB C 28 30.530 30.530 29.227 1.303 19694
8070 1 18 . 1 1 28 28 CYS H H 28 9.850 9.850 8.374 1.476 19694
8071 1 18 . 1 1 29 29 VAL N N 29 118.200 118.200 122.732 -4.532 19694
8072 1 18 . 1 1 29 29 VAL HA H 29 3.650 3.650 3.687 -0.037 19694
8073 1 18 . 1 1 29 29 VAL CA C 29 67.400 67.400 66.542 0.858 19694
8074 1 18 . 1 1 29 29 VAL CB C 29 31.860 31.860 31.024 0.836 19694
8075 1 18 . 1 1 29 29 VAL H H 29 8.430 8.430 9.062 -0.632 19694
8076 1 18 . 1 1 30 30 VAL N N 30 119.570 119.570 119.073 0.497 19694
8077 1 18 . 1 1 30 30 VAL HA H 30 3.860 3.860 3.564 0.296 19694
8078 1 18 . 1 1 30 30 VAL CA C 30 66.450 66.450 66.164 0.286 19694
8079 1 18 . 1 1 30 30 VAL CB C 30 31.540 31.540 31.108 0.433 19694
8080 1 18 . 1 1 30 30 VAL H H 30 7.700 7.700 8.250 -0.550 19694
8081 1 18 . 1 1 31 31 CYS N N 31 125.890 125.890 119.232 6.658 19694
8082 1 18 . 1 1 31 31 CYS HA H 31 3.830 3.830 3.888 -0.058 19694
8083 1 18 . 1 1 31 31 CYS CA C 31 65.850 65.850 64.249 1.601 19694
8084 1 18 . 1 1 31 31 CYS CB C 31 29.510 29.510 25.484 4.026 19694
8085 1 18 . 1 1 31 31 CYS H H 31 9.050 9.050 7.676 1.374 19694
8086 1 18 . 1 1 32 32 PHE N N 32 119.000 119.000 119.289 -0.289 19694
8087 1 18 . 1 1 32 32 PHE HA H 32 3.780 3.780 3.661 0.119 19694
8088 1 18 . 1 1 32 32 PHE CA C 32 62.610 62.610 61.758 0.852 19694
8089 1 18 . 1 1 32 32 PHE CB C 32 39.920 39.920 39.025 0.895 19694
8090 1 18 . 1 1 32 32 PHE H H 32 9.080 9.080 7.871 1.209 19694
8091 1 18 . 1 1 33 33 GLU N N 33 117.470 117.470 118.163 -0.693 19694
8092 1 18 . 1 1 33 33 GLU HA H 33 3.760 3.760 4.040 -0.280 19694
8093 1 18 . 1 1 33 33 GLU CA C 33 59.210 59.210 59.399 -0.189 19694
8094 1 18 . 1 1 33 33 GLU CB C 33 29.480 29.480 29.222 0.258 19694
8095 1 18 . 1 1 33 33 GLU H H 33 8.510 8.510 8.210 0.300 19694
8096 1 18 . 1 1 34 34 THR N N 34 114.140 114.140 115.422 -1.282 19694
8097 1 18 . 1 1 34 34 THR HA H 34 3.730 3.730 3.896 -0.166 19694
8098 1 18 . 1 1 34 34 THR CA C 34 65.890 65.890 66.081 -0.191 19694
8099 1 18 . 1 1 34 34 THR CB C 34 69.210 69.210 68.729 0.481 19694
8100 1 18 . 1 1 34 34 THR H H 34 7.880 7.880 8.287 -0.407 19694
8101 1 18 . 1 1 35 35 LEU N N 35 117.980 117.980 119.037 -1.057 19694
8102 1 18 . 1 1 35 35 LEU HA H 35 3.650 3.650 3.894 -0.244 19694
8103 1 18 . 1 1 35 35 LEU CA C 35 56.860 56.860 57.254 -0.394 19694
8104 1 18 . 1 1 35 35 LEU CB C 35 41.870 41.870 41.739 0.131 19694
8105 1 18 . 1 1 35 35 LEU H H 35 7.660 7.660 7.955 -0.295 19694
8106 1 18 . 1 1 36 36 PHE N N 36 113.900 113.900 113.790 0.110 19694
8107 1 18 . 1 1 36 36 PHE HA H 36 4.597 4.597 4.576 0.021 19694
8108 1 18 . 1 1 36 36 PHE CA C 36 56.860 56.860 55.923 0.937 19694
8109 1 18 . 1 1 36 36 PHE CB C 36 40.570 40.570 37.653 2.917 19694
8110 1 18 . 1 1 36 36 PHE H H 36 7.730 7.730 6.765 0.965 19694
8111 1 18 . 1 1 37 37 ALA N N 37 121.920 121.920 123.650 -1.730 19694
8112 1 18 . 1 1 37 37 ALA HA H 37 4.070 4.070 4.078 -0.008 19694
8113 1 18 . 1 1 37 37 ALA CA C 37 52.900 52.900 52.416 0.484 19694
8114 1 18 . 1 1 37 37 ALA CB C 37 19.770 19.770 19.593 0.177 19694
8115 1 18 . 1 1 37 37 ALA H H 37 7.090 7.090 7.883 -0.793 19694
8116 1 18 . 1 1 38 38 ASN N N 38 119.230 119.230 118.748 0.482 19694
8117 1 18 . 1 1 38 38 ASN HA H 38 4.450 4.450 4.686 -0.236 19694
8118 1 18 . 1 1 38 38 ASN CA C 38 52.850 52.850 52.631 0.219 19694
8119 1 18 . 1 1 38 38 ASN CB C 38 38.950 38.950 39.633 -0.683 19694
8120 1 18 . 1 1 38 38 ASN H H 38 8.790 8.790 8.208 0.582 19694
8121 1 18 . 1 1 39 39 THR N N 39 116.330 116.330 116.039 0.291 19694
8122 1 18 . 1 1 39 39 THR HA H 39 3.990 3.990 4.333 -0.343 19694
8123 1 18 . 1 1 39 39 THR CA C 39 62.130 62.130 62.334 -0.204 19694
8124 1 18 . 1 1 39 39 THR CB C 39 69.920 69.920 69.643 0.277 19694
8125 1 18 . 1 1 39 39 THR H H 39 8.540 8.540 8.198 0.342 19694
8126 1 18 . 1 1 40 40 CYS N N 40 126.950 126.950 127.915 -0.965 19694
8127 1 18 . 1 1 40 40 CYS HA H 40 4.300 4.300 4.429 -0.129 19694
8128 1 18 . 1 1 40 40 CYS CA C 40 58.350 58.350 57.116 1.234 19694
8129 1 18 . 1 1 40 40 CYS CB C 40 31.600 31.600 26.751 4.849 19694
8130 1 18 . 1 1 40 40 CYS H H 40 7.940 7.940 8.426 -0.486 19694
8131 1 18 . 1 1 41 41 GLU N N 41 130.560 130.560 127.524 3.036 19694
8132 1 18 . 1 1 41 41 GLU HA H 41 3.690 3.690 3.844 -0.154 19694
8133 1 18 . 1 1 41 41 GLU CA C 41 58.600 58.600 59.107 -0.507 19694
8134 1 18 . 1 1 41 41 GLU CB C 41 30.460 30.460 29.428 1.032 19694
8135 1 18 . 1 1 41 41 GLU H H 41 8.810 8.810 8.670 0.140 19694
8136 1 18 . 1 1 42 42 GLU N N 42 119.680 119.680 118.464 1.216 19694
8137 1 18 . 1 1 42 42 GLU HA H 42 4.570 4.570 4.329 0.241 19694
8138 1 18 . 1 1 42 42 GLU CA C 42 58.000 58.000 58.088 -0.088 19694
8139 1 18 . 1 1 42 42 GLU CB C 42 31.680 31.680 30.540 1.140 19694
8140 1 18 . 1 1 42 42 GLU H H 42 8.500 8.500 8.083 0.417 19694
8141 1 18 . 1 1 43 43 CYS N N 43 115.600 115.600 116.322 -0.722 19694
8142 1 18 . 1 1 43 43 CYS HA H 43 5.010 5.010 4.610 0.400 19694
8143 1 18 . 1 1 43 43 CYS CA C 43 58.810 58.810 60.108 -1.298 19694
8144 1 18 . 1 1 43 43 CYS CB C 43 31.580 31.580 29.030 2.550 19694
8145 1 18 . 1 1 43 43 CYS H H 43 8.120 8.120 8.022 0.098 19694
8146 1 18 . 1 1 44 44 GLY N N 44 112.100 112.100 106.841 5.259 19694
8147 1 18 . 1 1 44 44 GLY CA C 44 46.420 46.420 45.371 1.049 19694
8148 1 18 . 1 1 44 44 GLY H H 44 7.900 7.900 8.550 -0.650 19694
8149 1 18 . 1 1 45 45 LYS N N 45 121.210 121.210 121.941 -0.731 19694
8150 1 18 . 1 1 45 45 LYS HA H 45 4.840 4.840 4.648 0.192 19694
8151 1 18 . 1 1 45 45 LYS CA C 45 54.360 54.360 52.940 1.421 19694
8152 1 18 . 1 1 45 45 LYS CB C 45 32.430 32.430 32.933 -0.503 19694
8153 1 18 . 1 1 45 45 LYS H H 45 8.180 8.180 7.860 0.320 19694
8154 1 18 . 1 1 46 46 PRO HA H 46 4.477 4.477 4.584 -0.107 19694
8155 1 18 . 1 1 46 46 PRO CA C 46 62.700 62.700 63.020 -0.320 19694
8156 1 18 . 1 1 46 46 PRO CB C 46 32.490 32.490 32.085 0.405 19694
8157 1 18 . 1 1 47 47 ILE N N 47 125.280 125.280 123.140 2.140 19694
8158 1 18 . 1 1 47 47 ILE HA H 47 3.830 3.830 4.299 -0.469 19694
8159 1 18 . 1 1 47 47 ILE CA C 47 61.040 61.040 60.671 0.369 19694
8160 1 18 . 1 1 47 47 ILE CB C 47 37.440 37.440 37.654 -0.214 19694
8161 1 18 . 1 1 47 47 ILE H H 47 8.540 8.540 8.882 -0.342 19694
8162 1 18 . 1 1 48 48 GLY N N 48 114.120 114.120 114.320 -0.200 19694
8163 1 18 . 1 1 48 48 GLY CA C 48 45.240 45.240 44.716 0.524 19694
8164 1 18 . 1 1 48 48 GLY H H 48 8.660 8.660 8.554 0.106 19694
8165 1 18 . 1 1 49 49 CYS N N 49 117.140 117.140 118.294 -1.154 19694
8166 1 18 . 1 1 49 49 CYS HA H 49 4.280 4.280 4.410 -0.130 19694
8167 1 18 . 1 1 49 49 CYS CA C 49 60.880 60.880 58.786 2.094 19694
8168 1 18 . 1 1 49 49 CYS CB C 49 27.650 27.650 27.589 0.061 19694
8169 1 18 . 1 1 49 49 CYS H H 49 9.210 9.210 8.946 0.264 19694
8170 1 18 . 1 1 50 50 ASP N N 50 119.300 119.300 121.111 -1.811 19694
8171 1 18 . 1 1 50 50 ASP HA H 50 4.620 4.620 4.623 -0.003 19694
8172 1 18 . 1 1 50 50 ASP CA C 50 54.160 54.160 55.148 -0.988 19694
8173 1 18 . 1 1 50 50 ASP CB C 50 40.380 40.380 40.229 0.151 19694
8174 1 18 . 1 1 50 50 ASP H H 50 8.800 8.800 8.587 0.213 19694
8175 1 18 . 1 1 51 51 CYS N N 51 118.150 118.150 116.882 1.268 19694
8176 1 18 . 1 1 51 51 CYS HA H 51 4.620 4.620 4.693 -0.073 19694
8177 1 18 . 1 1 51 51 CYS CA C 51 58.030 58.030 56.986 1.044 19694
8178 1 18 . 1 1 51 51 CYS CB C 51 30.090 30.090 31.676 -1.586 19694
8179 1 18 . 1 1 51 51 CYS H H 51 7.590 7.590 7.086 0.504 19694
8180 1 18 . 1 1 52 52 LYS N N 52 123.800 123.800 122.551 1.249 19694
8181 1 18 . 1 1 52 52 LYS HA H 52 4.180 4.180 4.355 -0.175 19694
8182 1 18 . 1 1 52 52 LYS CA C 52 57.240 57.240 56.110 1.130 19694
8183 1 18 . 1 1 52 52 LYS CB C 52 33.030 33.030 30.588 2.442 19694
8184 1 18 . 1 1 52 52 LYS H H 52 8.600 8.600 8.463 0.137 19694
8185 1 18 . 1 1 53 53 ASP N N 53 124.900 124.900 123.756 1.144 19694
8186 1 18 . 1 1 53 53 ASP HA H 53 4.230 4.230 4.744 -0.514 19694
8187 1 18 . 1 1 53 53 ASP CA C 53 53.130 53.130 52.637 0.493 19694
8188 1 18 . 1 1 53 53 ASP CB C 53 42.230 42.230 40.774 1.456 19694
8189 1 18 . 1 1 53 53 ASP H H 53 8.250 8.250 8.350 -0.100 19694
8190 1 18 . 1 1 54 54 LEU N N 54 130.160 130.160 124.725 5.435 19694
8191 1 18 . 1 1 54 54 LEU HA H 54 4.440 4.440 4.594 -0.154 19694
8192 1 18 . 1 1 54 54 LEU CA C 54 53.340 53.340 55.097 -1.757 19694
8193 1 18 . 1 1 54 54 LEU CB C 54 41.170 41.170 43.203 -2.033 19694
8194 1 18 . 1 1 54 54 LEU H H 54 8.670 8.670 9.011 -0.341 19694
8195 1 18 . 1 1 55 55 SER N N 55 113.820 113.820 121.963 -8.143 19694
8196 1 18 . 1 1 55 55 SER HA H 55 5.580 5.580 5.285 0.295 19694
8197 1 18 . 1 1 55 55 SER CA C 55 55.850 55.850 57.328 -1.478 19694
8198 1 18 . 1 1 55 55 SER CB C 55 67.300 67.300 64.631 2.669 19694
8199 1 18 . 1 1 55 55 SER H H 55 8.160 8.160 8.627 -0.467 19694
8200 1 18 . 1 1 56 56 TYR N N 56 122.610 122.610 124.776 -2.166 19694
8201 1 18 . 1 1 56 56 TYR HA H 56 4.620 4.620 4.652 -0.032 19694
8202 1 18 . 1 1 56 56 TYR CA C 56 58.810 58.810 58.527 0.283 19694
8203 1 18 . 1 1 56 56 TYR CB C 56 41.000 41.000 42.822 -1.822 19694
8204 1 18 . 1 1 56 56 TYR H H 56 8.450 8.450 9.021 -0.571 19694
8205 1 18 . 1 1 57 57 LYS N N 57 126.020 126.020 128.369 -2.349 19694
8206 1 18 . 1 1 57 57 LYS HA H 57 3.470 3.470 3.874 -0.404 19694
8207 1 18 . 1 1 57 57 LYS CA C 57 58.100 58.100 57.405 0.695 19694
8208 1 18 . 1 1 57 57 LYS CB C 57 29.480 29.480 32.039 -2.559 19694
8209 1 18 . 1 1 57 57 LYS H H 57 8.920 8.920 8.645 0.275 19694
8210 1 18 . 1 1 58 58 ASP HA H 58 3.830 3.830 4.185 -0.355 19694
8211 1 18 . 1 1 58 58 ASP CA C 58 54.900 54.900 55.506 -0.606 19694
8212 1 18 . 1 1 58 58 ASP CB C 58 40.080 40.080 40.703 -0.622 19694
8213 1 18 . 1 1 58 58 ASP H H 58 8.400 8.400 8.634 -0.234 19694
8214 1 18 . 1 1 59 59 ARG N N 59 121.190 121.190 116.496 4.694 19694
8215 1 18 . 1 1 59 59 ARG HA H 59 4.250 4.250 4.284 -0.034 19694
8216 1 18 . 1 1 59 59 ARG CA C 59 55.580 55.580 54.250 1.330 19694
8217 1 18 . 1 1 59 59 ARG CB C 59 33.460 33.460 33.682 -0.222 19694
8218 1 18 . 1 1 59 59 ARG H H 59 7.980 7.980 7.808 0.172 19694
8219 1 18 . 1 1 60 60 HIS N N 60 118.420 118.420 117.563 0.857 19694
8220 1 18 . 1 1 60 60 HIS HA H 60 5.270 5.270 5.584 -0.314 19694
8221 1 18 . 1 1 60 60 HIS CA C 60 55.010 55.010 55.003 0.007 19694
8222 1 18 . 1 1 60 60 HIS CB C 60 32.380 32.380 33.363 -0.983 19694
8223 1 18 . 1 1 60 60 HIS H H 60 8.350 8.350 8.080 0.270 19694
8224 1 18 . 1 1 61 61 TRP N N 61 119.990 119.990 118.504 1.486 19694
8225 1 18 . 1 1 61 61 TRP HA H 61 5.930 5.930 4.796 1.134 19694
8226 1 18 . 1 1 61 61 TRP CA C 61 57.400 57.400 57.097 0.303 19694
8227 1 18 . 1 1 61 61 TRP CB C 61 35.380 35.380 34.236 1.144 19694
8228 1 18 . 1 1 61 61 TRP H H 61 9.310 9.310 9.361 -0.051 19694
8229 1 18 . 1 1 62 62 HIS N N 62 117.270 117.270 121.045 -3.775 19694
8230 1 18 . 1 1 62 62 HIS HA H 62 4.600 4.600 4.896 -0.296 19694
8231 1 18 . 1 1 62 62 HIS CA C 62 59.210 59.210 57.110 2.100 19694
8232 1 18 . 1 1 62 62 HIS CB C 62 31.200 31.200 30.341 0.859 19694
8233 1 18 . 1 1 62 62 HIS H H 62 8.430 8.430 9.155 -0.725 19694
8234 1 18 . 1 1 63 63 GLU N N 63 124.640 124.640 128.244 -3.604 19694
8235 1 18 . 1 1 63 63 GLU HA H 63 3.827 3.827 3.949 -0.122 19694
8236 1 18 . 1 1 63 63 GLU CA C 63 61.020 61.020 59.991 1.029 19694
8237 1 18 . 1 1 63 63 GLU CB C 63 30.310 30.310 29.621 0.689 19694
8238 1 18 . 1 1 63 63 GLU H H 63 9.040 9.040 8.257 0.783 19694
8239 1 18 . 1 1 64 64 ALA N N 64 117.050 117.050 117.528 -0.478 19694
8240 1 18 . 1 1 64 64 ALA HA H 64 4.230 4.230 4.412 -0.182 19694
8241 1 18 . 1 1 64 64 ALA CA C 64 54.000 54.000 53.005 0.995 19694
8242 1 18 . 1 1 64 64 ALA CB C 64 18.880 18.880 18.877 0.003 19694
8243 1 18 . 1 1 64 64 ALA H H 64 8.680 8.680 8.304 0.376 19694
8244 1 18 . 1 1 65 65 CYS N N 65 115.380 115.380 117.169 -1.789 19694
8245 1 18 . 1 1 65 65 CYS HA H 65 4.295 4.295 4.160 0.135 19694
8246 1 18 . 1 1 65 65 CYS CA C 65 59.850 59.850 60.278 -0.428 19694
8247 1 18 . 1 1 65 65 CYS CB C 65 32.840 32.840 26.937 5.903 19694
8248 1 18 . 1 1 65 65 CYS H H 65 7.490 7.490 8.149 -0.659 19694
8249 1 18 . 1 1 66 66 PHE N N 66 122.020 122.020 122.961 -0.941 19694
8250 1 18 . 1 1 66 66 PHE HA H 66 3.890 3.890 3.799 0.091 19694
8251 1 18 . 1 1 66 66 PHE CA C 66 57.010 57.010 58.540 -1.530 19694
8252 1 18 . 1 1 66 66 PHE CB C 66 38.070 38.070 38.244 -0.174 19694
8253 1 18 . 1 1 66 66 PHE H H 66 7.110 7.110 7.559 -0.449 19694
8254 1 18 . 1 1 67 67 HIS N N 67 121.280 121.280 121.756 -0.476 19694
8255 1 18 . 1 1 67 67 HIS HA H 67 4.720 4.720 5.192 -0.472 19694
8256 1 18 . 1 1 67 67 HIS CA C 67 52.730 52.730 53.293 -0.563 19694
8257 1 18 . 1 1 67 67 HIS CB C 67 32.230 32.230 30.961 1.269 19694
8258 1 18 . 1 1 67 67 HIS H H 67 7.380 7.380 7.587 -0.207 19694
8259 1 18 . 1 1 68 68 CYS N N 68 121.590 121.590 119.337 2.253 19694
8260 1 18 . 1 1 68 68 CYS HA H 68 3.960 3.960 4.848 -0.888 19694
8261 1 18 . 1 1 68 68 CYS CA C 68 59.790 59.790 57.865 1.925 19694
8262 1 18 . 1 1 68 68 CYS CB C 68 31.200 31.200 29.565 1.635 19694
8263 1 18 . 1 1 68 68 CYS H H 68 8.530 8.530 8.429 0.101 19694
8264 1 18 . 1 1 69 69 SER N N 69 126.530 126.530 120.806 5.724 19694
8265 1 18 . 1 1 69 69 SER HA H 69 4.310 4.310 4.144 0.166 19694
8266 1 18 . 1 1 69 69 SER CA C 69 61.760 61.760 60.955 0.805 19694
8267 1 18 . 1 1 69 69 SER CB C 69 64.040 64.040 63.109 0.931 19694
8268 1 18 . 1 1 69 69 SER H H 69 9.460 9.460 8.746 0.714 19694
8269 1 18 . 1 1 70 70 GLN N N 70 122.370 122.370 118.866 3.504 19694
8270 1 18 . 1 1 70 70 GLN HA H 70 4.510 4.510 4.442 0.068 19694
8271 1 18 . 1 1 70 70 GLN CA C 70 57.840 57.840 57.579 0.261 19694
8272 1 18 . 1 1 70 70 GLN CB C 70 30.430 30.430 29.633 0.797 19694
8273 1 18 . 1 1 70 70 GLN H H 70 8.980 8.980 8.001 0.979 19694
8274 1 18 . 1 1 71 71 CYS N N 71 118.860 118.860 116.242 2.618 19694
8275 1 18 . 1 1 71 71 CYS HA H 71 4.720 4.720 4.671 0.049 19694
8276 1 18 . 1 1 71 71 CYS CA C 71 59.770 59.770 58.447 1.323 19694
8277 1 18 . 1 1 71 71 CYS CB C 71 31.910 31.910 26.950 4.960 19694
8278 1 18 . 1 1 71 71 CYS H H 71 8.220 8.220 7.756 0.464 19694
8279 1 18 . 1 1 72 72 ARG N N 72 114.380 114.380 116.229 -1.849 19694
8280 1 18 . 1 1 72 72 ARG HA H 72 3.965 3.965 3.798 0.167 19694
8281 1 18 . 1 1 72 72 ARG CA C 72 58.030 58.030 57.138 0.892 19694
8282 1 18 . 1 1 72 72 ARG CB C 72 27.720 27.720 27.389 0.331 19694
8283 1 18 . 1 1 72 72 ARG H H 72 7.380 7.380 7.907 -0.527 19694
8284 1 18 . 1 1 73 73 ASN N N 73 121.480 121.480 116.069 5.411 19694
8285 1 18 . 1 1 73 73 ASN HA H 73 4.630 4.630 4.618 0.012 19694
8286 1 18 . 1 1 73 73 ASN CA C 73 54.110 54.110 53.996 0.114 19694
8287 1 18 . 1 1 73 73 ASN CB C 73 38.870 38.870 39.689 -0.819 19694
8288 1 18 . 1 1 73 73 ASN H H 73 8.722 8.722 8.093 0.629 19694
8289 1 18 . 1 1 74 74 SER N N 74 114.710 114.710 118.073 -3.363 19694
8290 1 18 . 1 1 74 74 SER HA H 74 4.060 4.060 4.764 -0.704 19694
8291 1 18 . 1 1 74 74 SER CA C 74 59.357 59.357 58.483 0.874 19694
8292 1 18 . 1 1 74 74 SER CB C 74 63.300 63.300 63.017 0.283 19694
8293 1 18 . 1 1 74 74 SER H H 74 8.690 8.690 8.517 0.173 19694
8294 1 18 . 1 1 75 75 LEU N N 75 125.757 125.757 127.639 -1.882 19694
8295 1 18 . 1 1 75 75 LEU HA H 75 4.280 4.280 4.386 -0.106 19694
8296 1 18 . 1 1 75 75 LEU CA C 75 53.510 53.510 54.688 -1.177 19694
8297 1 18 . 1 1 75 75 LEU CB C 75 42.200 42.200 42.317 -0.117 19694
8298 1 18 . 1 1 75 75 LEU H H 75 7.970 7.970 8.054 -0.084 19694
8299 1 18 . 1 1 76 76 VAL N N 76 120.860 120.860 123.530 -2.670 19694
8300 1 18 . 1 1 76 76 VAL HA H 76 3.570 3.570 3.854 -0.284 19694
8301 1 18 . 1 1 76 76 VAL CA C 76 65.420 65.420 60.873 4.547 19694
8302 1 18 . 1 1 76 76 VAL CB C 76 31.540 31.540 35.894 -4.354 19694
8303 1 18 . 1 1 76 76 VAL H H 76 7.830 7.830 7.952 -0.122 19694
8304 1 18 . 1 1 77 77 ASP N N 77 122.360 122.360 122.915 -0.555 19694
8305 1 18 . 1 1 77 77 ASP HA H 77 4.230 4.230 4.485 -0.255 19694
8306 1 18 . 1 1 77 77 ASP CA C 77 56.200 56.200 55.749 0.451 19694
8307 1 18 . 1 1 77 77 ASP CB C 77 39.380 39.380 40.885 -1.505 19694
8308 1 18 . 1 1 77 77 ASP H H 77 8.910 8.910 8.492 0.418 19694
8309 1 18 . 1 1 78 78 LYS N N 78 118.100 118.100 118.385 -0.285 19694
8310 1 18 . 1 1 78 78 LYS HA H 78 4.870 4.870 4.635 0.235 19694
8311 1 18 . 1 1 78 78 LYS CA C 78 56.960 56.960 53.699 3.261 19694
8312 1 18 . 1 1 78 78 LYS CB C 78 34.680 34.680 33.744 0.936 19694
8313 1 18 . 1 1 78 78 LYS H H 78 7.660 7.660 7.605 0.055 19694
8314 1 18 . 1 1 79 79 PRO HA H 79 4.460 4.460 4.228 0.232 19694
8315 1 18 . 1 1 79 79 PRO CA C 79 62.520 62.520 62.966 -0.446 19694
8316 1 18 . 1 1 79 79 PRO CB C 79 32.160 32.160 31.858 0.302 19694
8317 1 18 . 1 1 80 80 PHE N N 80 114.050 114.050 117.068 -3.018 19694
8318 1 18 . 1 1 80 80 PHE HA H 80 4.910 4.910 5.074 -0.164 19694
8319 1 18 . 1 1 80 80 PHE CA C 80 56.060 56.060 55.078 0.982 19694
8320 1 18 . 1 1 80 80 PHE CB C 80 42.410 42.410 41.972 0.438 19694
8321 1 18 . 1 1 80 80 PHE H H 80 7.510 7.510 7.197 0.313 19694
8322 1 18 . 1 1 81 81 ALA N N 81 123.290 123.290 123.800 -0.510 19694
8323 1 18 . 1 1 81 81 ALA HA H 81 4.310 4.310 4.361 -0.051 19694
8324 1 18 . 1 1 81 81 ALA CA C 81 50.450 50.450 50.403 0.048 19694
8325 1 18 . 1 1 81 81 ALA CB C 81 21.920 21.920 18.971 2.949 19694
8326 1 18 . 1 1 81 81 ALA H H 81 9.030 9.030 8.940 0.090 19694
8327 1 18 . 1 1 82 82 ALA N N 82 122.490 122.490 129.246 -6.756 19694
8328 1 18 . 1 1 82 82 ALA HA H 82 5.110 5.110 4.395 0.715 19694
8329 1 18 . 1 1 82 82 ALA CA C 82 51.100 51.100 51.674 -0.574 19694
8330 1 18 . 1 1 82 82 ALA CB C 82 21.130 21.130 18.804 2.326 19694
8331 1 18 . 1 1 82 82 ALA H H 82 8.240 8.240 8.647 -0.407 19694
8332 1 18 . 1 1 83 83 LYS N N 83 123.580 123.580 125.414 -1.834 19694
8333 1 18 . 1 1 83 83 LYS HA H 83 4.490 4.490 4.512 -0.022 19694
8334 1 18 . 1 1 83 83 LYS CA C 83 55.800 55.800 55.326 0.474 19694
8335 1 18 . 1 1 83 83 LYS CB C 83 34.720 34.720 34.090 0.630 19694
8336 1 18 . 1 1 83 83 LYS H H 83 8.400 8.400 8.281 0.119 19694
8337 1 18 . 1 1 84 84 GLU N N 84 125.470 125.470 120.911 4.559 19694
8338 1 18 . 1 1 84 84 GLU HA H 84 3.820 3.820 4.128 -0.308 19694
8339 1 18 . 1 1 84 84 GLU CA C 84 58.620 58.620 59.192 -0.572 19694
8340 1 18 . 1 1 84 84 GLU CB C 84 27.210 27.210 29.632 -2.422 19694
8341 1 18 . 1 1 84 84 GLU H H 84 9.320 9.320 8.733 0.587 19694
8342 1 18 . 1 1 85 85 ASP N N 85 118.550 118.550 114.482 4.068 19694
8343 1 18 . 1 1 85 85 ASP HA H 85 4.600 4.600 4.789 -0.189 19694
8344 1 18 . 1 1 85 85 ASP CA C 85 55.400 55.400 53.961 1.439 19694
8345 1 18 . 1 1 85 85 ASP CB C 85 40.400 40.400 41.943 -1.543 19694
8346 1 18 . 1 1 85 85 ASP H H 85 8.730 8.730 8.323 0.407 19694
8347 1 18 . 1 1 86 86 GLN N N 86 119.050 119.050 116.696 2.354 19694
8348 1 18 . 1 1 86 86 GLN HA H 86 4.540 4.540 4.689 -0.149 19694
8349 1 18 . 1 1 86 86 GLN CA C 86 55.100 55.100 53.853 1.247 19694
8350 1 18 . 1 1 86 86 GLN CB C 86 31.110 31.110 31.852 -0.742 19694
8351 1 18 . 1 1 86 86 GLN H H 86 8.170 8.170 7.593 0.577 19694
8352 1 18 . 1 1 87 87 LEU N N 87 123.110 123.110 121.348 1.762 19694
8353 1 18 . 1 1 87 87 LEU HA H 87 4.620 4.620 5.197 -0.577 19694
8354 1 18 . 1 1 87 87 LEU CA C 87 54.520 54.520 54.029 0.491 19694
8355 1 18 . 1 1 87 87 LEU CB C 87 42.700 42.700 44.565 -1.865 19694
8356 1 18 . 1 1 87 87 LEU H H 87 8.490 8.490 8.529 -0.039 19694
8357 1 18 . 1 1 88 88 LEU N N 88 123.690 123.690 120.188 3.502 19694
8358 1 18 . 1 1 88 88 LEU HA H 88 5.880 5.880 4.963 0.917 19694
8359 1 18 . 1 1 88 88 LEU CA C 88 53.340 53.340 52.809 0.531 19694
8360 1 18 . 1 1 88 88 LEU CB C 88 47.190 47.190 47.808 -0.618 19694
8361 1 18 . 1 1 88 88 LEU H H 88 8.930 8.930 8.329 0.601 19694
8362 1 18 . 1 1 89 89 CYS N N 89 122.270 122.270 119.701 2.569 19694
8363 1 18 . 1 1 89 89 CYS HA H 89 4.780 4.780 4.834 -0.054 19694
8364 1 18 . 1 1 89 89 CYS CA C 89 57.640 57.640 59.243 -1.603 19694
8365 1 18 . 1 1 89 89 CYS CB C 89 30.940 30.940 28.144 2.796 19694
8366 1 18 . 1 1 89 89 CYS H H 89 9.430 9.430 9.014 0.416 19694
8367 1 18 . 1 1 90 90 THR N N 90 110.620 110.620 117.416 -6.796 19694
8368 1 18 . 1 1 90 90 THR HA H 90 3.900 3.900 3.975 -0.075 19694
8369 1 18 . 1 1 90 90 THR CA C 90 65.460 65.460 65.955 -0.495 19694
8370 1 18 . 1 1 90 90 THR CB C 90 68.670 68.670 68.791 -0.121 19694
8371 1 18 . 1 1 90 90 THR H H 90 8.410 8.410 8.894 -0.484 19694
8372 1 18 . 1 1 91 91 ASP N N 91 123.470 123.470 122.152 1.318 19694
8373 1 18 . 1 1 91 91 ASP HA H 91 4.490 4.490 4.641 -0.151 19694
8374 1 18 . 1 1 91 91 ASP CA C 91 57.810 57.810 57.049 0.761 19694
8375 1 18 . 1 1 91 91 ASP CB C 91 41.160 41.160 40.102 1.058 19694
8376 1 18 . 1 1 91 91 ASP H H 91 8.150 8.150 8.479 -0.329 19694
8377 1 18 . 1 1 92 92 CYS N N 92 123.800 123.800 119.855 3.945 19694
8378 1 18 . 1 1 92 92 CYS HA H 92 3.970 3.970 4.257 -0.287 19694
8379 1 18 . 1 1 92 92 CYS CA C 92 64.100 64.100 61.808 2.292 19694
8380 1 18 . 1 1 92 92 CYS CB C 92 30.090 30.090 25.898 4.192 19694
8381 1 18 . 1 1 92 92 CYS H H 92 8.580 8.580 7.621 0.959 19694
8382 1 18 . 1 1 93 93 TYR N N 93 120.730 120.730 120.634 0.096 19694
8383 1 18 . 1 1 93 93 TYR HA H 93 4.140 4.140 4.049 0.091 19694
8384 1 18 . 1 1 93 93 TYR CA C 93 60.380 60.380 61.594 -1.214 19694
8385 1 18 . 1 1 93 93 TYR CB C 93 39.300 39.300 38.240 1.060 19694
8386 1 18 . 1 1 93 93 TYR H H 93 8.540 8.540 9.152 -0.612 19694
8387 1 18 . 1 1 94 94 SER N N 94 115.010 115.010 113.772 1.238 19694
8388 1 18 . 1 1 94 94 SER HA H 94 4.220 4.220 4.122 0.098 19694
8389 1 18 . 1 1 94 94 SER CA C 94 59.300 59.300 61.852 -2.552 19694
8390 1 18 . 1 1 94 94 SER CB C 94 63.660 63.660 62.823 0.837 19694
8391 1 18 . 1 1 94 94 SER H H 94 7.750 7.750 8.073 -0.323 19694
8392 1 18 . 1 1 95 95 ASN N N 95 119.820 119.820 117.177 2.643 19694
8393 1 18 . 1 1 95 95 ASN HA H 95 4.510 4.510 4.515 -0.005 19694
8394 1 18 . 1 1 95 95 ASN CA C 95 53.880 53.880 55.558 -1.678 19694
8395 1 18 . 1 1 95 95 ASN CB C 95 39.300 39.300 38.689 0.611 19694
8396 1 18 . 1 1 95 95 ASN H H 95 7.780 7.780 7.767 0.013 19694
8397 1 18 . 1 1 96 96 GLU N N 96 119.820 119.820 117.866 1.954 19694
8398 1 18 . 1 1 96 96 GLU HA H 96 4.096 4.096 4.140 -0.044 19694
8399 1 18 . 1 1 96 96 GLU CA C 96 56.910 56.910 57.414 -0.504 19694
8400 1 18 . 1 1 96 96 GLU CB C 96 30.220 30.220 29.865 0.355 19694
8401 1 18 . 1 1 96 96 GLU H H 96 7.950 7.950 8.019 -0.069 19694
8402 1 18 . 1 1 97 97 TYR N N 97 120.370 120.370 120.161 0.209 19694
8403 1 18 . 1 1 97 97 TYR HA H 97 4.620 4.620 4.228 0.392 19694
8404 1 18 . 1 1 97 97 TYR CA C 97 57.700 57.700 59.014 -1.314 19694
8405 1 18 . 1 1 97 97 TYR CB C 97 38.710 38.710 39.101 -0.391 19694
8406 1 18 . 1 1 97 97 TYR H H 97 8.070 8.070 8.118 -0.048 19694
8407 1 19 . 1 1 2 2 THR N N 2 113.570 113.570 116.265 -2.695 19694
8408 1 19 . 1 1 2 2 THR HA H 2 4.240 4.240 4.183 0.057 19694
8409 1 19 . 1 1 2 2 THR CA C 2 62.130 62.130 63.150 -1.020 19694
8410 1 19 . 1 1 2 2 THR CB C 2 69.250 69.250 68.943 0.307 19694
8411 1 19 . 1 1 2 2 THR H H 2 8.090 8.090 8.268 -0.178 19694
8412 1 19 . 1 1 3 3 GLU N N 3 122.880 122.880 120.368 2.512 19694
8413 1 19 . 1 1 3 3 GLU HA H 3 4.280 4.280 4.259 0.021 19694
8414 1 19 . 1 1 3 3 GLU CA C 3 56.860 56.860 56.507 0.353 19694
8415 1 19 . 1 1 3 3 GLU CB C 3 30.570 30.570 30.299 0.271 19694
8416 1 19 . 1 1 3 3 GLU H H 3 8.280 8.280 8.092 0.188 19694
8417 1 19 . 1 1 4 4 ARG N N 4 121.330 121.330 119.365 1.965 19694
8418 1 19 . 1 1 4 4 ARG HA H 4 4.300 4.300 4.561 -0.261 19694
8419 1 19 . 1 1 4 4 ARG CA C 4 55.870 55.870 55.070 0.800 19694
8420 1 19 . 1 1 4 4 ARG CB C 4 31.640 31.640 30.783 0.857 19694
8421 1 19 . 1 1 4 4 ARG H H 4 8.280 8.280 8.555 -0.275 19694
8422 1 19 . 1 1 5 5 PHE N N 5 125.490 125.490 125.092 0.398 19694
8423 1 19 . 1 1 5 5 PHE HA H 5 4.610 4.610 4.570 0.040 19694
8424 1 19 . 1 1 5 5 PHE CA C 5 56.380 56.380 56.573 -0.193 19694
8425 1 19 . 1 1 5 5 PHE CB C 5 39.560 39.560 39.458 0.102 19694
8426 1 19 . 1 1 5 5 PHE H H 5 8.290 8.290 8.809 -0.519 19694
8427 1 19 . 1 1 6 6 ASP N N 6 123.260 123.260 121.394 1.866 19694
8428 1 19 . 1 1 6 6 ASP HA H 6 5.045 5.045 4.828 0.217 19694
8429 1 19 . 1 1 6 6 ASP CA C 6 52.180 52.180 53.315 -1.135 19694
8430 1 19 . 1 1 6 6 ASP CB C 6 44.210 44.210 44.514 -0.304 19694
8431 1 19 . 1 1 6 6 ASP H H 6 7.940 7.940 7.574 0.366 19694
8432 1 19 . 1 1 7 7 CYS N N 7 121.440 121.440 123.174 -1.734 19694
8433 1 19 . 1 1 7 7 CYS HA H 7 3.960 3.960 4.452 -0.492 19694
8434 1 19 . 1 1 7 7 CYS CA C 7 59.820 59.820 59.675 0.145 19694
8435 1 19 . 1 1 7 7 CYS CB C 7 30.950 30.950 26.296 4.654 19694
8436 1 19 . 1 1 7 7 CYS H H 7 8.700 8.700 8.620 0.080 19694
8437 1 19 . 1 1 8 8 HIS N N 8 129.390 129.390 130.192 -0.802 19694
8438 1 19 . 1 1 8 8 HIS HA H 8 4.200 4.200 4.246 -0.046 19694
8439 1 19 . 1 1 8 8 HIS CA C 8 58.240 58.240 59.767 -1.527 19694
8440 1 19 . 1 1 8 8 HIS CB C 8 29.480 29.480 30.018 -0.538 19694
8441 1 19 . 1 1 8 8 HIS H H 8 9.160 9.160 9.631 -0.471 19694
8442 1 19 . 1 1 9 9 HIS N N 9 118.740 118.740 117.663 1.077 19694
8443 1 19 . 1 1 9 9 HIS HA H 9 4.880 4.880 4.583 0.297 19694
8444 1 19 . 1 1 9 9 HIS CA C 9 58.680 58.680 57.201 1.479 19694
8445 1 19 . 1 1 9 9 HIS CB C 9 31.040 31.040 30.410 0.630 19694
8446 1 19 . 1 1 9 9 HIS H H 9 9.270 9.270 8.081 1.189 19694
8447 1 19 . 1 1 10 10 CYS N N 10 118.600 118.600 117.366 1.234 19694
8448 1 19 . 1 1 10 10 CYS HA H 10 4.600 4.600 4.431 0.169 19694
8449 1 19 . 1 1 10 10 CYS CA C 10 59.600 59.600 59.090 0.510 19694
8450 1 19 . 1 1 10 10 CYS CB C 10 32.330 32.330 27.853 4.477 19694
8451 1 19 . 1 1 10 10 CYS H H 10 8.550 8.550 7.854 0.696 19694
8452 1 19 . 1 1 11 11 ASN N N 11 116.220 116.220 118.327 -2.107 19694
8453 1 19 . 1 1 11 11 ASN HA H 11 4.410 4.410 4.367 0.043 19694
8454 1 19 . 1 1 11 11 ASN CA C 11 55.640 55.640 54.591 1.049 19694
8455 1 19 . 1 1 11 11 ASN CB C 11 38.200 38.200 37.829 0.371 19694
8456 1 19 . 1 1 11 11 ASN H H 11 7.690 7.690 8.665 -0.975 19694
8457 1 19 . 1 1 12 12 GLU N N 12 120.330 120.330 117.897 2.433 19694
8458 1 19 . 1 1 12 12 GLU HA H 12 4.220 4.220 4.520 -0.300 19694
8459 1 19 . 1 1 12 12 GLU CA C 12 56.700 56.700 55.199 1.501 19694
8460 1 19 . 1 1 12 12 GLU CB C 12 30.910 30.910 30.730 0.180 19694
8461 1 19 . 1 1 12 12 GLU H H 12 8.210 8.210 7.752 0.458 19694
8462 1 19 . 1 1 13 13 SER N N 13 116.190 116.190 119.125 -2.935 19694
8463 1 19 . 1 1 13 13 SER HA H 13 4.060 4.060 4.411 -0.351 19694
8464 1 19 . 1 1 13 13 SER CA C 13 59.350 59.350 58.422 0.928 19694
8465 1 19 . 1 1 13 13 SER CB C 13 63.820 63.820 63.631 0.189 19694
8466 1 19 . 1 1 13 13 SER H H 13 8.520 8.520 8.628 -0.108 19694
8467 1 19 . 1 1 14 14 LEU N N 14 126.060 126.060 124.260 1.800 19694
8468 1 19 . 1 1 14 14 LEU HA H 14 4.310 4.310 4.339 -0.029 19694
8469 1 19 . 1 1 14 14 LEU CA C 14 54.100 54.100 55.755 -1.655 19694
8470 1 19 . 1 1 14 14 LEU CB C 14 42.200 42.200 41.565 0.635 19694
8471 1 19 . 1 1 14 14 LEU H H 14 8.910 8.910 7.841 1.069 19694
8472 1 19 . 1 1 15 15 PHE N N 15 120.660 120.660 121.122 -0.462 19694
8473 1 19 . 1 1 15 15 PHE HA H 15 4.480 4.480 4.617 -0.137 19694
8474 1 19 . 1 1 15 15 PHE CA C 15 60.400 60.400 56.272 4.128 19694
8475 1 19 . 1 1 15 15 PHE CB C 15 38.130 38.130 38.010 0.120 19694
8476 1 19 . 1 1 15 15 PHE H H 15 7.820 7.820 8.620 -0.800 19694
8477 1 19 . 1 1 16 16 GLY N N 16 114.730 114.730 110.938 3.792 19694
8478 1 19 . 1 1 16 16 GLY CA C 16 45.900 45.900 45.812 0.088 19694
8479 1 19 . 1 1 16 16 GLY H H 16 8.860 8.860 8.810 0.050 19694
8480 1 19 . 1 1 17 17 LYS N N 17 119.580 119.580 119.840 -0.260 19694
8481 1 19 . 1 1 17 17 LYS HA H 17 4.480 4.480 4.481 -0.001 19694
8482 1 19 . 1 1 17 17 LYS CA C 17 54.460 54.460 54.560 -0.100 19694
8483 1 19 . 1 1 17 17 LYS CB C 17 35.800 35.800 34.024 1.776 19694
8484 1 19 . 1 1 17 17 LYS H H 17 8.030 8.030 7.268 0.762 19694
8485 1 19 . 1 1 18 18 LYS N N 18 120.330 120.330 122.039 -1.709 19694
8486 1 19 . 1 1 18 18 LYS HA H 18 4.280 4.280 4.341 -0.061 19694
8487 1 19 . 1 1 18 18 LYS CA C 18 56.800 56.800 57.566 -0.765 19694
8488 1 19 . 1 1 18 18 LYS CB C 18 33.010 33.010 33.033 -0.023 19694
8489 1 19 . 1 1 18 18 LYS H H 18 8.190 8.190 8.543 -0.353 19694
8490 1 19 . 1 1 19 19 TYR N N 19 117.500 117.500 114.475 3.025 19694
8491 1 19 . 1 1 19 19 TYR HA H 19 5.240 5.240 4.781 0.459 19694
8492 1 19 . 1 1 19 19 TYR CA C 19 55.340 55.340 56.423 -1.083 19694
8493 1 19 . 1 1 19 19 TYR CB C 19 42.850 42.850 40.197 2.654 19694
8494 1 19 . 1 1 19 19 TYR H H 19 7.610 7.610 7.884 -0.274 19694
8495 1 19 . 1 1 20 20 ILE N N 20 121.430 121.430 121.881 -0.451 19694
8496 1 19 . 1 1 20 20 ILE HA H 20 4.137 4.137 4.261 -0.124 19694
8497 1 19 . 1 1 20 20 ILE CA C 20 60.010 60.010 60.146 -0.136 19694
8498 1 19 . 1 1 20 20 ILE CB C 20 41.570 41.570 40.590 0.980 19694
8499 1 19 . 1 1 20 20 ILE H H 20 9.350 9.350 8.268 1.082 19694
8500 1 19 . 1 1 21 21 LEU N N 21 126.720 126.720 126.114 0.606 19694
8501 1 19 . 1 1 21 21 LEU HA H 21 5.090 5.090 4.749 0.341 19694
8502 1 19 . 1 1 21 21 LEU CA C 21 54.020 54.020 53.932 0.088 19694
8503 1 19 . 1 1 21 21 LEU CB C 21 43.720 43.720 40.824 2.896 19694
8504 1 19 . 1 1 21 21 LEU H H 21 8.530 8.530 8.517 0.013 19694
8505 1 19 . 1 1 22 22 ARG N N 22 123.930 123.930 125.423 -1.493 19694
8506 1 19 . 1 1 22 22 ARG HA H 22 4.440 4.440 4.530 -0.090 19694
8507 1 19 . 1 1 22 22 ARG CA C 22 55.600 55.600 54.019 1.581 19694
8508 1 19 . 1 1 22 22 ARG CB C 22 32.280 32.280 32.539 -0.259 19694
8509 1 19 . 1 1 22 22 ARG H H 22 9.080 9.080 8.947 0.133 19694
8510 1 19 . 1 1 23 23 GLU N N 23 128.500 128.500 125.366 3.134 19694
8511 1 19 . 1 1 23 23 GLU HA H 23 3.840 3.840 3.948 -0.108 19694
8512 1 19 . 1 1 23 23 GLU CA C 23 58.030 58.030 57.616 0.414 19694
8513 1 19 . 1 1 23 23 GLU CB C 23 27.200 27.200 28.125 -0.924 19694
8514 1 19 . 1 1 23 23 GLU H H 23 9.610 9.610 9.037 0.573 19694
8515 1 19 . 1 1 24 24 GLU N N 24 110.300 110.300 113.555 -3.255 19694
8516 1 19 . 1 1 24 24 GLU HA H 24 3.780 3.780 3.966 -0.186 19694
8517 1 19 . 1 1 24 24 GLU CA C 24 58.320 58.320 57.347 0.973 19694
8518 1 19 . 1 1 24 24 GLU CB C 24 28.220 28.220 27.792 0.428 19694
8519 1 19 . 1 1 24 24 GLU H H 24 8.660 8.660 8.623 0.037 19694
8520 1 19 . 1 1 25 25 SER N N 25 117.700 117.700 112.996 4.704 19694
8521 1 19 . 1 1 25 25 SER HA H 25 4.890 4.890 4.793 0.097 19694
8522 1 19 . 1 1 25 25 SER CA C 25 56.540 56.540 55.531 1.009 19694
8523 1 19 . 1 1 25 25 SER CB C 25 64.720 64.720 65.431 -0.711 19694
8524 1 19 . 1 1 25 25 SER H H 25 7.900 7.900 7.862 0.038 19694
8525 1 19 . 1 1 26 26 PRO HA H 26 4.995 4.995 4.875 0.120 19694
8526 1 19 . 1 1 26 26 PRO CA C 26 61.750 61.750 62.989 -1.239 19694
8527 1 19 . 1 1 26 26 PRO CB C 26 32.660 32.660 31.718 0.942 19694
8528 1 19 . 1 1 27 27 TYR N N 27 118.100 118.100 123.616 -5.516 19694
8529 1 19 . 1 1 27 27 TYR HA H 27 5.910 5.910 4.983 0.927 19694
8530 1 19 . 1 1 27 27 TYR CA C 27 56.830 56.830 54.858 1.972 19694
8531 1 19 . 1 1 27 27 TYR CB C 27 42.810 42.810 42.533 0.277 19694
8532 1 19 . 1 1 27 27 TYR H H 27 9.040 9.040 8.682 0.358 19694
8533 1 19 . 1 1 28 28 CYS N N 28 122.230 122.230 119.590 2.640 19694
8534 1 19 . 1 1 28 28 CYS HA H 28 4.850 4.850 4.665 0.185 19694
8535 1 19 . 1 1 28 28 CYS CA C 28 58.110 58.110 58.473 -0.363 19694
8536 1 19 . 1 1 28 28 CYS CB C 28 30.530 30.530 29.151 1.379 19694
8537 1 19 . 1 1 28 28 CYS H H 28 9.850 9.850 8.365 1.485 19694
8538 1 19 . 1 1 29 29 VAL N N 29 118.200 118.200 121.997 -3.797 19694
8539 1 19 . 1 1 29 29 VAL HA H 29 3.650 3.650 3.802 -0.152 19694
8540 1 19 . 1 1 29 29 VAL CA C 29 67.400 67.400 66.499 0.901 19694
8541 1 19 . 1 1 29 29 VAL CB C 29 31.860 31.860 31.101 0.759 19694
8542 1 19 . 1 1 29 29 VAL H H 29 8.430 8.430 9.005 -0.575 19694
8543 1 19 . 1 1 30 30 VAL N N 30 119.570 119.570 118.615 0.955 19694
8544 1 19 . 1 1 30 30 VAL HA H 30 3.860 3.860 3.676 0.184 19694
8545 1 19 . 1 1 30 30 VAL CA C 30 66.450 66.450 65.773 0.677 19694
8546 1 19 . 1 1 30 30 VAL CB C 30 31.540 31.540 30.655 0.885 19694
8547 1 19 . 1 1 30 30 VAL H H 30 7.700 7.700 7.910 -0.210 19694
8548 1 19 . 1 1 31 31 CYS N N 31 125.890 125.890 119.625 6.265 19694
8549 1 19 . 1 1 31 31 CYS HA H 31 3.830 3.830 3.903 -0.073 19694
8550 1 19 . 1 1 31 31 CYS CA C 31 65.850 65.850 64.267 1.583 19694
8551 1 19 . 1 1 31 31 CYS CB C 31 29.510 29.510 25.559 3.951 19694
8552 1 19 . 1 1 31 31 CYS H H 31 9.050 9.050 7.596 1.454 19694
8553 1 19 . 1 1 32 32 PHE N N 32 119.000 119.000 119.238 -0.238 19694
8554 1 19 . 1 1 32 32 PHE HA H 32 3.780 3.780 3.670 0.110 19694
8555 1 19 . 1 1 32 32 PHE CA C 32 62.610 62.610 61.780 0.830 19694
8556 1 19 . 1 1 32 32 PHE CB C 32 39.920 39.920 39.028 0.892 19694
8557 1 19 . 1 1 32 32 PHE H H 32 9.080 9.080 7.875 1.205 19694
8558 1 19 . 1 1 33 33 GLU N N 33 117.470 117.470 117.569 -0.099 19694
8559 1 19 . 1 1 33 33 GLU HA H 33 3.760 3.760 4.050 -0.290 19694
8560 1 19 . 1 1 33 33 GLU CA C 33 59.210 59.210 59.394 -0.184 19694
8561 1 19 . 1 1 33 33 GLU CB C 33 29.480 29.480 29.205 0.275 19694
8562 1 19 . 1 1 33 33 GLU H H 33 8.510 8.510 7.842 0.668 19694
8563 1 19 . 1 1 34 34 THR N N 34 114.140 114.140 115.368 -1.228 19694
8564 1 19 . 1 1 34 34 THR HA H 34 3.730 3.730 3.972 -0.242 19694
8565 1 19 . 1 1 34 34 THR CA C 34 65.890 65.890 65.497 0.393 19694
8566 1 19 . 1 1 34 34 THR CB C 34 69.210 69.210 68.610 0.600 19694
8567 1 19 . 1 1 34 34 THR H H 34 7.880 7.880 8.298 -0.418 19694
8568 1 19 . 1 1 35 35 LEU N N 35 117.980 117.980 118.733 -0.753 19694
8569 1 19 . 1 1 35 35 LEU HA H 35 3.650 3.650 3.935 -0.285 19694
8570 1 19 . 1 1 35 35 LEU CA C 35 56.860 56.860 57.215 -0.355 19694
8571 1 19 . 1 1 35 35 LEU CB C 35 41.870 41.870 41.776 0.094 19694
8572 1 19 . 1 1 35 35 LEU H H 35 7.660 7.660 7.758 -0.098 19694
8573 1 19 . 1 1 36 36 PHE N N 36 113.900 113.900 113.849 0.051 19694
8574 1 19 . 1 1 36 36 PHE HA H 36 4.597 4.597 4.423 0.174 19694
8575 1 19 . 1 1 36 36 PHE CA C 36 56.860 56.860 56.353 0.507 19694
8576 1 19 . 1 1 36 36 PHE CB C 36 40.570 40.570 38.169 2.401 19694
8577 1 19 . 1 1 36 36 PHE H H 36 7.730 7.730 6.587 1.143 19694
8578 1 19 . 1 1 37 37 ALA N N 37 121.920 121.920 122.946 -1.026 19694
8579 1 19 . 1 1 37 37 ALA HA H 37 4.070 4.070 4.029 0.041 19694
8580 1 19 . 1 1 37 37 ALA CA C 37 52.900 52.900 52.364 0.536 19694
8581 1 19 . 1 1 37 37 ALA CB C 37 19.770 19.770 19.731 0.039 19694
8582 1 19 . 1 1 37 37 ALA H H 37 7.090 7.090 7.785 -0.695 19694
8583 1 19 . 1 1 38 38 ASN N N 38 119.230 119.230 119.346 -0.116 19694
8584 1 19 . 1 1 38 38 ASN HA H 38 4.450 4.450 4.691 -0.241 19694
8585 1 19 . 1 1 38 38 ASN CA C 38 52.850 52.850 52.384 0.466 19694
8586 1 19 . 1 1 38 38 ASN CB C 38 38.950 38.950 40.308 -1.358 19694
8587 1 19 . 1 1 38 38 ASN H H 38 8.790 8.790 8.299 0.491 19694
8588 1 19 . 1 1 39 39 THR N N 39 116.330 116.330 115.623 0.707 19694
8589 1 19 . 1 1 39 39 THR HA H 39 3.990 3.990 4.300 -0.310 19694
8590 1 19 . 1 1 39 39 THR CA C 39 62.130 62.130 62.451 -0.321 19694
8591 1 19 . 1 1 39 39 THR CB C 39 69.920 69.920 69.834 0.086 19694
8592 1 19 . 1 1 39 39 THR H H 39 8.540 8.540 8.282 0.258 19694
8593 1 19 . 1 1 40 40 CYS N N 40 126.950 126.950 127.968 -1.018 19694
8594 1 19 . 1 1 40 40 CYS HA H 40 4.300 4.300 4.421 -0.121 19694
8595 1 19 . 1 1 40 40 CYS CA C 40 58.350 58.350 57.311 1.039 19694
8596 1 19 . 1 1 40 40 CYS CB C 40 31.600 31.600 26.853 4.747 19694
8597 1 19 . 1 1 40 40 CYS H H 40 7.940 7.940 8.520 -0.580 19694
8598 1 19 . 1 1 41 41 GLU N N 41 130.560 130.560 127.648 2.912 19694
8599 1 19 . 1 1 41 41 GLU HA H 41 3.690 3.690 3.870 -0.180 19694
8600 1 19 . 1 1 41 41 GLU CA C 41 58.600 58.600 59.096 -0.496 19694
8601 1 19 . 1 1 41 41 GLU CB C 41 30.460 30.460 29.456 1.004 19694
8602 1 19 . 1 1 41 41 GLU H H 41 8.810 8.810 8.676 0.134 19694
8603 1 19 . 1 1 42 42 GLU N N 42 119.680 119.680 117.999 1.681 19694
8604 1 19 . 1 1 42 42 GLU HA H 42 4.570 4.570 4.348 0.222 19694
8605 1 19 . 1 1 42 42 GLU CA C 42 58.000 58.000 58.180 -0.180 19694
8606 1 19 . 1 1 42 42 GLU CB C 42 31.680 31.680 30.607 1.073 19694
8607 1 19 . 1 1 42 42 GLU H H 42 8.500 8.500 8.159 0.341 19694
8608 1 19 . 1 1 43 43 CYS N N 43 115.600 115.600 116.171 -0.571 19694
8609 1 19 . 1 1 43 43 CYS HA H 43 5.010 5.010 4.675 0.335 19694
8610 1 19 . 1 1 43 43 CYS CA C 43 58.810 58.810 60.010 -1.200 19694
8611 1 19 . 1 1 43 43 CYS CB C 43 31.580 31.580 29.777 1.803 19694
8612 1 19 . 1 1 43 43 CYS H H 43 8.120 8.120 7.925 0.195 19694
8613 1 19 . 1 1 44 44 GLY N N 44 112.100 112.100 108.815 3.285 19694
8614 1 19 . 1 1 44 44 GLY CA C 44 46.420 46.420 45.242 1.178 19694
8615 1 19 . 1 1 44 44 GLY H H 44 7.900 7.900 8.664 -0.764 19694
8616 1 19 . 1 1 45 45 LYS N N 45 121.210 121.210 120.555 0.655 19694
8617 1 19 . 1 1 45 45 LYS HA H 45 4.840 4.840 4.696 0.144 19694
8618 1 19 . 1 1 45 45 LYS CA C 45 54.360 54.360 52.959 1.401 19694
8619 1 19 . 1 1 45 45 LYS CB C 45 32.430 32.430 32.762 -0.332 19694
8620 1 19 . 1 1 45 45 LYS H H 45 8.180 8.180 7.822 0.358 19694
8621 1 19 . 1 1 46 46 PRO HA H 46 4.477 4.477 4.515 -0.038 19694
8622 1 19 . 1 1 46 46 PRO CA C 46 62.700 62.700 63.036 -0.336 19694
8623 1 19 . 1 1 46 46 PRO CB C 46 32.490 32.490 31.930 0.560 19694
8624 1 19 . 1 1 47 47 ILE N N 47 125.280 125.280 123.281 1.999 19694
8625 1 19 . 1 1 47 47 ILE HA H 47 3.830 3.830 4.307 -0.477 19694
8626 1 19 . 1 1 47 47 ILE CA C 47 61.040 61.040 60.703 0.337 19694
8627 1 19 . 1 1 47 47 ILE CB C 47 37.440 37.440 37.499 -0.059 19694
8628 1 19 . 1 1 47 47 ILE H H 47 8.540 8.540 8.909 -0.369 19694
8629 1 19 . 1 1 48 48 GLY N N 48 114.120 114.120 113.962 0.158 19694
8630 1 19 . 1 1 48 48 GLY CA C 48 45.240 45.240 44.569 0.671 19694
8631 1 19 . 1 1 48 48 GLY H H 48 8.660 8.660 8.457 0.203 19694
8632 1 19 . 1 1 49 49 CYS N N 49 117.140 117.140 118.710 -1.570 19694
8633 1 19 . 1 1 49 49 CYS HA H 49 4.280 4.280 4.327 -0.047 19694
8634 1 19 . 1 1 49 49 CYS CA C 49 60.880 60.880 59.794 1.086 19694
8635 1 19 . 1 1 49 49 CYS CB C 49 27.650 27.650 27.572 0.078 19694
8636 1 19 . 1 1 49 49 CYS H H 49 9.210 9.210 9.042 0.168 19694
8637 1 19 . 1 1 50 50 ASP N N 50 119.300 119.300 120.554 -1.254 19694
8638 1 19 . 1 1 50 50 ASP HA H 50 4.620 4.620 4.669 -0.049 19694
8639 1 19 . 1 1 50 50 ASP CA C 50 54.160 54.160 55.265 -1.105 19694
8640 1 19 . 1 1 50 50 ASP CB C 50 40.380 40.380 40.659 -0.279 19694
8641 1 19 . 1 1 50 50 ASP H H 50 8.800 8.800 8.411 0.389 19694
8642 1 19 . 1 1 51 51 CYS N N 51 118.150 118.150 116.805 1.345 19694
8643 1 19 . 1 1 51 51 CYS HA H 51 4.620 4.620 4.668 -0.048 19694
8644 1 19 . 1 1 51 51 CYS CA C 51 58.030 58.030 56.618 1.412 19694
8645 1 19 . 1 1 51 51 CYS CB C 51 30.090 30.090 31.659 -1.569 19694
8646 1 19 . 1 1 51 51 CYS H H 51 7.590 7.590 7.362 0.228 19694
8647 1 19 . 1 1 52 52 LYS N N 52 123.800 123.800 123.097 0.703 19694
8648 1 19 . 1 1 52 52 LYS HA H 52 4.180 4.180 4.256 -0.076 19694
8649 1 19 . 1 1 52 52 LYS CA C 52 57.240 57.240 57.140 0.100 19694
8650 1 19 . 1 1 52 52 LYS CB C 52 33.030 33.030 31.928 1.102 19694
8651 1 19 . 1 1 52 52 LYS H H 52 8.600 8.600 8.626 -0.026 19694
8652 1 19 . 1 1 53 53 ASP N N 53 124.900 124.900 124.026 0.874 19694
8653 1 19 . 1 1 53 53 ASP HA H 53 4.230 4.230 4.708 -0.478 19694
8654 1 19 . 1 1 53 53 ASP CA C 53 53.130 53.130 53.240 -0.110 19694
8655 1 19 . 1 1 53 53 ASP CB C 53 42.230 42.230 41.019 1.211 19694
8656 1 19 . 1 1 53 53 ASP H H 53 8.250 8.250 8.336 -0.086 19694
8657 1 19 . 1 1 54 54 LEU N N 54 130.160 130.160 125.792 4.368 19694
8658 1 19 . 1 1 54 54 LEU HA H 54 4.440 4.440 4.691 -0.251 19694
8659 1 19 . 1 1 54 54 LEU CA C 54 53.340 53.340 54.761 -1.421 19694
8660 1 19 . 1 1 54 54 LEU CB C 54 41.170 41.170 43.428 -2.258 19694
8661 1 19 . 1 1 54 54 LEU H H 54 8.670 8.670 9.021 -0.351 19694
8662 1 19 . 1 1 55 55 SER N N 55 113.820 113.820 121.770 -7.950 19694
8663 1 19 . 1 1 55 55 SER HA H 55 5.580 5.580 5.096 0.484 19694
8664 1 19 . 1 1 55 55 SER CA C 55 55.850 55.850 56.301 -0.451 19694
8665 1 19 . 1 1 55 55 SER CB C 55 67.300 67.300 64.458 2.842 19694
8666 1 19 . 1 1 55 55 SER H H 55 8.160 8.160 8.565 -0.405 19694
8667 1 19 . 1 1 56 56 TYR N N 56 122.610 122.610 125.931 -3.321 19694
8668 1 19 . 1 1 56 56 TYR HA H 56 4.620 4.620 4.622 -0.002 19694
8669 1 19 . 1 1 56 56 TYR CA C 56 58.810 58.810 58.687 0.123 19694
8670 1 19 . 1 1 56 56 TYR CB C 56 41.000 41.000 42.279 -1.279 19694
8671 1 19 . 1 1 56 56 TYR H H 56 8.450 8.450 8.738 -0.288 19694
8672 1 19 . 1 1 57 57 LYS N N 57 126.020 126.020 128.981 -2.961 19694
8673 1 19 . 1 1 57 57 LYS HA H 57 3.470 3.470 3.900 -0.430 19694
8674 1 19 . 1 1 57 57 LYS CA C 57 58.100 58.100 57.188 0.912 19694
8675 1 19 . 1 1 57 57 LYS CB C 57 29.480 29.480 32.106 -2.626 19694
8676 1 19 . 1 1 57 57 LYS H H 57 8.920 8.920 8.597 0.323 19694
8677 1 19 . 1 1 58 58 ASP HA H 58 3.830 3.830 4.220 -0.390 19694
8678 1 19 . 1 1 58 58 ASP CA C 58 54.900 54.900 55.344 -0.444 19694
8679 1 19 . 1 1 58 58 ASP CB C 58 40.080 40.080 40.544 -0.464 19694
8680 1 19 . 1 1 58 58 ASP H H 58 8.400 8.400 8.598 -0.198 19694
8681 1 19 . 1 1 59 59 ARG N N 59 121.190 121.190 116.037 5.153 19694
8682 1 19 . 1 1 59 59 ARG HA H 59 4.250 4.250 4.529 -0.279 19694
8683 1 19 . 1 1 59 59 ARG CA C 59 55.580 55.580 54.241 1.339 19694
8684 1 19 . 1 1 59 59 ARG CB C 59 33.460 33.460 33.556 -0.096 19694
8685 1 19 . 1 1 59 59 ARG H H 59 7.980 7.980 7.418 0.562 19694
8686 1 19 . 1 1 60 60 HIS N N 60 118.420 118.420 117.503 0.917 19694
8687 1 19 . 1 1 60 60 HIS HA H 60 5.270 5.270 5.647 -0.377 19694
8688 1 19 . 1 1 60 60 HIS CA C 60 55.010 55.010 55.108 -0.098 19694
8689 1 19 . 1 1 60 60 HIS CB C 60 32.380 32.380 33.483 -1.103 19694
8690 1 19 . 1 1 60 60 HIS H H 60 8.350 8.350 8.094 0.256 19694
8691 1 19 . 1 1 61 61 TRP N N 61 119.990 119.990 118.181 1.809 19694
8692 1 19 . 1 1 61 61 TRP HA H 61 5.930 5.930 4.782 1.148 19694
8693 1 19 . 1 1 61 61 TRP CA C 61 57.400 57.400 57.115 0.285 19694
8694 1 19 . 1 1 61 61 TRP CB C 61 35.380 35.380 34.179 1.201 19694
8695 1 19 . 1 1 61 61 TRP H H 61 9.310 9.310 9.266 0.044 19694
8696 1 19 . 1 1 62 62 HIS N N 62 117.270 117.270 121.751 -4.481 19694
8697 1 19 . 1 1 62 62 HIS HA H 62 4.600 4.600 5.019 -0.419 19694
8698 1 19 . 1 1 62 62 HIS CA C 62 59.210 59.210 57.136 2.074 19694
8699 1 19 . 1 1 62 62 HIS CB C 62 31.200 31.200 30.299 0.901 19694
8700 1 19 . 1 1 62 62 HIS H H 62 8.430 8.430 9.060 -0.630 19694
8701 1 19 . 1 1 63 63 GLU N N 63 124.640 124.640 128.363 -3.723 19694
8702 1 19 . 1 1 63 63 GLU HA H 63 3.827 3.827 3.950 -0.123 19694
8703 1 19 . 1 1 63 63 GLU CA C 63 61.020 61.020 59.439 1.581 19694
8704 1 19 . 1 1 63 63 GLU CB C 63 30.310 30.310 29.771 0.539 19694
8705 1 19 . 1 1 63 63 GLU H H 63 9.040 9.040 8.233 0.807 19694
8706 1 19 . 1 1 64 64 ALA N N 64 117.050 117.050 117.699 -0.649 19694
8707 1 19 . 1 1 64 64 ALA HA H 64 4.230 4.230 4.382 -0.152 19694
8708 1 19 . 1 1 64 64 ALA CA C 64 54.000 54.000 53.258 0.742 19694
8709 1 19 . 1 1 64 64 ALA CB C 64 18.880 18.880 19.018 -0.138 19694
8710 1 19 . 1 1 64 64 ALA H H 64 8.680 8.680 8.321 0.359 19694
8711 1 19 . 1 1 65 65 CYS N N 65 115.380 115.380 117.113 -1.733 19694
8712 1 19 . 1 1 65 65 CYS HA H 65 4.295 4.295 4.188 0.107 19694
8713 1 19 . 1 1 65 65 CYS CA C 65 59.850 59.850 60.259 -0.409 19694
8714 1 19 . 1 1 65 65 CYS CB C 65 32.840 32.840 26.826 6.014 19694
8715 1 19 . 1 1 65 65 CYS H H 65 7.490 7.490 8.187 -0.697 19694
8716 1 19 . 1 1 66 66 PHE N N 66 122.020 122.020 123.092 -1.072 19694
8717 1 19 . 1 1 66 66 PHE HA H 66 3.890 3.890 3.807 0.083 19694
8718 1 19 . 1 1 66 66 PHE CA C 66 57.010 57.010 58.455 -1.445 19694
8719 1 19 . 1 1 66 66 PHE CB C 66 38.070 38.070 38.196 -0.126 19694
8720 1 19 . 1 1 66 66 PHE H H 66 7.110 7.110 7.549 -0.439 19694
8721 1 19 . 1 1 67 67 HIS N N 67 121.280 121.280 121.849 -0.569 19694
8722 1 19 . 1 1 67 67 HIS HA H 67 4.720 4.720 5.285 -0.565 19694
8723 1 19 . 1 1 67 67 HIS CA C 67 52.730 52.730 52.947 -0.217 19694
8724 1 19 . 1 1 67 67 HIS CB C 67 32.230 32.230 30.868 1.362 19694
8725 1 19 . 1 1 67 67 HIS H H 67 7.380 7.380 7.506 -0.126 19694
8726 1 19 . 1 1 68 68 CYS N N 68 121.590 121.590 118.920 2.670 19694
8727 1 19 . 1 1 68 68 CYS HA H 68 3.960 3.960 4.984 -1.024 19694
8728 1 19 . 1 1 68 68 CYS CA C 68 59.790 59.790 57.920 1.870 19694
8729 1 19 . 1 1 68 68 CYS CB C 68 31.200 31.200 29.288 1.912 19694
8730 1 19 . 1 1 68 68 CYS H H 68 8.530 8.530 8.403 0.127 19694
8731 1 19 . 1 1 69 69 SER N N 69 126.530 126.530 120.234 6.296 19694
8732 1 19 . 1 1 69 69 SER HA H 69 4.310 4.310 4.108 0.202 19694
8733 1 19 . 1 1 69 69 SER CA C 69 61.760 61.760 60.743 1.017 19694
8734 1 19 . 1 1 69 69 SER CB C 69 64.040 64.040 63.338 0.702 19694
8735 1 19 . 1 1 69 69 SER H H 69 9.460 9.460 8.850 0.610 19694
8736 1 19 . 1 1 70 70 GLN N N 70 122.370 122.370 118.684 3.686 19694
8737 1 19 . 1 1 70 70 GLN HA H 70 4.510 4.510 4.417 0.093 19694
8738 1 19 . 1 1 70 70 GLN CA C 70 57.840 57.840 57.655 0.185 19694
8739 1 19 . 1 1 70 70 GLN CB C 70 30.430 30.430 29.741 0.689 19694
8740 1 19 . 1 1 70 70 GLN H H 70 8.980 8.980 7.961 1.019 19694
8741 1 19 . 1 1 71 71 CYS N N 71 118.860 118.860 116.423 2.437 19694
8742 1 19 . 1 1 71 71 CYS HA H 71 4.720 4.720 4.645 0.075 19694
8743 1 19 . 1 1 71 71 CYS CA C 71 59.770 59.770 58.472 1.298 19694
8744 1 19 . 1 1 71 71 CYS CB C 71 31.910 31.910 27.264 4.646 19694
8745 1 19 . 1 1 71 71 CYS H H 71 8.220 8.220 7.846 0.374 19694
8746 1 19 . 1 1 72 72 ARG N N 72 114.380 114.380 115.351 -0.971 19694
8747 1 19 . 1 1 72 72 ARG HA H 72 3.965 3.965 3.847 0.118 19694
8748 1 19 . 1 1 72 72 ARG CA C 72 58.030 58.030 56.676 1.354 19694
8749 1 19 . 1 1 72 72 ARG CB C 72 27.720 27.720 26.719 1.001 19694
8750 1 19 . 1 1 72 72 ARG H H 72 7.380 7.380 7.866 -0.486 19694
8751 1 19 . 1 1 73 73 ASN N N 73 121.480 121.480 116.775 4.705 19694
8752 1 19 . 1 1 73 73 ASN HA H 73 4.630 4.630 4.640 -0.010 19694
8753 1 19 . 1 1 73 73 ASN CA C 73 54.110 54.110 53.779 0.331 19694
8754 1 19 . 1 1 73 73 ASN CB C 73 38.870 38.870 39.550 -0.680 19694
8755 1 19 . 1 1 73 73 ASN H H 73 8.722 8.722 8.105 0.617 19694
8756 1 19 . 1 1 74 74 SER N N 74 114.710 114.710 118.134 -3.424 19694
8757 1 19 . 1 1 74 74 SER HA H 74 4.060 4.060 4.813 -0.753 19694
8758 1 19 . 1 1 74 74 SER CA C 74 59.357 59.357 58.374 0.983 19694
8759 1 19 . 1 1 74 74 SER CB C 74 63.300 63.300 63.069 0.231 19694
8760 1 19 . 1 1 74 74 SER H H 74 8.690 8.690 8.498 0.192 19694
8761 1 19 . 1 1 75 75 LEU N N 75 125.757 125.757 127.552 -1.795 19694
8762 1 19 . 1 1 75 75 LEU HA H 75 4.280 4.280 4.305 -0.025 19694
8763 1 19 . 1 1 75 75 LEU CA C 75 53.510 53.510 54.700 -1.190 19694
8764 1 19 . 1 1 75 75 LEU CB C 75 42.200 42.200 41.785 0.415 19694
8765 1 19 . 1 1 75 75 LEU H H 75 7.970 7.970 8.139 -0.169 19694
8766 1 19 . 1 1 76 76 VAL N N 76 120.860 120.860 124.626 -3.766 19694
8767 1 19 . 1 1 76 76 VAL HA H 76 3.570 3.570 3.852 -0.282 19694
8768 1 19 . 1 1 76 76 VAL CA C 76 65.420 65.420 60.901 4.519 19694
8769 1 19 . 1 1 76 76 VAL CB C 76 31.540 31.540 34.782 -3.242 19694
8770 1 19 . 1 1 76 76 VAL H H 76 7.830 7.830 8.002 -0.172 19694
8771 1 19 . 1 1 77 77 ASP N N 77 122.360 122.360 124.086 -1.726 19694
8772 1 19 . 1 1 77 77 ASP HA H 77 4.230 4.230 4.482 -0.252 19694
8773 1 19 . 1 1 77 77 ASP CA C 77 56.200 56.200 55.907 0.293 19694
8774 1 19 . 1 1 77 77 ASP CB C 77 39.380 39.380 40.940 -1.560 19694
8775 1 19 . 1 1 77 77 ASP H H 77 8.910 8.910 8.415 0.495 19694
8776 1 19 . 1 1 78 78 LYS N N 78 118.100 118.100 118.372 -0.272 19694
8777 1 19 . 1 1 78 78 LYS HA H 78 4.870 4.870 4.641 0.229 19694
8778 1 19 . 1 1 78 78 LYS CA C 78 56.960 56.960 53.642 3.318 19694
8779 1 19 . 1 1 78 78 LYS CB C 78 34.680 34.680 33.787 0.893 19694
8780 1 19 . 1 1 78 78 LYS H H 78 7.660 7.660 7.616 0.044 19694
8781 1 19 . 1 1 79 79 PRO HA H 79 4.460 4.460 4.211 0.249 19694
8782 1 19 . 1 1 79 79 PRO CA C 79 62.520 62.520 62.892 -0.372 19694
8783 1 19 . 1 1 79 79 PRO CB C 79 32.160 32.160 31.879 0.281 19694
8784 1 19 . 1 1 80 80 PHE N N 80 114.050 114.050 116.958 -2.908 19694
8785 1 19 . 1 1 80 80 PHE HA H 80 4.910 4.910 5.049 -0.139 19694
8786 1 19 . 1 1 80 80 PHE CA C 80 56.060 56.060 55.046 1.014 19694
8787 1 19 . 1 1 80 80 PHE CB C 80 42.410 42.410 41.953 0.457 19694
8788 1 19 . 1 1 80 80 PHE H H 80 7.510 7.510 7.122 0.388 19694
8789 1 19 . 1 1 81 81 ALA N N 81 123.290 123.290 123.577 -0.287 19694
8790 1 19 . 1 1 81 81 ALA HA H 81 4.310 4.310 4.327 -0.017 19694
8791 1 19 . 1 1 81 81 ALA CA C 81 50.450 50.450 50.341 0.109 19694
8792 1 19 . 1 1 81 81 ALA CB C 81 21.920 21.920 18.900 3.020 19694
8793 1 19 . 1 1 81 81 ALA H H 81 9.030 9.030 8.966 0.064 19694
8794 1 19 . 1 1 82 82 ALA N N 82 122.490 122.490 129.223 -6.733 19694
8795 1 19 . 1 1 82 82 ALA HA H 82 5.110 5.110 4.381 0.729 19694
8796 1 19 . 1 1 82 82 ALA CA C 82 51.100 51.100 51.609 -0.509 19694
8797 1 19 . 1 1 82 82 ALA CB C 82 21.130 21.130 18.819 2.311 19694
8798 1 19 . 1 1 82 82 ALA H H 82 8.240 8.240 8.635 -0.395 19694
8799 1 19 . 1 1 83 83 LYS N N 83 123.580 123.580 125.880 -2.300 19694
8800 1 19 . 1 1 83 83 LYS HA H 83 4.490 4.490 4.552 -0.062 19694
8801 1 19 . 1 1 83 83 LYS CA C 83 55.800 55.800 55.376 0.424 19694
8802 1 19 . 1 1 83 83 LYS CB C 83 34.720 34.720 34.082 0.638 19694
8803 1 19 . 1 1 83 83 LYS H H 83 8.400 8.400 8.299 0.101 19694
8804 1 19 . 1 1 84 84 GLU N N 84 125.470 125.470 120.360 5.110 19694
8805 1 19 . 1 1 84 84 GLU HA H 84 3.820 3.820 4.128 -0.308 19694
8806 1 19 . 1 1 84 84 GLU CA C 84 58.620 58.620 58.990 -0.370 19694
8807 1 19 . 1 1 84 84 GLU CB C 84 27.210 27.210 29.730 -2.520 19694
8808 1 19 . 1 1 84 84 GLU H H 84 9.320 9.320 8.811 0.509 19694
8809 1 19 . 1 1 85 85 ASP N N 85 118.550 118.550 114.414 4.136 19694
8810 1 19 . 1 1 85 85 ASP HA H 85 4.600 4.600 4.803 -0.203 19694
8811 1 19 . 1 1 85 85 ASP CA C 85 55.400 55.400 53.887 1.513 19694
8812 1 19 . 1 1 85 85 ASP CB C 85 40.400 40.400 42.097 -1.697 19694
8813 1 19 . 1 1 85 85 ASP H H 85 8.730 8.730 8.373 0.357 19694
8814 1 19 . 1 1 86 86 GLN N N 86 119.050 119.050 117.298 1.752 19694
8815 1 19 . 1 1 86 86 GLN HA H 86 4.540 4.540 4.707 -0.167 19694
8816 1 19 . 1 1 86 86 GLN CA C 86 55.100 55.100 54.015 1.085 19694
8817 1 19 . 1 1 86 86 GLN CB C 86 31.110 31.110 32.038 -0.928 19694
8818 1 19 . 1 1 86 86 GLN H H 86 8.170 8.170 7.592 0.578 19694
8819 1 19 . 1 1 87 87 LEU N N 87 123.110 123.110 121.318 1.792 19694
8820 1 19 . 1 1 87 87 LEU HA H 87 4.620 4.620 5.183 -0.563 19694
8821 1 19 . 1 1 87 87 LEU CA C 87 54.520 54.520 54.006 0.514 19694
8822 1 19 . 1 1 87 87 LEU CB C 87 42.700 42.700 44.572 -1.872 19694
8823 1 19 . 1 1 87 87 LEU H H 87 8.490 8.490 8.533 -0.043 19694
8824 1 19 . 1 1 88 88 LEU N N 88 123.690 123.690 120.184 3.506 19694
8825 1 19 . 1 1 88 88 LEU HA H 88 5.880 5.880 4.958 0.922 19694
8826 1 19 . 1 1 88 88 LEU CA C 88 53.340 53.340 52.827 0.513 19694
8827 1 19 . 1 1 88 88 LEU CB C 88 47.190 47.190 47.801 -0.611 19694
8828 1 19 . 1 1 88 88 LEU H H 88 8.930 8.930 8.345 0.585 19694
8829 1 19 . 1 1 89 89 CYS N N 89 122.270 122.270 119.066 3.204 19694
8830 1 19 . 1 1 89 89 CYS HA H 89 4.780 4.780 4.855 -0.075 19694
8831 1 19 . 1 1 89 89 CYS CA C 89 57.640 57.640 59.162 -1.522 19694
8832 1 19 . 1 1 89 89 CYS CB C 89 30.940 30.940 27.983 2.958 19694
8833 1 19 . 1 1 89 89 CYS H H 89 9.430 9.430 9.114 0.316 19694
8834 1 19 . 1 1 90 90 THR N N 90 110.620 110.620 116.233 -5.613 19694
8835 1 19 . 1 1 90 90 THR HA H 90 3.900 3.900 3.932 -0.032 19694
8836 1 19 . 1 1 90 90 THR CA C 90 65.460 65.460 65.543 -0.083 19694
8837 1 19 . 1 1 90 90 THR CB C 90 68.670 68.670 68.711 -0.041 19694
8838 1 19 . 1 1 90 90 THR H H 90 8.410 8.410 8.875 -0.465 19694
8839 1 19 . 1 1 91 91 ASP N N 91 123.470 123.470 121.989 1.481 19694
8840 1 19 . 1 1 91 91 ASP HA H 91 4.490 4.490 4.642 -0.152 19694
8841 1 19 . 1 1 91 91 ASP CA C 91 57.810 57.810 57.390 0.420 19694
8842 1 19 . 1 1 91 91 ASP CB C 91 41.160 41.160 40.772 0.388 19694
8843 1 19 . 1 1 91 91 ASP H H 91 8.150 8.150 8.343 -0.193 19694
8844 1 19 . 1 1 92 92 CYS N N 92 123.800 123.800 119.543 4.257 19694
8845 1 19 . 1 1 92 92 CYS HA H 92 3.970 3.970 4.315 -0.345 19694
8846 1 19 . 1 1 92 92 CYS CA C 92 64.100 64.100 61.144 2.956 19694
8847 1 19 . 1 1 92 92 CYS CB C 92 30.090 30.090 25.784 4.306 19694
8848 1 19 . 1 1 92 92 CYS H H 92 8.580 8.580 7.945 0.635 19694
8849 1 19 . 1 1 93 93 TYR N N 93 120.730 120.730 120.997 -0.267 19694
8850 1 19 . 1 1 93 93 TYR HA H 93 4.140 4.140 4.081 0.059 19694
8851 1 19 . 1 1 93 93 TYR CA C 93 60.380 60.380 61.547 -1.167 19694
8852 1 19 . 1 1 93 93 TYR CB C 93 39.300 39.300 38.373 0.927 19694
8853 1 19 . 1 1 93 93 TYR H H 93 8.540 8.540 9.142 -0.602 19694
8854 1 19 . 1 1 94 94 SER N N 94 115.010 115.010 112.845 2.165 19694
8855 1 19 . 1 1 94 94 SER HA H 94 4.220 4.220 4.271 -0.051 19694
8856 1 19 . 1 1 94 94 SER CA C 94 59.300 59.300 61.091 -1.791 19694
8857 1 19 . 1 1 94 94 SER CB C 94 63.660 63.660 62.769 0.891 19694
8858 1 19 . 1 1 94 94 SER H H 94 7.750 7.750 8.111 -0.361 19694
8859 1 19 . 1 1 95 95 ASN N N 95 119.820 119.820 118.760 1.060 19694
8860 1 19 . 1 1 95 95 ASN HA H 95 4.510 4.510 4.618 -0.108 19694
8861 1 19 . 1 1 95 95 ASN CA C 95 53.880 53.880 55.149 -1.269 19694
8862 1 19 . 1 1 95 95 ASN CB C 95 39.300 39.300 39.008 0.292 19694
8863 1 19 . 1 1 95 95 ASN H H 95 7.780 7.780 7.835 -0.055 19694
8864 1 19 . 1 1 96 96 GLU N N 96 119.820 119.820 116.750 3.070 19694
8865 1 19 . 1 1 96 96 GLU HA H 96 4.096 4.096 4.290 -0.194 19694
8866 1 19 . 1 1 96 96 GLU CA C 96 56.910 56.910 56.589 0.321 19694
8867 1 19 . 1 1 96 96 GLU CB C 96 30.220 30.220 30.151 0.069 19694
8868 1 19 . 1 1 96 96 GLU H H 96 7.950 7.950 7.744 0.206 19694
8869 1 19 . 1 1 97 97 TYR N N 97 120.370 120.370 120.473 -0.103 19694
8870 1 19 . 1 1 97 97 TYR HA H 97 4.620 4.620 4.243 0.377 19694
8871 1 19 . 1 1 97 97 TYR CA C 97 57.700 57.700 58.581 -0.881 19694
8872 1 19 . 1 1 97 97 TYR CB C 97 38.710 38.710 38.603 0.107 19694
8873 1 19 . 1 1 97 97 TYR H H 97 8.070 8.070 8.633 -0.563 19694
8874 1 20 . 1 1 2 2 THR N N 2 113.570 113.570 115.668 -2.098 19694
8875 1 20 . 1 1 2 2 THR HA H 2 4.240 4.240 4.320 -0.080 19694
8876 1 20 . 1 1 2 2 THR CA C 2 62.130 62.130 62.520 -0.390 19694
8877 1 20 . 1 1 2 2 THR CB C 2 69.250 69.250 69.277 -0.027 19694
8878 1 20 . 1 1 2 2 THR H H 2 8.090 8.090 8.065 0.025 19694
8879 1 20 . 1 1 3 3 GLU N N 3 122.880 122.880 120.935 1.945 19694
8880 1 20 . 1 1 3 3 GLU HA H 3 4.280 4.280 4.193 0.087 19694
8881 1 20 . 1 1 3 3 GLU CA C 3 56.860 56.860 56.580 0.280 19694
8882 1 20 . 1 1 3 3 GLU CB C 3 30.570 30.570 30.248 0.322 19694
8883 1 20 . 1 1 3 3 GLU H H 3 8.280 8.280 8.064 0.216 19694
8884 1 20 . 1 1 4 4 ARG N N 4 121.330 121.330 119.493 1.837 19694
8885 1 20 . 1 1 4 4 ARG HA H 4 4.300 4.300 4.541 -0.241 19694
8886 1 20 . 1 1 4 4 ARG CA C 4 55.870 55.870 55.286 0.584 19694
8887 1 20 . 1 1 4 4 ARG CB C 4 31.640 31.640 30.810 0.830 19694
8888 1 20 . 1 1 4 4 ARG H H 4 8.280 8.280 8.532 -0.252 19694
8889 1 20 . 1 1 5 5 PHE N N 5 125.490 125.490 124.876 0.614 19694
8890 1 20 . 1 1 5 5 PHE HA H 5 4.610 4.610 4.586 0.024 19694
8891 1 20 . 1 1 5 5 PHE CA C 5 56.380 56.380 56.371 0.009 19694
8892 1 20 . 1 1 5 5 PHE CB C 5 39.560 39.560 39.650 -0.090 19694
8893 1 20 . 1 1 5 5 PHE H H 5 8.290 8.290 8.714 -0.424 19694
8894 1 20 . 1 1 6 6 ASP N N 6 123.260 123.260 121.851 1.409 19694
8895 1 20 . 1 1 6 6 ASP HA H 6 5.045 5.045 4.792 0.253 19694
8896 1 20 . 1 1 6 6 ASP CA C 6 52.180 52.180 52.947 -0.767 19694
8897 1 20 . 1 1 6 6 ASP CB C 6 44.210 44.210 44.587 -0.377 19694
8898 1 20 . 1 1 6 6 ASP H H 6 7.940 7.940 7.631 0.309 19694
8899 1 20 . 1 1 7 7 CYS N N 7 121.440 121.440 122.784 -1.344 19694
8900 1 20 . 1 1 7 7 CYS HA H 7 3.960 3.960 4.399 -0.439 19694
8901 1 20 . 1 1 7 7 CYS CA C 7 59.820 59.820 59.481 0.339 19694
8902 1 20 . 1 1 7 7 CYS CB C 7 30.950 30.950 26.353 4.597 19694
8903 1 20 . 1 1 7 7 CYS H H 7 8.700 8.700 8.636 0.064 19694
8904 1 20 . 1 1 8 8 HIS N N 8 129.390 129.390 129.978 -0.588 19694
8905 1 20 . 1 1 8 8 HIS HA H 8 4.200 4.200 4.230 -0.030 19694
8906 1 20 . 1 1 8 8 HIS CA C 8 58.240 58.240 59.683 -1.443 19694
8907 1 20 . 1 1 8 8 HIS CB C 8 29.480 29.480 30.079 -0.599 19694
8908 1 20 . 1 1 8 8 HIS H H 8 9.160 9.160 9.631 -0.471 19694
8909 1 20 . 1 1 9 9 HIS N N 9 118.740 118.740 117.595 1.145 19694
8910 1 20 . 1 1 9 9 HIS HA H 9 4.880 4.880 4.486 0.394 19694
8911 1 20 . 1 1 9 9 HIS CA C 9 58.680 58.680 57.217 1.463 19694
8912 1 20 . 1 1 9 9 HIS CB C 9 31.040 31.040 30.395 0.645 19694
8913 1 20 . 1 1 9 9 HIS H H 9 9.270 9.270 8.051 1.219 19694
8914 1 20 . 1 1 10 10 CYS N N 10 118.600 118.600 117.189 1.411 19694
8915 1 20 . 1 1 10 10 CYS HA H 10 4.600 4.600 4.495 0.105 19694
8916 1 20 . 1 1 10 10 CYS CA C 10 59.600 59.600 59.006 0.594 19694
8917 1 20 . 1 1 10 10 CYS CB C 10 32.330 32.330 28.057 4.273 19694
8918 1 20 . 1 1 10 10 CYS H H 10 8.550 8.550 7.844 0.706 19694
8919 1 20 . 1 1 11 11 ASN N N 11 116.220 116.220 118.421 -2.201 19694
8920 1 20 . 1 1 11 11 ASN HA H 11 4.410 4.410 4.375 0.035 19694
8921 1 20 . 1 1 11 11 ASN CA C 11 55.640 55.640 54.589 1.051 19694
8922 1 20 . 1 1 11 11 ASN CB C 11 38.200 38.200 37.822 0.378 19694
8923 1 20 . 1 1 11 11 ASN H H 11 7.690 7.690 8.661 -0.971 19694
8924 1 20 . 1 1 12 12 GLU N N 12 120.330 120.330 117.880 2.450 19694
8925 1 20 . 1 1 12 12 GLU HA H 12 4.220 4.220 4.474 -0.254 19694
8926 1 20 . 1 1 12 12 GLU CA C 12 56.700 56.700 55.310 1.390 19694
8927 1 20 . 1 1 12 12 GLU CB C 12 30.910 30.910 30.825 0.085 19694
8928 1 20 . 1 1 12 12 GLU H H 12 8.210 8.210 7.764 0.446 19694
8929 1 20 . 1 1 13 13 SER N N 13 116.190 116.190 119.942 -3.752 19694
8930 1 20 . 1 1 13 13 SER HA H 13 4.060 4.060 4.505 -0.445 19694
8931 1 20 . 1 1 13 13 SER CA C 13 59.350 59.350 59.029 0.321 19694
8932 1 20 . 1 1 13 13 SER CB C 13 63.820 63.820 63.517 0.303 19694
8933 1 20 . 1 1 13 13 SER H H 13 8.520 8.520 8.697 -0.177 19694
8934 1 20 . 1 1 14 14 LEU N N 14 126.060 126.060 124.220 1.840 19694
8935 1 20 . 1 1 14 14 LEU HA H 14 4.310 4.310 4.346 -0.036 19694
8936 1 20 . 1 1 14 14 LEU CA C 14 54.100 54.100 55.839 -1.739 19694
8937 1 20 . 1 1 14 14 LEU CB C 14 42.200 42.200 41.474 0.726 19694
8938 1 20 . 1 1 14 14 LEU H H 14 8.910 8.910 7.716 1.194 19694
8939 1 20 . 1 1 15 15 PHE N N 15 120.660 120.660 121.158 -0.498 19694
8940 1 20 . 1 1 15 15 PHE HA H 15 4.480 4.480 4.607 -0.127 19694
8941 1 20 . 1 1 15 15 PHE CA C 15 60.400 60.400 56.094 4.306 19694
8942 1 20 . 1 1 15 15 PHE CB C 15 38.130 38.130 38.005 0.125 19694
8943 1 20 . 1 1 15 15 PHE H H 15 7.820 7.820 8.552 -0.732 19694
8944 1 20 . 1 1 16 16 GLY N N 16 114.730 114.730 110.945 3.785 19694
8945 1 20 . 1 1 16 16 GLY CA C 16 45.900 45.900 45.805 0.095 19694
8946 1 20 . 1 1 16 16 GLY H H 16 8.860 8.860 8.805 0.055 19694
8947 1 20 . 1 1 17 17 LYS N N 17 119.580 119.580 119.683 -0.103 19694
8948 1 20 . 1 1 17 17 LYS HA H 17 4.480 4.480 4.468 0.012 19694
8949 1 20 . 1 1 17 17 LYS CA C 17 54.460 54.460 54.450 0.010 19694
8950 1 20 . 1 1 17 17 LYS CB C 17 35.800 35.800 33.910 1.891 19694
8951 1 20 . 1 1 17 17 LYS H H 17 8.030 8.030 7.212 0.818 19694
8952 1 20 . 1 1 18 18 LYS N N 18 120.330 120.330 122.466 -2.136 19694
8953 1 20 . 1 1 18 18 LYS HA H 18 4.280 4.280 4.311 -0.031 19694
8954 1 20 . 1 1 18 18 LYS CA C 18 56.800 56.800 57.572 -0.772 19694
8955 1 20 . 1 1 18 18 LYS CB C 18 33.010 33.010 33.269 -0.259 19694
8956 1 20 . 1 1 18 18 LYS H H 18 8.190 8.190 8.590 -0.400 19694
8957 1 20 . 1 1 19 19 TYR N N 19 117.500 117.500 114.921 2.579 19694
8958 1 20 . 1 1 19 19 TYR HA H 19 5.240 5.240 4.805 0.435 19694
8959 1 20 . 1 1 19 19 TYR CA C 19 55.340 55.340 56.283 -0.944 19694
8960 1 20 . 1 1 19 19 TYR CB C 19 42.850 42.850 40.250 2.600 19694
8961 1 20 . 1 1 19 19 TYR H H 19 7.610 7.610 7.917 -0.307 19694
8962 1 20 . 1 1 20 20 ILE N N 20 121.430 121.430 121.830 -0.400 19694
8963 1 20 . 1 1 20 20 ILE HA H 20 4.137 4.137 4.237 -0.100 19694
8964 1 20 . 1 1 20 20 ILE CA C 20 60.010 60.010 60.105 -0.095 19694
8965 1 20 . 1 1 20 20 ILE CB C 20 41.570 41.570 40.631 0.939 19694
8966 1 20 . 1 1 20 20 ILE H H 20 9.350 9.350 8.198 1.152 19694
8967 1 20 . 1 1 21 21 LEU N N 21 126.720 126.720 126.144 0.576 19694
8968 1 20 . 1 1 21 21 LEU HA H 21 5.090 5.090 4.677 0.413 19694
8969 1 20 . 1 1 21 21 LEU CA C 21 54.020 54.020 53.941 0.078 19694
8970 1 20 . 1 1 21 21 LEU CB C 21 43.720 43.720 40.758 2.962 19694
8971 1 20 . 1 1 21 21 LEU H H 21 8.530 8.530 8.506 0.024 19694
8972 1 20 . 1 1 22 22 ARG N N 22 123.930 123.930 126.214 -2.284 19694
8973 1 20 . 1 1 22 22 ARG HA H 22 4.440 4.440 4.467 -0.027 19694
8974 1 20 . 1 1 22 22 ARG CA C 22 55.600 55.600 54.485 1.115 19694
8975 1 20 . 1 1 22 22 ARG CB C 22 32.280 32.280 32.055 0.225 19694
8976 1 20 . 1 1 22 22 ARG H H 22 9.080 9.080 8.874 0.206 19694
8977 1 20 . 1 1 23 23 GLU N N 23 128.500 128.500 124.513 3.987 19694
8978 1 20 . 1 1 23 23 GLU HA H 23 3.840 3.840 3.955 -0.115 19694
8979 1 20 . 1 1 23 23 GLU CA C 23 58.030 58.030 57.860 0.170 19694
8980 1 20 . 1 1 23 23 GLU CB C 23 27.200 27.200 27.482 -0.282 19694
8981 1 20 . 1 1 23 23 GLU H H 23 9.610 9.610 9.007 0.603 19694
8982 1 20 . 1 1 24 24 GLU N N 24 110.300 110.300 113.475 -3.175 19694
8983 1 20 . 1 1 24 24 GLU HA H 24 3.780 3.780 3.916 -0.136 19694
8984 1 20 . 1 1 24 24 GLU CA C 24 58.320 58.320 57.306 1.014 19694
8985 1 20 . 1 1 24 24 GLU CB C 24 28.220 28.220 28.376 -0.156 19694
8986 1 20 . 1 1 24 24 GLU H H 24 8.660 8.660 8.701 -0.041 19694
8987 1 20 . 1 1 25 25 SER N N 25 117.700 117.700 112.703 4.997 19694
8988 1 20 . 1 1 25 25 SER HA H 25 4.890 4.890 4.766 0.124 19694
8989 1 20 . 1 1 25 25 SER CA C 25 56.540 56.540 55.635 0.905 19694
8990 1 20 . 1 1 25 25 SER CB C 25 64.720 64.720 65.398 -0.678 19694
8991 1 20 . 1 1 25 25 SER H H 25 7.900 7.900 7.766 0.134 19694
8992 1 20 . 1 1 26 26 PRO HA H 26 4.995 4.995 4.862 0.133 19694
8993 1 20 . 1 1 26 26 PRO CA C 26 61.750 61.750 63.038 -1.288 19694
8994 1 20 . 1 1 26 26 PRO CB C 26 32.660 32.660 31.649 1.011 19694
8995 1 20 . 1 1 27 27 TYR N N 27 118.100 118.100 123.624 -5.524 19694
8996 1 20 . 1 1 27 27 TYR HA H 27 5.910 5.910 4.981 0.929 19694
8997 1 20 . 1 1 27 27 TYR CA C 27 56.830 56.830 54.851 1.979 19694
8998 1 20 . 1 1 27 27 TYR CB C 27 42.810 42.810 42.528 0.283 19694
8999 1 20 . 1 1 27 27 TYR H H 27 9.040 9.040 8.700 0.340 19694
9000 1 20 . 1 1 28 28 CYS N N 28 122.230 122.230 119.274 2.956 19694
9001 1 20 . 1 1 28 28 CYS HA H 28 4.850 4.850 4.721 0.129 19694
9002 1 20 . 1 1 28 28 CYS CA C 28 58.110 58.110 58.084 0.026 19694
9003 1 20 . 1 1 28 28 CYS CB C 28 30.530 30.530 29.138 1.392 19694
9004 1 20 . 1 1 28 28 CYS H H 28 9.850 9.850 8.392 1.458 19694
9005 1 20 . 1 1 29 29 VAL N N 29 118.200 118.200 123.294 -5.094 19694
9006 1 20 . 1 1 29 29 VAL HA H 29 3.650 3.650 3.646 0.004 19694
9007 1 20 . 1 1 29 29 VAL CA C 29 67.400 67.400 66.686 0.714 19694
9008 1 20 . 1 1 29 29 VAL CB C 29 31.860 31.860 31.536 0.324 19694
9009 1 20 . 1 1 29 29 VAL H H 29 8.430 8.430 8.954 -0.524 19694
9010 1 20 . 1 1 30 30 VAL N N 30 119.570 119.570 118.952 0.618 19694
9011 1 20 . 1 1 30 30 VAL HA H 30 3.860 3.860 3.434 0.426 19694
9012 1 20 . 1 1 30 30 VAL CA C 30 66.450 66.450 66.527 -0.077 19694
9013 1 20 . 1 1 30 30 VAL CB C 30 31.540 31.540 31.197 0.343 19694
9014 1 20 . 1 1 30 30 VAL H H 30 7.700 7.700 8.217 -0.517 19694
9015 1 20 . 1 1 31 31 CYS N N 31 125.890 125.890 119.215 6.675 19694
9016 1 20 . 1 1 31 31 CYS HA H 31 3.830 3.830 3.885 -0.055 19694
9017 1 20 . 1 1 31 31 CYS CA C 31 65.850 65.850 64.271 1.579 19694
9018 1 20 . 1 1 31 31 CYS CB C 31 29.510 29.510 25.478 4.032 19694
9019 1 20 . 1 1 31 31 CYS H H 31 9.050 9.050 7.614 1.436 19694
9020 1 20 . 1 1 32 32 PHE N N 32 119.000 119.000 119.360 -0.360 19694
9021 1 20 . 1 1 32 32 PHE HA H 32 3.780 3.780 3.681 0.099 19694
9022 1 20 . 1 1 32 32 PHE CA C 32 62.610 62.610 61.759 0.851 19694
9023 1 20 . 1 1 32 32 PHE CB C 32 39.920 39.920 39.035 0.885 19694
9024 1 20 . 1 1 32 32 PHE H H 32 9.080 9.080 7.887 1.193 19694
9025 1 20 . 1 1 33 33 GLU N N 33 117.470 117.470 118.028 -0.558 19694
9026 1 20 . 1 1 33 33 GLU HA H 33 3.760 3.760 4.071 -0.311 19694
9027 1 20 . 1 1 33 33 GLU CA C 33 59.210 59.210 59.531 -0.321 19694
9028 1 20 . 1 1 33 33 GLU CB C 33 29.480 29.480 29.212 0.268 19694
9029 1 20 . 1 1 33 33 GLU H H 33 8.510 8.510 8.388 0.122 19694
9030 1 20 . 1 1 34 34 THR N N 34 114.140 114.140 115.573 -1.433 19694
9031 1 20 . 1 1 34 34 THR HA H 34 3.730 3.730 3.941 -0.211 19694
9032 1 20 . 1 1 34 34 THR CA C 34 65.890 65.890 65.967 -0.077 19694
9033 1 20 . 1 1 34 34 THR CB C 34 69.210 69.210 68.713 0.497 19694
9034 1 20 . 1 1 34 34 THR H H 34 7.880 7.880 8.339 -0.459 19694
9035 1 20 . 1 1 35 35 LEU N N 35 117.980 117.980 118.612 -0.632 19694
9036 1 20 . 1 1 35 35 LEU HA H 35 3.650 3.650 3.943 -0.293 19694
9037 1 20 . 1 1 35 35 LEU CA C 35 56.860 56.860 57.199 -0.339 19694
9038 1 20 . 1 1 35 35 LEU CB C 35 41.870 41.870 41.687 0.183 19694
9039 1 20 . 1 1 35 35 LEU H H 35 7.660 7.660 7.719 -0.059 19694
9040 1 20 . 1 1 36 36 PHE N N 36 113.900 113.900 112.901 0.999 19694
9041 1 20 . 1 1 36 36 PHE HA H 36 4.597 4.597 4.470 0.127 19694
9042 1 20 . 1 1 36 36 PHE CA C 36 56.860 56.860 56.420 0.440 19694
9043 1 20 . 1 1 36 36 PHE CB C 36 40.570 40.570 38.317 2.253 19694
9044 1 20 . 1 1 36 36 PHE H H 36 7.730 7.730 6.679 1.051 19694
9045 1 20 . 1 1 37 37 ALA N N 37 121.920 121.920 123.736 -1.816 19694
9046 1 20 . 1 1 37 37 ALA HA H 37 4.070 4.070 4.121 -0.051 19694
9047 1 20 . 1 1 37 37 ALA CA C 37 52.900 52.900 52.360 0.540 19694
9048 1 20 . 1 1 37 37 ALA CB C 37 19.770 19.770 19.585 0.185 19694
9049 1 20 . 1 1 37 37 ALA H H 37 7.090 7.090 7.846 -0.756 19694
9050 1 20 . 1 1 38 38 ASN N N 38 119.230 119.230 119.590 -0.360 19694
9051 1 20 . 1 1 38 38 ASN HA H 38 4.450 4.450 4.637 -0.187 19694
9052 1 20 . 1 1 38 38 ASN CA C 38 52.850 52.850 52.728 0.122 19694
9053 1 20 . 1 1 38 38 ASN CB C 38 38.950 38.950 39.908 -0.958 19694
9054 1 20 . 1 1 38 38 ASN H H 38 8.790 8.790 8.381 0.409 19694
9055 1 20 . 1 1 39 39 THR N N 39 116.330 116.330 115.728 0.602 19694
9056 1 20 . 1 1 39 39 THR HA H 39 3.990 3.990 4.388 -0.398 19694
9057 1 20 . 1 1 39 39 THR CA C 39 62.130 62.130 62.456 -0.326 19694
9058 1 20 . 1 1 39 39 THR CB C 39 69.920 69.920 69.827 0.093 19694
9059 1 20 . 1 1 39 39 THR H H 39 8.540 8.540 8.133 0.407 19694
9060 1 20 . 1 1 40 40 CYS N N 40 126.950 126.950 128.072 -1.122 19694
9061 1 20 . 1 1 40 40 CYS HA H 40 4.300 4.300 4.432 -0.132 19694
9062 1 20 . 1 1 40 40 CYS CA C 40 58.350 58.350 57.189 1.161 19694
9063 1 20 . 1 1 40 40 CYS CB C 40 31.600 31.600 26.669 4.931 19694
9064 1 20 . 1 1 40 40 CYS H H 40 7.940 7.940 8.531 -0.591 19694
9065 1 20 . 1 1 41 41 GLU N N 41 130.560 130.560 127.622 2.938 19694
9066 1 20 . 1 1 41 41 GLU HA H 41 3.690 3.690 3.839 -0.149 19694
9067 1 20 . 1 1 41 41 GLU CA C 41 58.600 58.600 59.128 -0.528 19694
9068 1 20 . 1 1 41 41 GLU CB C 41 30.460 30.460 29.421 1.039 19694
9069 1 20 . 1 1 41 41 GLU H H 41 8.810 8.810 8.655 0.155 19694
9070 1 20 . 1 1 42 42 GLU N N 42 119.680 119.680 118.207 1.473 19694
9071 1 20 . 1 1 42 42 GLU HA H 42 4.570 4.570 4.330 0.240 19694
9072 1 20 . 1 1 42 42 GLU CA C 42 58.000 58.000 58.210 -0.210 19694
9073 1 20 . 1 1 42 42 GLU CB C 42 31.680 31.680 30.509 1.171 19694
9074 1 20 . 1 1 42 42 GLU H H 42 8.500 8.500 8.127 0.373 19694
9075 1 20 . 1 1 43 43 CYS N N 43 115.600 115.600 116.238 -0.638 19694
9076 1 20 . 1 1 43 43 CYS HA H 43 5.010 5.010 4.603 0.407 19694
9077 1 20 . 1 1 43 43 CYS CA C 43 58.810 58.810 60.086 -1.276 19694
9078 1 20 . 1 1 43 43 CYS CB C 43 31.580 31.580 29.445 2.135 19694
9079 1 20 . 1 1 43 43 CYS H H 43 8.120 8.120 7.938 0.182 19694
9080 1 20 . 1 1 44 44 GLY N N 44 112.100 112.100 107.659 4.441 19694
9081 1 20 . 1 1 44 44 GLY CA C 44 46.420 46.420 45.188 1.232 19694
9082 1 20 . 1 1 44 44 GLY H H 44 7.900 7.900 8.636 -0.736 19694
9083 1 20 . 1 1 45 45 LYS N N 45 121.210 121.210 121.558 -0.348 19694
9084 1 20 . 1 1 45 45 LYS HA H 45 4.840 4.840 4.687 0.153 19694
9085 1 20 . 1 1 45 45 LYS CA C 45 54.360 54.360 52.738 1.622 19694
9086 1 20 . 1 1 45 45 LYS CB C 45 32.430 32.430 32.805 -0.375 19694
9087 1 20 . 1 1 45 45 LYS H H 45 8.180 8.180 7.834 0.346 19694
9088 1 20 . 1 1 46 46 PRO HA H 46 4.477 4.477 4.502 -0.025 19694
9089 1 20 . 1 1 46 46 PRO CA C 46 62.700 62.700 63.050 -0.350 19694
9090 1 20 . 1 1 46 46 PRO CB C 46 32.490 32.490 32.042 0.448 19694
9091 1 20 . 1 1 47 47 ILE N N 47 125.280 125.280 122.946 2.334 19694
9092 1 20 . 1 1 47 47 ILE HA H 47 3.830 3.830 4.284 -0.454 19694
9093 1 20 . 1 1 47 47 ILE CA C 47 61.040 61.040 60.822 0.218 19694
9094 1 20 . 1 1 47 47 ILE CB C 47 37.440 37.440 37.944 -0.504 19694
9095 1 20 . 1 1 47 47 ILE H H 47 8.540 8.540 8.850 -0.310 19694
9096 1 20 . 1 1 48 48 GLY N N 48 114.120 114.120 113.336 0.784 19694
9097 1 20 . 1 1 48 48 GLY CA C 48 45.240 45.240 44.568 0.672 19694
9098 1 20 . 1 1 48 48 GLY H H 48 8.660 8.660 8.623 0.037 19694
9099 1 20 . 1 1 49 49 CYS N N 49 117.140 117.140 120.909 -3.769 19694
9100 1 20 . 1 1 49 49 CYS HA H 49 4.280 4.280 4.324 -0.044 19694
9101 1 20 . 1 1 49 49 CYS CA C 49 60.880 60.880 59.659 1.221 19694
9102 1 20 . 1 1 49 49 CYS CB C 49 27.650 27.650 27.987 -0.337 19694
9103 1 20 . 1 1 49 49 CYS H H 49 9.210 9.210 8.652 0.558 19694
9104 1 20 . 1 1 50 50 ASP N N 50 119.300 119.300 119.928 -0.628 19694
9105 1 20 . 1 1 50 50 ASP HA H 50 4.620 4.620 4.604 0.016 19694
9106 1 20 . 1 1 50 50 ASP CA C 50 54.160 54.160 55.720 -1.560 19694
9107 1 20 . 1 1 50 50 ASP CB C 50 40.380 40.380 40.314 0.066 19694
9108 1 20 . 1 1 50 50 ASP H H 50 8.800 8.800 8.462 0.338 19694
9109 1 20 . 1 1 51 51 CYS N N 51 118.150 118.150 117.671 0.479 19694
9110 1 20 . 1 1 51 51 CYS HA H 51 4.620 4.620 4.673 -0.053 19694
9111 1 20 . 1 1 51 51 CYS CA C 51 58.030 58.030 57.804 0.226 19694
9112 1 20 . 1 1 51 51 CYS CB C 51 30.090 30.090 30.112 -0.022 19694
9113 1 20 . 1 1 51 51 CYS H H 51 7.590 7.590 7.454 0.136 19694
9114 1 20 . 1 1 52 52 LYS N N 52 123.800 123.800 122.262 1.538 19694
9115 1 20 . 1 1 52 52 LYS HA H 52 4.180 4.180 4.232 -0.052 19694
9116 1 20 . 1 1 52 52 LYS CA C 52 57.240 57.240 56.437 0.803 19694
9117 1 20 . 1 1 52 52 LYS CB C 52 33.030 33.030 31.843 1.187 19694
9118 1 20 . 1 1 52 52 LYS H H 52 8.600 8.600 8.623 -0.023 19694
9119 1 20 . 1 1 53 53 ASP N N 53 124.900 124.900 125.404 -0.504 19694
9120 1 20 . 1 1 53 53 ASP HA H 53 4.230 4.230 4.764 -0.534 19694
9121 1 20 . 1 1 53 53 ASP CA C 53 53.130 53.130 53.683 -0.553 19694
9122 1 20 . 1 1 53 53 ASP CB C 53 42.230 42.230 41.957 0.273 19694
9123 1 20 . 1 1 53 53 ASP H H 53 8.250 8.250 8.246 0.004 19694
9124 1 20 . 1 1 54 54 LEU N N 54 130.160 130.160 127.452 2.708 19694
9125 1 20 . 1 1 54 54 LEU HA H 54 4.440 4.440 4.751 -0.311 19694
9126 1 20 . 1 1 54 54 LEU CA C 54 53.340 53.340 54.221 -0.881 19694
9127 1 20 . 1 1 54 54 LEU CB C 54 41.170 41.170 43.938 -2.768 19694
9128 1 20 . 1 1 54 54 LEU H H 54 8.670 8.670 9.137 -0.467 19694
9129 1 20 . 1 1 55 55 SER N N 55 113.820 113.820 121.229 -7.409 19694
9130 1 20 . 1 1 55 55 SER HA H 55 5.580 5.580 5.023 0.557 19694
9131 1 20 . 1 1 55 55 SER CA C 55 55.850 55.850 56.792 -0.942 19694
9132 1 20 . 1 1 55 55 SER CB C 55 67.300 67.300 64.445 2.855 19694
9133 1 20 . 1 1 55 55 SER H H 55 8.160 8.160 8.573 -0.413 19694
9134 1 20 . 1 1 56 56 TYR N N 56 122.610 122.610 125.933 -3.323 19694
9135 1 20 . 1 1 56 56 TYR HA H 56 4.620 4.620 4.642 -0.022 19694
9136 1 20 . 1 1 56 56 TYR CA C 56 58.810 58.810 58.437 0.374 19694
9137 1 20 . 1 1 56 56 TYR CB C 56 41.000 41.000 42.552 -1.552 19694
9138 1 20 . 1 1 56 56 TYR H H 56 8.450 8.450 8.927 -0.477 19694
9139 1 20 . 1 1 57 57 LYS N N 57 126.020 126.020 129.150 -3.130 19694
9140 1 20 . 1 1 57 57 LYS HA H 57 3.470 3.470 3.865 -0.395 19694
9141 1 20 . 1 1 57 57 LYS CA C 57 58.100 58.100 57.524 0.576 19694
9142 1 20 . 1 1 57 57 LYS CB C 57 29.480 29.480 32.059 -2.579 19694
9143 1 20 . 1 1 57 57 LYS H H 57 8.920 8.920 8.725 0.195 19694
9144 1 20 . 1 1 58 58 ASP HA H 58 3.830 3.830 4.224 -0.394 19694
9145 1 20 . 1 1 58 58 ASP CA C 58 54.900 54.900 55.353 -0.453 19694
9146 1 20 . 1 1 58 58 ASP CB C 58 40.080 40.080 40.828 -0.748 19694
9147 1 20 . 1 1 58 58 ASP H H 58 8.400 8.400 8.481 -0.081 19694
9148 1 20 . 1 1 59 59 ARG N N 59 121.190 121.190 115.997 5.193 19694
9149 1 20 . 1 1 59 59 ARG HA H 59 4.250 4.250 4.625 -0.375 19694
9150 1 20 . 1 1 59 59 ARG CA C 59 55.580 55.580 54.414 1.166 19694
9151 1 20 . 1 1 59 59 ARG CB C 59 33.460 33.460 33.598 -0.138 19694
9152 1 20 . 1 1 59 59 ARG H H 59 7.980 7.980 7.880 0.100 19694
9153 1 20 . 1 1 60 60 HIS N N 60 118.420 118.420 117.557 0.863 19694
9154 1 20 . 1 1 60 60 HIS HA H 60 5.270 5.270 5.647 -0.377 19694
9155 1 20 . 1 1 60 60 HIS CA C 60 55.010 55.010 55.159 -0.149 19694
9156 1 20 . 1 1 60 60 HIS CB C 60 32.380 32.380 33.300 -0.920 19694
9157 1 20 . 1 1 60 60 HIS H H 60 8.350 8.350 8.165 0.185 19694
9158 1 20 . 1 1 61 61 TRP N N 61 119.990 119.990 118.175 1.815 19694
9159 1 20 . 1 1 61 61 TRP HA H 61 5.930 5.930 4.775 1.155 19694
9160 1 20 . 1 1 61 61 TRP CA C 61 57.400 57.400 57.133 0.267 19694
9161 1 20 . 1 1 61 61 TRP CB C 61 35.380 35.380 34.168 1.212 19694
9162 1 20 . 1 1 61 61 TRP H H 61 9.310 9.310 9.286 0.024 19694
9163 1 20 . 1 1 62 62 HIS N N 62 117.270 117.270 121.996 -4.726 19694
9164 1 20 . 1 1 62 62 HIS HA H 62 4.600 4.600 4.832 -0.232 19694
9165 1 20 . 1 1 62 62 HIS CA C 62 59.210 59.210 57.614 1.596 19694
9166 1 20 . 1 1 62 62 HIS CB C 62 31.200 31.200 30.452 0.748 19694
9167 1 20 . 1 1 62 62 HIS H H 62 8.430 8.430 9.123 -0.693 19694
9168 1 20 . 1 1 63 63 GLU N N 63 124.640 124.640 128.496 -3.856 19694
9169 1 20 . 1 1 63 63 GLU HA H 63 3.827 3.827 3.959 -0.132 19694
9170 1 20 . 1 1 63 63 GLU CA C 63 61.020 61.020 59.548 1.472 19694
9171 1 20 . 1 1 63 63 GLU CB C 63 30.310 30.310 29.813 0.497 19694
9172 1 20 . 1 1 63 63 GLU H H 63 9.040 9.040 8.449 0.591 19694
9173 1 20 . 1 1 64 64 ALA N N 64 117.050 117.050 117.484 -0.434 19694
9174 1 20 . 1 1 64 64 ALA HA H 64 4.230 4.230 4.398 -0.168 19694
9175 1 20 . 1 1 64 64 ALA CA C 64 54.000 54.000 53.237 0.763 19694
9176 1 20 . 1 1 64 64 ALA CB C 64 18.880 18.880 19.030 -0.150 19694
9177 1 20 . 1 1 64 64 ALA H H 64 8.680 8.680 8.387 0.293 19694
9178 1 20 . 1 1 65 65 CYS N N 65 115.380 115.380 117.163 -1.783 19694
9179 1 20 . 1 1 65 65 CYS HA H 65 4.295 4.295 4.225 0.070 19694
9180 1 20 . 1 1 65 65 CYS CA C 65 59.850 59.850 60.250 -0.400 19694
9181 1 20 . 1 1 65 65 CYS CB C 65 32.840 32.840 26.964 5.876 19694
9182 1 20 . 1 1 65 65 CYS H H 65 7.490 7.490 8.146 -0.656 19694
9183 1 20 . 1 1 66 66 PHE N N 66 122.020 122.020 123.068 -1.048 19694
9184 1 20 . 1 1 66 66 PHE HA H 66 3.890 3.890 3.771 0.119 19694
9185 1 20 . 1 1 66 66 PHE CA C 66 57.010 57.010 58.467 -1.457 19694
9186 1 20 . 1 1 66 66 PHE CB C 66 38.070 38.070 38.107 -0.037 19694
9187 1 20 . 1 1 66 66 PHE H H 66 7.110 7.110 7.589 -0.479 19694
9188 1 20 . 1 1 67 67 HIS N N 67 121.280 121.280 121.740 -0.460 19694
9189 1 20 . 1 1 67 67 HIS HA H 67 4.720 4.720 5.205 -0.485 19694
9190 1 20 . 1 1 67 67 HIS CA C 67 52.730 52.730 53.171 -0.441 19694
9191 1 20 . 1 1 67 67 HIS CB C 67 32.230 32.230 30.837 1.393 19694
9192 1 20 . 1 1 67 67 HIS H H 67 7.380 7.380 7.429 -0.049 19694
9193 1 20 . 1 1 68 68 CYS N N 68 121.590 121.590 118.943 2.647 19694
9194 1 20 . 1 1 68 68 CYS HA H 68 3.960 3.960 4.983 -1.023 19694
9195 1 20 . 1 1 68 68 CYS CA C 68 59.790 59.790 57.998 1.792 19694
9196 1 20 . 1 1 68 68 CYS CB C 68 31.200 31.200 29.337 1.863 19694
9197 1 20 . 1 1 68 68 CYS H H 68 8.530 8.530 8.340 0.190 19694
9198 1 20 . 1 1 69 69 SER N N 69 126.530 126.530 120.081 6.449 19694
9199 1 20 . 1 1 69 69 SER HA H 69 4.310 4.310 4.087 0.223 19694
9200 1 20 . 1 1 69 69 SER CA C 69 61.760 61.760 60.622 1.138 19694
9201 1 20 . 1 1 69 69 SER CB C 69 64.040 64.040 63.248 0.792 19694
9202 1 20 . 1 1 69 69 SER H H 69 9.460 9.460 8.715 0.745 19694
9203 1 20 . 1 1 70 70 GLN N N 70 122.370 122.370 117.630 4.740 19694
9204 1 20 . 1 1 70 70 GLN HA H 70 4.510 4.510 4.408 0.102 19694
9205 1 20 . 1 1 70 70 GLN CA C 70 57.840 57.840 56.995 0.845 19694
9206 1 20 . 1 1 70 70 GLN CB C 70 30.430 30.430 29.760 0.670 19694
9207 1 20 . 1 1 70 70 GLN H H 70 8.980 8.980 7.769 1.211 19694
9208 1 20 . 1 1 71 71 CYS N N 71 118.860 118.860 116.703 2.157 19694
9209 1 20 . 1 1 71 71 CYS HA H 71 4.720 4.720 4.637 0.083 19694
9210 1 20 . 1 1 71 71 CYS CA C 71 59.770 59.770 58.154 1.616 19694
9211 1 20 . 1 1 71 71 CYS CB C 71 31.910 31.910 28.011 3.899 19694
9212 1 20 . 1 1 71 71 CYS H H 71 8.220 8.220 7.796 0.424 19694
9213 1 20 . 1 1 72 72 ARG N N 72 114.380 114.380 116.119 -1.739 19694
9214 1 20 . 1 1 72 72 ARG HA H 72 3.965 3.965 3.805 0.160 19694
9215 1 20 . 1 1 72 72 ARG CA C 72 58.030 58.030 56.867 1.163 19694
9216 1 20 . 1 1 72 72 ARG CB C 72 27.720 27.720 26.829 0.891 19694
9217 1 20 . 1 1 72 72 ARG H H 72 7.380 7.380 7.936 -0.556 19694
9218 1 20 . 1 1 73 73 ASN N N 73 121.480 121.480 116.539 4.941 19694
9219 1 20 . 1 1 73 73 ASN HA H 73 4.630 4.630 4.620 0.010 19694
9220 1 20 . 1 1 73 73 ASN CA C 73 54.110 54.110 54.029 0.082 19694
9221 1 20 . 1 1 73 73 ASN CB C 73 38.870 38.870 39.549 -0.679 19694
9222 1 20 . 1 1 73 73 ASN H H 73 8.722 8.722 8.107 0.615 19694
9223 1 20 . 1 1 74 74 SER N N 74 114.710 114.710 118.031 -3.321 19694
9224 1 20 . 1 1 74 74 SER HA H 74 4.060 4.060 4.752 -0.692 19694
9225 1 20 . 1 1 74 74 SER CA C 74 59.357 59.357 58.520 0.837 19694
9226 1 20 . 1 1 74 74 SER CB C 74 63.300 63.300 62.956 0.344 19694
9227 1 20 . 1 1 74 74 SER H H 74 8.690 8.690 8.517 0.173 19694
9228 1 20 . 1 1 75 75 LEU N N 75 125.757 125.757 127.648 -1.891 19694
9229 1 20 . 1 1 75 75 LEU HA H 75 4.280 4.280 4.318 -0.038 19694
9230 1 20 . 1 1 75 75 LEU CA C 75 53.510 53.510 54.673 -1.163 19694
9231 1 20 . 1 1 75 75 LEU CB C 75 42.200 42.200 41.882 0.319 19694
9232 1 20 . 1 1 75 75 LEU H H 75 7.970 7.970 8.090 -0.120 19694
9233 1 20 . 1 1 76 76 VAL N N 76 120.860 120.860 124.396 -3.536 19694
9234 1 20 . 1 1 76 76 VAL HA H 76 3.570 3.570 3.858 -0.288 19694
9235 1 20 . 1 1 76 76 VAL CA C 76 65.420 65.420 60.978 4.441 19694
9236 1 20 . 1 1 76 76 VAL CB C 76 31.540 31.540 34.757 -3.217 19694
9237 1 20 . 1 1 76 76 VAL H H 76 7.830 7.830 8.043 -0.213 19694
9238 1 20 . 1 1 77 77 ASP N N 77 122.360 122.360 123.888 -1.528 19694
9239 1 20 . 1 1 77 77 ASP HA H 77 4.230 4.230 4.471 -0.241 19694
9240 1 20 . 1 1 77 77 ASP CA C 77 56.200 56.200 55.889 0.311 19694
9241 1 20 . 1 1 77 77 ASP CB C 77 39.380 39.380 40.989 -1.609 19694
9242 1 20 . 1 1 77 77 ASP H H 77 8.910 8.910 8.444 0.466 19694
9243 1 20 . 1 1 78 78 LYS N N 78 118.100 118.100 118.451 -0.351 19694
9244 1 20 . 1 1 78 78 LYS HA H 78 4.870 4.870 4.642 0.228 19694
9245 1 20 . 1 1 78 78 LYS CA C 78 56.960 56.960 53.681 3.279 19694
9246 1 20 . 1 1 78 78 LYS CB C 78 34.680 34.680 33.753 0.927 19694
9247 1 20 . 1 1 78 78 LYS H H 78 7.660 7.660 7.623 0.037 19694
9248 1 20 . 1 1 79 79 PRO HA H 79 4.460 4.460 4.213 0.247 19694
9249 1 20 . 1 1 79 79 PRO CA C 79 62.520 62.520 62.983 -0.463 19694
9250 1 20 . 1 1 79 79 PRO CB C 79 32.160 32.160 31.854 0.306 19694
9251 1 20 . 1 1 80 80 PHE N N 80 114.050 114.050 117.141 -3.091 19694
9252 1 20 . 1 1 80 80 PHE HA H 80 4.910 4.910 5.028 -0.118 19694
9253 1 20 . 1 1 80 80 PHE CA C 80 56.060 56.060 55.103 0.957 19694
9254 1 20 . 1 1 80 80 PHE CB C 80 42.410 42.410 41.839 0.571 19694
9255 1 20 . 1 1 80 80 PHE H H 80 7.510 7.510 7.188 0.322 19694
9256 1 20 . 1 1 81 81 ALA N N 81 123.290 123.290 123.597 -0.307 19694
9257 1 20 . 1 1 81 81 ALA HA H 81 4.310 4.310 4.354 -0.044 19694
9258 1 20 . 1 1 81 81 ALA CA C 81 50.450 50.450 50.389 0.061 19694
9259 1 20 . 1 1 81 81 ALA CB C 81 21.920 21.920 18.982 2.938 19694
9260 1 20 . 1 1 81 81 ALA H H 81 9.030 9.030 8.987 0.043 19694
9261 1 20 . 1 1 82 82 ALA N N 82 122.490 122.490 128.346 -5.856 19694
9262 1 20 . 1 1 82 82 ALA HA H 82 5.110 5.110 4.375 0.735 19694
9263 1 20 . 1 1 82 82 ALA CA C 82 51.100 51.100 51.907 -0.807 19694
9264 1 20 . 1 1 82 82 ALA CB C 82 21.130 21.130 18.803 2.327 19694
9265 1 20 . 1 1 82 82 ALA H H 82 8.240 8.240 8.574 -0.334 19694
9266 1 20 . 1 1 83 83 LYS N N 83 123.580 123.580 125.929 -2.349 19694
9267 1 20 . 1 1 83 83 LYS HA H 83 4.490 4.490 4.490 -0.000 19694
9268 1 20 . 1 1 83 83 LYS CA C 83 55.800 55.800 55.602 0.198 19694
9269 1 20 . 1 1 83 83 LYS CB C 83 34.720 34.720 34.099 0.621 19694
9270 1 20 . 1 1 83 83 LYS H H 83 8.400 8.400 8.301 0.099 19694
9271 1 20 . 1 1 84 84 GLU N N 84 125.470 125.470 120.068 5.402 19694
9272 1 20 . 1 1 84 84 GLU HA H 84 3.820 3.820 4.132 -0.312 19694
9273 1 20 . 1 1 84 84 GLU CA C 84 58.620 58.620 59.144 -0.524 19694
9274 1 20 . 1 1 84 84 GLU CB C 84 27.210 27.210 29.558 -2.348 19694
9275 1 20 . 1 1 84 84 GLU H H 84 9.320 9.320 8.669 0.651 19694
9276 1 20 . 1 1 85 85 ASP N N 85 118.550 118.550 113.996 4.554 19694
9277 1 20 . 1 1 85 85 ASP HA H 85 4.600 4.600 4.780 -0.180 19694
9278 1 20 . 1 1 85 85 ASP CA C 85 55.400 55.400 53.972 1.428 19694
9279 1 20 . 1 1 85 85 ASP CB C 85 40.400 40.400 41.947 -1.547 19694
9280 1 20 . 1 1 85 85 ASP H H 85 8.730 8.730 8.226 0.504 19694
9281 1 20 . 1 1 86 86 GLN N N 86 119.050 119.050 116.694 2.356 19694
9282 1 20 . 1 1 86 86 GLN HA H 86 4.540 4.540 4.694 -0.154 19694
9283 1 20 . 1 1 86 86 GLN CA C 86 55.100 55.100 53.954 1.146 19694
9284 1 20 . 1 1 86 86 GLN CB C 86 31.110 31.110 32.030 -0.920 19694
9285 1 20 . 1 1 86 86 GLN H H 86 8.170 8.170 7.589 0.581 19694
9286 1 20 . 1 1 87 87 LEU N N 87 123.110 123.110 121.312 1.798 19694
9287 1 20 . 1 1 87 87 LEU HA H 87 4.620 4.620 5.204 -0.584 19694
9288 1 20 . 1 1 87 87 LEU CA C 87 54.520 54.520 54.013 0.507 19694
9289 1 20 . 1 1 87 87 LEU CB C 87 42.700 42.700 44.570 -1.870 19694
9290 1 20 . 1 1 87 87 LEU H H 87 8.490 8.490 8.533 -0.043 19694
9291 1 20 . 1 1 88 88 LEU N N 88 123.690 123.690 120.225 3.465 19694
9292 1 20 . 1 1 88 88 LEU HA H 88 5.880 5.880 4.969 0.911 19694
9293 1 20 . 1 1 88 88 LEU CA C 88 53.340 53.340 52.792 0.548 19694
9294 1 20 . 1 1 88 88 LEU CB C 88 47.190 47.190 47.811 -0.621 19694
9295 1 20 . 1 1 88 88 LEU H H 88 8.930 8.930 8.353 0.577 19694
9296 1 20 . 1 1 89 89 CYS N N 89 122.270 122.270 119.002 3.268 19694
9297 1 20 . 1 1 89 89 CYS HA H 89 4.780 4.780 4.816 -0.036 19694
9298 1 20 . 1 1 89 89 CYS CA C 89 57.640 57.640 59.491 -1.851 19694
9299 1 20 . 1 1 89 89 CYS CB C 89 30.940 30.940 27.818 3.122 19694
9300 1 20 . 1 1 89 89 CYS H H 89 9.430 9.430 9.106 0.324 19694
9301 1 20 . 1 1 90 90 THR N N 90 110.620 110.620 117.165 -6.545 19694
9302 1 20 . 1 1 90 90 THR HA H 90 3.900 3.900 3.941 -0.041 19694
9303 1 20 . 1 1 90 90 THR CA C 90 65.460 65.460 65.770 -0.310 19694
9304 1 20 . 1 1 90 90 THR CB C 90 68.670 68.670 68.856 -0.186 19694
9305 1 20 . 1 1 90 90 THR H H 90 8.410 8.410 8.880 -0.470 19694
9306 1 20 . 1 1 91 91 ASP N N 91 123.470 123.470 121.417 2.053 19694
9307 1 20 . 1 1 91 91 ASP HA H 91 4.490 4.490 4.647 -0.157 19694
9308 1 20 . 1 1 91 91 ASP CA C 91 57.810 57.810 56.893 0.917 19694
9309 1 20 . 1 1 91 91 ASP CB C 91 41.160 41.160 40.525 0.635 19694
9310 1 20 . 1 1 91 91 ASP H H 91 8.150 8.150 8.307 -0.157 19694
9311 1 20 . 1 1 92 92 CYS N N 92 123.800 123.800 119.620 4.180 19694
9312 1 20 . 1 1 92 92 CYS HA H 92 3.970 3.970 4.237 -0.267 19694
9313 1 20 . 1 1 92 92 CYS CA C 92 64.100 64.100 61.211 2.889 19694
9314 1 20 . 1 1 92 92 CYS CB C 92 30.090 30.090 25.619 4.471 19694
9315 1 20 . 1 1 92 92 CYS H H 92 8.580 8.580 7.933 0.647 19694
9316 1 20 . 1 1 93 93 TYR N N 93 120.730 120.730 120.889 -0.159 19694
9317 1 20 . 1 1 93 93 TYR HA H 93 4.140 4.140 4.090 0.050 19694
9318 1 20 . 1 1 93 93 TYR CA C 93 60.380 60.380 61.277 -0.897 19694
9319 1 20 . 1 1 93 93 TYR CB C 93 39.300 39.300 38.344 0.955 19694
9320 1 20 . 1 1 93 93 TYR H H 93 8.540 8.540 9.144 -0.604 19694
9321 1 20 . 1 1 94 94 SER N N 94 115.010 115.010 113.173 1.837 19694
9322 1 20 . 1 1 94 94 SER HA H 94 4.220 4.220 4.232 -0.012 19694
9323 1 20 . 1 1 94 94 SER CA C 94 59.300 59.300 61.290 -1.990 19694
9324 1 20 . 1 1 94 94 SER CB C 94 63.660 63.660 62.594 1.065 19694
9325 1 20 . 1 1 94 94 SER H H 94 7.750 7.750 8.083 -0.333 19694
9326 1 20 . 1 1 95 95 ASN N N 95 119.820 119.820 118.942 0.878 19694
9327 1 20 . 1 1 95 95 ASN HA H 95 4.510 4.510 4.579 -0.069 19694
9328 1 20 . 1 1 95 95 ASN CA C 95 53.880 53.880 55.335 -1.455 19694
9329 1 20 . 1 1 95 95 ASN CB C 95 39.300 39.300 39.048 0.252 19694
9330 1 20 . 1 1 95 95 ASN H H 95 7.780 7.780 7.849 -0.069 19694
9331 1 20 . 1 1 96 96 GLU N N 96 119.820 119.820 116.062 3.758 19694
9332 1 20 . 1 1 96 96 GLU HA H 96 4.096 4.096 4.195 -0.099 19694
9333 1 20 . 1 1 96 96 GLU CA C 96 56.910 56.910 57.438 -0.528 19694
9334 1 20 . 1 1 96 96 GLU CB C 96 30.220 30.220 29.551 0.669 19694
9335 1 20 . 1 1 96 96 GLU H H 96 7.950 7.950 7.488 0.462 19694
9336 1 20 . 1 1 97 97 TYR N N 97 120.370 120.370 121.991 -1.621 19694
9337 1 20 . 1 1 97 97 TYR HA H 97 4.620 4.620 4.000 0.620 19694
9338 1 20 . 1 1 97 97 TYR CA C 97 57.700 57.700 59.257 -1.557 19694
9339 1 20 . 1 1 97 97 TYR CB C 97 38.710 38.710 38.320 0.390 19694
9340 1 20 . 1 1 97 97 TYR H H 97 8.070 8.070 8.536 -0.466 19694
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 92 2.977 -0.272 2.981 19694
2 1 1 "Average Difference" HA 99 0.335 0.028 0.336 19694
3 1 1 "Average Difference" C 0 0.000 0.000 0.000 19694
4 1 1 "Average Difference" CA 96 1.284 -0.280 1.259 19694
5 1 1 "Average Difference" CB 93 1.740 -0.630 1.631 19694
6 1 1 "Average Difference" HN 93 0.549 -0.120 0.539 19694
7 1 2 "Average Difference" N 92 2.966 -0.207 2.975 19694
8 1 2 "Average Difference" HA 99 0.337 0.016 0.338 19694
9 1 2 "Average Difference" C 0 0.000 0.000 0.000 19694
10 1 2 "Average Difference" CA 96 1.238 -0.284 1.211 19694
11 1 2 "Average Difference" CB 93 1.767 -0.697 1.633 19694
12 1 2 "Average Difference" HN 93 0.535 -0.110 0.527 19694
13 1 3 "Average Difference" N 92 2.968 -0.253 2.973 19694
14 1 3 "Average Difference" HA 99 0.330 0.023 0.331 19694
15 1 3 "Average Difference" C 0 0.000 0.000 0.000 19694
16 1 3 "Average Difference" CA 96 1.204 -0.254 1.183 19694
17 1 3 "Average Difference" CB 93 1.768 -0.626 1.662 19694
18 1 3 "Average Difference" HN 93 0.543 -0.122 0.532 19694
19 1 4 "Average Difference" N 92 2.896 -0.292 2.897 19694
20 1 4 "Average Difference" HA 99 0.329 0.019 0.330 19694
21 1 4 "Average Difference" C 0 0.000 0.000 0.000 19694
22 1 4 "Average Difference" CA 96 1.228 -0.309 1.194 19694
23 1 4 "Average Difference" CB 93 1.742 -0.647 1.627 19694
24 1 4 "Average Difference" HN 93 0.546 -0.137 0.532 19694
25 1 5 "Average Difference" N 92 2.844 -0.220 2.851 19694
26 1 5 "Average Difference" HA 99 0.335 0.009 0.337 19694
27 1 5 "Average Difference" C 0 0.000 0.000 0.000 19694
28 1 5 "Average Difference" CA 96 1.185 -0.287 1.155 19694
29 1 5 "Average Difference" CB 93 1.793 -0.672 1.671 19694
30 1 5 "Average Difference" HN 93 0.556 -0.140 0.541 19694
31 1 6 "Average Difference" N 92 2.964 -0.203 2.973 19694
32 1 6 "Average Difference" HA 99 0.339 0.009 0.341 19694
33 1 6 "Average Difference" C 0 0.000 0.000 0.000 19694
34 1 6 "Average Difference" CA 96 1.242 -0.269 1.219 19694
35 1 6 "Average Difference" CB 93 1.764 -0.697 1.629 19694
36 1 6 "Average Difference" HN 93 0.547 -0.114 0.538 19694
37 1 7 "Average Difference" N 92 2.935 -0.261 2.939 19694
38 1 7 "Average Difference" HA 99 0.325 0.018 0.326 19694
39 1 7 "Average Difference" C 0 0.000 0.000 0.000 19694
40 1 7 "Average Difference" CA 96 1.232 -0.245 1.214 19694
41 1 7 "Average Difference" CB 93 1.736 -0.630 1.626 19694
42 1 7 "Average Difference" HN 93 0.543 -0.116 0.534 19694
43 1 8 "Average Difference" N 92 2.838 -0.234 2.844 19694
44 1 8 "Average Difference" HA 99 0.323 0.017 0.324 19694
45 1 8 "Average Difference" C 0 0.000 0.000 0.000 19694
46 1 8 "Average Difference" CA 96 1.211 -0.294 1.181 19694
47 1 8 "Average Difference" CB 93 1.745 -0.657 1.625 19694
48 1 8 "Average Difference" HN 93 0.544 -0.119 0.533 19694
49 1 9 "Average Difference" N 92 3.031 -0.304 3.032 19694
50 1 9 "Average Difference" HA 99 0.334 0.029 0.335 19694
51 1 9 "Average Difference" C 0 0.000 0.000 0.000 19694
52 1 9 "Average Difference" CA 96 1.232 -0.280 1.207 19694
53 1 9 "Average Difference" CB 93 1.728 -0.667 1.603 19694
54 1 9 "Average Difference" HN 93 0.540 -0.133 0.527 19694
55 1 10 "Average Difference" N 92 2.851 -0.311 2.850 19694
56 1 10 "Average Difference" HA 99 0.337 0.020 0.338 19694
57 1 10 "Average Difference" C 0 0.000 0.000 0.000 19694
58 1 10 "Average Difference" CA 96 1.278 -0.343 1.238 19694
59 1 10 "Average Difference" CB 93 1.775 -0.665 1.655 19694
60 1 10 "Average Difference" HN 93 0.533 -0.125 0.521 19694
61 1 11 "Average Difference" N 92 2.979 -0.225 2.986 19694
62 1 11 "Average Difference" HA 99 0.338 0.034 0.338 19694
63 1 11 "Average Difference" C 0 0.000 0.000 0.000 19694
64 1 11 "Average Difference" CA 96 1.242 -0.345 1.200 19694
65 1 11 "Average Difference" CB 93 1.758 -0.633 1.649 19694
66 1 11 "Average Difference" HN 93 0.553 -0.099 0.547 19694
67 1 12 "Average Difference" N 92 2.960 -0.231 2.967 19694
68 1 12 "Average Difference" HA 99 0.325 0.015 0.327 19694
69 1 12 "Average Difference" C 0 0.000 0.000 0.000 19694
70 1 12 "Average Difference" CA 96 1.257 -0.345 1.216 19694
71 1 12 "Average Difference" CB 93 1.771 -0.699 1.636 19694
72 1 12 "Average Difference" HN 93 0.547 -0.111 0.538 19694
73 1 13 "Average Difference" N 92 2.943 -0.275 2.946 19694
74 1 13 "Average Difference" HA 99 0.326 0.013 0.328 19694
75 1 13 "Average Difference" C 0 0.000 0.000 0.000 19694
76 1 13 "Average Difference" CA 96 1.214 -0.315 1.178 19694
77 1 13 "Average Difference" CB 93 1.809 -0.692 1.681 19694
78 1 13 "Average Difference" HN 93 0.549 -0.105 0.542 19694
79 1 14 "Average Difference" N 92 2.868 -0.263 2.872 19694
80 1 14 "Average Difference" HA 99 0.334 0.025 0.335 19694
81 1 14 "Average Difference" C 0 0.000 0.000 0.000 19694
82 1 14 "Average Difference" CA 96 1.218 -0.310 1.184 19694
83 1 14 "Average Difference" CB 93 1.763 -0.636 1.654 19694
84 1 14 "Average Difference" HN 93 0.542 -0.119 0.531 19694
85 1 15 "Average Difference" N 92 2.935 -0.214 2.943 19694
86 1 15 "Average Difference" HA 99 0.335 0.020 0.336 19694
87 1 15 "Average Difference" C 0 0.000 0.000 0.000 19694
88 1 15 "Average Difference" CA 96 1.253 -0.328 1.215 19694
89 1 15 "Average Difference" CB 93 1.817 -0.636 1.711 19694
90 1 15 "Average Difference" HN 93 0.541 -0.098 0.535 19694
91 1 16 "Average Difference" N 92 2.920 -0.217 2.928 19694
92 1 16 "Average Difference" HA 99 0.332 0.027 0.332 19694
93 1 16 "Average Difference" C 0 0.000 0.000 0.000 19694
94 1 16 "Average Difference" CA 96 1.273 -0.268 1.251 19694
95 1 16 "Average Difference" CB 93 1.721 -0.600 1.622 19694
96 1 16 "Average Difference" HN 93 0.545 -0.132 0.532 19694
97 1 17 "Average Difference" N 92 3.018 -0.246 3.024 19694
98 1 17 "Average Difference" HA 99 0.330 0.011 0.331 19694
99 1 17 "Average Difference" C 0 0.000 0.000 0.000 19694
100 1 17 "Average Difference" CA 96 1.269 -0.277 1.245 19694
101 1 17 "Average Difference" CB 93 1.747 -0.667 1.623 19694
102 1 17 "Average Difference" HN 93 0.554 -0.136 0.540 19694
103 1 18 "Average Difference" N 92 2.888 -0.285 2.889 19694
104 1 18 "Average Difference" HA 99 0.316 0.024 0.316 19694
105 1 18 "Average Difference" C 0 0.000 0.000 0.000 19694
106 1 18 "Average Difference" CA 96 1.261 -0.329 1.223 19694
107 1 18 "Average Difference" CB 93 1.825 -0.648 1.716 19694
108 1 18 "Average Difference" HN 93 0.542 -0.117 0.532 19694
109 1 19 "Average Difference" N 92 2.844 -0.268 2.846 19694
110 1 19 "Average Difference" HA 99 0.326 0.030 0.327 19694
111 1 19 "Average Difference" C 0 0.000 0.000 0.000 19694
112 1 19 "Average Difference" CA 96 1.215 -0.355 1.168 19694
113 1 19 "Average Difference" CB 93 1.769 -0.625 1.664 19694
114 1 19 "Average Difference" HN 93 0.537 -0.118 0.527 19694
115 1 20 "Average Difference" N 92 2.965 -0.214 2.973 19694
116 1 20 "Average Difference" HA 99 0.332 0.013 0.334 19694
117 1 20 "Average Difference" C 0 0.000 0.000 0.000 19694
118 1 20 "Average Difference" CA 96 1.208 -0.293 1.178 19694
119 1 20 "Average Difference" CB 93 1.745 -0.623 1.639 19694
120 1 20 "Average Difference" HN 93 0.543 -0.116 0.534 19694
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 19694
_Entity_delta_chem_shifts.ID 2
_Entity_delta_chem_shifts.Details
;
This saveframe contains the averaged SPARTA chemical shift over all the models used.
;
loop_
_Delta_CS.Atom_chem_shift_ID
_Delta_CS.Entity_delta_chem_shifts_ID
_Delta_CS.Assembly_atom_ID
_Delta_CS.Entity_assembly_ID
_Delta_CS.Entity_ID
_Delta_CS.Comp_index_ID
_Delta_CS.Seq_ID
_Delta_CS.Comp_ID
_Delta_CS.Atom_ID
_Delta_CS.Atom_type
_Delta_CS.Auth_seq_ID
_Delta_CS.Original_CS_value
_Delta_CS.Corrected_CS_value
_Delta_CS.Sparta_CS_value
_Delta_CS.Delta_CS_value
_Delta_CS.Entry_ID
1 1 . 1 1 2 2 THR N N 2 113.570 113.570 116.116 -2.546 19694
2 1 . 1 1 2 2 THR HA H 2 4.240 4.240 4.303 -0.063 19694
3 1 . 1 1 2 2 THR CA C 2 62.130 62.130 63.012 -0.882 19694
4 1 . 1 1 2 2 THR CB C 2 69.250 69.250 69.141 0.109 19694
5 1 . 1 1 2 2 THR H H 2 8.090 8.090 8.209 -0.119 19694
6 1 . 1 1 3 3 GLU N N 3 122.880 122.880 120.649 2.231 19694
7 1 . 1 1 3 3 GLU HA H 3 4.280 4.280 4.302 -0.022 19694
8 1 . 1 1 3 3 GLU CA C 3 56.860 56.860 56.121 0.738 19694
9 1 . 1 1 3 3 GLU CB C 3 30.570 30.570 30.356 0.214 19694
10 1 . 1 1 3 3 GLU H H 3 8.280 8.280 8.058 0.222 19694
11 1 . 1 1 4 4 ARG N N 4 121.330 121.330 119.564 1.766 19694
12 1 . 1 1 4 4 ARG HA H 4 4.300 4.300 4.562 -0.262 19694
13 1 . 1 1 4 4 ARG CA C 4 55.870 55.870 55.250 0.620 19694
14 1 . 1 1 4 4 ARG CB C 4 31.640 31.640 30.815 0.825 19694
15 1 . 1 1 4 4 ARG H H 4 8.280 8.280 8.543 -0.263 19694
16 1 . 1 1 5 5 PHE N N 5 125.490 125.490 124.841 0.649 19694
17 1 . 1 1 5 5 PHE HA H 5 4.610 4.610 4.580 0.030 19694
18 1 . 1 1 5 5 PHE CA C 5 56.380 56.380 56.454 -0.074 19694
19 1 . 1 1 5 5 PHE CB C 5 39.560 39.560 39.653 -0.094 19694
20 1 . 1 1 5 5 PHE H H 5 8.290 8.290 8.738 -0.448 19694
21 1 . 1 1 6 6 ASP N N 6 123.260 123.260 121.344 1.916 19694
22 1 . 1 1 6 6 ASP HA H 6 5.045 5.045 4.799 0.246 19694
23 1 . 1 1 6 6 ASP CA C 6 52.180 52.180 52.985 -0.805 19694
24 1 . 1 1 6 6 ASP CB C 6 44.210 44.210 44.477 -0.267 19694
25 1 . 1 1 6 6 ASP H H 6 7.940 7.940 7.595 0.345 19694
26 1 . 1 1 7 7 CYS N N 7 121.440 121.440 122.709 -1.269 19694
27 1 . 1 1 7 7 CYS HA H 7 3.960 3.960 4.437 -0.477 19694
28 1 . 1 1 7 7 CYS CA C 7 59.820 59.820 59.556 0.264 19694
29 1 . 1 1 7 7 CYS CB C 7 30.950 30.950 26.190 4.760 19694
30 1 . 1 1 7 7 CYS H H 7 8.700 8.700 8.598 0.102 19694
31 1 . 1 1 8 8 HIS N N 8 129.390 129.390 129.694 -0.304 19694
32 1 . 1 1 8 8 HIS HA H 8 4.200 4.200 4.231 -0.031 19694
33 1 . 1 1 8 8 HIS CA C 8 58.240 58.240 59.560 -1.320 19694
34 1 . 1 1 8 8 HIS CB C 8 29.480 29.480 30.078 -0.598 19694
35 1 . 1 1 8 8 HIS H H 8 9.160 9.160 9.607 -0.447 19694
36 1 . 1 1 9 9 HIS N N 9 118.740 118.740 117.209 1.531 19694
37 1 . 1 1 9 9 HIS HA H 9 4.880 4.880 4.458 0.422 19694
38 1 . 1 1 9 9 HIS CA C 9 58.680 58.680 57.170 1.511 19694
39 1 . 1 1 9 9 HIS CB C 9 31.040 31.040 30.234 0.806 19694
40 1 . 1 1 9 9 HIS H H 9 9.270 9.270 8.004 1.266 19694
41 1 . 1 1 10 10 CYS N N 10 118.600 118.600 117.474 1.126 19694
42 1 . 1 1 10 10 CYS HA H 10 4.600 4.600 4.413 0.187 19694
43 1 . 1 1 10 10 CYS CA C 10 59.600 59.600 59.160 0.440 19694
44 1 . 1 1 10 10 CYS CB C 10 32.330 32.330 27.946 4.384 19694
45 1 . 1 1 10 10 CYS H H 10 8.550 8.550 7.863 0.687 19694
46 1 . 1 1 11 11 ASN N N 11 116.220 116.220 117.678 -1.458 19694
47 1 . 1 1 11 11 ASN HA H 11 4.410 4.410 4.386 0.024 19694
48 1 . 1 1 11 11 ASN CA C 11 55.640 55.640 54.484 1.156 19694
49 1 . 1 1 11 11 ASN CB C 11 38.200 38.200 36.932 1.268 19694
50 1 . 1 1 11 11 ASN H H 11 7.690 7.690 8.704 -1.014 19694
51 1 . 1 1 12 12 GLU N N 12 120.330 120.330 117.692 2.638 19694
52 1 . 1 1 12 12 GLU HA H 12 4.220 4.220 4.515 -0.295 19694
53 1 . 1 1 12 12 GLU CA C 12 56.700 56.700 54.988 1.711 19694
54 1 . 1 1 12 12 GLU CB C 12 30.910 30.910 30.878 0.032 19694
55 1 . 1 1 12 12 GLU H H 12 8.210 8.210 7.711 0.499 19694
56 1 . 1 1 13 13 SER N N 13 116.190 116.190 119.901 -3.711 19694
57 1 . 1 1 13 13 SER HA H 13 4.060 4.060 4.435 -0.375 19694
58 1 . 1 1 13 13 SER CA C 13 59.350 59.350 58.920 0.430 19694
59 1 . 1 1 13 13 SER CB C 13 63.820 63.820 63.570 0.250 19694
60 1 . 1 1 13 13 SER H H 13 8.520 8.520 8.670 -0.150 19694
61 1 . 1 1 14 14 LEU N N 14 126.060 126.060 125.394 0.666 19694
62 1 . 1 1 14 14 LEU HA H 14 4.310 4.310 4.341 -0.031 19694
63 1 . 1 1 14 14 LEU CA C 14 54.100 54.100 55.761 -1.661 19694
64 1 . 1 1 14 14 LEU CB C 14 42.200 42.200 41.618 0.582 19694
65 1 . 1 1 14 14 LEU H H 14 8.910 8.910 7.754 1.156 19694
66 1 . 1 1 15 15 PHE N N 15 120.660 120.660 121.085 -0.425 19694
67 1 . 1 1 15 15 PHE HA H 15 4.480 4.480 4.605 -0.125 19694
68 1 . 1 1 15 15 PHE CA C 15 60.400 60.400 56.326 4.074 19694
69 1 . 1 1 15 15 PHE CB C 15 38.130 38.130 37.913 0.217 19694
70 1 . 1 1 15 15 PHE H H 15 7.820 7.820 8.551 -0.731 19694
71 1 . 1 1 16 16 GLY N N 16 114.730 114.730 110.936 3.794 19694
72 1 . 1 1 16 16 GLY CA C 16 45.900 45.900 45.814 0.086 19694
73 1 . 1 1 16 16 GLY H H 16 8.860 8.860 8.771 0.089 19694
74 1 . 1 1 17 17 LYS N N 17 119.580 119.580 119.930 -0.350 19694
75 1 . 1 1 17 17 LYS HA H 17 4.480 4.480 4.488 -0.008 19694
76 1 . 1 1 17 17 LYS CA C 17 54.460 54.460 54.515 -0.055 19694
77 1 . 1 1 17 17 LYS CB C 17 35.800 35.800 34.089 1.711 19694
78 1 . 1 1 17 17 LYS H H 17 8.030 8.030 7.240 0.790 19694
79 1 . 1 1 18 18 LYS N N 18 120.330 120.330 122.114 -1.784 19694
80 1 . 1 1 18 18 LYS HA H 18 4.280 4.280 4.329 -0.049 19694
81 1 . 1 1 18 18 LYS CA C 18 56.800 56.800 57.493 -0.693 19694
82 1 . 1 1 18 18 LYS CB C 18 33.010 33.010 32.940 0.070 19694
83 1 . 1 1 18 18 LYS H H 18 8.190 8.190 8.518 -0.328 19694
84 1 . 1 1 19 19 TYR N N 19 117.500 117.500 114.754 2.746 19694
85 1 . 1 1 19 19 TYR HA H 19 5.240 5.240 4.802 0.438 19694
86 1 . 1 1 19 19 TYR CA C 19 55.340 55.340 56.349 -1.009 19694
87 1 . 1 1 19 19 TYR CB C 19 42.850 42.850 40.279 2.571 19694
88 1 . 1 1 19 19 TYR H H 19 7.610 7.610 7.882 -0.272 19694
89 1 . 1 1 20 20 ILE N N 20 121.430 121.430 121.857 -0.427 19694
90 1 . 1 1 20 20 ILE HA H 20 4.137 4.137 4.245 -0.108 19694
91 1 . 1 1 20 20 ILE CA C 20 60.010 60.010 60.111 -0.101 19694
92 1 . 1 1 20 20 ILE CB C 20 41.570 41.570 40.604 0.966 19694
93 1 . 1 1 20 20 ILE H H 20 9.350 9.350 8.239 1.111 19694
94 1 . 1 1 21 21 LEU N N 21 126.720 126.720 126.384 0.336 19694
95 1 . 1 1 21 21 LEU HA H 21 5.090 5.090 4.679 0.411 19694
96 1 . 1 1 21 21 LEU CA C 21 54.020 54.020 54.062 -0.042 19694
97 1 . 1 1 21 21 LEU CB C 21 43.720 43.720 40.716 3.004 19694
98 1 . 1 1 21 21 LEU H H 21 8.530 8.530 8.511 0.019 19694
99 1 . 1 1 22 22 ARG N N 22 123.930 123.930 125.770 -1.840 19694
100 1 . 1 1 22 22 ARG HA H 22 4.440 4.440 4.500 -0.060 19694
101 1 . 1 1 22 22 ARG CA C 22 55.600 55.600 54.084 1.516 19694
102 1 . 1 1 22 22 ARG CB C 22 32.280 32.280 32.276 0.004 19694
103 1 . 1 1 22 22 ARG H H 22 9.080 9.080 8.948 0.132 19694
104 1 . 1 1 23 23 GLU N N 23 128.500 128.500 124.523 3.977 19694
105 1 . 1 1 23 23 GLU HA H 23 3.840 3.840 3.938 -0.098 19694
106 1 . 1 1 23 23 GLU CA C 23 58.030 58.030 57.750 0.280 19694
107 1 . 1 1 23 23 GLU CB C 23 27.200 27.200 27.834 -0.634 19694
108 1 . 1 1 23 23 GLU H H 23 9.610 9.610 9.024 0.587 19694
109 1 . 1 1 24 24 GLU N N 24 110.300 110.300 113.303 -3.003 19694
110 1 . 1 1 24 24 GLU HA H 24 3.780 3.780 3.945 -0.165 19694
111 1 . 1 1 24 24 GLU CA C 24 58.320 58.320 57.375 0.945 19694
112 1 . 1 1 24 24 GLU CB C 24 28.220 28.220 28.137 0.083 19694
113 1 . 1 1 24 24 GLU H H 24 8.660 8.660 8.688 -0.028 19694
114 1 . 1 1 25 25 SER N N 25 117.700 117.700 113.033 4.667 19694
115 1 . 1 1 25 25 SER HA H 25 4.890 4.890 4.792 0.098 19694
116 1 . 1 1 25 25 SER CA C 25 56.540 56.540 55.664 0.876 19694
117 1 . 1 1 25 25 SER CB C 25 64.720 64.720 65.089 -0.369 19694
118 1 . 1 1 25 25 SER H H 25 7.900 7.900 7.785 0.115 19694
119 1 . 1 1 26 26 PRO HA H 26 4.995 4.995 4.851 0.144 19694
120 1 . 1 1 26 26 PRO CA C 26 61.750 61.750 63.075 -1.325 19694
121 1 . 1 1 26 26 PRO CB C 26 32.660 32.660 31.709 0.951 19694
122 1 . 1 1 27 27 TYR N N 27 118.100 118.100 123.716 -5.616 19694
123 1 . 1 1 27 27 TYR HA H 27 5.910 5.910 4.979 0.930 19694
124 1 . 1 1 27 27 TYR CA C 27 56.830 56.830 54.984 1.846 19694
125 1 . 1 1 27 27 TYR CB C 27 42.810 42.810 42.554 0.256 19694
126 1 . 1 1 27 27 TYR H H 27 9.040 9.040 8.751 0.289 19694
127 1 . 1 1 28 28 CYS N N 28 122.230 122.230 119.255 2.975 19694
128 1 . 1 1 28 28 CYS HA H 28 4.850 4.850 4.683 0.167 19694
129 1 . 1 1 28 28 CYS CA C 28 58.110 58.110 58.342 -0.232 19694
130 1 . 1 1 28 28 CYS CB C 28 30.530 30.530 29.137 1.393 19694
131 1 . 1 1 28 28 CYS H H 28 9.850 9.850 8.346 1.504 19694
132 1 . 1 1 29 29 VAL N N 29 118.200 118.200 122.810 -4.610 19694
133 1 . 1 1 29 29 VAL HA H 29 3.650 3.650 3.711 -0.061 19694
134 1 . 1 1 29 29 VAL CA C 29 67.400 67.400 66.817 0.583 19694
135 1 . 1 1 29 29 VAL CB C 29 31.860 31.860 31.279 0.581 19694
136 1 . 1 1 29 29 VAL H H 29 8.430 8.430 8.986 -0.556 19694
137 1 . 1 1 30 30 VAL N N 30 119.570 119.570 118.664 0.906 19694
138 1 . 1 1 30 30 VAL HA H 30 3.860 3.860 3.579 0.281 19694
139 1 . 1 1 30 30 VAL CA C 30 66.450 66.450 66.273 0.177 19694
140 1 . 1 1 30 30 VAL CB C 30 31.540 31.540 30.842 0.698 19694
141 1 . 1 1 30 30 VAL H H 30 7.700 7.700 8.099 -0.399 19694
142 1 . 1 1 31 31 CYS N N 31 125.890 125.890 119.396 6.494 19694
143 1 . 1 1 31 31 CYS HA H 31 3.830 3.830 3.900 -0.070 19694
144 1 . 1 1 31 31 CYS CA C 31 65.850 65.850 64.304 1.546 19694
145 1 . 1 1 31 31 CYS CB C 31 29.510 29.510 25.541 3.969 19694
146 1 . 1 1 31 31 CYS H H 31 9.050 9.050 7.619 1.431 19694
147 1 . 1 1 32 32 PHE N N 32 119.000 119.000 119.309 -0.309 19694
148 1 . 1 1 32 32 PHE HA H 32 3.780 3.780 3.694 0.086 19694
149 1 . 1 1 32 32 PHE CA C 32 62.610 62.610 61.792 0.818 19694
150 1 . 1 1 32 32 PHE CB C 32 39.920 39.920 39.046 0.874 19694
151 1 . 1 1 32 32 PHE H H 32 9.080 9.080 7.886 1.194 19694
152 1 . 1 1 33 33 GLU N N 33 117.470 117.470 118.074 -0.604 19694
153 1 . 1 1 33 33 GLU HA H 33 3.760 3.760 4.052 -0.292 19694
154 1 . 1 1 33 33 GLU CA C 33 59.210 59.210 59.433 -0.223 19694
155 1 . 1 1 33 33 GLU CB C 33 29.480 29.480 29.255 0.225 19694
156 1 . 1 1 33 33 GLU H H 33 8.510 8.510 8.169 0.341 19694
157 1 . 1 1 34 34 THR N N 34 114.140 114.140 115.372 -1.232 19694
158 1 . 1 1 34 34 THR HA H 34 3.730 3.730 3.943 -0.213 19694
159 1 . 1 1 34 34 THR CA C 34 65.890 65.890 65.869 0.021 19694
160 1 . 1 1 34 34 THR CB C 34 69.210 69.210 68.701 0.509 19694
161 1 . 1 1 34 34 THR H H 34 7.880 7.880 8.288 -0.408 19694
162 1 . 1 1 35 35 LEU N N 35 117.980 117.980 118.938 -0.958 19694
163 1 . 1 1 35 35 LEU HA H 35 3.650 3.650 3.938 -0.288 19694
164 1 . 1 1 35 35 LEU CA C 35 56.860 56.860 57.271 -0.411 19694
165 1 . 1 1 35 35 LEU CB C 35 41.870 41.870 41.791 0.079 19694
166 1 . 1 1 35 35 LEU H H 35 7.660 7.660 7.784 -0.124 19694
167 1 . 1 1 36 36 PHE N N 36 113.900 113.900 113.490 0.410 19694
168 1 . 1 1 36 36 PHE HA H 36 4.597 4.597 4.464 0.133 19694
169 1 . 1 1 36 36 PHE CA C 36 56.860 56.860 56.303 0.557 19694
170 1 . 1 1 36 36 PHE CB C 36 40.570 40.570 38.188 2.382 19694
171 1 . 1 1 36 36 PHE H H 36 7.730 7.730 6.666 1.064 19694
172 1 . 1 1 37 37 ALA N N 37 121.920 121.920 123.265 -1.345 19694
173 1 . 1 1 37 37 ALA HA H 37 4.070 4.070 4.073 -0.003 19694
174 1 . 1 1 37 37 ALA CA C 37 52.900 52.900 52.366 0.534 19694
175 1 . 1 1 37 37 ALA CB C 37 19.770 19.770 19.645 0.125 19694
176 1 . 1 1 37 37 ALA H H 37 7.090 7.090 7.840 -0.750 19694
177 1 . 1 1 38 38 ASN N N 38 119.230 119.230 119.268 -0.038 19694
178 1 . 1 1 38 38 ASN HA H 38 4.450 4.450 4.655 -0.205 19694
179 1 . 1 1 38 38 ASN CA C 38 52.850 52.850 52.605 0.245 19694
180 1 . 1 1 38 38 ASN CB C 38 38.950 38.950 40.017 -1.067 19694
181 1 . 1 1 38 38 ASN H H 38 8.790 8.790 8.320 0.470 19694
182 1 . 1 1 39 39 THR N N 39 116.330 116.330 115.751 0.579 19694
183 1 . 1 1 39 39 THR HA H 39 3.990 3.990 4.367 -0.377 19694
184 1 . 1 1 39 39 THR CA C 39 62.130 62.130 62.580 -0.450 19694
185 1 . 1 1 39 39 THR CB C 39 69.920 69.920 69.745 0.175 19694
186 1 . 1 1 39 39 THR H H 39 8.540 8.540 8.215 0.325 19694
187 1 . 1 1 40 40 CYS N N 40 126.950 126.950 128.062 -1.112 19694
188 1 . 1 1 40 40 CYS HA H 40 4.300 4.300 4.457 -0.157 19694
189 1 . 1 1 40 40 CYS CA C 40 58.350 58.350 57.116 1.234 19694
190 1 . 1 1 40 40 CYS CB C 40 31.600 31.600 26.672 4.928 19694
191 1 . 1 1 40 40 CYS H H 40 7.940 7.940 8.502 -0.562 19694
192 1 . 1 1 41 41 GLU N N 41 130.560 130.560 127.594 2.966 19694
193 1 . 1 1 41 41 GLU HA H 41 3.690 3.690 3.841 -0.151 19694
194 1 . 1 1 41 41 GLU CA C 41 58.600 58.600 59.123 -0.523 19694
195 1 . 1 1 41 41 GLU CB C 41 30.460 30.460 29.419 1.041 19694
196 1 . 1 1 41 41 GLU H H 41 8.810 8.810 8.662 0.148 19694
197 1 . 1 1 42 42 GLU N N 42 119.680 119.680 118.253 1.427 19694
198 1 . 1 1 42 42 GLU HA H 42 4.570 4.570 4.342 0.228 19694
199 1 . 1 1 42 42 GLU CA C 42 58.000 58.000 58.086 -0.086 19694
200 1 . 1 1 42 42 GLU CB C 42 31.680 31.680 30.582 1.098 19694
201 1 . 1 1 42 42 GLU H H 42 8.500 8.500 8.110 0.390 19694
202 1 . 1 1 43 43 CYS N N 43 115.600 115.600 116.392 -0.792 19694
203 1 . 1 1 43 43 CYS HA H 43 5.010 5.010 4.573 0.437 19694
204 1 . 1 1 43 43 CYS CA C 43 58.810 58.810 60.042 -1.232 19694
205 1 . 1 1 43 43 CYS CB C 43 31.580 31.580 29.133 2.447 19694
206 1 . 1 1 43 43 CYS H H 43 8.120 8.120 7.997 0.123 19694
207 1 . 1 1 44 44 GLY N N 44 112.100 112.100 107.454 4.646 19694
208 1 . 1 1 44 44 GLY CA C 44 46.420 46.420 45.290 1.131 19694
209 1 . 1 1 44 44 GLY H H 44 7.900 7.900 8.602 -0.702 19694
210 1 . 1 1 45 45 LYS N N 45 121.210 121.210 121.661 -0.451 19694
211 1 . 1 1 45 45 LYS HA H 45 4.840 4.840 4.703 0.137 19694
212 1 . 1 1 45 45 LYS CA C 45 54.360 54.360 52.848 1.512 19694
213 1 . 1 1 45 45 LYS CB C 45 32.430 32.430 32.805 -0.375 19694
214 1 . 1 1 45 45 LYS H H 45 8.180 8.180 7.878 0.302 19694
215 1 . 1 1 46 46 PRO HA H 46 4.477 4.477 4.547 -0.070 19694
216 1 . 1 1 46 46 PRO CA C 46 62.700 62.700 63.029 -0.329 19694
217 1 . 1 1 46 46 PRO CB C 46 32.490 32.490 32.046 0.444 19694
218 1 . 1 1 47 47 ILE N N 47 125.280 125.280 123.107 2.173 19694
219 1 . 1 1 47 47 ILE HA H 47 3.830 3.830 4.295 -0.465 19694
220 1 . 1 1 47 47 ILE CA C 47 61.040 61.040 60.741 0.299 19694
221 1 . 1 1 47 47 ILE CB C 47 37.440 37.440 37.669 -0.229 19694
222 1 . 1 1 47 47 ILE H H 47 8.540 8.540 8.884 -0.344 19694
223 1 . 1 1 48 48 GLY N N 48 114.120 114.120 113.683 0.437 19694
224 1 . 1 1 48 48 GLY CA C 48 45.240 45.240 44.686 0.554 19694
225 1 . 1 1 48 48 GLY H H 48 8.660 8.660 8.502 0.158 19694
226 1 . 1 1 49 49 CYS N N 49 117.140 117.140 120.148 -3.008 19694
227 1 . 1 1 49 49 CYS HA H 49 4.280 4.280 4.312 -0.032 19694
228 1 . 1 1 49 49 CYS CA C 49 60.880 60.880 59.864 1.016 19694
229 1 . 1 1 49 49 CYS CB C 49 27.650 27.650 27.665 -0.015 19694
230 1 . 1 1 49 49 CYS H H 49 9.210 9.210 8.886 0.324 19694
231 1 . 1 1 50 50 ASP N N 50 119.300 119.300 120.328 -1.028 19694
232 1 . 1 1 50 50 ASP HA H 50 4.620 4.620 4.641 -0.021 19694
233 1 . 1 1 50 50 ASP CA C 50 54.160 54.160 55.186 -1.025 19694
234 1 . 1 1 50 50 ASP CB C 50 40.380 40.380 40.250 0.130 19694
235 1 . 1 1 50 50 ASP H H 50 8.800 8.800 8.413 0.387 19694
236 1 . 1 1 51 51 CYS N N 51 118.150 118.150 117.030 1.120 19694
237 1 . 1 1 51 51 CYS HA H 51 4.620 4.620 4.688 -0.068 19694
238 1 . 1 1 51 51 CYS CA C 51 58.030 58.030 57.138 0.892 19694
239 1 . 1 1 51 51 CYS CB C 51 30.090 30.090 31.597 -1.507 19694
240 1 . 1 1 51 51 CYS H H 51 7.590 7.590 7.402 0.189 19694
241 1 . 1 1 52 52 LYS N N 52 123.800 123.800 122.840 0.960 19694
242 1 . 1 1 52 52 LYS HA H 52 4.180 4.180 4.316 -0.136 19694
243 1 . 1 1 52 52 LYS CA C 52 57.240 57.240 56.364 0.876 19694
244 1 . 1 1 52 52 LYS CB C 52 33.030 33.030 31.394 1.636 19694
245 1 . 1 1 52 52 LYS H H 52 8.600 8.600 8.552 0.048 19694
246 1 . 1 1 53 53 ASP N N 53 124.900 124.900 124.062 0.838 19694
247 1 . 1 1 53 53 ASP HA H 53 4.230 4.230 4.710 -0.480 19694
248 1 . 1 1 53 53 ASP CA C 53 53.130 53.130 53.084 0.046 19694
249 1 . 1 1 53 53 ASP CB C 53 42.230 42.230 40.864 1.366 19694
250 1 . 1 1 53 53 ASP H H 53 8.250 8.250 8.352 -0.102 19694
251 1 . 1 1 54 54 LEU N N 54 130.160 130.160 125.551 4.609 19694
252 1 . 1 1 54 54 LEU HA H 54 4.440 4.440 4.597 -0.157 19694
253 1 . 1 1 54 54 LEU CA C 54 53.340 53.340 55.226 -1.886 19694
254 1 . 1 1 54 54 LEU CB C 54 41.170 41.170 43.157 -1.987 19694
255 1 . 1 1 54 54 LEU H H 54 8.670 8.670 8.938 -0.267 19694
256 1 . 1 1 55 55 SER N N 55 113.820 113.820 121.248 -7.428 19694
257 1 . 1 1 55 55 SER HA H 55 5.580 5.580 5.149 0.431 19694
258 1 . 1 1 55 55 SER CA C 55 55.850 55.850 56.602 -0.752 19694
259 1 . 1 1 55 55 SER CB C 55 67.300 67.300 64.479 2.822 19694
260 1 . 1 1 55 55 SER H H 55 8.160 8.160 8.508 -0.348 19694
261 1 . 1 1 56 56 TYR N N 56 122.610 122.610 126.278 -3.668 19694
262 1 . 1 1 56 56 TYR HA H 56 4.620 4.620 4.639 -0.019 19694
263 1 . 1 1 56 56 TYR CA C 56 58.810 58.810 58.672 0.138 19694
264 1 . 1 1 56 56 TYR CB C 56 41.000 41.000 42.196 -1.196 19694
265 1 . 1 1 56 56 TYR H H 56 8.450 8.450 8.810 -0.360 19694
266 1 . 1 1 57 57 LYS N N 57 126.020 126.020 128.571 -2.551 19694
267 1 . 1 1 57 57 LYS HA H 57 3.470 3.470 3.912 -0.442 19694
268 1 . 1 1 57 57 LYS CA C 57 58.100 58.100 57.410 0.690 19694
269 1 . 1 1 57 57 LYS CB C 57 29.480 29.480 31.941 -2.461 19694
270 1 . 1 1 57 57 LYS H H 57 8.920 8.920 8.711 0.209 19694
271 1 . 1 1 58 58 ASP HA H 58 3.830 3.830 4.228 -0.398 19694
272 1 . 1 1 58 58 ASP CA C 58 54.900 54.900 55.446 -0.546 19694
273 1 . 1 1 58 58 ASP CB C 58 40.080 40.080 40.644 -0.563 19694
274 1 . 1 1 58 58 ASP H H 58 8.400 8.400 8.570 -0.170 19694
275 1 . 1 1 59 59 ARG N N 59 121.190 121.190 116.187 5.003 19694
276 1 . 1 1 59 59 ARG HA H 59 4.250 4.250 4.477 -0.227 19694
277 1 . 1 1 59 59 ARG CA C 59 55.580 55.580 54.179 1.400 19694
278 1 . 1 1 59 59 ARG CB C 59 33.460 33.460 33.530 -0.070 19694
279 1 . 1 1 59 59 ARG H H 59 7.980 7.980 7.666 0.314 19694
280 1 . 1 1 60 60 HIS N N 60 118.420 118.420 117.664 0.756 19694
281 1 . 1 1 60 60 HIS HA H 60 5.270 5.270 5.634 -0.364 19694
282 1 . 1 1 60 60 HIS CA C 60 55.010 55.010 55.176 -0.166 19694
283 1 . 1 1 60 60 HIS CB C 60 32.380 32.380 33.345 -0.965 19694
284 1 . 1 1 60 60 HIS H H 60 8.350 8.350 8.124 0.226 19694
285 1 . 1 1 61 61 TRP N N 61 119.990 119.990 118.311 1.679 19694
286 1 . 1 1 61 61 TRP HA H 61 5.930 5.930 4.790 1.140 19694
287 1 . 1 1 61 61 TRP CA C 61 57.400 57.400 57.117 0.283 19694
288 1 . 1 1 61 61 TRP CB C 61 35.380 35.380 34.207 1.173 19694
289 1 . 1 1 61 61 TRP H H 61 9.310 9.310 9.282 0.028 19694
290 1 . 1 1 62 62 HIS N N 62 117.270 117.270 121.294 -4.024 19694
291 1 . 1 1 62 62 HIS HA H 62 4.600 4.600 4.865 -0.265 19694
292 1 . 1 1 62 62 HIS CA C 62 59.210 59.210 57.312 1.898 19694
293 1 . 1 1 62 62 HIS CB C 62 31.200 31.200 30.427 0.773 19694
294 1 . 1 1 62 62 HIS H H 62 8.430 8.430 9.138 -0.708 19694
295 1 . 1 1 63 63 GLU N N 63 124.640 124.640 128.452 -3.812 19694
296 1 . 1 1 63 63 GLU HA H 63 3.827 3.827 3.968 -0.141 19694
297 1 . 1 1 63 63 GLU CA C 63 61.020 61.020 59.642 1.378 19694
298 1 . 1 1 63 63 GLU CB C 63 30.310 30.310 29.674 0.636 19694
299 1 . 1 1 63 63 GLU H H 63 9.040 9.040 8.359 0.681 19694
300 1 . 1 1 64 64 ALA N N 64 117.050 117.050 117.800 -0.750 19694
301 1 . 1 1 64 64 ALA HA H 64 4.230 4.230 4.332 -0.102 19694
302 1 . 1 1 64 64 ALA CA C 64 54.000 54.000 53.058 0.942 19694
303 1 . 1 1 64 64 ALA CB C 64 18.880 18.880 18.976 -0.096 19694
304 1 . 1 1 64 64 ALA H H 64 8.680 8.680 8.282 0.398 19694
305 1 . 1 1 65 65 CYS N N 65 115.380 115.380 117.125 -1.745 19694
306 1 . 1 1 65 65 CYS HA H 65 4.295 4.295 4.210 0.085 19694
307 1 . 1 1 65 65 CYS CA C 65 59.850 59.850 60.337 -0.487 19694
308 1 . 1 1 65 65 CYS CB C 65 32.840 32.840 27.112 5.728 19694
309 1 . 1 1 65 65 CYS H H 65 7.490 7.490 8.181 -0.691 19694
310 1 . 1 1 66 66 PHE N N 66 122.020 122.020 123.030 -1.010 19694
311 1 . 1 1 66 66 PHE HA H 66 3.890 3.890 3.859 0.031 19694
312 1 . 1 1 66 66 PHE CA C 66 57.010 57.010 58.552 -1.542 19694
313 1 . 1 1 66 66 PHE CB C 66 38.070 38.070 38.136 -0.066 19694
314 1 . 1 1 66 66 PHE H H 66 7.110 7.110 7.617 -0.507 19694
315 1 . 1 1 67 67 HIS N N 67 121.280 121.280 121.708 -0.428 19694
316 1 . 1 1 67 67 HIS HA H 67 4.720 4.720 5.257 -0.537 19694
317 1 . 1 1 67 67 HIS CA C 67 52.730 52.730 53.141 -0.411 19694
318 1 . 1 1 67 67 HIS CB C 67 32.230 32.230 31.095 1.135 19694
319 1 . 1 1 67 67 HIS H H 67 7.380 7.380 7.588 -0.208 19694
320 1 . 1 1 68 68 CYS N N 68 121.590 121.590 118.938 2.652 19694
321 1 . 1 1 68 68 CYS HA H 68 3.960 3.960 4.917 -0.957 19694
322 1 . 1 1 68 68 CYS CA C 68 59.790 59.790 57.983 1.807 19694
323 1 . 1 1 68 68 CYS CB C 68 31.200 31.200 29.434 1.766 19694
324 1 . 1 1 68 68 CYS H H 68 8.530 8.530 8.366 0.164 19694
325 1 . 1 1 69 69 SER N N 69 126.530 126.530 120.305 6.225 19694
326 1 . 1 1 69 69 SER HA H 69 4.310 4.310 4.150 0.160 19694
327 1 . 1 1 69 69 SER CA C 69 61.760 61.760 60.852 0.908 19694
328 1 . 1 1 69 69 SER CB C 69 64.040 64.040 63.260 0.780 19694
329 1 . 1 1 69 69 SER H H 69 9.460 9.460 8.754 0.706 19694
330 1 . 1 1 70 70 GLN N N 70 122.370 122.370 118.565 3.805 19694
331 1 . 1 1 70 70 GLN HA H 70 4.510 4.510 4.419 0.091 19694
332 1 . 1 1 70 70 GLN CA C 70 57.840 57.840 57.304 0.536 19694
333 1 . 1 1 70 70 GLN CB C 70 30.430 30.430 29.632 0.798 19694
334 1 . 1 1 70 70 GLN H H 70 8.980 8.980 7.917 1.063 19694
335 1 . 1 1 71 71 CYS N N 71 118.860 118.860 116.315 2.545 19694
336 1 . 1 1 71 71 CYS HA H 71 4.720 4.720 4.703 0.017 19694
337 1 . 1 1 71 71 CYS CA C 71 59.770 59.770 58.332 1.438 19694
338 1 . 1 1 71 71 CYS CB C 71 31.910 31.910 27.908 4.002 19694
339 1 . 1 1 71 71 CYS H H 71 8.220 8.220 7.758 0.462 19694
340 1 . 1 1 72 72 ARG N N 72 114.380 114.380 116.343 -1.963 19694
341 1 . 1 1 72 72 ARG HA H 72 3.965 3.965 3.853 0.112 19694
342 1 . 1 1 72 72 ARG CA C 72 58.030 58.030 57.177 0.853 19694
343 1 . 1 1 72 72 ARG CB C 72 27.720 27.720 27.427 0.293 19694
344 1 . 1 1 72 72 ARG H H 72 7.380 7.380 7.833 -0.453 19694
345 1 . 1 1 73 73 ASN N N 73 121.480 121.480 116.375 5.105 19694
346 1 . 1 1 73 73 ASN HA H 73 4.630 4.630 4.653 -0.023 19694
347 1 . 1 1 73 73 ASN CA C 73 54.110 54.110 53.891 0.219 19694
348 1 . 1 1 73 73 ASN CB C 73 38.870 38.870 39.639 -0.769 19694
349 1 . 1 1 73 73 ASN H H 73 8.722 8.722 8.108 0.614 19694
350 1 . 1 1 74 74 SER N N 74 114.710 114.710 117.846 -3.136 19694
351 1 . 1 1 74 74 SER HA H 74 4.060 4.060 4.836 -0.776 19694
352 1 . 1 1 74 74 SER CA C 74 59.357 59.357 58.255 1.102 19694
353 1 . 1 1 74 74 SER CB C 74 63.300 63.300 62.996 0.304 19694
354 1 . 1 1 74 74 SER H H 74 8.690 8.690 8.510 0.180 19694
355 1 . 1 1 75 75 LEU N N 75 125.757 125.757 127.766 -2.009 19694
356 1 . 1 1 75 75 LEU HA H 75 4.280 4.280 4.304 -0.024 19694
357 1 . 1 1 75 75 LEU CA C 75 53.510 53.510 54.781 -1.271 19694
358 1 . 1 1 75 75 LEU CB C 75 42.200 42.200 41.858 0.342 19694
359 1 . 1 1 75 75 LEU H H 75 7.970 7.970 8.057 -0.087 19694
360 1 . 1 1 76 76 VAL N N 76 120.860 120.860 124.313 -3.453 19694
361 1 . 1 1 76 76 VAL HA H 76 3.570 3.570 3.864 -0.294 19694
362 1 . 1 1 76 76 VAL CA C 76 65.420 65.420 60.881 4.539 19694
363 1 . 1 1 76 76 VAL CB C 76 31.540 31.540 35.148 -3.608 19694
364 1 . 1 1 76 76 VAL H H 76 7.830 7.830 7.991 -0.161 19694
365 1 . 1 1 77 77 ASP N N 77 122.360 122.360 122.964 -0.604 19694
366 1 . 1 1 77 77 ASP HA H 77 4.230 4.230 4.467 -0.237 19694
367 1 . 1 1 77 77 ASP CA C 77 56.200 56.200 55.818 0.382 19694
368 1 . 1 1 77 77 ASP CB C 77 39.380 39.380 40.772 -1.392 19694
369 1 . 1 1 77 77 ASP H H 77 8.910 8.910 8.440 0.470 19694
370 1 . 1 1 78 78 LYS N N 78 118.100 118.100 118.545 -0.445 19694
371 1 . 1 1 78 78 LYS HA H 78 4.870 4.870 4.631 0.239 19694
372 1 . 1 1 78 78 LYS CA C 78 56.960 56.960 53.651 3.309 19694
373 1 . 1 1 78 78 LYS CB C 78 34.680 34.680 33.743 0.937 19694
374 1 . 1 1 78 78 LYS H H 78 7.660 7.660 7.611 0.049 19694
375 1 . 1 1 79 79 PRO HA H 79 4.460 4.460 4.216 0.244 19694
376 1 . 1 1 79 79 PRO CA C 79 62.520 62.520 62.936 -0.416 19694
377 1 . 1 1 79 79 PRO CB C 79 32.160 32.160 31.859 0.301 19694
378 1 . 1 1 80 80 PHE N N 80 114.050 114.050 117.112 -3.062 19694
379 1 . 1 1 80 80 PHE HA H 80 4.910 4.910 5.046 -0.136 19694
380 1 . 1 1 80 80 PHE CA C 80 56.060 56.060 55.104 0.956 19694
381 1 . 1 1 80 80 PHE CB C 80 42.410 42.410 41.848 0.562 19694
382 1 . 1 1 80 80 PHE H H 80 7.510 7.510 7.191 0.319 19694
383 1 . 1 1 81 81 ALA N N 81 123.290 123.290 123.692 -0.402 19694
384 1 . 1 1 81 81 ALA HA H 81 4.310 4.310 4.357 -0.047 19694
385 1 . 1 1 81 81 ALA CA C 81 50.450 50.450 50.383 0.067 19694
386 1 . 1 1 81 81 ALA CB C 81 21.920 21.920 18.961 2.959 19694
387 1 . 1 1 81 81 ALA H H 81 9.030 9.030 8.990 0.040 19694
388 1 . 1 1 82 82 ALA N N 82 122.490 122.490 128.866 -6.376 19694
389 1 . 1 1 82 82 ALA HA H 82 5.110 5.110 4.383 0.727 19694
390 1 . 1 1 82 82 ALA CA C 82 51.100 51.100 51.806 -0.706 19694
391 1 . 1 1 82 82 ALA CB C 82 21.130 21.130 18.806 2.324 19694
392 1 . 1 1 82 82 ALA H H 82 8.240 8.240 8.612 -0.372 19694
393 1 . 1 1 83 83 LYS N N 83 123.580 123.580 125.869 -2.289 19694
394 1 . 1 1 83 83 LYS HA H 83 4.490 4.490 4.503 -0.013 19694
395 1 . 1 1 83 83 LYS CA C 83 55.800 55.800 55.399 0.401 19694
396 1 . 1 1 83 83 LYS CB C 83 34.720 34.720 34.108 0.613 19694
397 1 . 1 1 83 83 LYS H H 83 8.400 8.400 8.280 0.120 19694
398 1 . 1 1 84 84 GLU N N 84 125.470 125.470 120.381 5.089 19694
399 1 . 1 1 84 84 GLU HA H 84 3.820 3.820 4.123 -0.303 19694
400 1 . 1 1 84 84 GLU CA C 84 58.620 58.620 59.054 -0.434 19694
401 1 . 1 1 84 84 GLU CB C 84 27.210 27.210 29.677 -2.467 19694
402 1 . 1 1 84 84 GLU H H 84 9.320 9.320 8.750 0.570 19694
403 1 . 1 1 85 85 ASP N N 85 118.550 118.550 114.364 4.186 19694
404 1 . 1 1 85 85 ASP HA H 85 4.600 4.600 4.781 -0.181 19694
405 1 . 1 1 85 85 ASP CA C 85 55.400 55.400 53.937 1.463 19694
406 1 . 1 1 85 85 ASP CB C 85 40.400 40.400 42.034 -1.634 19694
407 1 . 1 1 85 85 ASP H H 85 8.730 8.730 8.316 0.414 19694
408 1 . 1 1 86 86 GLN N N 86 119.050 119.050 116.974 2.076 19694
409 1 . 1 1 86 86 GLN HA H 86 4.540 4.540 4.638 -0.098 19694
410 1 . 1 1 86 86 GLN CA C 86 55.100 55.100 53.942 1.158 19694
411 1 . 1 1 86 86 GLN CB C 86 31.110 31.110 31.886 -0.776 19694
412 1 . 1 1 86 86 GLN H H 86 8.170 8.170 7.596 0.574 19694
413 1 . 1 1 87 87 LEU N N 87 123.110 123.110 121.308 1.802 19694
414 1 . 1 1 87 87 LEU HA H 87 4.620 4.620 5.189 -0.569 19694
415 1 . 1 1 87 87 LEU CA C 87 54.520 54.520 54.000 0.520 19694
416 1 . 1 1 87 87 LEU CB C 87 42.700 42.700 44.550 -1.850 19694
417 1 . 1 1 87 87 LEU H H 87 8.490 8.490 8.502 -0.012 19694
418 1 . 1 1 88 88 LEU N N 88 123.690 123.690 120.173 3.518 19694
419 1 . 1 1 88 88 LEU HA H 88 5.880 5.880 4.955 0.925 19694
420 1 . 1 1 88 88 LEU CA C 88 53.340 53.340 52.805 0.535 19694
421 1 . 1 1 88 88 LEU CB C 88 47.190 47.190 47.804 -0.614 19694
422 1 . 1 1 88 88 LEU H H 88 8.930 8.930 8.349 0.581 19694
423 1 . 1 1 89 89 CYS N N 89 122.270 122.270 119.100 3.170 19694
424 1 . 1 1 89 89 CYS HA H 89 4.780 4.780 4.817 -0.037 19694
425 1 . 1 1 89 89 CYS CA C 89 57.640 57.640 59.177 -1.537 19694
426 1 . 1 1 89 89 CYS CB C 89 30.940 30.940 27.913 3.027 19694
427 1 . 1 1 89 89 CYS H H 89 9.430 9.430 9.069 0.361 19694
428 1 . 1 1 90 90 THR N N 90 110.620 110.620 116.831 -6.211 19694
429 1 . 1 1 90 90 THR HA H 90 3.900 3.900 3.964 -0.064 19694
430 1 . 1 1 90 90 THR CA C 90 65.460 65.460 65.849 -0.389 19694
431 1 . 1 1 90 90 THR CB C 90 68.670 68.670 68.831 -0.161 19694
432 1 . 1 1 90 90 THR H H 90 8.410 8.410 8.929 -0.519 19694
433 1 . 1 1 91 91 ASP N N 91 123.470 123.470 121.418 2.052 19694
434 1 . 1 1 91 91 ASP HA H 91 4.490 4.490 4.638 -0.148 19694
435 1 . 1 1 91 91 ASP CA C 91 57.810 57.810 57.299 0.511 19694
436 1 . 1 1 91 91 ASP CB C 91 41.160 41.160 40.509 0.651 19694
437 1 . 1 1 91 91 ASP H H 91 8.150 8.150 8.387 -0.237 19694
438 1 . 1 1 92 92 CYS N N 92 123.800 123.800 119.633 4.167 19694
439 1 . 1 1 92 92 CYS HA H 92 3.970 3.970 4.321 -0.351 19694
440 1 . 1 1 92 92 CYS CA C 92 64.100 64.100 61.392 2.708 19694
441 1 . 1 1 92 92 CYS CB C 92 30.090 30.090 25.963 4.127 19694
442 1 . 1 1 92 92 CYS H H 92 8.580 8.580 7.858 0.722 19694
443 1 . 1 1 93 93 TYR N N 93 120.730 120.730 121.020 -0.290 19694
444 1 . 1 1 93 93 TYR HA H 93 4.140 4.140 4.102 0.038 19694
445 1 . 1 1 93 93 TYR CA C 93 60.380 60.380 61.399 -1.019 19694
446 1 . 1 1 93 93 TYR CB C 93 39.300 39.300 38.358 0.942 19694
447 1 . 1 1 93 93 TYR H H 93 8.540 8.540 9.140 -0.600 19694
448 1 . 1 1 94 94 SER N N 94 115.010 115.010 113.205 1.805 19694
449 1 . 1 1 94 94 SER HA H 94 4.220 4.220 4.191 0.029 19694
450 1 . 1 1 94 94 SER CA C 94 59.300 59.300 61.317 -2.017 19694
451 1 . 1 1 94 94 SER CB C 94 63.660 63.660 62.639 1.021 19694
452 1 . 1 1 94 94 SER H H 94 7.750 7.750 8.075 -0.325 19694
453 1 . 1 1 95 95 ASN N N 95 119.820 119.820 118.940 0.880 19694
454 1 . 1 1 95 95 ASN HA H 95 4.510 4.510 4.581 -0.071 19694
455 1 . 1 1 95 95 ASN CA C 95 53.880 53.880 55.458 -1.578 19694
456 1 . 1 1 95 95 ASN CB C 95 39.300 39.300 38.867 0.433 19694
457 1 . 1 1 95 95 ASN H H 95 7.780 7.780 7.857 -0.077 19694
458 1 . 1 1 96 96 GLU N N 96 119.820 119.820 117.402 2.418 19694
459 1 . 1 1 96 96 GLU HA H 96 4.096 4.096 4.207 -0.111 19694
460 1 . 1 1 96 96 GLU CA C 96 56.910 56.910 57.204 -0.294 19694
461 1 . 1 1 96 96 GLU CB C 96 30.220 30.220 29.577 0.643 19694
462 1 . 1 1 96 96 GLU H H 96 7.950 7.950 7.724 0.226 19694
463 1 . 1 1 97 97 TYR N N 97 120.370 120.370 121.035 -0.665 19694
464 1 . 1 1 97 97 TYR HA H 97 4.620 4.620 4.058 0.561 19694
465 1 . 1 1 97 97 TYR CA C 97 57.700 57.700 59.597 -1.897 19694
466 1 . 1 1 97 97 TYR CB C 97 38.710 38.710 38.476 0.234 19694
467 1 . 1 1 97 97 TYR H H 97 8.070 8.070 8.418 -0.348 19694
stop_
save_