data_19287
save_entry_information
_Entry.Sf_category entry_information
_Entry.NMR_STAR_version 3.0.9.13
_Entry.Entry_ID 19287
_Entry.PDB_ID 2M99
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 19287
_Entity_delta_chem_shifts.ID 1
loop_
_Delta_CS.Atom_chem_shift_ID
_Delta_CS.Entity_delta_chem_shifts_ID
_Delta_CS.Conformer_ID
_Delta_CS.Assembly_atom_ID
_Delta_CS.Entity_assembly_ID
_Delta_CS.Entity_ID
_Delta_CS.Comp_index_ID
_Delta_CS.Seq_ID
_Delta_CS.Comp_ID
_Delta_CS.Atom_ID
_Delta_CS.Atom_type
_Delta_CS.Auth_seq_ID
_Delta_CS.Original_CS_value
_Delta_CS.Corrected_CS_value
_Delta_CS.Sparta_CS_value
_Delta_CS.Delta_CS_value
_Delta_CS.Entry_ID
1 1 1 . 1 1 2 2 PRO HA H 2 4.017 4.017 4.452 -0.435 19287
2 1 1 . 1 1 2 2 PRO C C 2 177.920 177.920 177.512 0.408 19287
3 1 1 . 1 1 2 2 PRO CA C 2 62.800 62.800 62.299 0.501 19287
4 1 1 . 1 1 2 2 PRO CB C 2 32.050 32.050 32.793 -0.743 19287
5 1 1 . 1 1 3 3 ARG N N 3 122.340 122.340 122.423 -0.083 19287
6 1 1 . 1 1 3 3 ARG HA H 3 3.786 3.786 3.986 -0.200 19287
7 1 1 . 1 1 3 3 ARG C C 3 178.950 178.950 177.751 1.199 19287
8 1 1 . 1 1 3 3 ARG CA C 3 58.410 58.410 57.962 0.448 19287
9 1 1 . 1 1 3 3 ARG CB C 3 29.220 29.220 29.448 -0.228 19287
10 1 1 . 1 1 3 3 ARG H H 3 8.550 8.550 8.796 -0.246 19287
11 1 1 . 1 1 4 4 PHE N N 4 113.010 113.010 118.201 -5.191 19287
12 1 1 . 1 1 4 4 PHE HA H 4 4.300 4.300 4.556 -0.256 19287
13 1 1 . 1 1 4 4 PHE C C 4 176.070 176.070 176.316 -0.246 19287
14 1 1 . 1 1 4 4 PHE CA C 4 58.220 58.220 58.100 0.120 19287
15 1 1 . 1 1 4 4 PHE CB C 4 37.310 37.310 38.099 -0.789 19287
16 1 1 . 1 1 4 4 PHE H H 4 7.150 7.150 7.696 -0.546 19287
17 1 1 . 1 1 5 5 CYS N N 5 118.600 118.600 117.160 1.440 19287
18 1 1 . 1 1 5 5 CYS HA H 5 4.130 4.130 4.023 0.107 19287
19 1 1 . 1 1 5 5 CYS C C 5 173.450 173.450 174.561 -1.111 19287
20 1 1 . 1 1 5 5 CYS CA C 5 57.960 57.960 60.366 -2.406 19287
21 1 1 . 1 1 5 5 CYS CB C 5 39.210 39.210 25.272 13.938 19287
22 1 1 . 1 1 5 5 CYS H H 5 7.090 7.090 7.392 -0.302 19287
23 1 1 . 1 1 6 6 GLU N N 6 110.710 110.710 117.696 -6.986 19287
24 1 1 . 1 1 6 6 GLU HA H 6 4.182 4.182 4.406 -0.224 19287
25 1 1 . 1 1 6 6 GLU C C 6 176.310 176.310 176.443 -0.133 19287
26 1 1 . 1 1 6 6 GLU CA C 6 55.510 55.510 55.270 0.240 19287
27 1 1 . 1 1 6 6 GLU CB C 6 28.160 28.160 29.623 -1.463 19287
28 1 1 . 1 1 6 6 GLU H H 6 7.300 7.300 7.472 -0.172 19287
29 1 1 . 1 1 7 7 LEU N N 7 119.090 119.090 121.084 -1.994 19287
30 1 1 . 1 1 7 7 LEU HA H 7 4.160 4.160 4.335 -0.175 19287
31 1 1 . 1 1 7 7 LEU C C 7 176.630 176.630 175.994 0.636 19287
32 1 1 . 1 1 7 7 LEU CA C 7 54.510 54.510 54.512 -0.002 19287
33 1 1 . 1 1 7 7 LEU CB C 7 42.330 42.330 42.796 -0.466 19287
34 1 1 . 1 1 7 7 LEU H H 7 7.210 7.210 7.086 0.124 19287
35 1 1 . 1 1 8 8 ALA N N 8 124.490 124.490 122.185 2.305 19287
36 1 1 . 1 1 8 8 ALA HA H 8 4.250 4.250 4.782 -0.532 19287
37 1 1 . 1 1 8 8 ALA C C 8 174.710 174.710 175.362 -0.652 19287
38 1 1 . 1 1 8 8 ALA CA C 8 50.210 50.210 48.596 1.614 19287
39 1 1 . 1 1 8 8 ALA CB C 8 16.930 16.930 19.333 -2.403 19287
40 1 1 . 1 1 8 8 ALA H H 8 8.280 8.280 8.406 -0.126 19287
41 1 1 . 1 1 9 9 PRO HA H 9 4.180 4.180 4.666 -0.486 19287
42 1 1 . 1 1 9 9 PRO C C 9 176.700 176.700 176.571 0.129 19287
43 1 1 . 1 1 9 9 PRO CA C 9 61.490 61.490 62.928 -1.438 19287
44 1 1 . 1 1 9 9 PRO CB C 9 30.360 30.360 31.537 -1.177 19287
45 1 1 . 1 1 10 10 SER N N 10 112.100 112.100 120.904 -8.804 19287
46 1 1 . 1 1 10 10 SER HA H 10 4.630 4.630 4.323 0.307 19287
47 1 1 . 1 1 10 10 SER C C 10 174.190 174.190 175.067 -0.877 19287
48 1 1 . 1 1 10 10 SER CA C 10 55.360 55.360 57.008 -1.648 19287
49 1 1 . 1 1 10 10 SER CB C 10 64.550 64.550 62.252 2.298 19287
50 1 1 . 1 1 10 10 SER H H 10 7.450 7.450 8.341 -0.891 19287
51 1 1 . 1 1 11 11 ALA N N 11 129.980 129.980 126.635 3.345 19287
52 1 1 . 1 1 11 11 ALA HA H 11 4.496 4.496 4.014 0.482 19287
53 1 1 . 1 1 11 11 ALA C C 11 178.510 178.510 179.028 -0.518 19287
54 1 1 . 1 1 11 11 ALA CA C 11 54.810 54.810 54.215 0.595 19287
55 1 1 . 1 1 11 11 ALA CB C 11 19.910 19.910 18.890 1.020 19287
56 1 1 . 1 1 11 11 ALA H H 11 9.210 9.210 8.273 0.937 19287
57 1 1 . 1 1 12 12 GLY N N 12 104.410 104.410 105.043 -0.633 19287
58 1 1 . 1 1 12 12 GLY C C 12 174.850 174.850 175.752 -0.902 19287
59 1 1 . 1 1 12 12 GLY CA C 12 44.450 44.450 45.520 -1.070 19287
60 1 1 . 1 1 12 12 GLY H H 12 8.190 8.190 8.589 -0.399 19287
61 1 1 . 1 1 14 14 CYS HA H 14 4.250 4.250 4.593 -0.343 19287
62 1 1 . 1 1 14 14 CYS C C 14 172.410 172.410 173.557 -1.147 19287
63 1 1 . 1 1 14 14 CYS CA C 14 59.750 59.750 58.161 1.589 19287
64 1 1 . 1 1 14 14 CYS CB C 14 39.130 39.130 30.477 8.652 19287
65 1 1 . 1 1 15 15 PHE N N 15 116.000 116.000 123.972 -7.972 19287
66 1 1 . 1 1 15 15 PHE HA H 15 4.380 4.380 4.429 -0.049 19287
67 1 1 . 1 1 15 15 PHE C C 15 174.300 174.300 174.741 -0.441 19287
68 1 1 . 1 1 15 15 PHE CA C 15 56.830 56.830 58.266 -1.436 19287
69 1 1 . 1 1 15 15 PHE CB C 15 39.440 39.440 39.085 0.355 19287
70 1 1 . 1 1 15 15 PHE H H 15 7.960 7.960 8.594 -0.634 19287
71 1 1 . 1 1 16 16 ALA N N 16 125.630 125.630 129.738 -4.108 19287
72 1 1 . 1 1 16 16 ALA HA H 16 4.320 4.320 4.596 -0.276 19287
73 1 1 . 1 1 16 16 ALA C C 16 174.300 174.300 175.468 -1.168 19287
74 1 1 . 1 1 16 16 ALA CA C 16 50.130 50.130 51.441 -1.311 19287
75 1 1 . 1 1 16 16 ALA CB C 16 19.180 19.180 21.404 -2.224 19287
76 1 1 . 1 1 16 16 ALA H H 16 7.800 7.800 7.808 -0.008 19287
77 1 1 . 1 1 17 17 PHE N N 17 116.330 116.330 122.359 -6.029 19287
78 1 1 . 1 1 17 17 PHE HA H 17 4.390 4.390 4.670 -0.280 19287
79 1 1 . 1 1 17 17 PHE C C 17 175.310 175.310 174.060 1.250 19287
80 1 1 . 1 1 17 17 PHE CA C 17 57.160 57.160 55.752 1.408 19287
81 1 1 . 1 1 17 17 PHE CB C 17 39.380 39.380 41.257 -1.877 19287
82 1 1 . 1 1 17 17 PHE H H 17 7.330 7.330 8.456 -1.126 19287
83 1 1 . 1 1 18 18 VAL N N 18 122.890 122.890 124.613 -1.723 19287
84 1 1 . 1 1 18 18 VAL HA H 18 4.475 4.475 4.714 -0.239 19287
85 1 1 . 1 1 18 18 VAL C C 18 173.590 173.590 173.364 0.226 19287
86 1 1 . 1 1 18 18 VAL CA C 18 58.900 58.900 58.729 0.171 19287
87 1 1 . 1 1 18 18 VAL CB C 18 33.900 33.900 33.858 0.042 19287
88 1 1 . 1 1 18 18 VAL H H 18 8.680 8.680 8.424 0.256 19287
89 1 1 . 1 1 19 19 PRO HA H 19 4.275 4.275 4.680 -0.405 19287
90 1 1 . 1 1 19 19 PRO C C 19 176.940 176.940 176.423 0.517 19287
91 1 1 . 1 1 19 19 PRO CA C 19 64.060 64.060 62.592 1.468 19287
92 1 1 . 1 1 19 19 PRO CB C 19 31.710 31.710 31.780 -0.070 19287
93 1 1 . 1 1 20 20 SER N N 20 120.230 120.230 117.996 2.234 19287
94 1 1 . 1 1 20 20 SER HA H 20 4.780 4.780 4.737 0.043 19287
95 1 1 . 1 1 20 20 SER C C 20 170.900 170.900 172.808 -1.908 19287
96 1 1 . 1 1 20 20 SER CA C 20 57.450 57.450 56.930 0.520 19287
97 1 1 . 1 1 20 20 SER CB C 20 67.910 67.910 66.793 1.117 19287
98 1 1 . 1 1 20 20 SER H H 20 8.390 8.390 7.851 0.539 19287
99 1 1 . 1 1 21 21 TYR N N 21 118.220 118.220 119.055 -0.835 19287
100 1 1 . 1 1 21 21 TYR HA H 21 5.600 5.600 5.123 0.477 19287
101 1 1 . 1 1 21 21 TYR C C 21 173.770 173.770 175.425 -1.655 19287
102 1 1 . 1 1 21 21 TYR CA C 21 57.740 57.740 58.045 -0.305 19287
103 1 1 . 1 1 21 21 TYR CB C 21 42.660 42.660 41.399 1.261 19287
104 1 1 . 1 1 21 21 TYR H H 21 9.020 9.020 8.948 0.072 19287
105 1 1 . 1 1 22 22 TYR N N 22 119.260 119.260 125.533 -6.273 19287
106 1 1 . 1 1 22 22 TYR HA H 22 5.110 5.110 4.742 0.368 19287
107 1 1 . 1 1 22 22 TYR C C 22 172.610 172.610 174.184 -1.574 19287
108 1 1 . 1 1 22 22 TYR CA C 22 55.380 55.380 56.373 -0.993 19287
109 1 1 . 1 1 22 22 TYR CB C 22 41.550 41.550 42.732 -1.182 19287
110 1 1 . 1 1 22 22 TYR H H 22 9.410 9.410 9.561 -0.151 19287
111 1 1 . 1 1 23 23 TYR N N 23 123.200 123.200 125.639 -2.439 19287
112 1 1 . 1 1 23 23 TYR HA H 23 4.382 4.382 5.010 -0.628 19287
113 1 1 . 1 1 23 23 TYR C C 23 173.250 173.250 174.190 -0.940 19287
114 1 1 . 1 1 23 23 TYR CA C 23 58.360 58.360 56.756 1.604 19287
115 1 1 . 1 1 23 23 TYR CB C 23 39.570 39.570 40.945 -1.375 19287
116 1 1 . 1 1 23 23 TYR H H 23 10.190 10.190 8.273 1.917 19287
117 1 1 . 1 1 24 24 ASN N N 24 126.280 126.280 127.063 -0.783 19287
118 1 1 . 1 1 24 24 ASN HA H 24 4.550 4.550 5.008 -0.458 19287
119 1 1 . 1 1 24 24 ASN C C 24 174.000 174.000 175.440 -1.440 19287
120 1 1 . 1 1 24 24 ASN CA C 24 51.360 51.360 51.960 -0.600 19287
121 1 1 . 1 1 24 24 ASN CB C 24 40.040 40.040 38.992 1.048 19287
122 1 1 . 1 1 24 24 ASN H H 24 7.890 7.890 8.625 -0.735 19287
123 1 1 . 1 1 25 25 GLN N N 25 122.760 122.760 122.785 -0.025 19287
124 1 1 . 1 1 25 25 GLN HA H 25 3.691 3.691 3.794 -0.103 19287
125 1 1 . 1 1 25 25 GLN C C 25 175.670 175.670 177.080 -1.410 19287
126 1 1 . 1 1 25 25 GLN CA C 25 57.480 57.480 58.453 -0.973 19287
127 1 1 . 1 1 25 25 GLN CB C 25 28.120 28.120 27.992 0.128 19287
128 1 1 . 1 1 25 25 GLN H H 25 8.440 8.440 8.385 0.055 19287
129 1 1 . 1 1 26 26 TYR N N 26 119.190 119.190 119.400 -0.210 19287
130 1 1 . 1 1 26 26 TYR HA H 26 4.160 4.160 4.257 -0.097 19287
131 1 1 . 1 1 26 26 TYR C C 26 176.520 176.520 176.776 -0.256 19287
132 1 1 . 1 1 26 26 TYR CA C 26 60.170 60.170 60.033 0.136 19287
133 1 1 . 1 1 26 26 TYR CB C 26 36.880 36.880 38.044 -1.164 19287
134 1 1 . 1 1 26 26 TYR H H 26 7.810 7.810 8.137 -0.327 19287
135 1 1 . 1 1 27 27 SER N N 27 109.600 109.600 111.632 -2.032 19287
136 1 1 . 1 1 27 27 SER HA H 27 4.330 4.330 4.598 -0.268 19287
137 1 1 . 1 1 27 27 SER C C 27 174.830 174.830 173.729 1.101 19287
138 1 1 . 1 1 27 27 SER CA C 27 57.490 57.490 57.306 0.184 19287
139 1 1 . 1 1 27 27 SER CB C 27 64.640 64.640 63.966 0.674 19287
140 1 1 . 1 1 27 27 SER H H 27 7.350 7.350 7.625 -0.275 19287
141 1 1 . 1 1 28 28 ASN N N 28 119.830 119.830 118.964 0.866 19287
142 1 1 . 1 1 28 28 ASN HA H 28 4.060 4.060 4.313 -0.253 19287
143 1 1 . 1 1 28 28 ASN C C 28 173.040 173.040 174.227 -1.187 19287
144 1 1 . 1 1 28 28 ASN CA C 28 53.830 53.830 54.799 -0.969 19287
145 1 1 . 1 1 28 28 ASN CB C 28 37.400 37.400 38.149 -0.749 19287
146 1 1 . 1 1 28 28 ASN H H 28 7.930 7.930 8.073 -0.143 19287
147 1 1 . 1 1 29 29 THR N N 29 103.070 103.070 111.553 -8.483 19287
148 1 1 . 1 1 29 29 THR HA H 29 4.441 4.441 4.675 -0.234 19287
149 1 1 . 1 1 29 29 THR C C 29 172.980 172.980 172.033 0.947 19287
150 1 1 . 1 1 29 29 THR CA C 29 58.920 58.920 61.421 -2.501 19287
151 1 1 . 1 1 29 29 THR CB C 29 73.260 73.260 71.080 2.180 19287
152 1 1 . 1 1 29 29 THR H H 29 6.990 6.990 7.593 -0.603 19287
153 1 1 . 1 1 30 30 CYS N N 30 118.340 118.340 118.365 -0.025 19287
154 1 1 . 1 1 30 30 CYS HA H 30 5.462 5.462 5.367 0.095 19287
155 1 1 . 1 1 30 30 CYS C C 30 173.320 173.320 173.645 -0.325 19287
156 1 1 . 1 1 30 30 CYS CA C 30 57.750 57.750 57.429 0.321 19287
157 1 1 . 1 1 30 30 CYS CB C 30 50.680 50.680 31.770 18.910 19287
158 1 1 . 1 1 30 30 CYS H H 30 8.954 8.954 8.599 0.355 19287
159 1 1 . 1 1 31 31 HIS N N 31 118.930 118.930 120.034 -1.104 19287
160 1 1 . 1 1 31 31 HIS HA H 31 4.780 4.780 5.034 -0.254 19287
161 1 1 . 1 1 31 31 HIS C C 31 172.790 172.790 173.844 -1.054 19287
162 1 1 . 1 1 31 31 HIS CA C 31 53.530 53.530 55.335 -1.805 19287
163 1 1 . 1 1 31 31 HIS CB C 31 33.040 33.040 33.303 -0.263 19287
164 1 1 . 1 1 31 31 HIS H H 31 9.010 9.010 9.403 -0.393 19287
165 1 1 . 1 1 32 32 SER N N 32 117.600 117.600 120.665 -3.065 19287
166 1 1 . 1 1 32 32 SER HA H 32 4.700 4.700 4.266 0.434 19287
167 1 1 . 1 1 32 32 SER C C 32 174.930 174.930 173.809 1.121 19287
168 1 1 . 1 1 32 32 SER CA C 32 57.980 57.980 59.289 -1.309 19287
169 1 1 . 1 1 32 32 SER CB C 32 64.440 64.440 63.039 1.401 19287
170 1 1 . 1 1 32 32 SER H H 32 8.740 8.740 8.261 0.479 19287
171 1 1 . 1 1 33 33 PHE N N 33 120.690 120.690 121.093 -0.403 19287
172 1 1 . 1 1 33 33 PHE HA H 33 4.790 4.790 5.046 -0.256 19287
173 1 1 . 1 1 33 33 PHE C C 33 171.810 171.810 173.651 -1.841 19287
174 1 1 . 1 1 33 33 PHE CA C 33 56.200 56.200 56.227 -0.027 19287
175 1 1 . 1 1 33 33 PHE CB C 33 40.230 40.230 41.744 -1.514 19287
176 1 1 . 1 1 33 33 PHE H H 33 8.830 8.830 8.979 -0.149 19287
177 1 1 . 1 1 34 34 THR N N 34 116.650 116.650 111.782 4.868 19287
178 1 1 . 1 1 34 34 THR HA H 34 3.965 3.965 4.227 -0.262 19287
179 1 1 . 1 1 34 34 THR C C 34 172.600 172.600 172.531 0.069 19287
180 1 1 . 1 1 34 34 THR CA C 34 61.980 61.980 60.518 1.462 19287
181 1 1 . 1 1 34 34 THR CB C 34 68.530 68.530 69.771 -1.241 19287
182 1 1 . 1 1 34 34 THR H H 34 8.400 8.400 8.134 0.266 19287
183 1 1 . 1 1 35 35 TYR N N 35 127.790 127.790 126.470 1.320 19287
184 1 1 . 1 1 35 35 TYR HA H 35 4.500 4.500 4.764 -0.264 19287
185 1 1 . 1 1 35 35 TYR C C 35 174.200 174.200 173.473 0.727 19287
186 1 1 . 1 1 35 35 TYR CA C 35 55.130 55.130 56.683 -1.553 19287
187 1 1 . 1 1 35 35 TYR CB C 35 39.650 39.650 42.183 -2.533 19287
188 1 1 . 1 1 35 35 TYR H H 35 8.010 8.010 8.336 -0.326 19287
189 1 1 . 1 1 39 39 GLY N N 39 103.730 103.730 111.852 -8.122 19287
190 1 1 . 1 1 39 39 GLY C C 39 175.700 175.700 173.625 2.075 19287
191 1 1 . 1 1 39 39 GLY CA C 39 45.370 45.370 44.638 0.732 19287
192 1 1 . 1 1 39 39 GLY H H 39 8.500 8.500 8.287 0.213 19287
193 1 1 . 1 1 40 40 GLY N N 40 110.170 110.170 109.027 1.143 19287
194 1 1 . 1 1 40 40 GLY C C 40 173.140 173.140 173.195 -0.055 19287
195 1 1 . 1 1 40 40 GLY CA C 40 44.320 44.320 44.767 -0.448 19287
196 1 1 . 1 1 40 40 GLY H H 40 8.670 8.670 7.987 0.683 19287
197 1 1 . 1 1 41 41 ASN N N 41 116.960 116.960 117.908 -0.948 19287
198 1 1 . 1 1 41 41 ASN HA H 41 4.560 4.560 4.937 -0.377 19287
199 1 1 . 1 1 41 41 ASN C C 41 173.670 173.670 175.574 -1.904 19287
200 1 1 . 1 1 41 41 ASN CA C 41 51.850 51.850 51.710 0.140 19287
201 1 1 . 1 1 41 41 ASN CB C 41 40.230 40.230 41.596 -1.366 19287
202 1 1 . 1 1 41 41 ASN H H 41 8.790 8.790 8.579 0.211 19287
203 1 1 . 1 1 42 42 ALA N N 42 113.290 113.290 122.750 -9.460 19287
204 1 1 . 1 1 42 42 ALA HA H 42 3.720 3.720 4.074 -0.354 19287
205 1 1 . 1 1 42 42 ALA C C 42 177.220 177.220 177.410 -0.190 19287
206 1 1 . 1 1 42 42 ALA CA C 42 52.810 52.810 54.571 -1.761 19287
207 1 1 . 1 1 42 42 ALA CB C 42 17.980 17.980 18.715 -0.735 19287
208 1 1 . 1 1 42 42 ALA H H 42 7.590 7.590 8.721 -1.131 19287
209 1 1 . 1 1 43 43 ASN N N 43 117.710 117.710 113.648 4.062 19287
210 1 1 . 1 1 43 43 ASN HA H 43 4.700 4.700 4.525 0.175 19287
211 1 1 . 1 1 43 43 ASN C C 43 173.660 173.660 175.278 -1.618 19287
212 1 1 . 1 1 43 43 ASN CA C 43 50.630 50.630 54.044 -3.414 19287
213 1 1 . 1 1 43 43 ASN CB C 43 34.840 34.840 37.812 -2.972 19287
214 1 1 . 1 1 43 43 ASN H H 43 7.900 7.900 8.045 -0.145 19287
215 1 1 . 1 1 44 44 ARG N N 44 120.690 120.690 121.282 -0.592 19287
216 1 1 . 1 1 44 44 ARG HA H 44 4.692 4.692 4.713 -0.021 19287
217 1 1 . 1 1 44 44 ARG C C 44 173.530 173.530 174.703 -1.173 19287
218 1 1 . 1 1 44 44 ARG CA C 44 56.660 56.660 56.421 0.239 19287
219 1 1 . 1 1 44 44 ARG CB C 44 31.450 31.450 29.672 1.778 19287
220 1 1 . 1 1 44 44 ARG H H 44 6.860 6.860 7.117 -0.257 19287
221 1 1 . 1 1 45 45 PHE N N 45 123.690 123.690 123.245 0.445 19287
222 1 1 . 1 1 45 45 PHE HA H 45 4.810 4.810 4.914 -0.104 19287
223 1 1 . 1 1 45 45 PHE C C 45 175.420 175.420 175.614 -0.194 19287
224 1 1 . 1 1 45 45 PHE CA C 45 55.670 55.670 56.739 -1.069 19287
225 1 1 . 1 1 45 45 PHE CB C 45 43.790 43.790 42.952 0.838 19287
226 1 1 . 1 1 45 45 PHE H H 45 9.340 9.340 9.135 0.205 19287
227 1 1 . 1 1 46 46 ARG N N 46 120.920 120.920 118.894 2.026 19287
228 1 1 . 1 1 46 46 ARG HA H 46 4.397 4.397 4.624 -0.227 19287
229 1 1 . 1 1 46 46 ARG C C 46 176.560 176.560 175.678 0.882 19287
230 1 1 . 1 1 46 46 ARG CA C 46 58.210 58.210 56.013 2.197 19287
231 1 1 . 1 1 46 46 ARG CB C 46 30.900 30.900 30.692 0.208 19287
232 1 1 . 1 1 46 46 ARG H H 46 9.080 9.080 8.826 0.254 19287
233 1 1 . 1 1 47 47 THR N N 47 102.800 102.800 113.028 -10.228 19287
234 1 1 . 1 1 47 47 THR HA H 47 4.660 4.660 4.336 0.324 19287
235 1 1 . 1 1 47 47 THR C C 47 174.110 174.110 173.106 1.004 19287
236 1 1 . 1 1 47 47 THR CA C 47 58.170 58.170 60.200 -2.030 19287
237 1 1 . 1 1 47 47 THR CB C 47 72.380 72.380 70.514 1.866 19287
238 1 1 . 1 1 47 47 THR H H 47 7.230 7.230 7.338 -0.108 19287
239 1 1 . 1 1 48 48 ILE N N 48 123.200 123.200 124.239 -1.039 19287
240 1 1 . 1 1 48 48 ILE HA H 48 2.901 2.901 3.457 -0.556 19287
241 1 1 . 1 1 48 48 ILE C C 48 176.420 176.420 175.804 0.616 19287
242 1 1 . 1 1 48 48 ILE CA C 48 64.000 64.000 63.226 0.774 19287
243 1 1 . 1 1 48 48 ILE CB C 48 37.060 37.060 37.928 -0.868 19287
244 1 1 . 1 1 48 48 ILE H H 48 8.110 8.110 7.998 0.112 19287
245 1 1 . 1 1 49 49 ASP N N 49 119.560 119.560 119.948 -0.388 19287
246 1 1 . 1 1 49 49 ASP HA H 49 4.130 4.130 4.229 -0.099 19287
247 1 1 . 1 1 49 49 ASP C C 49 177.740 177.740 178.104 -0.364 19287
248 1 1 . 1 1 49 49 ASP CA C 49 56.690 56.690 57.737 -1.047 19287
249 1 1 . 1 1 49 49 ASP CB C 49 39.970 39.970 40.615 -0.645 19287
250 1 1 . 1 1 49 49 ASP H H 49 7.700 7.700 7.710 -0.010 19287
251 1 1 . 1 1 50 50 GLU N N 50 117.720 117.720 119.410 -1.690 19287
252 1 1 . 1 1 50 50 GLU HA H 50 3.710 3.710 4.124 -0.414 19287
253 1 1 . 1 1 50 50 GLU C C 50 177.550 177.550 178.279 -0.729 19287
254 1 1 . 1 1 50 50 GLU CA C 50 58.550 58.550 59.007 -0.457 19287
255 1 1 . 1 1 50 50 GLU CB C 50 29.190 29.190 29.729 -0.539 19287
256 1 1 . 1 1 50 50 GLU H H 50 7.410 7.410 7.607 -0.197 19287
257 1 1 . 1 1 51 51 CYS N N 51 120.260 120.260 119.553 0.707 19287
258 1 1 . 1 1 51 51 CYS HA H 51 1.650 1.650 2.541 -0.891 19287
259 1 1 . 1 1 51 51 CYS C C 51 175.070 175.070 176.330 -1.260 19287
260 1 1 . 1 1 51 51 CYS CA C 51 59.120 59.120 61.763 -2.643 19287
261 1 1 . 1 1 51 51 CYS CB C 51 43.000 43.000 26.084 16.916 19287
262 1 1 . 1 1 51 51 CYS H H 51 6.760 6.760 7.640 -0.880 19287
263 1 1 . 1 1 52 52 ASN N N 52 120.160 120.160 119.397 0.763 19287
264 1 1 . 1 1 52 52 ASN HA H 52 4.090 4.090 4.403 -0.313 19287
265 1 1 . 1 1 52 52 ASN C C 52 177.820 177.820 177.603 0.217 19287
266 1 1 . 1 1 52 52 ASN CA C 52 55.060 55.060 56.036 -0.976 19287
267 1 1 . 1 1 52 52 ASN CB C 52 37.500 37.500 37.997 -0.497 19287
268 1 1 . 1 1 52 52 ASN H H 52 8.650 8.650 8.527 0.123 19287
269 1 1 . 1 1 53 53 ARG N N 53 117.000 117.000 118.382 -1.382 19287
270 1 1 . 1 1 53 53 ARG HA H 53 3.770 3.770 4.022 -0.252 19287
271 1 1 . 1 1 53 53 ARG C C 53 177.360 177.360 177.779 -0.419 19287
272 1 1 . 1 1 53 53 ARG CA C 53 58.490 58.490 58.708 -0.218 19287
273 1 1 . 1 1 53 53 ARG CB C 53 30.180 30.180 29.439 0.741 19287
274 1 1 . 1 1 53 53 ARG H H 53 7.900 7.900 7.720 0.180 19287
275 1 1 . 1 1 54 54 THR N N 54 112.080 112.080 111.831 0.249 19287
276 1 1 . 1 1 54 54 THR HA H 54 3.838 3.838 4.499 -0.661 19287
277 1 1 . 1 1 54 54 THR C C 54 174.990 174.990 174.655 0.335 19287
278 1 1 . 1 1 54 54 THR CA C 54 65.740 65.740 64.453 1.287 19287
279 1 1 . 1 1 54 54 THR CB C 54 68.870 68.870 70.259 -1.389 19287
280 1 1 . 1 1 54 54 THR H H 54 7.260 7.260 7.694 -0.434 19287
281 1 1 . 1 1 55 55 CYS N N 55 112.540 112.540 117.158 -4.618 19287
282 1 1 . 1 1 55 55 CYS HA H 55 4.400 4.400 4.488 -0.088 19287
283 1 1 . 1 1 55 55 CYS C C 55 172.940 172.940 174.230 -1.290 19287
284 1 1 . 1 1 55 55 CYS CA C 55 54.230 54.230 58.708 -4.478 19287
285 1 1 . 1 1 55 55 CYS CB C 55 42.930 42.930 29.109 13.821 19287
286 1 1 . 1 1 55 55 CYS H H 55 7.590 7.590 7.595 -0.005 19287
287 1 1 . 1 1 56 56 VAL N N 56 119.720 119.720 123.331 -3.611 19287
288 1 1 . 1 1 56 56 VAL HA H 56 3.631 3.631 4.126 -0.495 19287
289 1 1 . 1 1 56 56 VAL C C 56 176.710 176.710 175.910 0.800 19287
290 1 1 . 1 1 56 56 VAL CA C 56 64.540 64.540 63.239 1.301 19287
291 1 1 . 1 1 56 56 VAL CB C 56 30.970 30.970 30.953 0.017 19287
292 1 1 . 1 1 56 56 VAL H H 56 7.280 7.280 7.986 -0.706 19287
293 1 2 . 1 1 2 2 PRO HA H 2 4.017 4.017 4.341 -0.324 19287
294 1 2 . 1 1 2 2 PRO C C 2 177.920 177.920 177.197 0.723 19287
295 1 2 . 1 1 2 2 PRO CA C 2 62.800 62.800 61.968 0.832 19287
296 1 2 . 1 1 2 2 PRO CB C 2 32.050 32.050 32.443 -0.393 19287
297 1 2 . 1 1 3 3 ARG N N 3 122.340 122.340 121.591 0.749 19287
298 1 2 . 1 1 3 3 ARG HA H 3 3.786 3.786 3.947 -0.161 19287
299 1 2 . 1 1 3 3 ARG C C 3 178.950 178.950 177.898 1.052 19287
300 1 2 . 1 1 3 3 ARG CA C 3 58.410 58.410 58.167 0.243 19287
301 1 2 . 1 1 3 3 ARG CB C 3 29.220 29.220 29.521 -0.301 19287
302 1 2 . 1 1 3 3 ARG H H 3 8.550 8.550 8.641 -0.091 19287
303 1 2 . 1 1 4 4 PHE N N 4 113.010 113.010 116.601 -3.591 19287
304 1 2 . 1 1 4 4 PHE HA H 4 4.300 4.300 4.523 -0.223 19287
305 1 2 . 1 1 4 4 PHE C C 4 176.070 176.070 176.030 0.040 19287
306 1 2 . 1 1 4 4 PHE CA C 4 58.220 58.220 58.228 -0.008 19287
307 1 2 . 1 1 4 4 PHE CB C 4 37.310 37.310 37.867 -0.557 19287
308 1 2 . 1 1 4 4 PHE H H 4 7.150 7.150 7.767 -0.617 19287
309 1 2 . 1 1 5 5 CYS N N 5 118.600 118.600 116.984 1.616 19287
310 1 2 . 1 1 5 5 CYS HA H 5 4.130 4.130 4.175 -0.045 19287
311 1 2 . 1 1 5 5 CYS C C 5 173.450 173.450 174.722 -1.272 19287
312 1 2 . 1 1 5 5 CYS CA C 5 57.960 57.960 59.989 -2.029 19287
313 1 2 . 1 1 5 5 CYS CB C 5 39.210 39.210 25.788 13.422 19287
314 1 2 . 1 1 5 5 CYS H H 5 7.090 7.090 7.035 0.055 19287
315 1 2 . 1 1 6 6 GLU N N 6 110.710 110.710 117.984 -7.274 19287
316 1 2 . 1 1 6 6 GLU HA H 6 4.182 4.182 4.492 -0.310 19287
317 1 2 . 1 1 6 6 GLU C C 6 176.310 176.310 176.333 -0.023 19287
318 1 2 . 1 1 6 6 GLU CA C 6 55.510 55.510 55.209 0.301 19287
319 1 2 . 1 1 6 6 GLU CB C 6 28.160 28.160 29.243 -1.083 19287
320 1 2 . 1 1 6 6 GLU H H 6 7.300 7.300 7.522 -0.222 19287
321 1 2 . 1 1 7 7 LEU N N 7 119.090 119.090 120.970 -1.880 19287
322 1 2 . 1 1 7 7 LEU HA H 7 4.160 4.160 4.443 -0.283 19287
323 1 2 . 1 1 7 7 LEU C C 7 176.630 176.630 175.808 0.822 19287
324 1 2 . 1 1 7 7 LEU CA C 7 54.510 54.510 54.248 0.261 19287
325 1 2 . 1 1 7 7 LEU CB C 7 42.330 42.330 43.140 -0.810 19287
326 1 2 . 1 1 7 7 LEU H H 7 7.210 7.210 7.118 0.092 19287
327 1 2 . 1 1 8 8 ALA N N 8 124.490 124.490 122.008 2.482 19287
328 1 2 . 1 1 8 8 ALA HA H 8 4.250 4.250 4.839 -0.589 19287
329 1 2 . 1 1 8 8 ALA C C 8 174.710 174.710 175.256 -0.546 19287
330 1 2 . 1 1 8 8 ALA CA C 8 50.210 50.210 48.485 1.725 19287
331 1 2 . 1 1 8 8 ALA CB C 8 16.930 16.930 19.579 -2.649 19287
332 1 2 . 1 1 8 8 ALA H H 8 8.280 8.280 8.403 -0.123 19287
333 1 2 . 1 1 9 9 PRO HA H 9 4.180 4.180 4.664 -0.484 19287
334 1 2 . 1 1 9 9 PRO C C 9 176.700 176.700 176.973 -0.273 19287
335 1 2 . 1 1 9 9 PRO CA C 9 61.490 61.490 62.940 -1.450 19287
336 1 2 . 1 1 9 9 PRO CB C 9 30.360 30.360 32.174 -1.814 19287
337 1 2 . 1 1 10 10 SER N N 10 112.100 112.100 121.913 -9.813 19287
338 1 2 . 1 1 10 10 SER HA H 10 4.630 4.630 4.394 0.236 19287
339 1 2 . 1 1 10 10 SER C C 10 174.190 174.190 174.960 -0.770 19287
340 1 2 . 1 1 10 10 SER CA C 10 55.360 55.360 56.524 -1.164 19287
341 1 2 . 1 1 10 10 SER CB C 10 64.550 64.550 62.053 2.497 19287
342 1 2 . 1 1 10 10 SER H H 10 7.450 7.450 8.672 -1.222 19287
343 1 2 . 1 1 11 11 ALA N N 11 129.980 129.980 124.177 5.803 19287
344 1 2 . 1 1 11 11 ALA HA H 11 4.496 4.496 3.923 0.573 19287
345 1 2 . 1 1 11 11 ALA C C 11 178.510 178.510 178.265 0.245 19287
346 1 2 . 1 1 11 11 ALA CA C 11 54.810 54.810 54.107 0.703 19287
347 1 2 . 1 1 11 11 ALA CB C 11 19.910 19.910 18.816 1.094 19287
348 1 2 . 1 1 11 11 ALA H H 11 9.210 9.210 8.105 1.105 19287
349 1 2 . 1 1 12 12 GLY N N 12 104.410 104.410 103.446 0.964 19287
350 1 2 . 1 1 12 12 GLY C C 12 174.850 174.850 175.658 -0.808 19287
351 1 2 . 1 1 12 12 GLY CA C 12 44.450 44.450 45.340 -0.890 19287
352 1 2 . 1 1 12 12 GLY H H 12 8.190 8.190 8.510 -0.320 19287
353 1 2 . 1 1 14 14 CYS HA H 14 4.250 4.250 4.652 -0.402 19287
354 1 2 . 1 1 14 14 CYS C C 14 172.410 172.410 173.546 -1.136 19287
355 1 2 . 1 1 14 14 CYS CA C 14 59.750 59.750 58.238 1.512 19287
356 1 2 . 1 1 14 14 CYS CB C 14 39.130 39.130 30.718 8.412 19287
357 1 2 . 1 1 15 15 PHE N N 15 116.000 116.000 122.826 -6.826 19287
358 1 2 . 1 1 15 15 PHE HA H 15 4.380 4.380 4.613 -0.233 19287
359 1 2 . 1 1 15 15 PHE C C 15 174.300 174.300 174.675 -0.375 19287
360 1 2 . 1 1 15 15 PHE CA C 15 56.830 56.830 58.191 -1.361 19287
361 1 2 . 1 1 15 15 PHE CB C 15 39.440 39.440 39.800 -0.360 19287
362 1 2 . 1 1 15 15 PHE H H 15 7.960 7.960 8.636 -0.676 19287
363 1 2 . 1 1 16 16 ALA N N 16 125.630 125.630 131.254 -5.624 19287
364 1 2 . 1 1 16 16 ALA HA H 16 4.320 4.320 4.631 -0.311 19287
365 1 2 . 1 1 16 16 ALA C C 16 174.300 174.300 175.644 -1.344 19287
366 1 2 . 1 1 16 16 ALA CA C 16 50.130 50.130 51.446 -1.316 19287
367 1 2 . 1 1 16 16 ALA CB C 16 19.180 19.180 21.513 -2.333 19287
368 1 2 . 1 1 16 16 ALA H H 16 7.800 7.800 7.656 0.144 19287
369 1 2 . 1 1 17 17 PHE N N 17 116.330 116.330 121.963 -5.633 19287
370 1 2 . 1 1 17 17 PHE HA H 17 4.390 4.390 4.655 -0.265 19287
371 1 2 . 1 1 17 17 PHE C C 17 175.310 175.310 174.068 1.242 19287
372 1 2 . 1 1 17 17 PHE CA C 17 57.160 57.160 55.949 1.211 19287
373 1 2 . 1 1 17 17 PHE CB C 17 39.380 39.380 41.300 -1.921 19287
374 1 2 . 1 1 17 17 PHE H H 17 7.330 7.330 8.430 -1.100 19287
375 1 2 . 1 1 18 18 VAL N N 18 122.890 122.890 124.763 -1.873 19287
376 1 2 . 1 1 18 18 VAL HA H 18 4.475 4.475 4.729 -0.254 19287
377 1 2 . 1 1 18 18 VAL C C 18 173.590 173.590 173.434 0.156 19287
378 1 2 . 1 1 18 18 VAL CA C 18 58.900 58.900 58.732 0.168 19287
379 1 2 . 1 1 18 18 VAL CB C 18 33.900 33.900 33.365 0.535 19287
380 1 2 . 1 1 18 18 VAL H H 18 8.680 8.680 8.521 0.159 19287
381 1 2 . 1 1 19 19 PRO HA H 19 4.275 4.275 4.618 -0.343 19287
382 1 2 . 1 1 19 19 PRO C C 19 176.940 176.940 176.471 0.469 19287
383 1 2 . 1 1 19 19 PRO CA C 19 64.060 64.060 62.762 1.298 19287
384 1 2 . 1 1 19 19 PRO CB C 19 31.710 31.710 31.598 0.112 19287
385 1 2 . 1 1 20 20 SER N N 20 120.230 120.230 118.635 1.595 19287
386 1 2 . 1 1 20 20 SER HA H 20 4.780 4.780 5.007 -0.227 19287
387 1 2 . 1 1 20 20 SER C C 20 170.900 170.900 172.905 -2.005 19287
388 1 2 . 1 1 20 20 SER CA C 20 57.450 57.450 57.008 0.442 19287
389 1 2 . 1 1 20 20 SER CB C 20 67.910 67.910 66.633 1.276 19287
390 1 2 . 1 1 20 20 SER H H 20 8.390 8.390 8.133 0.257 19287
391 1 2 . 1 1 21 21 TYR N N 21 118.220 118.220 118.848 -0.628 19287
392 1 2 . 1 1 21 21 TYR HA H 21 5.600 5.600 5.136 0.464 19287
393 1 2 . 1 1 21 21 TYR C C 21 173.770 173.770 175.144 -1.374 19287
394 1 2 . 1 1 21 21 TYR CA C 21 57.740 57.740 58.266 -0.526 19287
395 1 2 . 1 1 21 21 TYR CB C 21 42.660 42.660 41.793 0.867 19287
396 1 2 . 1 1 21 21 TYR H H 21 9.020 9.020 8.577 0.443 19287
397 1 2 . 1 1 22 22 TYR N N 22 119.260 119.260 124.493 -5.233 19287
398 1 2 . 1 1 22 22 TYR HA H 22 5.110 5.110 4.575 0.535 19287
399 1 2 . 1 1 22 22 TYR C C 22 172.610 172.610 173.868 -1.258 19287
400 1 2 . 1 1 22 22 TYR CA C 22 55.380 55.380 56.591 -1.211 19287
401 1 2 . 1 1 22 22 TYR CB C 22 41.550 41.550 42.588 -1.038 19287
402 1 2 . 1 1 22 22 TYR H H 22 9.410 9.410 9.475 -0.065 19287
403 1 2 . 1 1 23 23 TYR N N 23 123.200 123.200 124.855 -1.655 19287
404 1 2 . 1 1 23 23 TYR HA H 23 4.382 4.382 4.914 -0.532 19287
405 1 2 . 1 1 23 23 TYR C C 23 173.250 173.250 173.960 -0.710 19287
406 1 2 . 1 1 23 23 TYR CA C 23 58.360 58.360 56.878 1.482 19287
407 1 2 . 1 1 23 23 TYR CB C 23 39.570 39.570 41.031 -1.460 19287
408 1 2 . 1 1 23 23 TYR H H 23 10.190 10.190 8.528 1.662 19287
409 1 2 . 1 1 24 24 ASN N N 24 126.280 126.280 126.847 -0.567 19287
410 1 2 . 1 1 24 24 ASN HA H 24 4.550 4.550 4.996 -0.446 19287
411 1 2 . 1 1 24 24 ASN C C 24 174.000 174.000 175.435 -1.435 19287
412 1 2 . 1 1 24 24 ASN CA C 24 51.360 51.360 51.565 -0.205 19287
413 1 2 . 1 1 24 24 ASN CB C 24 40.040 40.040 38.900 1.140 19287
414 1 2 . 1 1 24 24 ASN H H 24 7.890 7.890 8.494 -0.604 19287
415 1 2 . 1 1 25 25 GLN N N 25 122.760 122.760 122.755 0.005 19287
416 1 2 . 1 1 25 25 GLN HA H 25 3.691 3.691 3.791 -0.100 19287
417 1 2 . 1 1 25 25 GLN C C 25 175.670 175.670 177.266 -1.596 19287
418 1 2 . 1 1 25 25 GLN CA C 25 57.480 57.480 58.438 -0.958 19287
419 1 2 . 1 1 25 25 GLN CB C 25 28.120 28.120 27.744 0.376 19287
420 1 2 . 1 1 25 25 GLN H H 25 8.440 8.440 8.275 0.165 19287
421 1 2 . 1 1 26 26 TYR N N 26 119.190 119.190 119.329 -0.139 19287
422 1 2 . 1 1 26 26 TYR HA H 26 4.160 4.160 4.269 -0.109 19287
423 1 2 . 1 1 26 26 TYR C C 26 176.520 176.520 176.769 -0.249 19287
424 1 2 . 1 1 26 26 TYR CA C 26 60.170 60.170 59.688 0.482 19287
425 1 2 . 1 1 26 26 TYR CB C 26 36.880 36.880 37.969 -1.089 19287
426 1 2 . 1 1 26 26 TYR H H 26 7.810 7.810 7.827 -0.017 19287
427 1 2 . 1 1 27 27 SER N N 27 109.600 109.600 111.145 -1.545 19287
428 1 2 . 1 1 27 27 SER HA H 27 4.330 4.330 4.567 -0.237 19287
429 1 2 . 1 1 27 27 SER C C 27 174.830 174.830 173.906 0.924 19287
430 1 2 . 1 1 27 27 SER CA C 27 57.490 57.490 57.281 0.209 19287
431 1 2 . 1 1 27 27 SER CB C 27 64.640 64.640 64.296 0.343 19287
432 1 2 . 1 1 27 27 SER H H 27 7.350 7.350 7.758 -0.408 19287
433 1 2 . 1 1 28 28 ASN N N 28 119.830 119.830 119.252 0.578 19287
434 1 2 . 1 1 28 28 ASN HA H 28 4.060 4.060 4.328 -0.268 19287
435 1 2 . 1 1 28 28 ASN C C 28 173.040 173.040 174.358 -1.318 19287
436 1 2 . 1 1 28 28 ASN CA C 28 53.830 53.830 54.503 -0.673 19287
437 1 2 . 1 1 28 28 ASN CB C 28 37.400 37.400 38.038 -0.638 19287
438 1 2 . 1 1 28 28 ASN H H 28 7.930 7.930 7.891 0.039 19287
439 1 2 . 1 1 29 29 THR N N 29 103.070 103.070 111.303 -8.233 19287
440 1 2 . 1 1 29 29 THR HA H 29 4.441 4.441 4.698 -0.257 19287
441 1 2 . 1 1 29 29 THR C C 29 172.980 172.980 172.126 0.854 19287
442 1 2 . 1 1 29 29 THR CA C 29 58.920 58.920 61.570 -2.650 19287
443 1 2 . 1 1 29 29 THR CB C 29 73.260 73.260 71.630 1.630 19287
444 1 2 . 1 1 29 29 THR H H 29 6.990 6.990 7.545 -0.555 19287
445 1 2 . 1 1 30 30 CYS N N 30 118.340 118.340 119.905 -1.565 19287
446 1 2 . 1 1 30 30 CYS HA H 30 5.462 5.462 5.440 0.022 19287
447 1 2 . 1 1 30 30 CYS C C 30 173.320 173.320 173.612 -0.292 19287
448 1 2 . 1 1 30 30 CYS CA C 30 57.750 57.750 57.468 0.282 19287
449 1 2 . 1 1 30 30 CYS CB C 30 50.680 50.680 31.657 19.023 19287
450 1 2 . 1 1 30 30 CYS H H 30 8.954 8.954 8.682 0.272 19287
451 1 2 . 1 1 31 31 HIS N N 31 118.930 118.930 120.633 -1.703 19287
452 1 2 . 1 1 31 31 HIS HA H 31 4.780 4.780 5.078 -0.298 19287
453 1 2 . 1 1 31 31 HIS C C 31 172.790 172.790 173.901 -1.111 19287
454 1 2 . 1 1 31 31 HIS CA C 31 53.530 53.530 55.530 -2.000 19287
455 1 2 . 1 1 31 31 HIS CB C 31 33.040 33.040 32.869 0.171 19287
456 1 2 . 1 1 31 31 HIS H H 31 9.010 9.010 9.495 -0.485 19287
457 1 2 . 1 1 32 32 SER N N 32 117.600 117.600 121.132 -3.532 19287
458 1 2 . 1 1 32 32 SER HA H 32 4.700 4.700 4.330 0.370 19287
459 1 2 . 1 1 32 32 SER C C 32 174.930 174.930 173.803 1.127 19287
460 1 2 . 1 1 32 32 SER CA C 32 57.980 57.980 59.230 -1.250 19287
461 1 2 . 1 1 32 32 SER CB C 32 64.440 64.440 63.464 0.976 19287
462 1 2 . 1 1 32 32 SER H H 32 8.740 8.740 8.337 0.403 19287
463 1 2 . 1 1 33 33 PHE N N 33 120.690 120.690 119.796 0.894 19287
464 1 2 . 1 1 33 33 PHE HA H 33 4.790 4.790 4.993 -0.203 19287
465 1 2 . 1 1 33 33 PHE C C 33 171.810 171.810 173.536 -1.726 19287
466 1 2 . 1 1 33 33 PHE CA C 33 56.200 56.200 56.236 -0.036 19287
467 1 2 . 1 1 33 33 PHE CB C 33 40.230 40.230 41.348 -1.118 19287
468 1 2 . 1 1 33 33 PHE H H 33 8.830 8.830 9.090 -0.260 19287
469 1 2 . 1 1 34 34 THR N N 34 116.650 116.650 112.204 4.446 19287
470 1 2 . 1 1 34 34 THR HA H 34 3.965 3.965 4.318 -0.353 19287
471 1 2 . 1 1 34 34 THR C C 34 172.600 172.600 172.415 0.185 19287
472 1 2 . 1 1 34 34 THR CA C 34 61.980 61.980 60.481 1.499 19287
473 1 2 . 1 1 34 34 THR CB C 34 68.530 68.530 69.419 -0.889 19287
474 1 2 . 1 1 34 34 THR H H 34 8.400 8.400 8.152 0.248 19287
475 1 2 . 1 1 35 35 TYR N N 35 127.790 127.790 126.079 1.711 19287
476 1 2 . 1 1 35 35 TYR HA H 35 4.500 4.500 4.729 -0.229 19287
477 1 2 . 1 1 35 35 TYR C C 35 174.200 174.200 173.213 0.987 19287
478 1 2 . 1 1 35 35 TYR CA C 35 55.130 55.130 56.768 -1.638 19287
479 1 2 . 1 1 35 35 TYR CB C 35 39.650 39.650 41.931 -2.281 19287
480 1 2 . 1 1 35 35 TYR H H 35 8.010 8.010 7.871 0.139 19287
481 1 2 . 1 1 39 39 GLY N N 39 103.730 103.730 109.795 -6.065 19287
482 1 2 . 1 1 39 39 GLY C C 39 175.700 175.700 174.092 1.608 19287
483 1 2 . 1 1 39 39 GLY CA C 39 45.370 45.370 44.897 0.473 19287
484 1 2 . 1 1 39 39 GLY H H 39 8.500 8.500 8.417 0.083 19287
485 1 2 . 1 1 40 40 GLY N N 40 110.170 110.170 112.249 -2.079 19287
486 1 2 . 1 1 40 40 GLY C C 40 173.140 173.140 173.058 0.082 19287
487 1 2 . 1 1 40 40 GLY CA C 40 44.320 44.320 44.882 -0.562 19287
488 1 2 . 1 1 40 40 GLY H H 40 8.670 8.670 8.196 0.474 19287
489 1 2 . 1 1 41 41 ASN N N 41 116.960 116.960 117.743 -0.783 19287
490 1 2 . 1 1 41 41 ASN HA H 41 4.560 4.560 4.942 -0.382 19287
491 1 2 . 1 1 41 41 ASN C C 41 173.670 173.670 175.535 -1.865 19287
492 1 2 . 1 1 41 41 ASN CA C 41 51.850 51.850 51.912 -0.062 19287
493 1 2 . 1 1 41 41 ASN CB C 41 40.230 40.230 42.069 -1.839 19287
494 1 2 . 1 1 41 41 ASN H H 41 8.790 8.790 8.719 0.071 19287
495 1 2 . 1 1 42 42 ALA N N 42 113.290 113.290 123.129 -9.839 19287
496 1 2 . 1 1 42 42 ALA HA H 42 3.720 3.720 4.148 -0.428 19287
497 1 2 . 1 1 42 42 ALA C C 42 177.220 177.220 178.259 -1.039 19287
498 1 2 . 1 1 42 42 ALA CA C 42 52.810 52.810 54.652 -1.842 19287
499 1 2 . 1 1 42 42 ALA CB C 42 17.980 17.980 18.674 -0.694 19287
500 1 2 . 1 1 42 42 ALA H H 42 7.590 7.590 8.792 -1.202 19287
501 1 2 . 1 1 43 43 ASN N N 43 117.710 117.710 115.094 2.616 19287
502 1 2 . 1 1 43 43 ASN HA H 43 4.700 4.700 4.734 -0.034 19287
503 1 2 . 1 1 43 43 ASN C C 43 173.660 173.660 175.505 -1.845 19287
504 1 2 . 1 1 43 43 ASN CA C 43 50.630 50.630 54.604 -3.974 19287
505 1 2 . 1 1 43 43 ASN CB C 43 34.840 34.840 37.770 -2.930 19287
506 1 2 . 1 1 43 43 ASN H H 43 7.900 7.900 8.122 -0.222 19287
507 1 2 . 1 1 44 44 ARG N N 44 120.690 120.690 121.811 -1.121 19287
508 1 2 . 1 1 44 44 ARG HA H 44 4.692 4.692 4.610 0.082 19287
509 1 2 . 1 1 44 44 ARG C C 44 173.530 173.530 174.798 -1.268 19287
510 1 2 . 1 1 44 44 ARG CA C 44 56.660 56.660 56.633 0.027 19287
511 1 2 . 1 1 44 44 ARG CB C 44 31.450 31.450 29.546 1.904 19287
512 1 2 . 1 1 44 44 ARG H H 44 6.860 6.860 7.382 -0.522 19287
513 1 2 . 1 1 45 45 PHE N N 45 123.690 123.690 124.867 -1.177 19287
514 1 2 . 1 1 45 45 PHE HA H 45 4.810 4.810 4.920 -0.110 19287
515 1 2 . 1 1 45 45 PHE C C 45 175.420 175.420 175.203 0.217 19287
516 1 2 . 1 1 45 45 PHE CA C 45 55.670 55.670 56.801 -1.131 19287
517 1 2 . 1 1 45 45 PHE CB C 45 43.790 43.790 42.637 1.153 19287
518 1 2 . 1 1 45 45 PHE H H 45 9.340 9.340 8.658 0.682 19287
519 1 2 . 1 1 46 46 ARG N N 46 120.920 120.920 117.129 3.791 19287
520 1 2 . 1 1 46 46 ARG HA H 46 4.397 4.397 4.685 -0.288 19287
521 1 2 . 1 1 46 46 ARG C C 46 176.560 176.560 175.394 1.166 19287
522 1 2 . 1 1 46 46 ARG CA C 46 58.210 58.210 55.473 2.737 19287
523 1 2 . 1 1 46 46 ARG CB C 46 30.900 30.900 30.743 0.157 19287
524 1 2 . 1 1 46 46 ARG H H 46 9.080 9.080 8.712 0.368 19287
525 1 2 . 1 1 47 47 THR N N 47 102.800 102.800 112.304 -9.504 19287
526 1 2 . 1 1 47 47 THR HA H 47 4.660 4.660 4.251 0.409 19287
527 1 2 . 1 1 47 47 THR C C 47 174.110 174.110 173.549 0.561 19287
528 1 2 . 1 1 47 47 THR CA C 47 58.170 58.170 60.093 -1.923 19287
529 1 2 . 1 1 47 47 THR CB C 47 72.380 72.380 71.376 1.004 19287
530 1 2 . 1 1 47 47 THR H H 47 7.230 7.230 7.343 -0.113 19287
531 1 2 . 1 1 48 48 ILE N N 48 123.200 123.200 125.771 -2.571 19287
532 1 2 . 1 1 48 48 ILE HA H 48 2.901 2.901 3.509 -0.608 19287
533 1 2 . 1 1 48 48 ILE C C 48 176.420 176.420 175.943 0.477 19287
534 1 2 . 1 1 48 48 ILE CA C 48 64.000 64.000 63.675 0.325 19287
535 1 2 . 1 1 48 48 ILE CB C 48 37.060 37.060 37.982 -0.922 19287
536 1 2 . 1 1 48 48 ILE H H 48 8.110 8.110 7.910 0.200 19287
537 1 2 . 1 1 49 49 ASP N N 49 119.560 119.560 119.876 -0.316 19287
538 1 2 . 1 1 49 49 ASP HA H 49 4.130 4.130 4.267 -0.137 19287
539 1 2 . 1 1 49 49 ASP C C 49 177.740 177.740 178.183 -0.443 19287
540 1 2 . 1 1 49 49 ASP CA C 49 56.690 56.690 57.886 -1.196 19287
541 1 2 . 1 1 49 49 ASP CB C 49 39.970 39.970 40.714 -0.744 19287
542 1 2 . 1 1 49 49 ASP H H 49 7.700 7.700 7.702 -0.002 19287
543 1 2 . 1 1 50 50 GLU N N 50 117.720 117.720 119.438 -1.718 19287
544 1 2 . 1 1 50 50 GLU HA H 50 3.710 3.710 4.114 -0.404 19287
545 1 2 . 1 1 50 50 GLU C C 50 177.550 177.550 178.729 -1.179 19287
546 1 2 . 1 1 50 50 GLU CA C 50 58.550 58.550 59.051 -0.501 19287
547 1 2 . 1 1 50 50 GLU CB C 50 29.190 29.190 29.725 -0.535 19287
548 1 2 . 1 1 50 50 GLU H H 50 7.410 7.410 7.760 -0.350 19287
549 1 2 . 1 1 51 51 CYS N N 51 120.260 120.260 119.542 0.718 19287
550 1 2 . 1 1 51 51 CYS HA H 51 1.650 1.650 3.974 -2.324 19287
551 1 2 . 1 1 51 51 CYS C C 51 175.070 175.070 176.285 -1.215 19287
552 1 2 . 1 1 51 51 CYS CA C 51 59.120 59.120 61.706 -2.587 19287
553 1 2 . 1 1 51 51 CYS CB C 51 43.000 43.000 26.410 16.590 19287
554 1 2 . 1 1 51 51 CYS H H 51 6.760 6.760 8.169 -1.409 19287
555 1 2 . 1 1 52 52 ASN N N 52 120.160 120.160 120.231 -0.071 19287
556 1 2 . 1 1 52 52 ASN HA H 52 4.090 4.090 4.445 -0.355 19287
557 1 2 . 1 1 52 52 ASN C C 52 177.820 177.820 177.692 0.128 19287
558 1 2 . 1 1 52 52 ASN CA C 52 55.060 55.060 56.132 -1.072 19287
559 1 2 . 1 1 52 52 ASN CB C 52 37.500 37.500 37.961 -0.461 19287
560 1 2 . 1 1 52 52 ASN H H 52 8.650 8.650 8.671 -0.021 19287
561 1 2 . 1 1 53 53 ARG N N 53 117.000 117.000 118.025 -1.025 19287
562 1 2 . 1 1 53 53 ARG HA H 53 3.770 3.770 4.087 -0.317 19287
563 1 2 . 1 1 53 53 ARG C C 53 177.360 177.360 177.949 -0.589 19287
564 1 2 . 1 1 53 53 ARG CA C 53 58.490 58.490 58.869 -0.379 19287
565 1 2 . 1 1 53 53 ARG CB C 53 30.180 30.180 29.573 0.607 19287
566 1 2 . 1 1 53 53 ARG H H 53 7.900 7.900 8.073 -0.173 19287
567 1 2 . 1 1 54 54 THR N N 54 112.080 112.080 112.114 -0.034 19287
568 1 2 . 1 1 54 54 THR HA H 54 3.838 3.838 4.324 -0.486 19287
569 1 2 . 1 1 54 54 THR C C 54 174.990 174.990 174.268 0.722 19287
570 1 2 . 1 1 54 54 THR CA C 54 65.740 65.740 65.020 0.720 19287
571 1 2 . 1 1 54 54 THR CB C 54 68.870 68.870 69.975 -1.105 19287
572 1 2 . 1 1 54 54 THR H H 54 7.260 7.260 7.614 -0.354 19287
573 1 2 . 1 1 55 55 CYS N N 55 112.540 112.540 117.447 -4.907 19287
574 1 2 . 1 1 55 55 CYS HA H 55 4.400 4.400 4.488 -0.088 19287
575 1 2 . 1 1 55 55 CYS C C 55 172.940 172.940 174.119 -1.179 19287
576 1 2 . 1 1 55 55 CYS CA C 55 54.230 54.230 58.607 -4.377 19287
577 1 2 . 1 1 55 55 CYS CB C 55 42.930 42.930 28.948 13.982 19287
578 1 2 . 1 1 55 55 CYS H H 55 7.590 7.590 8.074 -0.484 19287
579 1 2 . 1 1 56 56 VAL N N 56 119.720 119.720 122.869 -3.149 19287
580 1 2 . 1 1 56 56 VAL HA H 56 3.631 3.631 4.124 -0.493 19287
581 1 2 . 1 1 56 56 VAL C C 56 176.710 176.710 176.463 0.247 19287
582 1 2 . 1 1 56 56 VAL CA C 56 64.540 64.540 62.309 2.231 19287
583 1 2 . 1 1 56 56 VAL CB C 56 30.970 30.970 29.416 1.554 19287
584 1 2 . 1 1 56 56 VAL H H 56 7.280 7.280 7.991 -0.711 19287
585 1 3 . 1 1 2 2 PRO HA H 2 4.017 4.017 4.501 -0.484 19287
586 1 3 . 1 1 2 2 PRO C C 2 177.920 177.920 177.441 0.479 19287
587 1 3 . 1 1 2 2 PRO CA C 2 62.800 62.800 62.123 0.677 19287
588 1 3 . 1 1 2 2 PRO CB C 2 32.050 32.050 32.950 -0.901 19287
589 1 3 . 1 1 3 3 ARG N N 3 122.340 122.340 122.292 0.048 19287
590 1 3 . 1 1 3 3 ARG HA H 3 3.786 3.786 4.186 -0.400 19287
591 1 3 . 1 1 3 3 ARG C C 3 178.950 178.950 178.334 0.616 19287
592 1 3 . 1 1 3 3 ARG CA C 3 58.410 58.410 58.169 0.241 19287
593 1 3 . 1 1 3 3 ARG CB C 3 29.220 29.220 29.598 -0.378 19287
594 1 3 . 1 1 3 3 ARG H H 3 8.550 8.550 8.829 -0.279 19287
595 1 3 . 1 1 4 4 PHE N N 4 113.010 113.010 117.278 -4.268 19287
596 1 3 . 1 1 4 4 PHE HA H 4 4.300 4.300 4.531 -0.231 19287
597 1 3 . 1 1 4 4 PHE C C 4 176.070 176.070 176.563 -0.493 19287
598 1 3 . 1 1 4 4 PHE CA C 4 58.220 58.220 58.751 -0.531 19287
599 1 3 . 1 1 4 4 PHE CB C 4 37.310 37.310 38.093 -0.783 19287
600 1 3 . 1 1 4 4 PHE H H 4 7.150 7.150 8.015 -0.865 19287
601 1 3 . 1 1 5 5 CYS N N 5 118.600 118.600 117.849 0.751 19287
602 1 3 . 1 1 5 5 CYS HA H 5 4.130 4.130 4.382 -0.252 19287
603 1 3 . 1 1 5 5 CYS C C 5 173.450 173.450 174.742 -1.292 19287
604 1 3 . 1 1 5 5 CYS CA C 5 57.960 57.960 59.785 -1.825 19287
605 1 3 . 1 1 5 5 CYS CB C 5 39.210 39.210 25.545 13.665 19287
606 1 3 . 1 1 5 5 CYS H H 5 7.090 7.090 7.236 -0.146 19287
607 1 3 . 1 1 6 6 GLU N N 6 110.710 110.710 117.862 -7.152 19287
608 1 3 . 1 1 6 6 GLU HA H 6 4.182 4.182 4.442 -0.260 19287
609 1 3 . 1 1 6 6 GLU C C 6 176.310 176.310 176.243 0.067 19287
610 1 3 . 1 1 6 6 GLU CA C 6 55.510 55.510 55.188 0.322 19287
611 1 3 . 1 1 6 6 GLU CB C 6 28.160 28.160 29.542 -1.382 19287
612 1 3 . 1 1 6 6 GLU H H 6 7.300 7.300 7.686 -0.386 19287
613 1 3 . 1 1 7 7 LEU N N 7 119.090 119.090 121.341 -2.251 19287
614 1 3 . 1 1 7 7 LEU HA H 7 4.160 4.160 4.373 -0.213 19287
615 1 3 . 1 1 7 7 LEU C C 7 176.630 176.630 176.179 0.451 19287
616 1 3 . 1 1 7 7 LEU CA C 7 54.510 54.510 54.141 0.369 19287
617 1 3 . 1 1 7 7 LEU CB C 7 42.330 42.330 42.403 -0.073 19287
618 1 3 . 1 1 7 7 LEU H H 7 7.210 7.210 7.365 -0.155 19287
619 1 3 . 1 1 8 8 ALA N N 8 124.490 124.490 122.513 1.977 19287
620 1 3 . 1 1 8 8 ALA HA H 8 4.250 4.250 4.759 -0.509 19287
621 1 3 . 1 1 8 8 ALA C C 8 174.710 174.710 175.647 -0.937 19287
622 1 3 . 1 1 8 8 ALA CA C 8 50.210 50.210 48.690 1.520 19287
623 1 3 . 1 1 8 8 ALA CB C 8 16.930 16.930 19.496 -2.566 19287
624 1 3 . 1 1 8 8 ALA H H 8 8.280 8.280 8.244 0.036 19287
625 1 3 . 1 1 9 9 PRO HA H 9 4.180 4.180 4.553 -0.373 19287
626 1 3 . 1 1 9 9 PRO C C 9 176.700 176.700 176.501 0.199 19287
627 1 3 . 1 1 9 9 PRO CA C 9 61.490 61.490 62.669 -1.179 19287
628 1 3 . 1 1 9 9 PRO CB C 9 30.360 30.360 32.151 -1.791 19287
629 1 3 . 1 1 10 10 SER N N 10 112.100 112.100 124.028 -11.928 19287
630 1 3 . 1 1 10 10 SER HA H 10 4.630 4.630 4.390 0.240 19287
631 1 3 . 1 1 10 10 SER C C 10 174.190 174.190 174.648 -0.458 19287
632 1 3 . 1 1 10 10 SER CA C 10 55.360 55.360 58.043 -2.683 19287
633 1 3 . 1 1 10 10 SER CB C 10 64.550 64.550 61.563 2.987 19287
634 1 3 . 1 1 10 10 SER H H 10 7.450 7.450 8.704 -1.254 19287
635 1 3 . 1 1 11 11 ALA N N 11 129.980 129.980 123.916 6.064 19287
636 1 3 . 1 1 11 11 ALA HA H 11 4.496 4.496 4.104 0.392 19287
637 1 3 . 1 1 11 11 ALA C C 11 178.510 178.510 177.347 1.163 19287
638 1 3 . 1 1 11 11 ALA CA C 11 54.810 54.810 53.432 1.377 19287
639 1 3 . 1 1 11 11 ALA CB C 11 19.910 19.910 19.094 0.816 19287
640 1 3 . 1 1 11 11 ALA H H 11 9.210 9.210 7.906 1.304 19287
641 1 3 . 1 1 12 12 GLY N N 12 104.410 104.410 103.447 0.963 19287
642 1 3 . 1 1 12 12 GLY C C 12 174.850 174.850 175.424 -0.574 19287
643 1 3 . 1 1 12 12 GLY CA C 12 44.450 44.450 44.020 0.430 19287
644 1 3 . 1 1 12 12 GLY H H 12 8.190 8.190 8.030 0.160 19287
645 1 3 . 1 1 14 14 CYS HA H 14 4.250 4.250 4.625 -0.375 19287
646 1 3 . 1 1 14 14 CYS C C 14 172.410 172.410 173.465 -1.055 19287
647 1 3 . 1 1 14 14 CYS CA C 14 59.750 59.750 58.125 1.625 19287
648 1 3 . 1 1 14 14 CYS CB C 14 39.130 39.130 30.326 8.804 19287
649 1 3 . 1 1 15 15 PHE N N 15 116.000 116.000 123.855 -7.855 19287
650 1 3 . 1 1 15 15 PHE HA H 15 4.380 4.380 4.537 -0.157 19287
651 1 3 . 1 1 15 15 PHE C C 15 174.300 174.300 174.628 -0.328 19287
652 1 3 . 1 1 15 15 PHE CA C 15 56.830 56.830 58.301 -1.471 19287
653 1 3 . 1 1 15 15 PHE CB C 15 39.440 39.440 38.832 0.608 19287
654 1 3 . 1 1 15 15 PHE H H 15 7.960 7.960 8.681 -0.721 19287
655 1 3 . 1 1 16 16 ALA N N 16 125.630 125.630 130.330 -4.700 19287
656 1 3 . 1 1 16 16 ALA HA H 16 4.320 4.320 4.646 -0.326 19287
657 1 3 . 1 1 16 16 ALA C C 16 174.300 174.300 174.776 -0.476 19287
658 1 3 . 1 1 16 16 ALA CA C 16 50.130 50.130 51.918 -1.788 19287
659 1 3 . 1 1 16 16 ALA CB C 16 19.180 19.180 21.862 -2.682 19287
660 1 3 . 1 1 16 16 ALA H H 16 7.800 7.800 8.127 -0.327 19287
661 1 3 . 1 1 17 17 PHE N N 17 116.330 116.330 121.962 -5.632 19287
662 1 3 . 1 1 17 17 PHE HA H 17 4.390 4.390 4.699 -0.309 19287
663 1 3 . 1 1 17 17 PHE C C 17 175.310 175.310 174.095 1.215 19287
664 1 3 . 1 1 17 17 PHE CA C 17 57.160 57.160 55.740 1.420 19287
665 1 3 . 1 1 17 17 PHE CB C 17 39.380 39.380 40.342 -0.962 19287
666 1 3 . 1 1 17 17 PHE H H 17 7.330 7.330 8.385 -1.055 19287
667 1 3 . 1 1 18 18 VAL N N 18 122.890 122.890 124.986 -2.096 19287
668 1 3 . 1 1 18 18 VAL HA H 18 4.475 4.475 4.689 -0.214 19287
669 1 3 . 1 1 18 18 VAL C C 18 173.590 173.590 173.639 -0.049 19287
670 1 3 . 1 1 18 18 VAL CA C 18 58.900 58.900 58.700 0.201 19287
671 1 3 . 1 1 18 18 VAL CB C 18 33.900 33.900 33.902 -0.002 19287
672 1 3 . 1 1 18 18 VAL H H 18 8.680 8.680 8.278 0.402 19287
673 1 3 . 1 1 19 19 PRO HA H 19 4.275 4.275 4.671 -0.396 19287
674 1 3 . 1 1 19 19 PRO C C 19 176.940 176.940 176.315 0.625 19287
675 1 3 . 1 1 19 19 PRO CA C 19 64.060 64.060 62.664 1.396 19287
676 1 3 . 1 1 19 19 PRO CB C 19 31.710 31.710 31.491 0.219 19287
677 1 3 . 1 1 20 20 SER N N 20 120.230 120.230 117.759 2.471 19287
678 1 3 . 1 1 20 20 SER HA H 20 4.780 4.780 4.663 0.117 19287
679 1 3 . 1 1 20 20 SER C C 20 170.900 170.900 173.109 -2.209 19287
680 1 3 . 1 1 20 20 SER CA C 20 57.450 57.450 56.055 1.395 19287
681 1 3 . 1 1 20 20 SER CB C 20 67.910 67.910 65.773 2.137 19287
682 1 3 . 1 1 20 20 SER H H 20 8.390 8.390 7.847 0.543 19287
683 1 3 . 1 1 21 21 TYR N N 21 118.220 118.220 119.427 -1.207 19287
684 1 3 . 1 1 21 21 TYR HA H 21 5.600 5.600 4.905 0.695 19287
685 1 3 . 1 1 21 21 TYR C C 21 173.770 173.770 174.558 -0.788 19287
686 1 3 . 1 1 21 21 TYR CA C 21 57.740 57.740 57.912 -0.172 19287
687 1 3 . 1 1 21 21 TYR CB C 21 42.660 42.660 41.992 0.668 19287
688 1 3 . 1 1 21 21 TYR H H 21 9.020 9.020 8.387 0.633 19287
689 1 3 . 1 1 22 22 TYR N N 22 119.260 119.260 125.583 -6.323 19287
690 1 3 . 1 1 22 22 TYR HA H 22 5.110 5.110 4.610 0.500 19287
691 1 3 . 1 1 22 22 TYR C C 22 172.610 172.610 174.069 -1.459 19287
692 1 3 . 1 1 22 22 TYR CA C 22 55.380 55.380 55.861 -0.481 19287
693 1 3 . 1 1 22 22 TYR CB C 22 41.550 41.550 42.239 -0.689 19287
694 1 3 . 1 1 22 22 TYR H H 22 9.410 9.410 9.415 -0.005 19287
695 1 3 . 1 1 23 23 TYR N N 23 123.200 123.200 128.605 -5.405 19287
696 1 3 . 1 1 23 23 TYR HA H 23 4.382 4.382 4.971 -0.589 19287
697 1 3 . 1 1 23 23 TYR C C 23 173.250 173.250 174.717 -1.467 19287
698 1 3 . 1 1 23 23 TYR CA C 23 58.360 58.360 57.246 1.114 19287
699 1 3 . 1 1 23 23 TYR CB C 23 39.570 39.570 39.932 -0.362 19287
700 1 3 . 1 1 23 23 TYR H H 23 10.190 10.190 8.181 2.009 19287
701 1 3 . 1 1 24 24 ASN N N 24 126.280 126.280 128.007 -1.727 19287
702 1 3 . 1 1 24 24 ASN HA H 24 4.550 4.550 4.966 -0.416 19287
703 1 3 . 1 1 24 24 ASN C C 24 174.000 174.000 175.523 -1.523 19287
704 1 3 . 1 1 24 24 ASN CA C 24 51.360 51.360 51.424 -0.064 19287
705 1 3 . 1 1 24 24 ASN CB C 24 40.040 40.040 38.263 1.778 19287
706 1 3 . 1 1 24 24 ASN H H 24 7.890 7.890 8.656 -0.766 19287
707 1 3 . 1 1 25 25 GLN N N 25 122.760 122.760 123.532 -0.772 19287
708 1 3 . 1 1 25 25 GLN HA H 25 3.691 3.691 3.665 0.026 19287
709 1 3 . 1 1 25 25 GLN C C 25 175.670 175.670 176.728 -1.058 19287
710 1 3 . 1 1 25 25 GLN CA C 25 57.480 57.480 58.155 -0.675 19287
711 1 3 . 1 1 25 25 GLN CB C 25 28.120 28.120 27.479 0.641 19287
712 1 3 . 1 1 25 25 GLN H H 25 8.440 8.440 8.177 0.263 19287
713 1 3 . 1 1 26 26 TYR N N 26 119.190 119.190 119.710 -0.520 19287
714 1 3 . 1 1 26 26 TYR HA H 26 4.160 4.160 4.282 -0.122 19287
715 1 3 . 1 1 26 26 TYR C C 26 176.520 176.520 176.904 -0.384 19287
716 1 3 . 1 1 26 26 TYR CA C 26 60.170 60.170 59.849 0.321 19287
717 1 3 . 1 1 26 26 TYR CB C 26 36.880 36.880 38.095 -1.215 19287
718 1 3 . 1 1 26 26 TYR H H 26 7.810 7.810 7.732 0.078 19287
719 1 3 . 1 1 27 27 SER N N 27 109.600 109.600 111.560 -1.960 19287
720 1 3 . 1 1 27 27 SER HA H 27 4.330 4.330 4.594 -0.264 19287
721 1 3 . 1 1 27 27 SER C C 27 174.830 174.830 174.030 0.800 19287
722 1 3 . 1 1 27 27 SER CA C 27 57.490 57.490 57.528 -0.038 19287
723 1 3 . 1 1 27 27 SER CB C 27 64.640 64.640 63.980 0.660 19287
724 1 3 . 1 1 27 27 SER H H 27 7.350 7.350 7.631 -0.281 19287
725 1 3 . 1 1 28 28 ASN N N 28 119.830 119.830 119.869 -0.039 19287
726 1 3 . 1 1 28 28 ASN HA H 28 4.060 4.060 4.433 -0.373 19287
727 1 3 . 1 1 28 28 ASN C C 28 173.040 173.040 174.455 -1.415 19287
728 1 3 . 1 1 28 28 ASN CA C 28 53.830 53.830 54.618 -0.788 19287
729 1 3 . 1 1 28 28 ASN CB C 28 37.400 37.400 38.092 -0.692 19287
730 1 3 . 1 1 28 28 ASN H H 28 7.930 7.930 7.940 -0.010 19287
731 1 3 . 1 1 29 29 THR N N 29 103.070 103.070 111.516 -8.446 19287
732 1 3 . 1 1 29 29 THR HA H 29 4.441 4.441 4.793 -0.352 19287
733 1 3 . 1 1 29 29 THR C C 29 172.980 172.980 172.210 0.770 19287
734 1 3 . 1 1 29 29 THR CA C 29 58.920 58.920 61.673 -2.753 19287
735 1 3 . 1 1 29 29 THR CB C 29 73.260 73.260 71.713 1.547 19287
736 1 3 . 1 1 29 29 THR H H 29 6.990 6.990 7.641 -0.651 19287
737 1 3 . 1 1 30 30 CYS N N 30 118.340 118.340 119.652 -1.312 19287
738 1 3 . 1 1 30 30 CYS HA H 30 5.462 5.462 5.700 -0.238 19287
739 1 3 . 1 1 30 30 CYS C C 30 173.320 173.320 173.606 -0.286 19287
740 1 3 . 1 1 30 30 CYS CA C 30 57.750 57.750 57.094 0.656 19287
741 1 3 . 1 1 30 30 CYS CB C 30 50.680 50.680 32.110 18.570 19287
742 1 3 . 1 1 30 30 CYS H H 30 8.954 8.954 8.699 0.255 19287
743 1 3 . 1 1 31 31 HIS N N 31 118.930 118.930 119.939 -1.009 19287
744 1 3 . 1 1 31 31 HIS HA H 31 4.780 4.780 5.103 -0.323 19287
745 1 3 . 1 1 31 31 HIS C C 31 172.790 172.790 173.998 -1.208 19287
746 1 3 . 1 1 31 31 HIS CA C 31 53.530 53.530 55.592 -2.062 19287
747 1 3 . 1 1 31 31 HIS CB C 31 33.040 33.040 33.154 -0.114 19287
748 1 3 . 1 1 31 31 HIS H H 31 9.010 9.010 9.460 -0.450 19287
749 1 3 . 1 1 32 32 SER N N 32 117.600 117.600 120.888 -3.288 19287
750 1 3 . 1 1 32 32 SER HA H 32 4.700 4.700 4.373 0.327 19287
751 1 3 . 1 1 32 32 SER C C 32 174.930 174.930 173.779 1.151 19287
752 1 3 . 1 1 32 32 SER CA C 32 57.980 57.980 58.906 -0.926 19287
753 1 3 . 1 1 32 32 SER CB C 32 64.440 64.440 63.326 1.114 19287
754 1 3 . 1 1 32 32 SER H H 32 8.740 8.740 8.327 0.413 19287
755 1 3 . 1 1 33 33 PHE N N 33 120.690 120.690 120.771 -0.081 19287
756 1 3 . 1 1 33 33 PHE HA H 33 4.790 4.790 5.015 -0.225 19287
757 1 3 . 1 1 33 33 PHE C C 33 171.810 171.810 173.492 -1.682 19287
758 1 3 . 1 1 33 33 PHE CA C 33 56.200 56.200 55.598 0.602 19287
759 1 3 . 1 1 33 33 PHE CB C 33 40.230 40.230 41.057 -0.827 19287
760 1 3 . 1 1 33 33 PHE H H 33 8.830 8.830 8.818 0.012 19287
761 1 3 . 1 1 34 34 THR N N 34 116.650 116.650 111.954 4.696 19287
762 1 3 . 1 1 34 34 THR HA H 34 3.965 3.965 4.444 -0.479 19287
763 1 3 . 1 1 34 34 THR C C 34 172.600 172.600 172.405 0.195 19287
764 1 3 . 1 1 34 34 THR CA C 34 61.980 61.980 60.756 1.224 19287
765 1 3 . 1 1 34 34 THR CB C 34 68.530 68.530 69.363 -0.833 19287
766 1 3 . 1 1 34 34 THR H H 34 8.400 8.400 8.221 0.179 19287
767 1 3 . 1 1 35 35 TYR N N 35 127.790 127.790 125.873 1.917 19287
768 1 3 . 1 1 35 35 TYR HA H 35 4.500 4.500 4.630 -0.130 19287
769 1 3 . 1 1 35 35 TYR C C 35 174.200 174.200 173.355 0.845 19287
770 1 3 . 1 1 35 35 TYR CA C 35 55.130 55.130 56.975 -1.845 19287
771 1 3 . 1 1 35 35 TYR CB C 35 39.650 39.650 41.930 -2.280 19287
772 1 3 . 1 1 35 35 TYR H H 35 8.010 8.010 8.243 -0.233 19287
773 1 3 . 1 1 39 39 GLY N N 39 103.730 103.730 109.462 -5.732 19287
774 1 3 . 1 1 39 39 GLY C C 39 175.700 175.700 174.761 0.939 19287
775 1 3 . 1 1 39 39 GLY CA C 39 45.370 45.370 45.793 -0.423 19287
776 1 3 . 1 1 39 39 GLY H H 39 8.500 8.500 8.649 -0.149 19287
777 1 3 . 1 1 40 40 GLY N N 40 110.170 110.170 108.930 1.240 19287
778 1 3 . 1 1 40 40 GLY C C 40 173.140 173.140 172.764 0.376 19287
779 1 3 . 1 1 40 40 GLY CA C 40 44.320 44.320 44.869 -0.549 19287
780 1 3 . 1 1 40 40 GLY H H 40 8.670 8.670 7.840 0.830 19287
781 1 3 . 1 1 41 41 ASN N N 41 116.960 116.960 117.310 -0.350 19287
782 1 3 . 1 1 41 41 ASN HA H 41 4.560 4.560 4.940 -0.380 19287
783 1 3 . 1 1 41 41 ASN C C 41 173.670 173.670 175.150 -1.480 19287
784 1 3 . 1 1 41 41 ASN CA C 41 51.850 51.850 52.294 -0.444 19287
785 1 3 . 1 1 41 41 ASN CB C 41 40.230 40.230 39.934 0.295 19287
786 1 3 . 1 1 41 41 ASN H H 41 8.790 8.790 8.397 0.393 19287
787 1 3 . 1 1 42 42 ALA N N 42 113.290 113.290 122.065 -8.775 19287
788 1 3 . 1 1 42 42 ALA HA H 42 3.720 3.720 4.158 -0.438 19287
789 1 3 . 1 1 42 42 ALA C C 42 177.220 177.220 178.217 -0.997 19287
790 1 3 . 1 1 42 42 ALA CA C 42 52.810 52.810 54.581 -1.772 19287
791 1 3 . 1 1 42 42 ALA CB C 42 17.980 17.980 18.774 -0.794 19287
792 1 3 . 1 1 42 42 ALA H H 42 7.590 7.590 8.625 -1.035 19287
793 1 3 . 1 1 43 43 ASN N N 43 117.710 117.710 115.348 2.362 19287
794 1 3 . 1 1 43 43 ASN HA H 43 4.700 4.700 4.623 0.077 19287
795 1 3 . 1 1 43 43 ASN C C 43 173.660 173.660 174.054 -0.394 19287
796 1 3 . 1 1 43 43 ASN CA C 43 50.630 50.630 53.811 -3.181 19287
797 1 3 . 1 1 43 43 ASN CB C 43 34.840 34.840 38.322 -3.482 19287
798 1 3 . 1 1 43 43 ASN H H 43 7.900 7.900 8.058 -0.158 19287
799 1 3 . 1 1 44 44 ARG N N 44 120.690 120.690 119.380 1.310 19287
800 1 3 . 1 1 44 44 ARG HA H 44 4.692 4.692 4.100 0.592 19287
801 1 3 . 1 1 44 44 ARG C C 44 173.530 173.530 174.520 -0.990 19287
802 1 3 . 1 1 44 44 ARG CA C 44 56.660 56.660 55.828 0.832 19287
803 1 3 . 1 1 44 44 ARG CB C 44 31.450 31.450 29.793 1.657 19287
804 1 3 . 1 1 44 44 ARG H H 44 6.860 6.860 6.995 -0.135 19287
805 1 3 . 1 1 45 45 PHE N N 45 123.690 123.690 122.371 1.319 19287
806 1 3 . 1 1 45 45 PHE HA H 45 4.810 4.810 4.953 -0.143 19287
807 1 3 . 1 1 45 45 PHE C C 45 175.420 175.420 175.159 0.261 19287
808 1 3 . 1 1 45 45 PHE CA C 45 55.670 55.670 55.765 -0.095 19287
809 1 3 . 1 1 45 45 PHE CB C 45 43.790 43.790 41.631 2.159 19287
810 1 3 . 1 1 45 45 PHE H H 45 9.340 9.340 8.113 1.227 19287
811 1 3 . 1 1 46 46 ARG N N 46 120.920 120.920 118.498 2.422 19287
812 1 3 . 1 1 46 46 ARG HA H 46 4.397 4.397 4.663 -0.266 19287
813 1 3 . 1 1 46 46 ARG C C 46 176.560 176.560 175.751 0.809 19287
814 1 3 . 1 1 46 46 ARG CA C 46 58.210 58.210 56.072 2.138 19287
815 1 3 . 1 1 46 46 ARG CB C 46 30.900 30.900 30.709 0.191 19287
816 1 3 . 1 1 46 46 ARG H H 46 9.080 9.080 8.826 0.254 19287
817 1 3 . 1 1 47 47 THR N N 47 102.800 102.800 112.333 -9.533 19287
818 1 3 . 1 1 47 47 THR HA H 47 4.660 4.660 4.088 0.572 19287
819 1 3 . 1 1 47 47 THR C C 47 174.110 174.110 173.142 0.968 19287
820 1 3 . 1 1 47 47 THR CA C 47 58.170 58.170 60.317 -2.147 19287
821 1 3 . 1 1 47 47 THR CB C 47 72.380 72.380 70.402 1.978 19287
822 1 3 . 1 1 47 47 THR H H 47 7.230 7.230 7.282 -0.052 19287
823 1 3 . 1 1 48 48 ILE N N 48 123.200 123.200 124.923 -1.723 19287
824 1 3 . 1 1 48 48 ILE HA H 48 2.901 2.901 3.889 -0.988 19287
825 1 3 . 1 1 48 48 ILE C C 48 176.420 176.420 175.747 0.673 19287
826 1 3 . 1 1 48 48 ILE CA C 48 64.000 64.000 62.685 1.315 19287
827 1 3 . 1 1 48 48 ILE CB C 48 37.060 37.060 38.371 -1.311 19287
828 1 3 . 1 1 48 48 ILE H H 48 8.110 8.110 7.976 0.134 19287
829 1 3 . 1 1 49 49 ASP N N 49 119.560 119.560 120.152 -0.592 19287
830 1 3 . 1 1 49 49 ASP HA H 49 4.130 4.130 4.242 -0.112 19287
831 1 3 . 1 1 49 49 ASP C C 49 177.740 177.740 178.392 -0.652 19287
832 1 3 . 1 1 49 49 ASP CA C 49 56.690 56.690 57.633 -0.943 19287
833 1 3 . 1 1 49 49 ASP CB C 49 39.970 39.970 39.763 0.207 19287
834 1 3 . 1 1 49 49 ASP H H 49 7.700 7.700 7.681 0.019 19287
835 1 3 . 1 1 50 50 GLU N N 50 117.720 117.720 119.176 -1.456 19287
836 1 3 . 1 1 50 50 GLU HA H 50 3.710 3.710 4.210 -0.500 19287
837 1 3 . 1 1 50 50 GLU C C 50 177.550 177.550 178.721 -1.171 19287
838 1 3 . 1 1 50 50 GLU CA C 50 58.550 58.550 58.448 0.102 19287
839 1 3 . 1 1 50 50 GLU CB C 50 29.190 29.190 29.372 -0.182 19287
840 1 3 . 1 1 50 50 GLU H H 50 7.410 7.410 7.813 -0.403 19287
841 1 3 . 1 1 51 51 CYS N N 51 120.260 120.260 117.252 3.008 19287
842 1 3 . 1 1 51 51 CYS HA H 51 1.650 1.650 3.726 -2.076 19287
843 1 3 . 1 1 51 51 CYS C C 51 175.070 175.070 176.659 -1.589 19287
844 1 3 . 1 1 51 51 CYS CA C 51 59.120 59.120 60.432 -1.312 19287
845 1 3 . 1 1 51 51 CYS CB C 51 43.000 43.000 26.252 16.748 19287
846 1 3 . 1 1 51 51 CYS H H 51 6.760 6.760 7.752 -0.992 19287
847 1 3 . 1 1 52 52 ASN N N 52 120.160 120.160 121.267 -1.107 19287
848 1 3 . 1 1 52 52 ASN HA H 52 4.090 4.090 4.396 -0.306 19287
849 1 3 . 1 1 52 52 ASN C C 52 177.820 177.820 177.527 0.293 19287
850 1 3 . 1 1 52 52 ASN CA C 52 55.060 55.060 55.832 -0.772 19287
851 1 3 . 1 1 52 52 ASN CB C 52 37.500 37.500 38.246 -0.746 19287
852 1 3 . 1 1 52 52 ASN H H 52 8.650 8.650 8.491 0.159 19287
853 1 3 . 1 1 53 53 ARG N N 53 117.000 117.000 118.867 -1.867 19287
854 1 3 . 1 1 53 53 ARG HA H 53 3.770 3.770 4.032 -0.262 19287
855 1 3 . 1 1 53 53 ARG C C 53 177.360 177.360 178.143 -0.783 19287
856 1 3 . 1 1 53 53 ARG CA C 53 58.490 58.490 58.845 -0.355 19287
857 1 3 . 1 1 53 53 ARG CB C 53 30.180 30.180 29.400 0.780 19287
858 1 3 . 1 1 53 53 ARG H H 53 7.900 7.900 7.812 0.088 19287
859 1 3 . 1 1 54 54 THR N N 54 112.080 112.080 111.833 0.247 19287
860 1 3 . 1 1 54 54 THR HA H 54 3.838 3.838 4.345 -0.507 19287
861 1 3 . 1 1 54 54 THR C C 54 174.990 174.990 174.538 0.452 19287
862 1 3 . 1 1 54 54 THR CA C 54 65.740 65.740 65.038 0.702 19287
863 1 3 . 1 1 54 54 THR CB C 54 68.870 68.870 70.018 -1.148 19287
864 1 3 . 1 1 54 54 THR H H 54 7.260 7.260 7.852 -0.592 19287
865 1 3 . 1 1 55 55 CYS N N 55 112.540 112.540 117.043 -4.503 19287
866 1 3 . 1 1 55 55 CYS HA H 55 4.400 4.400 4.392 0.008 19287
867 1 3 . 1 1 55 55 CYS C C 55 172.940 172.940 173.796 -0.856 19287
868 1 3 . 1 1 55 55 CYS CA C 55 54.230 54.230 57.923 -3.693 19287
869 1 3 . 1 1 55 55 CYS CB C 55 42.930 42.930 28.859 14.071 19287
870 1 3 . 1 1 55 55 CYS H H 55 7.590 7.590 7.594 -0.004 19287
871 1 3 . 1 1 56 56 VAL N N 56 119.720 119.720 123.013 -3.293 19287
872 1 3 . 1 1 56 56 VAL HA H 56 3.631 3.631 4.128 -0.497 19287
873 1 3 . 1 1 56 56 VAL C C 56 176.710 176.710 175.849 0.861 19287
874 1 3 . 1 1 56 56 VAL CA C 56 64.540 64.540 62.931 1.609 19287
875 1 3 . 1 1 56 56 VAL CB C 56 30.970 30.970 30.618 0.352 19287
876 1 3 . 1 1 56 56 VAL H H 56 7.280 7.280 7.984 -0.704 19287
877 1 4 . 1 1 2 2 PRO HA H 2 4.017 4.017 4.489 -0.472 19287
878 1 4 . 1 1 2 2 PRO C C 2 177.920 177.920 177.990 -0.070 19287
879 1 4 . 1 1 2 2 PRO CA C 2 62.800 62.800 62.472 0.328 19287
880 1 4 . 1 1 2 2 PRO CB C 2 32.050 32.050 32.859 -0.809 19287
881 1 4 . 1 1 3 3 ARG N N 3 122.340 122.340 122.218 0.122 19287
882 1 4 . 1 1 3 3 ARG HA H 3 3.786 3.786 4.233 -0.447 19287
883 1 4 . 1 1 3 3 ARG C C 3 178.950 178.950 175.353 3.597 19287
884 1 4 . 1 1 3 3 ARG CA C 3 58.410 58.410 57.729 0.681 19287
885 1 4 . 1 1 3 3 ARG CB C 3 29.220 29.220 28.608 0.612 19287
886 1 4 . 1 1 3 3 ARG H H 3 8.550 8.550 8.736 -0.186 19287
887 1 4 . 1 1 4 4 PHE N N 4 113.010 113.010 113.389 -0.379 19287
888 1 4 . 1 1 4 4 PHE HA H 4 4.300 4.300 4.683 -0.383 19287
889 1 4 . 1 1 4 4 PHE C C 4 176.070 176.070 176.030 0.040 19287
890 1 4 . 1 1 4 4 PHE CA C 4 58.220 58.220 57.017 1.203 19287
891 1 4 . 1 1 4 4 PHE CB C 4 37.310 37.310 38.541 -1.232 19287
892 1 4 . 1 1 4 4 PHE H H 4 7.150 7.150 7.362 -0.212 19287
893 1 4 . 1 1 5 5 CYS N N 5 118.600 118.600 119.102 -0.502 19287
894 1 4 . 1 1 5 5 CYS HA H 5 4.130 4.130 4.061 0.069 19287
895 1 4 . 1 1 5 5 CYS C C 5 173.450 173.450 174.910 -1.460 19287
896 1 4 . 1 1 5 5 CYS CA C 5 57.960 57.960 60.289 -2.329 19287
897 1 4 . 1 1 5 5 CYS CB C 5 39.210 39.210 26.031 13.179 19287
898 1 4 . 1 1 5 5 CYS H H 5 7.090 7.090 7.341 -0.251 19287
899 1 4 . 1 1 6 6 GLU N N 6 110.710 110.710 117.577 -6.867 19287
900 1 4 . 1 1 6 6 GLU HA H 6 4.182 4.182 4.383 -0.201 19287
901 1 4 . 1 1 6 6 GLU C C 6 176.310 176.310 176.186 0.124 19287
902 1 4 . 1 1 6 6 GLU CA C 6 55.510 55.510 55.221 0.288 19287
903 1 4 . 1 1 6 6 GLU CB C 6 28.160 28.160 28.977 -0.817 19287
904 1 4 . 1 1 6 6 GLU H H 6 7.300 7.300 8.081 -0.781 19287
905 1 4 . 1 1 7 7 LEU N N 7 119.090 119.090 120.756 -1.666 19287
906 1 4 . 1 1 7 7 LEU HA H 7 4.160 4.160 4.423 -0.263 19287
907 1 4 . 1 1 7 7 LEU C C 7 176.630 176.630 175.795 0.835 19287
908 1 4 . 1 1 7 7 LEU CA C 7 54.510 54.510 54.126 0.384 19287
909 1 4 . 1 1 7 7 LEU CB C 7 42.330 42.330 43.122 -0.792 19287
910 1 4 . 1 1 7 7 LEU H H 7 7.210 7.210 7.115 0.095 19287
911 1 4 . 1 1 8 8 ALA N N 8 124.490 124.490 121.635 2.855 19287
912 1 4 . 1 1 8 8 ALA HA H 8 4.250 4.250 4.758 -0.508 19287
913 1 4 . 1 1 8 8 ALA C C 8 174.710 174.710 175.119 -0.409 19287
914 1 4 . 1 1 8 8 ALA CA C 8 50.210 50.210 48.573 1.637 19287
915 1 4 . 1 1 8 8 ALA CB C 8 16.930 16.930 19.537 -2.607 19287
916 1 4 . 1 1 8 8 ALA H H 8 8.280 8.280 8.336 -0.056 19287
917 1 4 . 1 1 9 9 PRO HA H 9 4.180 4.180 4.609 -0.429 19287
918 1 4 . 1 1 9 9 PRO C C 9 176.700 176.700 176.835 -0.135 19287
919 1 4 . 1 1 9 9 PRO CA C 9 61.490 61.490 63.174 -1.684 19287
920 1 4 . 1 1 9 9 PRO CB C 9 30.360 30.360 31.834 -1.474 19287
921 1 4 . 1 1 10 10 SER N N 10 112.100 112.100 121.516 -9.416 19287
922 1 4 . 1 1 10 10 SER HA H 10 4.630 4.630 4.413 0.217 19287
923 1 4 . 1 1 10 10 SER C C 10 174.190 174.190 174.945 -0.755 19287
924 1 4 . 1 1 10 10 SER CA C 10 55.360 55.360 56.340 -0.980 19287
925 1 4 . 1 1 10 10 SER CB C 10 64.550 64.550 62.028 2.522 19287
926 1 4 . 1 1 10 10 SER H H 10 7.450 7.450 8.644 -1.194 19287
927 1 4 . 1 1 11 11 ALA N N 11 129.980 129.980 124.505 5.475 19287
928 1 4 . 1 1 11 11 ALA HA H 11 4.496 4.496 3.975 0.521 19287
929 1 4 . 1 1 11 11 ALA C C 11 178.510 178.510 178.144 0.366 19287
930 1 4 . 1 1 11 11 ALA CA C 11 54.810 54.810 53.686 1.124 19287
931 1 4 . 1 1 11 11 ALA CB C 11 19.910 19.910 18.945 0.965 19287
932 1 4 . 1 1 11 11 ALA H H 11 9.210 9.210 8.111 1.099 19287
933 1 4 . 1 1 12 12 GLY N N 12 104.410 104.410 104.032 0.378 19287
934 1 4 . 1 1 12 12 GLY C C 12 174.850 174.850 175.691 -0.841 19287
935 1 4 . 1 1 12 12 GLY CA C 12 44.450 44.450 45.259 -0.809 19287
936 1 4 . 1 1 12 12 GLY H H 12 8.190 8.190 8.364 -0.174 19287
937 1 4 . 1 1 14 14 CYS HA H 14 4.250 4.250 4.626 -0.376 19287
938 1 4 . 1 1 14 14 CYS C C 14 172.410 172.410 173.506 -1.096 19287
939 1 4 . 1 1 14 14 CYS CA C 14 59.750 59.750 58.282 1.468 19287
940 1 4 . 1 1 14 14 CYS CB C 14 39.130 39.130 30.697 8.433 19287
941 1 4 . 1 1 15 15 PHE N N 15 116.000 116.000 123.372 -7.372 19287
942 1 4 . 1 1 15 15 PHE HA H 15 4.380 4.380 4.785 -0.405 19287
943 1 4 . 1 1 15 15 PHE C C 15 174.300 174.300 174.074 0.226 19287
944 1 4 . 1 1 15 15 PHE CA C 15 56.830 56.830 57.290 -0.460 19287
945 1 4 . 1 1 15 15 PHE CB C 15 39.440 39.440 39.910 -0.470 19287
946 1 4 . 1 1 15 15 PHE H H 15 7.960 7.960 8.614 -0.654 19287
947 1 4 . 1 1 16 16 ALA N N 16 125.630 125.630 130.408 -4.778 19287
948 1 4 . 1 1 16 16 ALA HA H 16 4.320 4.320 4.216 0.104 19287
949 1 4 . 1 1 16 16 ALA C C 16 174.300 174.300 175.429 -1.129 19287
950 1 4 . 1 1 16 16 ALA CA C 16 50.130 50.130 51.403 -1.273 19287
951 1 4 . 1 1 16 16 ALA CB C 16 19.180 19.180 21.480 -2.300 19287
952 1 4 . 1 1 16 16 ALA H H 16 7.800 7.800 8.014 -0.214 19287
953 1 4 . 1 1 17 17 PHE N N 17 116.330 116.330 121.880 -5.550 19287
954 1 4 . 1 1 17 17 PHE HA H 17 4.390 4.390 4.765 -0.375 19287
955 1 4 . 1 1 17 17 PHE C C 17 175.310 175.310 174.240 1.070 19287
956 1 4 . 1 1 17 17 PHE CA C 17 57.160 57.160 56.297 0.863 19287
957 1 4 . 1 1 17 17 PHE CB C 17 39.380 39.380 41.119 -1.739 19287
958 1 4 . 1 1 17 17 PHE H H 17 7.330 7.330 8.324 -0.994 19287
959 1 4 . 1 1 18 18 VAL N N 18 122.890 122.890 124.644 -1.754 19287
960 1 4 . 1 1 18 18 VAL HA H 18 4.475 4.475 4.409 0.066 19287
961 1 4 . 1 1 18 18 VAL C C 18 173.590 173.590 173.154 0.436 19287
962 1 4 . 1 1 18 18 VAL CA C 18 58.900 58.900 58.263 0.638 19287
963 1 4 . 1 1 18 18 VAL CB C 18 33.900 33.900 33.410 0.490 19287
964 1 4 . 1 1 18 18 VAL H H 18 8.680 8.680 7.989 0.691 19287
965 1 4 . 1 1 19 19 PRO HA H 19 4.275 4.275 4.495 -0.220 19287
966 1 4 . 1 1 19 19 PRO C C 19 176.940 176.940 176.456 0.484 19287
967 1 4 . 1 1 19 19 PRO CA C 19 64.060 64.060 62.210 1.850 19287
968 1 4 . 1 1 19 19 PRO CB C 19 31.710 31.710 31.710 -0.000 19287
969 1 4 . 1 1 20 20 SER N N 20 120.230 120.230 118.081 2.149 19287
970 1 4 . 1 1 20 20 SER HA H 20 4.780 4.780 4.713 0.067 19287
971 1 4 . 1 1 20 20 SER C C 20 170.900 170.900 172.891 -1.991 19287
972 1 4 . 1 1 20 20 SER CA C 20 57.450 57.450 56.990 0.460 19287
973 1 4 . 1 1 20 20 SER CB C 20 67.910 67.910 66.770 1.140 19287
974 1 4 . 1 1 20 20 SER H H 20 8.390 8.390 8.073 0.317 19287
975 1 4 . 1 1 21 21 TYR N N 21 118.220 118.220 118.801 -0.581 19287
976 1 4 . 1 1 21 21 TYR HA H 21 5.600 5.600 4.846 0.754 19287
977 1 4 . 1 1 21 21 TYR C C 21 173.770 173.770 175.057 -1.287 19287
978 1 4 . 1 1 21 21 TYR CA C 21 57.740 57.740 57.872 -0.132 19287
979 1 4 . 1 1 21 21 TYR CB C 21 42.660 42.660 41.803 0.857 19287
980 1 4 . 1 1 21 21 TYR H H 21 9.020 9.020 8.773 0.247 19287
981 1 4 . 1 1 22 22 TYR N N 22 119.260 119.260 125.462 -6.202 19287
982 1 4 . 1 1 22 22 TYR HA H 22 5.110 5.110 4.897 0.213 19287
983 1 4 . 1 1 22 22 TYR C C 22 172.610 172.610 174.029 -1.419 19287
984 1 4 . 1 1 22 22 TYR CA C 22 55.380 55.380 56.842 -1.462 19287
985 1 4 . 1 1 22 22 TYR CB C 22 41.550 41.550 41.974 -0.424 19287
986 1 4 . 1 1 22 22 TYR H H 22 9.410 9.410 9.583 -0.173 19287
987 1 4 . 1 1 23 23 TYR N N 23 123.200 123.200 129.015 -5.815 19287
988 1 4 . 1 1 23 23 TYR HA H 23 4.382 4.382 4.831 -0.449 19287
989 1 4 . 1 1 23 23 TYR C C 23 173.250 173.250 174.326 -1.076 19287
990 1 4 . 1 1 23 23 TYR CA C 23 58.360 58.360 57.335 1.025 19287
991 1 4 . 1 1 23 23 TYR CB C 23 39.570 39.570 39.816 -0.246 19287
992 1 4 . 1 1 23 23 TYR H H 23 10.190 10.190 8.807 1.383 19287
993 1 4 . 1 1 24 24 ASN N N 24 126.280 126.280 127.378 -1.098 19287
994 1 4 . 1 1 24 24 ASN HA H 24 4.550 4.550 4.865 -0.315 19287
995 1 4 . 1 1 24 24 ASN C C 24 174.000 174.000 175.287 -1.287 19287
996 1 4 . 1 1 24 24 ASN CA C 24 51.360 51.360 51.944 -0.584 19287
997 1 4 . 1 1 24 24 ASN CB C 24 40.040 40.040 39.035 1.005 19287
998 1 4 . 1 1 24 24 ASN H H 24 7.890 7.890 8.765 -0.875 19287
999 1 4 . 1 1 25 25 GLN N N 25 122.760 122.760 123.576 -0.816 19287
1000 1 4 . 1 1 25 25 GLN HA H 25 3.691 3.691 3.617 0.074 19287
1001 1 4 . 1 1 25 25 GLN C C 25 175.670 175.670 176.848 -1.178 19287
1002 1 4 . 1 1 25 25 GLN CA C 25 57.480 57.480 58.170 -0.690 19287
1003 1 4 . 1 1 25 25 GLN CB C 25 28.120 28.120 27.260 0.860 19287
1004 1 4 . 1 1 25 25 GLN H H 25 8.440 8.440 8.047 0.393 19287
1005 1 4 . 1 1 26 26 TYR N N 26 119.190 119.190 120.031 -0.841 19287
1006 1 4 . 1 1 26 26 TYR HA H 26 4.160 4.160 4.255 -0.095 19287
1007 1 4 . 1 1 26 26 TYR C C 26 176.520 176.520 177.085 -0.565 19287
1008 1 4 . 1 1 26 26 TYR CA C 26 60.170 60.170 59.931 0.239 19287
1009 1 4 . 1 1 26 26 TYR CB C 26 36.880 36.880 37.866 -0.986 19287
1010 1 4 . 1 1 26 26 TYR H H 26 7.810 7.810 7.512 0.298 19287
1011 1 4 . 1 1 27 27 SER N N 27 109.600 109.600 111.309 -1.709 19287
1012 1 4 . 1 1 27 27 SER HA H 27 4.330 4.330 4.590 -0.260 19287
1013 1 4 . 1 1 27 27 SER C C 27 174.830 174.830 174.063 0.767 19287
1014 1 4 . 1 1 27 27 SER CA C 27 57.490 57.490 57.527 -0.037 19287
1015 1 4 . 1 1 27 27 SER CB C 27 64.640 64.640 63.996 0.644 19287
1016 1 4 . 1 1 27 27 SER H H 27 7.350 7.350 7.685 -0.335 19287
1017 1 4 . 1 1 28 28 ASN N N 28 119.830 119.830 119.019 0.811 19287
1018 1 4 . 1 1 28 28 ASN HA H 28 4.060 4.060 4.404 -0.344 19287
1019 1 4 . 1 1 28 28 ASN C C 28 173.040 173.040 174.472 -1.432 19287
1020 1 4 . 1 1 28 28 ASN CA C 28 53.830 53.830 54.676 -0.846 19287
1021 1 4 . 1 1 28 28 ASN CB C 28 37.400 37.400 38.268 -0.868 19287
1022 1 4 . 1 1 28 28 ASN H H 28 7.930 7.930 7.981 -0.051 19287
1023 1 4 . 1 1 29 29 THR N N 29 103.070 103.070 110.889 -7.819 19287
1024 1 4 . 1 1 29 29 THR HA H 29 4.441 4.441 4.706 -0.265 19287
1025 1 4 . 1 1 29 29 THR C C 29 172.980 172.980 172.077 0.903 19287
1026 1 4 . 1 1 29 29 THR CA C 29 58.920 58.920 61.271 -2.351 19287
1027 1 4 . 1 1 29 29 THR CB C 29 73.260 73.260 70.749 2.511 19287
1028 1 4 . 1 1 29 29 THR H H 29 6.990 6.990 7.577 -0.587 19287
1029 1 4 . 1 1 30 30 CYS N N 30 118.340 118.340 119.505 -1.165 19287
1030 1 4 . 1 1 30 30 CYS HA H 30 5.462 5.462 5.636 -0.174 19287
1031 1 4 . 1 1 30 30 CYS C C 30 173.320 173.320 173.433 -0.113 19287
1032 1 4 . 1 1 30 30 CYS CA C 30 57.750 57.750 57.374 0.376 19287
1033 1 4 . 1 1 30 30 CYS CB C 30 50.680 50.680 31.660 19.020 19287
1034 1 4 . 1 1 30 30 CYS H H 30 8.954 8.954 8.668 0.286 19287
1035 1 4 . 1 1 31 31 HIS N N 31 118.930 118.930 120.665 -1.735 19287
1036 1 4 . 1 1 31 31 HIS HA H 31 4.780 4.780 5.103 -0.323 19287
1037 1 4 . 1 1 31 31 HIS C C 31 172.790 172.790 173.927 -1.137 19287
1038 1 4 . 1 1 31 31 HIS CA C 31 53.530 53.530 55.383 -1.853 19287
1039 1 4 . 1 1 31 31 HIS CB C 31 33.040 33.040 33.329 -0.289 19287
1040 1 4 . 1 1 31 31 HIS H H 31 9.010 9.010 9.599 -0.589 19287
1041 1 4 . 1 1 32 32 SER N N 32 117.600 117.600 120.712 -3.112 19287
1042 1 4 . 1 1 32 32 SER HA H 32 4.700 4.700 4.202 0.498 19287
1043 1 4 . 1 1 32 32 SER C C 32 174.930 174.930 173.631 1.299 19287
1044 1 4 . 1 1 32 32 SER CA C 32 57.980 57.980 58.644 -0.664 19287
1045 1 4 . 1 1 32 32 SER CB C 32 64.440 64.440 63.282 1.158 19287
1046 1 4 . 1 1 32 32 SER H H 32 8.740 8.740 8.267 0.473 19287
1047 1 4 . 1 1 33 33 PHE N N 33 120.690 120.690 119.609 1.081 19287
1048 1 4 . 1 1 33 33 PHE HA H 33 4.790 4.790 4.955 -0.166 19287
1049 1 4 . 1 1 33 33 PHE C C 33 171.810 171.810 173.580 -1.770 19287
1050 1 4 . 1 1 33 33 PHE CA C 33 56.200 56.200 55.808 0.392 19287
1051 1 4 . 1 1 33 33 PHE CB C 33 40.230 40.230 40.931 -0.701 19287
1052 1 4 . 1 1 33 33 PHE H H 33 8.830 8.830 8.945 -0.115 19287
1053 1 4 . 1 1 34 34 THR N N 34 116.650 116.650 112.088 4.562 19287
1054 1 4 . 1 1 34 34 THR HA H 34 3.965 3.965 4.154 -0.189 19287
1055 1 4 . 1 1 34 34 THR C C 34 172.600 172.600 172.717 -0.117 19287
1056 1 4 . 1 1 34 34 THR CA C 34 61.980 61.980 61.382 0.598 19287
1057 1 4 . 1 1 34 34 THR CB C 34 68.530 68.530 69.582 -1.052 19287
1058 1 4 . 1 1 34 34 THR H H 34 8.400 8.400 8.281 0.119 19287
1059 1 4 . 1 1 35 35 TYR N N 35 127.790 127.790 125.303 2.487 19287
1060 1 4 . 1 1 35 35 TYR HA H 35 4.500 4.500 4.761 -0.261 19287
1061 1 4 . 1 1 35 35 TYR C C 35 174.200 174.200 173.703 0.497 19287
1062 1 4 . 1 1 35 35 TYR CA C 35 55.130 55.130 57.073 -1.943 19287
1063 1 4 . 1 1 35 35 TYR CB C 35 39.650 39.650 42.012 -2.362 19287
1064 1 4 . 1 1 35 35 TYR H H 35 8.010 8.010 8.199 -0.189 19287
1065 1 4 . 1 1 39 39 GLY N N 39 103.730 103.730 111.248 -7.518 19287
1066 1 4 . 1 1 39 39 GLY C C 39 175.700 175.700 173.932 1.768 19287
1067 1 4 . 1 1 39 39 GLY CA C 39 45.370 45.370 44.755 0.615 19287
1068 1 4 . 1 1 39 39 GLY H H 39 8.500 8.500 8.388 0.112 19287
1069 1 4 . 1 1 40 40 GLY N N 40 110.170 110.170 112.753 -2.583 19287
1070 1 4 . 1 1 40 40 GLY C C 40 173.140 173.140 173.006 0.134 19287
1071 1 4 . 1 1 40 40 GLY CA C 40 44.320 44.320 44.778 -0.458 19287
1072 1 4 . 1 1 40 40 GLY H H 40 8.670 8.670 8.303 0.367 19287
1073 1 4 . 1 1 41 41 ASN N N 41 116.960 116.960 117.468 -0.508 19287
1074 1 4 . 1 1 41 41 ASN HA H 41 4.560 4.560 4.968 -0.408 19287
1075 1 4 . 1 1 41 41 ASN C C 41 173.670 173.670 175.730 -2.060 19287
1076 1 4 . 1 1 41 41 ASN CA C 41 51.850 51.850 52.040 -0.190 19287
1077 1 4 . 1 1 41 41 ASN CB C 41 40.230 40.230 42.022 -1.792 19287
1078 1 4 . 1 1 41 41 ASN H H 41 8.790 8.790 8.785 0.005 19287
1079 1 4 . 1 1 42 42 ALA N N 42 113.290 113.290 123.163 -9.873 19287
1080 1 4 . 1 1 42 42 ALA HA H 42 3.720 3.720 4.133 -0.413 19287
1081 1 4 . 1 1 42 42 ALA C C 42 177.220 177.220 178.004 -0.784 19287
1082 1 4 . 1 1 42 42 ALA CA C 42 52.810 52.810 54.699 -1.889 19287
1083 1 4 . 1 1 42 42 ALA CB C 42 17.980 17.980 18.595 -0.615 19287
1084 1 4 . 1 1 42 42 ALA H H 42 7.590 7.590 8.772 -1.182 19287
1085 1 4 . 1 1 43 43 ASN N N 43 117.710 117.710 114.722 2.988 19287
1086 1 4 . 1 1 43 43 ASN HA H 43 4.700 4.700 4.637 0.063 19287
1087 1 4 . 1 1 43 43 ASN C C 43 173.660 173.660 175.318 -1.658 19287
1088 1 4 . 1 1 43 43 ASN CA C 43 50.630 50.630 54.042 -3.412 19287
1089 1 4 . 1 1 43 43 ASN CB C 43 34.840 34.840 37.790 -2.950 19287
1090 1 4 . 1 1 43 43 ASN H H 43 7.900 7.900 8.172 -0.273 19287
1091 1 4 . 1 1 44 44 ARG N N 44 120.690 120.690 121.030 -0.340 19287
1092 1 4 . 1 1 44 44 ARG HA H 44 4.692 4.692 4.182 0.510 19287
1093 1 4 . 1 1 44 44 ARG C C 44 173.530 173.530 174.575 -1.045 19287
1094 1 4 . 1 1 44 44 ARG CA C 44 56.660 56.660 56.992 -0.333 19287
1095 1 4 . 1 1 44 44 ARG CB C 44 31.450 31.450 30.347 1.103 19287
1096 1 4 . 1 1 44 44 ARG H H 44 6.860 6.860 7.369 -0.509 19287
1097 1 4 . 1 1 45 45 PHE N N 45 123.690 123.690 122.143 1.547 19287
1098 1 4 . 1 1 45 45 PHE HA H 45 4.810 4.810 4.866 -0.056 19287
1099 1 4 . 1 1 45 45 PHE C C 45 175.420 175.420 175.446 -0.026 19287
1100 1 4 . 1 1 45 45 PHE CA C 45 55.670 55.670 56.828 -1.158 19287
1101 1 4 . 1 1 45 45 PHE CB C 45 43.790 43.790 43.342 0.448 19287
1102 1 4 . 1 1 45 45 PHE H H 45 9.340 9.340 8.139 1.201 19287
1103 1 4 . 1 1 46 46 ARG N N 46 120.920 120.920 118.546 2.374 19287
1104 1 4 . 1 1 46 46 ARG HA H 46 4.397 4.397 4.509 -0.112 19287
1105 1 4 . 1 1 46 46 ARG C C 46 176.560 176.560 175.742 0.818 19287
1106 1 4 . 1 1 46 46 ARG CA C 46 58.210 58.210 55.581 2.629 19287
1107 1 4 . 1 1 46 46 ARG CB C 46 30.900 30.900 30.791 0.109 19287
1108 1 4 . 1 1 46 46 ARG H H 46 9.080 9.080 8.672 0.408 19287
1109 1 4 . 1 1 47 47 THR N N 47 102.800 102.800 111.673 -8.873 19287
1110 1 4 . 1 1 47 47 THR HA H 47 4.660 4.660 3.691 0.969 19287
1111 1 4 . 1 1 47 47 THR C C 47 174.110 174.110 173.175 0.935 19287
1112 1 4 . 1 1 47 47 THR CA C 47 58.170 58.170 59.167 -0.997 19287
1113 1 4 . 1 1 47 47 THR CB C 47 72.380 72.380 71.129 1.251 19287
1114 1 4 . 1 1 47 47 THR H H 47 7.230 7.230 7.251 -0.021 19287
1115 1 4 . 1 1 48 48 ILE N N 48 123.200 123.200 122.829 0.371 19287
1116 1 4 . 1 1 48 48 ILE HA H 48 2.901 2.901 3.594 -0.693 19287
1117 1 4 . 1 1 48 48 ILE C C 48 176.420 176.420 175.915 0.505 19287
1118 1 4 . 1 1 48 48 ILE CA C 48 64.000 64.000 63.481 0.519 19287
1119 1 4 . 1 1 48 48 ILE CB C 48 37.060 37.060 38.159 -1.099 19287
1120 1 4 . 1 1 48 48 ILE H H 48 8.110 8.110 7.915 0.195 19287
1121 1 4 . 1 1 49 49 ASP N N 49 119.560 119.560 119.806 -0.246 19287
1122 1 4 . 1 1 49 49 ASP HA H 49 4.130 4.130 4.250 -0.120 19287
1123 1 4 . 1 1 49 49 ASP C C 49 177.740 177.740 178.347 -0.607 19287
1124 1 4 . 1 1 49 49 ASP CA C 49 56.690 56.690 57.638 -0.948 19287
1125 1 4 . 1 1 49 49 ASP CB C 49 39.970 39.970 40.522 -0.552 19287
1126 1 4 . 1 1 49 49 ASP H H 49 7.700 7.700 7.645 0.055 19287
1127 1 4 . 1 1 50 50 GLU N N 50 117.720 117.720 119.481 -1.761 19287
1128 1 4 . 1 1 50 50 GLU HA H 50 3.710 3.710 4.200 -0.490 19287
1129 1 4 . 1 1 50 50 GLU C C 50 177.550 177.550 177.989 -0.439 19287
1130 1 4 . 1 1 50 50 GLU CA C 50 58.550 58.550 58.545 0.005 19287
1131 1 4 . 1 1 50 50 GLU CB C 50 29.190 29.190 29.630 -0.440 19287
1132 1 4 . 1 1 50 50 GLU H H 50 7.410 7.410 7.596 -0.186 19287
1133 1 4 . 1 1 51 51 CYS N N 51 120.260 120.260 119.380 0.880 19287
1134 1 4 . 1 1 51 51 CYS HA H 51 1.650 1.650 2.855 -1.205 19287
1135 1 4 . 1 1 51 51 CYS C C 51 175.070 175.070 176.300 -1.230 19287
1136 1 4 . 1 1 51 51 CYS CA C 51 59.120 59.120 61.070 -1.950 19287
1137 1 4 . 1 1 51 51 CYS CB C 51 43.000 43.000 25.768 17.232 19287
1138 1 4 . 1 1 51 51 CYS H H 51 6.760 6.760 7.673 -0.913 19287
1139 1 4 . 1 1 52 52 ASN N N 52 120.160 120.160 119.657 0.503 19287
1140 1 4 . 1 1 52 52 ASN HA H 52 4.090 4.090 4.367 -0.277 19287
1141 1 4 . 1 1 52 52 ASN C C 52 177.820 177.820 177.650 0.170 19287
1142 1 4 . 1 1 52 52 ASN CA C 52 55.060 55.060 55.903 -0.842 19287
1143 1 4 . 1 1 52 52 ASN CB C 52 37.500 37.500 37.921 -0.421 19287
1144 1 4 . 1 1 52 52 ASN H H 52 8.650 8.650 8.511 0.139 19287
1145 1 4 . 1 1 53 53 ARG N N 53 117.000 117.000 118.256 -1.256 19287
1146 1 4 . 1 1 53 53 ARG HA H 53 3.770 3.770 4.020 -0.250 19287
1147 1 4 . 1 1 53 53 ARG C C 53 177.360 177.360 177.633 -0.273 19287
1148 1 4 . 1 1 53 53 ARG CA C 53 58.490 58.490 58.663 -0.173 19287
1149 1 4 . 1 1 53 53 ARG CB C 53 30.180 30.180 29.347 0.833 19287
1150 1 4 . 1 1 53 53 ARG H H 53 7.900 7.900 7.525 0.375 19287
1151 1 4 . 1 1 54 54 THR N N 54 112.080 112.080 112.345 -0.265 19287
1152 1 4 . 1 1 54 54 THR HA H 54 3.838 3.838 4.482 -0.644 19287
1153 1 4 . 1 1 54 54 THR C C 54 174.990 174.990 174.589 0.401 19287
1154 1 4 . 1 1 54 54 THR CA C 54 65.740 65.740 63.446 2.294 19287
1155 1 4 . 1 1 54 54 THR CB C 54 68.870 68.870 70.185 -1.315 19287
1156 1 4 . 1 1 54 54 THR H H 54 7.260 7.260 7.957 -0.697 19287
1157 1 4 . 1 1 55 55 CYS N N 55 112.540 112.540 117.600 -5.060 19287
1158 1 4 . 1 1 55 55 CYS HA H 55 4.400 4.400 4.417 -0.017 19287
1159 1 4 . 1 1 55 55 CYS C C 55 172.940 172.940 174.415 -1.475 19287
1160 1 4 . 1 1 55 55 CYS CA C 55 54.230 54.230 58.766 -4.536 19287
1161 1 4 . 1 1 55 55 CYS CB C 55 42.930 42.930 29.002 13.928 19287
1162 1 4 . 1 1 55 55 CYS H H 55 7.590 7.590 7.488 0.102 19287
1163 1 4 . 1 1 56 56 VAL N N 56 119.720 119.720 123.745 -4.025 19287
1164 1 4 . 1 1 56 56 VAL HA H 56 3.631 3.631 3.970 -0.339 19287
1165 1 4 . 1 1 56 56 VAL C C 56 176.710 176.710 176.105 0.605 19287
1166 1 4 . 1 1 56 56 VAL CA C 56 64.540 64.540 63.785 0.755 19287
1167 1 4 . 1 1 56 56 VAL CB C 56 30.970 30.970 30.541 0.429 19287
1168 1 4 . 1 1 56 56 VAL H H 56 7.280 7.280 7.604 -0.324 19287
1169 1 5 . 1 1 2 2 PRO HA H 2 4.017 4.017 4.377 -0.360 19287
1170 1 5 . 1 1 2 2 PRO C C 2 177.920 177.920 177.558 0.362 19287
1171 1 5 . 1 1 2 2 PRO CA C 2 62.800 62.800 62.124 0.676 19287
1172 1 5 . 1 1 2 2 PRO CB C 2 32.050 32.050 32.384 -0.334 19287
1173 1 5 . 1 1 3 3 ARG N N 3 122.340 122.340 122.641 -0.301 19287
1174 1 5 . 1 1 3 3 ARG HA H 3 3.786 3.786 4.154 -0.368 19287
1175 1 5 . 1 1 3 3 ARG C C 3 178.950 178.950 175.284 3.666 19287
1176 1 5 . 1 1 3 3 ARG CA C 3 58.410 58.410 57.542 0.868 19287
1177 1 5 . 1 1 3 3 ARG CB C 3 29.220 29.220 28.524 0.696 19287
1178 1 5 . 1 1 3 3 ARG H H 3 8.550 8.550 8.625 -0.075 19287
1179 1 5 . 1 1 4 4 PHE N N 4 113.010 113.010 112.754 0.256 19287
1180 1 5 . 1 1 4 4 PHE HA H 4 4.300 4.300 4.668 -0.368 19287
1181 1 5 . 1 1 4 4 PHE C C 4 176.070 176.070 176.623 -0.553 19287
1182 1 5 . 1 1 4 4 PHE CA C 4 58.220 58.220 56.682 1.538 19287
1183 1 5 . 1 1 4 4 PHE CB C 4 37.310 37.310 38.194 -0.884 19287
1184 1 5 . 1 1 4 4 PHE H H 4 7.150 7.150 7.005 0.145 19287
1185 1 5 . 1 1 5 5 CYS N N 5 118.600 118.600 119.844 -1.244 19287
1186 1 5 . 1 1 5 5 CYS HA H 5 4.130 4.130 4.229 -0.099 19287
1187 1 5 . 1 1 5 5 CYS C C 5 173.450 173.450 174.895 -1.445 19287
1188 1 5 . 1 1 5 5 CYS CA C 5 57.960 57.960 60.455 -2.495 19287
1189 1 5 . 1 1 5 5 CYS CB C 5 39.210 39.210 26.157 13.053 19287
1190 1 5 . 1 1 5 5 CYS H H 5 7.090 7.090 7.391 -0.301 19287
1191 1 5 . 1 1 6 6 GLU N N 6 110.710 110.710 117.664 -6.954 19287
1192 1 5 . 1 1 6 6 GLU HA H 6 4.182 4.182 4.356 -0.174 19287
1193 1 5 . 1 1 6 6 GLU C C 6 176.310 176.310 176.332 -0.022 19287
1194 1 5 . 1 1 6 6 GLU CA C 6 55.510 55.510 55.415 0.095 19287
1195 1 5 . 1 1 6 6 GLU CB C 6 28.160 28.160 29.023 -0.864 19287
1196 1 5 . 1 1 6 6 GLU H H 6 7.300 7.300 8.008 -0.708 19287
1197 1 5 . 1 1 7 7 LEU N N 7 119.090 119.090 120.931 -1.841 19287
1198 1 5 . 1 1 7 7 LEU HA H 7 4.160 4.160 4.311 -0.151 19287
1199 1 5 . 1 1 7 7 LEU C C 7 176.630 176.630 175.919 0.711 19287
1200 1 5 . 1 1 7 7 LEU CA C 7 54.510 54.510 54.491 0.019 19287
1201 1 5 . 1 1 7 7 LEU CB C 7 42.330 42.330 42.837 -0.507 19287
1202 1 5 . 1 1 7 7 LEU H H 7 7.210 7.210 7.097 0.113 19287
1203 1 5 . 1 1 8 8 ALA N N 8 124.490 124.490 121.746 2.744 19287
1204 1 5 . 1 1 8 8 ALA HA H 8 4.250 4.250 4.756 -0.506 19287
1205 1 5 . 1 1 8 8 ALA C C 8 174.710 174.710 175.176 -0.466 19287
1206 1 5 . 1 1 8 8 ALA CA C 8 50.210 50.210 48.594 1.616 19287
1207 1 5 . 1 1 8 8 ALA CB C 8 16.930 16.930 19.538 -2.607 19287
1208 1 5 . 1 1 8 8 ALA H H 8 8.280 8.280 8.375 -0.095 19287
1209 1 5 . 1 1 9 9 PRO HA H 9 4.180 4.180 4.675 -0.495 19287
1210 1 5 . 1 1 9 9 PRO C C 9 176.700 176.700 176.353 0.347 19287
1211 1 5 . 1 1 9 9 PRO CA C 9 61.490 61.490 62.834 -1.344 19287
1212 1 5 . 1 1 9 9 PRO CB C 9 30.360 30.360 32.327 -1.967 19287
1213 1 5 . 1 1 10 10 SER N N 10 112.100 112.100 121.818 -9.718 19287
1214 1 5 . 1 1 10 10 SER HA H 10 4.630 4.630 4.418 0.212 19287
1215 1 5 . 1 1 10 10 SER C C 10 174.190 174.190 174.978 -0.788 19287
1216 1 5 . 1 1 10 10 SER CA C 10 55.360 55.360 56.574 -1.214 19287
1217 1 5 . 1 1 10 10 SER CB C 10 64.550 64.550 62.306 2.244 19287
1218 1 5 . 1 1 10 10 SER H H 10 7.450 7.450 8.553 -1.103 19287
1219 1 5 . 1 1 11 11 ALA N N 11 129.980 129.980 128.153 1.827 19287
1220 1 5 . 1 1 11 11 ALA HA H 11 4.496 4.496 4.347 0.149 19287
1221 1 5 . 1 1 11 11 ALA C C 11 178.510 178.510 178.852 -0.342 19287
1222 1 5 . 1 1 11 11 ALA CA C 11 54.810 54.810 53.513 1.297 19287
1223 1 5 . 1 1 11 11 ALA CB C 11 19.910 19.910 18.883 1.027 19287
1224 1 5 . 1 1 11 11 ALA H H 11 9.210 9.210 8.211 0.999 19287
1225 1 5 . 1 1 12 12 GLY N N 12 104.410 104.410 105.013 -0.603 19287
1226 1 5 . 1 1 12 12 GLY C C 12 174.850 174.850 175.807 -0.957 19287
1227 1 5 . 1 1 12 12 GLY CA C 12 44.450 44.450 45.086 -0.636 19287
1228 1 5 . 1 1 12 12 GLY H H 12 8.190 8.190 8.213 -0.022 19287
1229 1 5 . 1 1 14 14 CYS HA H 14 4.250 4.250 4.608 -0.358 19287
1230 1 5 . 1 1 14 14 CYS C C 14 172.410 172.410 173.783 -1.373 19287
1231 1 5 . 1 1 14 14 CYS CA C 14 59.750 59.750 57.735 2.015 19287
1232 1 5 . 1 1 14 14 CYS CB C 14 39.130 39.130 30.794 8.336 19287
1233 1 5 . 1 1 15 15 PHE N N 15 116.000 116.000 124.325 -8.325 19287
1234 1 5 . 1 1 15 15 PHE HA H 15 4.380 4.380 4.675 -0.295 19287
1235 1 5 . 1 1 15 15 PHE C C 15 174.300 174.300 174.689 -0.389 19287
1236 1 5 . 1 1 15 15 PHE CA C 15 56.830 56.830 57.931 -1.101 19287
1237 1 5 . 1 1 15 15 PHE CB C 15 39.440 39.440 39.060 0.380 19287
1238 1 5 . 1 1 15 15 PHE H H 15 7.960 7.960 8.663 -0.703 19287
1239 1 5 . 1 1 16 16 ALA N N 16 125.630 125.630 131.040 -5.410 19287
1240 1 5 . 1 1 16 16 ALA HA H 16 4.320 4.320 4.596 -0.276 19287
1241 1 5 . 1 1 16 16 ALA C C 16 174.300 174.300 175.333 -1.033 19287
1242 1 5 . 1 1 16 16 ALA CA C 16 50.130 50.130 52.077 -1.947 19287
1243 1 5 . 1 1 16 16 ALA CB C 16 19.180 19.180 22.159 -2.979 19287
1244 1 5 . 1 1 16 16 ALA H H 16 7.800 7.800 8.080 -0.280 19287
1245 1 5 . 1 1 17 17 PHE N N 17 116.330 116.330 123.122 -6.792 19287
1246 1 5 . 1 1 17 17 PHE HA H 17 4.390 4.390 4.927 -0.537 19287
1247 1 5 . 1 1 17 17 PHE C C 17 175.310 175.310 173.659 1.651 19287
1248 1 5 . 1 1 17 17 PHE CA C 17 57.160 57.160 55.013 2.147 19287
1249 1 5 . 1 1 17 17 PHE CB C 17 39.380 39.380 40.077 -0.697 19287
1250 1 5 . 1 1 17 17 PHE H H 17 7.330 7.330 8.338 -1.008 19287
1251 1 5 . 1 1 18 18 VAL N N 18 122.890 122.890 125.037 -2.147 19287
1252 1 5 . 1 1 18 18 VAL HA H 18 4.475 4.475 4.599 -0.124 19287
1253 1 5 . 1 1 18 18 VAL C C 18 173.590 173.590 173.554 0.036 19287
1254 1 5 . 1 1 18 18 VAL CA C 18 58.900 58.900 58.364 0.536 19287
1255 1 5 . 1 1 18 18 VAL CB C 18 33.900 33.900 34.724 -0.824 19287
1256 1 5 . 1 1 18 18 VAL H H 18 8.680 8.680 8.955 -0.275 19287
1257 1 5 . 1 1 19 19 PRO HA H 19 4.275 4.275 4.850 -0.575 19287
1258 1 5 . 1 1 19 19 PRO C C 19 176.940 176.940 176.382 0.558 19287
1259 1 5 . 1 1 19 19 PRO CA C 19 64.060 64.060 62.676 1.384 19287
1260 1 5 . 1 1 19 19 PRO CB C 19 31.710 31.710 31.469 0.241 19287
1261 1 5 . 1 1 20 20 SER N N 20 120.230 120.230 118.199 2.031 19287
1262 1 5 . 1 1 20 20 SER HA H 20 4.780 4.780 4.727 0.053 19287
1263 1 5 . 1 1 20 20 SER C C 20 170.900 170.900 173.062 -2.162 19287
1264 1 5 . 1 1 20 20 SER CA C 20 57.450 57.450 56.032 1.418 19287
1265 1 5 . 1 1 20 20 SER CB C 20 67.910 67.910 66.038 1.872 19287
1266 1 5 . 1 1 20 20 SER H H 20 8.390 8.390 8.422 -0.032 19287
1267 1 5 . 1 1 21 21 TYR N N 21 118.220 118.220 119.395 -1.175 19287
1268 1 5 . 1 1 21 21 TYR HA H 21 5.600 5.600 5.066 0.534 19287
1269 1 5 . 1 1 21 21 TYR C C 21 173.770 173.770 174.773 -1.003 19287
1270 1 5 . 1 1 21 21 TYR CA C 21 57.740 57.740 57.844 -0.104 19287
1271 1 5 . 1 1 21 21 TYR CB C 21 42.660 42.660 42.094 0.566 19287
1272 1 5 . 1 1 21 21 TYR H H 21 9.020 9.020 8.441 0.579 19287
1273 1 5 . 1 1 22 22 TYR N N 22 119.260 119.260 124.012 -4.752 19287
1274 1 5 . 1 1 22 22 TYR HA H 22 5.110 5.110 4.629 0.481 19287
1275 1 5 . 1 1 22 22 TYR C C 22 172.610 172.610 173.581 -0.971 19287
1276 1 5 . 1 1 22 22 TYR CA C 22 55.380 55.380 56.183 -0.803 19287
1277 1 5 . 1 1 22 22 TYR CB C 22 41.550 41.550 42.399 -0.849 19287
1278 1 5 . 1 1 22 22 TYR H H 22 9.410 9.410 9.506 -0.096 19287
1279 1 5 . 1 1 23 23 TYR N N 23 123.200 123.200 128.840 -5.640 19287
1280 1 5 . 1 1 23 23 TYR HA H 23 4.382 4.382 4.782 -0.400 19287
1281 1 5 . 1 1 23 23 TYR C C 23 173.250 173.250 174.634 -1.384 19287
1282 1 5 . 1 1 23 23 TYR CA C 23 58.360 58.360 57.216 1.144 19287
1283 1 5 . 1 1 23 23 TYR CB C 23 39.570 39.570 39.318 0.252 19287
1284 1 5 . 1 1 23 23 TYR H H 23 10.190 10.190 8.657 1.533 19287
1285 1 5 . 1 1 24 24 ASN N N 24 126.280 126.280 127.724 -1.444 19287
1286 1 5 . 1 1 24 24 ASN HA H 24 4.550 4.550 4.793 -0.243 19287
1287 1 5 . 1 1 24 24 ASN C C 24 174.000 174.000 175.078 -1.078 19287
1288 1 5 . 1 1 24 24 ASN CA C 24 51.360 51.360 51.624 -0.264 19287
1289 1 5 . 1 1 24 24 ASN CB C 24 40.040 40.040 38.591 1.449 19287
1290 1 5 . 1 1 24 24 ASN H H 24 7.890 7.890 8.560 -0.670 19287
1291 1 5 . 1 1 25 25 GLN N N 25 122.760 122.760 122.903 -0.143 19287
1292 1 5 . 1 1 25 25 GLN HA H 25 3.691 3.691 3.609 0.082 19287
1293 1 5 . 1 1 25 25 GLN C C 25 175.670 175.670 176.579 -0.909 19287
1294 1 5 . 1 1 25 25 GLN CA C 25 57.480 57.480 58.075 -0.595 19287
1295 1 5 . 1 1 25 25 GLN CB C 25 28.120 28.120 27.577 0.543 19287
1296 1 5 . 1 1 25 25 GLN H H 25 8.440 8.440 7.863 0.577 19287
1297 1 5 . 1 1 26 26 TYR N N 26 119.190 119.190 118.849 0.341 19287
1298 1 5 . 1 1 26 26 TYR HA H 26 4.160 4.160 4.321 -0.161 19287
1299 1 5 . 1 1 26 26 TYR C C 26 176.520 176.520 176.625 -0.105 19287
1300 1 5 . 1 1 26 26 TYR CA C 26 60.170 60.170 59.514 0.655 19287
1301 1 5 . 1 1 26 26 TYR CB C 26 36.880 36.880 37.587 -0.707 19287
1302 1 5 . 1 1 26 26 TYR H H 26 7.810 7.810 7.595 0.215 19287
1303 1 5 . 1 1 27 27 SER N N 27 109.600 109.600 112.367 -2.767 19287
1304 1 5 . 1 1 27 27 SER HA H 27 4.330 4.330 4.558 -0.228 19287
1305 1 5 . 1 1 27 27 SER C C 27 174.830 174.830 174.128 0.702 19287
1306 1 5 . 1 1 27 27 SER CA C 27 57.490 57.490 57.301 0.189 19287
1307 1 5 . 1 1 27 27 SER CB C 27 64.640 64.640 64.177 0.463 19287
1308 1 5 . 1 1 27 27 SER H H 27 7.350 7.350 7.469 -0.119 19287
1309 1 5 . 1 1 28 28 ASN N N 28 119.830 119.830 119.433 0.397 19287
1310 1 5 . 1 1 28 28 ASN HA H 28 4.060 4.060 4.351 -0.291 19287
1311 1 5 . 1 1 28 28 ASN C C 28 173.040 173.040 174.390 -1.350 19287
1312 1 5 . 1 1 28 28 ASN CA C 28 53.830 53.830 54.755 -0.925 19287
1313 1 5 . 1 1 28 28 ASN CB C 28 37.400 37.400 38.148 -0.748 19287
1314 1 5 . 1 1 28 28 ASN H H 28 7.930 7.930 7.982 -0.052 19287
1315 1 5 . 1 1 29 29 THR N N 29 103.070 103.070 111.130 -8.060 19287
1316 1 5 . 1 1 29 29 THR HA H 29 4.441 4.441 4.708 -0.267 19287
1317 1 5 . 1 1 29 29 THR C C 29 172.980 172.980 172.104 0.876 19287
1318 1 5 . 1 1 29 29 THR CA C 29 58.920 58.920 61.645 -2.725 19287
1319 1 5 . 1 1 29 29 THR CB C 29 73.260 73.260 71.372 1.888 19287
1320 1 5 . 1 1 29 29 THR H H 29 6.990 6.990 7.689 -0.699 19287
1321 1 5 . 1 1 30 30 CYS N N 30 118.340 118.340 119.413 -1.073 19287
1322 1 5 . 1 1 30 30 CYS HA H 30 5.462 5.462 5.427 0.035 19287
1323 1 5 . 1 1 30 30 CYS C C 30 173.320 173.320 173.380 -0.060 19287
1324 1 5 . 1 1 30 30 CYS CA C 30 57.750 57.750 57.359 0.391 19287
1325 1 5 . 1 1 30 30 CYS CB C 30 50.680 50.680 31.790 18.890 19287
1326 1 5 . 1 1 30 30 CYS H H 30 8.954 8.954 8.615 0.339 19287
1327 1 5 . 1 1 31 31 HIS N N 31 118.930 118.930 120.644 -1.714 19287
1328 1 5 . 1 1 31 31 HIS HA H 31 4.780 4.780 5.074 -0.294 19287
1329 1 5 . 1 1 31 31 HIS C C 31 172.790 172.790 173.778 -0.988 19287
1330 1 5 . 1 1 31 31 HIS CA C 31 53.530 53.530 55.448 -1.918 19287
1331 1 5 . 1 1 31 31 HIS CB C 31 33.040 33.040 33.150 -0.110 19287
1332 1 5 . 1 1 31 31 HIS H H 31 9.010 9.010 9.594 -0.584 19287
1333 1 5 . 1 1 32 32 SER N N 32 117.600 117.600 119.352 -1.752 19287
1334 1 5 . 1 1 32 32 SER HA H 32 4.700 4.700 4.297 0.403 19287
1335 1 5 . 1 1 32 32 SER C C 32 174.930 174.930 173.668 1.262 19287
1336 1 5 . 1 1 32 32 SER CA C 32 57.980 57.980 58.955 -0.975 19287
1337 1 5 . 1 1 32 32 SER CB C 32 64.440 64.440 63.510 0.930 19287
1338 1 5 . 1 1 32 32 SER H H 32 8.740 8.740 7.998 0.742 19287
1339 1 5 . 1 1 33 33 PHE N N 33 120.690 120.690 119.347 1.343 19287
1340 1 5 . 1 1 33 33 PHE HA H 33 4.790 4.790 5.023 -0.233 19287
1341 1 5 . 1 1 33 33 PHE C C 33 171.810 171.810 173.694 -1.884 19287
1342 1 5 . 1 1 33 33 PHE CA C 33 56.200 56.200 56.153 0.047 19287
1343 1 5 . 1 1 33 33 PHE CB C 33 40.230 40.230 41.215 -0.985 19287
1344 1 5 . 1 1 33 33 PHE H H 33 8.830 8.830 8.999 -0.169 19287
1345 1 5 . 1 1 34 34 THR N N 34 116.650 116.650 111.813 4.837 19287
1346 1 5 . 1 1 34 34 THR HA H 34 3.965 3.965 4.233 -0.268 19287
1347 1 5 . 1 1 34 34 THR C C 34 172.600 172.600 172.563 0.037 19287
1348 1 5 . 1 1 34 34 THR CA C 34 61.980 61.980 60.845 1.135 19287
1349 1 5 . 1 1 34 34 THR CB C 34 68.530 68.530 69.680 -1.151 19287
1350 1 5 . 1 1 34 34 THR H H 34 8.400 8.400 8.154 0.246 19287
1351 1 5 . 1 1 35 35 TYR N N 35 127.790 127.790 126.106 1.684 19287
1352 1 5 . 1 1 35 35 TYR HA H 35 4.500 4.500 4.674 -0.174 19287
1353 1 5 . 1 1 35 35 TYR C C 35 174.200 174.200 174.563 -0.363 19287
1354 1 5 . 1 1 35 35 TYR CA C 35 55.130 55.130 56.593 -1.463 19287
1355 1 5 . 1 1 35 35 TYR CB C 35 39.650 39.650 42.125 -2.475 19287
1356 1 5 . 1 1 35 35 TYR H H 35 8.010 8.010 8.569 -0.559 19287
1357 1 5 . 1 1 39 39 GLY N N 39 103.730 103.730 107.986 -4.256 19287
1358 1 5 . 1 1 39 39 GLY C C 39 175.700 175.700 173.349 2.351 19287
1359 1 5 . 1 1 39 39 GLY CA C 39 45.370 45.370 43.507 1.863 19287
1360 1 5 . 1 1 39 39 GLY H H 39 8.500 8.500 7.517 0.983 19287
1361 1 5 . 1 1 40 40 GLY N N 40 110.170 110.170 106.675 3.495 19287
1362 1 5 . 1 1 40 40 GLY C C 40 173.140 173.140 172.605 0.535 19287
1363 1 5 . 1 1 40 40 GLY CA C 40 44.320 44.320 44.696 -0.376 19287
1364 1 5 . 1 1 40 40 GLY H H 40 8.670 8.670 7.737 0.933 19287
1365 1 5 . 1 1 41 41 ASN N N 41 116.960 116.960 117.851 -0.891 19287
1366 1 5 . 1 1 41 41 ASN HA H 41 4.560 4.560 4.896 -0.336 19287
1367 1 5 . 1 1 41 41 ASN C C 41 173.670 173.670 175.633 -1.963 19287
1368 1 5 . 1 1 41 41 ASN CA C 41 51.850 51.850 51.457 0.393 19287
1369 1 5 . 1 1 41 41 ASN CB C 41 40.230 40.230 40.254 -0.024 19287
1370 1 5 . 1 1 41 41 ASN H H 41 8.790 8.790 8.676 0.114 19287
1371 1 5 . 1 1 42 42 ALA N N 42 113.290 113.290 122.611 -9.321 19287
1372 1 5 . 1 1 42 42 ALA HA H 42 3.720 3.720 4.162 -0.442 19287
1373 1 5 . 1 1 42 42 ALA C C 42 177.220 177.220 178.571 -1.351 19287
1374 1 5 . 1 1 42 42 ALA CA C 42 52.810 52.810 54.744 -1.934 19287
1375 1 5 . 1 1 42 42 ALA CB C 42 17.980 17.980 18.598 -0.618 19287
1376 1 5 . 1 1 42 42 ALA H H 42 7.590 7.590 8.730 -1.140 19287
1377 1 5 . 1 1 43 43 ASN N N 43 117.710 117.710 115.732 1.978 19287
1378 1 5 . 1 1 43 43 ASN HA H 43 4.700 4.700 4.643 0.057 19287
1379 1 5 . 1 1 43 43 ASN C C 43 173.660 173.660 175.260 -1.600 19287
1380 1 5 . 1 1 43 43 ASN CA C 43 50.630 50.630 53.857 -3.227 19287
1381 1 5 . 1 1 43 43 ASN CB C 43 34.840 34.840 38.106 -3.266 19287
1382 1 5 . 1 1 43 43 ASN H H 43 7.900 7.900 8.156 -0.256 19287
1383 1 5 . 1 1 44 44 ARG N N 44 120.690 120.690 121.052 -0.362 19287
1384 1 5 . 1 1 44 44 ARG HA H 44 4.692 4.692 4.249 0.443 19287
1385 1 5 . 1 1 44 44 ARG C C 44 173.530 173.530 175.141 -1.611 19287
1386 1 5 . 1 1 44 44 ARG CA C 44 56.660 56.660 56.993 -0.333 19287
1387 1 5 . 1 1 44 44 ARG CB C 44 31.450 31.450 29.451 1.999 19287
1388 1 5 . 1 1 44 44 ARG H H 44 6.860 6.860 7.524 -0.664 19287
1389 1 5 . 1 1 45 45 PHE N N 45 123.690 123.690 125.039 -1.349 19287
1390 1 5 . 1 1 45 45 PHE HA H 45 4.810 4.810 4.912 -0.102 19287
1391 1 5 . 1 1 45 45 PHE C C 45 175.420 175.420 174.481 0.939 19287
1392 1 5 . 1 1 45 45 PHE CA C 45 55.670 55.670 56.581 -0.911 19287
1393 1 5 . 1 1 45 45 PHE CB C 45 43.790 43.790 43.192 0.598 19287
1394 1 5 . 1 1 45 45 PHE H H 45 9.340 9.340 8.301 1.039 19287
1395 1 5 . 1 1 46 46 ARG N N 46 120.920 120.920 117.272 3.648 19287
1396 1 5 . 1 1 46 46 ARG HA H 46 4.397 4.397 4.619 -0.222 19287
1397 1 5 . 1 1 46 46 ARG C C 46 176.560 176.560 175.422 1.138 19287
1398 1 5 . 1 1 46 46 ARG CA C 46 58.210 58.210 55.789 2.421 19287
1399 1 5 . 1 1 46 46 ARG CB C 46 30.900 30.900 30.816 0.084 19287
1400 1 5 . 1 1 46 46 ARG H H 46 9.080 9.080 8.685 0.395 19287
1401 1 5 . 1 1 47 47 THR N N 47 102.800 102.800 112.187 -9.387 19287
1402 1 5 . 1 1 47 47 THR HA H 47 4.660 4.660 3.461 1.199 19287
1403 1 5 . 1 1 47 47 THR C C 47 174.110 174.110 173.451 0.659 19287
1404 1 5 . 1 1 47 47 THR CA C 47 58.170 58.170 59.692 -1.522 19287
1405 1 5 . 1 1 47 47 THR CB C 47 72.380 72.380 70.639 1.741 19287
1406 1 5 . 1 1 47 47 THR H H 47 7.230 7.230 7.364 -0.134 19287
1407 1 5 . 1 1 48 48 ILE N N 48 123.200 123.200 124.330 -1.130 19287
1408 1 5 . 1 1 48 48 ILE HA H 48 2.901 2.901 3.625 -0.724 19287
1409 1 5 . 1 1 48 48 ILE C C 48 176.420 176.420 175.992 0.428 19287
1410 1 5 . 1 1 48 48 ILE CA C 48 64.000 64.000 63.516 0.484 19287
1411 1 5 . 1 1 48 48 ILE CB C 48 37.060 37.060 38.206 -1.146 19287
1412 1 5 . 1 1 48 48 ILE H H 48 8.110 8.110 7.892 0.218 19287
1413 1 5 . 1 1 49 49 ASP N N 49 119.560 119.560 120.079 -0.519 19287
1414 1 5 . 1 1 49 49 ASP HA H 49 4.130 4.130 4.319 -0.189 19287
1415 1 5 . 1 1 49 49 ASP C C 49 177.740 177.740 178.506 -0.766 19287
1416 1 5 . 1 1 49 49 ASP CA C 49 56.690 56.690 57.797 -1.107 19287
1417 1 5 . 1 1 49 49 ASP CB C 49 39.970 39.970 40.366 -0.396 19287
1418 1 5 . 1 1 49 49 ASP H H 49 7.700 7.700 7.677 0.023 19287
1419 1 5 . 1 1 50 50 GLU N N 50 117.720 117.720 119.564 -1.844 19287
1420 1 5 . 1 1 50 50 GLU HA H 50 3.710 3.710 4.268 -0.558 19287
1421 1 5 . 1 1 50 50 GLU C C 50 177.550 177.550 178.753 -1.203 19287
1422 1 5 . 1 1 50 50 GLU CA C 50 58.550 58.550 58.650 -0.100 19287
1423 1 5 . 1 1 50 50 GLU CB C 50 29.190 29.190 29.605 -0.415 19287
1424 1 5 . 1 1 50 50 GLU H H 50 7.410 7.410 7.758 -0.348 19287
1425 1 5 . 1 1 51 51 CYS N N 51 120.260 120.260 120.194 0.066 19287
1426 1 5 . 1 1 51 51 CYS HA H 51 1.650 1.650 3.640 -1.990 19287
1427 1 5 . 1 1 51 51 CYS C C 51 175.070 175.070 176.348 -1.278 19287
1428 1 5 . 1 1 51 51 CYS CA C 51 59.120 59.120 61.600 -2.480 19287
1429 1 5 . 1 1 51 51 CYS CB C 51 43.000 43.000 26.342 16.658 19287
1430 1 5 . 1 1 51 51 CYS H H 51 6.760 6.760 7.989 -1.229 19287
1431 1 5 . 1 1 52 52 ASN N N 52 120.160 120.160 119.699 0.461 19287
1432 1 5 . 1 1 52 52 ASN HA H 52 4.090 4.090 4.420 -0.330 19287
1433 1 5 . 1 1 52 52 ASN C C 52 177.820 177.820 177.761 0.059 19287
1434 1 5 . 1 1 52 52 ASN CA C 52 55.060 55.060 56.125 -1.065 19287
1435 1 5 . 1 1 52 52 ASN CB C 52 37.500 37.500 38.075 -0.575 19287
1436 1 5 . 1 1 52 52 ASN H H 52 8.650 8.650 8.677 -0.027 19287
1437 1 5 . 1 1 53 53 ARG N N 53 117.000 117.000 118.265 -1.265 19287
1438 1 5 . 1 1 53 53 ARG HA H 53 3.770 3.770 4.096 -0.326 19287
1439 1 5 . 1 1 53 53 ARG C C 53 177.360 177.360 178.039 -0.679 19287
1440 1 5 . 1 1 53 53 ARG CA C 53 58.490 58.490 58.864 -0.374 19287
1441 1 5 . 1 1 53 53 ARG CB C 53 30.180 30.180 29.623 0.557 19287
1442 1 5 . 1 1 53 53 ARG H H 53 7.900 7.900 7.741 0.159 19287
1443 1 5 . 1 1 54 54 THR N N 54 112.080 112.080 111.973 0.107 19287
1444 1 5 . 1 1 54 54 THR HA H 54 3.838 3.838 4.367 -0.529 19287
1445 1 5 . 1 1 54 54 THR C C 54 174.990 174.990 174.194 0.796 19287
1446 1 5 . 1 1 54 54 THR CA C 54 65.740 65.740 64.733 1.007 19287
1447 1 5 . 1 1 54 54 THR CB C 54 68.870 68.870 69.959 -1.089 19287
1448 1 5 . 1 1 54 54 THR H H 54 7.260 7.260 7.850 -0.590 19287
1449 1 5 . 1 1 55 55 CYS N N 55 112.540 112.540 116.647 -4.107 19287
1450 1 5 . 1 1 55 55 CYS HA H 55 4.400 4.400 4.431 -0.031 19287
1451 1 5 . 1 1 55 55 CYS C C 55 172.940 172.940 173.953 -1.013 19287
1452 1 5 . 1 1 55 55 CYS CA C 55 54.230 54.230 58.423 -4.193 19287
1453 1 5 . 1 1 55 55 CYS CB C 55 42.930 42.930 29.003 13.927 19287
1454 1 5 . 1 1 55 55 CYS H H 55 7.590 7.590 7.822 -0.232 19287
1455 1 5 . 1 1 56 56 VAL N N 56 119.720 119.720 123.337 -3.617 19287
1456 1 5 . 1 1 56 56 VAL HA H 56 3.631 3.631 4.017 -0.386 19287
1457 1 5 . 1 1 56 56 VAL C C 56 176.710 176.710 175.770 0.940 19287
1458 1 5 . 1 1 56 56 VAL CA C 56 64.540 64.540 63.478 1.062 19287
1459 1 5 . 1 1 56 56 VAL CB C 56 30.970 30.970 30.568 0.402 19287
1460 1 5 . 1 1 56 56 VAL H H 56 7.280 7.280 7.851 -0.571 19287
1461 1 6 . 1 1 2 2 PRO HA H 2 4.017 4.017 4.428 -0.411 19287
1462 1 6 . 1 1 2 2 PRO C C 2 177.920 177.920 177.906 0.014 19287
1463 1 6 . 1 1 2 2 PRO CA C 2 62.800 62.800 62.447 0.353 19287
1464 1 6 . 1 1 2 2 PRO CB C 2 32.050 32.050 32.604 -0.554 19287
1465 1 6 . 1 1 3 3 ARG N N 3 122.340 122.340 121.727 0.613 19287
1466 1 6 . 1 1 3 3 ARG HA H 3 3.786 3.786 4.015 -0.229 19287
1467 1 6 . 1 1 3 3 ARG C C 3 178.950 178.950 175.347 3.603 19287
1468 1 6 . 1 1 3 3 ARG CA C 3 58.410 58.410 57.897 0.513 19287
1469 1 6 . 1 1 3 3 ARG CB C 3 29.220 29.220 28.730 0.489 19287
1470 1 6 . 1 1 3 3 ARG H H 3 8.550 8.550 8.672 -0.122 19287
1471 1 6 . 1 1 4 4 PHE N N 4 113.010 113.010 113.270 -0.260 19287
1472 1 6 . 1 1 4 4 PHE HA H 4 4.300 4.300 4.597 -0.297 19287
1473 1 6 . 1 1 4 4 PHE C C 4 176.070 176.070 176.640 -0.570 19287
1474 1 6 . 1 1 4 4 PHE CA C 4 58.220 58.220 57.189 1.031 19287
1475 1 6 . 1 1 4 4 PHE CB C 4 37.310 37.310 38.335 -1.025 19287
1476 1 6 . 1 1 4 4 PHE H H 4 7.150 7.150 7.339 -0.189 19287
1477 1 6 . 1 1 5 5 CYS N N 5 118.600 118.600 119.671 -1.071 19287
1478 1 6 . 1 1 5 5 CYS HA H 5 4.130 4.130 4.086 0.044 19287
1479 1 6 . 1 1 5 5 CYS C C 5 173.450 173.450 175.019 -1.569 19287
1480 1 6 . 1 1 5 5 CYS CA C 5 57.960 57.960 60.707 -2.747 19287
1481 1 6 . 1 1 5 5 CYS CB C 5 39.210 39.210 26.018 13.192 19287
1482 1 6 . 1 1 5 5 CYS H H 5 7.090 7.090 7.298 -0.208 19287
1483 1 6 . 1 1 6 6 GLU N N 6 110.710 110.710 117.879 -7.169 19287
1484 1 6 . 1 1 6 6 GLU HA H 6 4.182 4.182 4.442 -0.260 19287
1485 1 6 . 1 1 6 6 GLU C C 6 176.310 176.310 176.312 -0.002 19287
1486 1 6 . 1 1 6 6 GLU CA C 6 55.510 55.510 55.699 -0.189 19287
1487 1 6 . 1 1 6 6 GLU CB C 6 28.160 28.160 28.816 -0.656 19287
1488 1 6 . 1 1 6 6 GLU H H 6 7.300 7.300 8.006 -0.706 19287
1489 1 6 . 1 1 7 7 LEU N N 7 119.090 119.090 120.975 -1.885 19287
1490 1 6 . 1 1 7 7 LEU HA H 7 4.160 4.160 4.281 -0.121 19287
1491 1 6 . 1 1 7 7 LEU C C 7 176.630 176.630 175.986 0.644 19287
1492 1 6 . 1 1 7 7 LEU CA C 7 54.510 54.510 54.026 0.484 19287
1493 1 6 . 1 1 7 7 LEU CB C 7 42.330 42.330 42.667 -0.337 19287
1494 1 6 . 1 1 7 7 LEU H H 7 7.210 7.210 7.143 0.067 19287
1495 1 6 . 1 1 8 8 ALA N N 8 124.490 124.490 121.791 2.699 19287
1496 1 6 . 1 1 8 8 ALA HA H 8 4.250 4.250 4.688 -0.438 19287
1497 1 6 . 1 1 8 8 ALA C C 8 174.710 174.710 175.532 -0.822 19287
1498 1 6 . 1 1 8 8 ALA CA C 8 50.210 50.210 48.791 1.419 19287
1499 1 6 . 1 1 8 8 ALA CB C 8 16.930 16.930 19.749 -2.819 19287
1500 1 6 . 1 1 8 8 ALA H H 8 8.280 8.280 8.221 0.059 19287
1501 1 6 . 1 1 9 9 PRO HA H 9 4.180 4.180 4.610 -0.430 19287
1502 1 6 . 1 1 9 9 PRO C C 9 176.700 176.700 176.712 -0.012 19287
1503 1 6 . 1 1 9 9 PRO CA C 9 61.490 61.490 62.840 -1.349 19287
1504 1 6 . 1 1 9 9 PRO CB C 9 30.360 30.360 32.451 -2.091 19287
1505 1 6 . 1 1 10 10 SER N N 10 112.100 112.100 122.354 -10.254 19287
1506 1 6 . 1 1 10 10 SER HA H 10 4.630 4.630 4.404 0.226 19287
1507 1 6 . 1 1 10 10 SER C C 10 174.190 174.190 175.036 -0.846 19287
1508 1 6 . 1 1 10 10 SER CA C 10 55.360 55.360 56.774 -1.414 19287
1509 1 6 . 1 1 10 10 SER CB C 10 64.550 64.550 61.877 2.673 19287
1510 1 6 . 1 1 10 10 SER H H 10 7.450 7.450 8.832 -1.382 19287
1511 1 6 . 1 1 11 11 ALA N N 11 129.980 129.980 123.850 6.130 19287
1512 1 6 . 1 1 11 11 ALA HA H 11 4.496 4.496 4.036 0.460 19287
1513 1 6 . 1 1 11 11 ALA C C 11 178.510 178.510 179.257 -0.747 19287
1514 1 6 . 1 1 11 11 ALA CA C 11 54.810 54.810 54.097 0.713 19287
1515 1 6 . 1 1 11 11 ALA CB C 11 19.910 19.910 18.876 1.034 19287
1516 1 6 . 1 1 11 11 ALA H H 11 9.210 9.210 8.069 1.141 19287
1517 1 6 . 1 1 12 12 GLY N N 12 104.410 104.410 105.476 -1.066 19287
1518 1 6 . 1 1 12 12 GLY C C 12 174.850 174.850 175.751 -0.901 19287
1519 1 6 . 1 1 12 12 GLY CA C 12 44.450 44.450 45.352 -0.902 19287
1520 1 6 . 1 1 12 12 GLY H H 12 8.190 8.190 8.561 -0.371 19287
1521 1 6 . 1 1 14 14 CYS HA H 14 4.250 4.250 4.610 -0.360 19287
1522 1 6 . 1 1 14 14 CYS C C 14 172.410 172.410 173.629 -1.219 19287
1523 1 6 . 1 1 14 14 CYS CA C 14 59.750 59.750 57.980 1.770 19287
1524 1 6 . 1 1 14 14 CYS CB C 14 39.130 39.130 30.377 8.753 19287
1525 1 6 . 1 1 15 15 PHE N N 15 116.000 116.000 124.254 -8.254 19287
1526 1 6 . 1 1 15 15 PHE HA H 15 4.380 4.380 4.755 -0.375 19287
1527 1 6 . 1 1 15 15 PHE C C 15 174.300 174.300 174.377 -0.077 19287
1528 1 6 . 1 1 15 15 PHE CA C 15 56.830 56.830 57.390 -0.560 19287
1529 1 6 . 1 1 15 15 PHE CB C 15 39.440 39.440 38.938 0.502 19287
1530 1 6 . 1 1 15 15 PHE H H 15 7.960 7.960 8.646 -0.686 19287
1531 1 6 . 1 1 16 16 ALA N N 16 125.630 125.630 130.439 -4.809 19287
1532 1 6 . 1 1 16 16 ALA HA H 16 4.320 4.320 4.206 0.114 19287
1533 1 6 . 1 1 16 16 ALA C C 16 174.300 174.300 175.214 -0.914 19287
1534 1 6 . 1 1 16 16 ALA CA C 16 50.130 50.130 51.984 -1.854 19287
1535 1 6 . 1 1 16 16 ALA CB C 16 19.180 19.180 21.824 -2.644 19287
1536 1 6 . 1 1 16 16 ALA H H 16 7.800 7.800 8.040 -0.240 19287
1537 1 6 . 1 1 17 17 PHE N N 17 116.330 116.330 121.991 -5.661 19287
1538 1 6 . 1 1 17 17 PHE HA H 17 4.390 4.390 4.795 -0.405 19287
1539 1 6 . 1 1 17 17 PHE C C 17 175.310 175.310 174.241 1.069 19287
1540 1 6 . 1 1 17 17 PHE CA C 17 57.160 57.160 56.379 0.781 19287
1541 1 6 . 1 1 17 17 PHE CB C 17 39.380 39.380 41.048 -1.668 19287
1542 1 6 . 1 1 17 17 PHE H H 17 7.330 7.330 8.131 -0.801 19287
1543 1 6 . 1 1 18 18 VAL N N 18 122.890 122.890 124.654 -1.764 19287
1544 1 6 . 1 1 18 18 VAL HA H 18 4.475 4.475 4.452 0.023 19287
1545 1 6 . 1 1 18 18 VAL C C 18 173.590 173.590 173.108 0.482 19287
1546 1 6 . 1 1 18 18 VAL CA C 18 58.900 58.900 58.381 0.519 19287
1547 1 6 . 1 1 18 18 VAL CB C 18 33.900 33.900 33.081 0.819 19287
1548 1 6 . 1 1 18 18 VAL H H 18 8.680 8.680 8.490 0.190 19287
1549 1 6 . 1 1 19 19 PRO HA H 19 4.275 4.275 4.293 -0.018 19287
1550 1 6 . 1 1 19 19 PRO C C 19 176.940 176.940 176.339 0.601 19287
1551 1 6 . 1 1 19 19 PRO CA C 19 64.060 64.060 62.521 1.539 19287
1552 1 6 . 1 1 19 19 PRO CB C 19 31.710 31.710 30.882 0.828 19287
1553 1 6 . 1 1 20 20 SER N N 20 120.230 120.230 118.841 1.389 19287
1554 1 6 . 1 1 20 20 SER HA H 20 4.780 4.780 4.620 0.160 19287
1555 1 6 . 1 1 20 20 SER C C 20 170.900 170.900 172.890 -1.990 19287
1556 1 6 . 1 1 20 20 SER CA C 20 57.450 57.450 57.309 0.141 19287
1557 1 6 . 1 1 20 20 SER CB C 20 67.910 67.910 65.781 2.129 19287
1558 1 6 . 1 1 20 20 SER H H 20 8.390 8.390 7.576 0.814 19287
1559 1 6 . 1 1 21 21 TYR N N 21 118.220 118.220 118.898 -0.678 19287
1560 1 6 . 1 1 21 21 TYR HA H 21 5.600 5.600 5.088 0.512 19287
1561 1 6 . 1 1 21 21 TYR C C 21 173.770 173.770 175.187 -1.417 19287
1562 1 6 . 1 1 21 21 TYR CA C 21 57.740 57.740 58.268 -0.528 19287
1563 1 6 . 1 1 21 21 TYR CB C 21 42.660 42.660 41.808 0.852 19287
1564 1 6 . 1 1 21 21 TYR H H 21 9.020 9.020 9.025 -0.005 19287
1565 1 6 . 1 1 22 22 TYR N N 22 119.260 119.260 125.724 -6.464 19287
1566 1 6 . 1 1 22 22 TYR HA H 22 5.110 5.110 4.827 0.283 19287
1567 1 6 . 1 1 22 22 TYR C C 22 172.610 172.610 173.890 -1.280 19287
1568 1 6 . 1 1 22 22 TYR CA C 22 55.380 55.380 56.195 -0.815 19287
1569 1 6 . 1 1 22 22 TYR CB C 22 41.550 41.550 42.419 -0.869 19287
1570 1 6 . 1 1 22 22 TYR H H 22 9.410 9.410 9.741 -0.331 19287
1571 1 6 . 1 1 23 23 TYR N N 23 123.200 123.200 128.438 -5.238 19287
1572 1 6 . 1 1 23 23 TYR HA H 23 4.382 4.382 4.900 -0.518 19287
1573 1 6 . 1 1 23 23 TYR C C 23 173.250 173.250 174.411 -1.161 19287
1574 1 6 . 1 1 23 23 TYR CA C 23 58.360 58.360 57.391 0.969 19287
1575 1 6 . 1 1 23 23 TYR CB C 23 39.570 39.570 39.542 0.028 19287
1576 1 6 . 1 1 23 23 TYR H H 23 10.190 10.190 8.434 1.756 19287
1577 1 6 . 1 1 24 24 ASN N N 24 126.280 126.280 127.957 -1.677 19287
1578 1 6 . 1 1 24 24 ASN HA H 24 4.550 4.550 4.921 -0.371 19287
1579 1 6 . 1 1 24 24 ASN C C 24 174.000 174.000 175.492 -1.492 19287
1580 1 6 . 1 1 24 24 ASN CA C 24 51.360 51.360 51.818 -0.458 19287
1581 1 6 . 1 1 24 24 ASN CB C 24 40.040 40.040 38.770 1.270 19287
1582 1 6 . 1 1 24 24 ASN H H 24 7.890 7.890 8.626 -0.736 19287
1583 1 6 . 1 1 25 25 GLN N N 25 122.760 122.760 122.673 0.087 19287
1584 1 6 . 1 1 25 25 GLN HA H 25 3.691 3.691 3.742 -0.051 19287
1585 1 6 . 1 1 25 25 GLN C C 25 175.670 175.670 177.380 -1.710 19287
1586 1 6 . 1 1 25 25 GLN CA C 25 57.480 57.480 58.479 -0.999 19287
1587 1 6 . 1 1 25 25 GLN CB C 25 28.120 28.120 27.637 0.483 19287
1588 1 6 . 1 1 25 25 GLN H H 25 8.440 8.440 8.004 0.436 19287
1589 1 6 . 1 1 26 26 TYR N N 26 119.190 119.190 119.729 -0.539 19287
1590 1 6 . 1 1 26 26 TYR HA H 26 4.160 4.160 4.245 -0.085 19287
1591 1 6 . 1 1 26 26 TYR C C 26 176.520 176.520 176.943 -0.423 19287
1592 1 6 . 1 1 26 26 TYR CA C 26 60.170 60.170 60.172 -0.002 19287
1593 1 6 . 1 1 26 26 TYR CB C 26 36.880 36.880 37.855 -0.975 19287
1594 1 6 . 1 1 26 26 TYR H H 26 7.810 7.810 7.790 0.020 19287
1595 1 6 . 1 1 27 27 SER N N 27 109.600 109.600 111.484 -1.884 19287
1596 1 6 . 1 1 27 27 SER HA H 27 4.330 4.330 4.604 -0.274 19287
1597 1 6 . 1 1 27 27 SER C C 27 174.830 174.830 173.822 1.008 19287
1598 1 6 . 1 1 27 27 SER CA C 27 57.490 57.490 57.446 0.044 19287
1599 1 6 . 1 1 27 27 SER CB C 27 64.640 64.640 64.076 0.564 19287
1600 1 6 . 1 1 27 27 SER H H 27 7.350 7.350 7.649 -0.299 19287
1601 1 6 . 1 1 28 28 ASN N N 28 119.830 119.830 119.020 0.810 19287
1602 1 6 . 1 1 28 28 ASN HA H 28 4.060 4.060 4.361 -0.301 19287
1603 1 6 . 1 1 28 28 ASN C C 28 173.040 173.040 174.386 -1.346 19287
1604 1 6 . 1 1 28 28 ASN CA C 28 53.830 53.830 54.736 -0.906 19287
1605 1 6 . 1 1 28 28 ASN CB C 28 37.400 37.400 37.961 -0.561 19287
1606 1 6 . 1 1 28 28 ASN H H 28 7.930 7.930 8.094 -0.164 19287
1607 1 6 . 1 1 29 29 THR N N 29 103.070 103.070 110.911 -7.841 19287
1608 1 6 . 1 1 29 29 THR HA H 29 4.441 4.441 4.675 -0.234 19287
1609 1 6 . 1 1 29 29 THR C C 29 172.980 172.980 171.997 0.983 19287
1610 1 6 . 1 1 29 29 THR CA C 29 58.920 58.920 61.325 -2.405 19287
1611 1 6 . 1 1 29 29 THR CB C 29 73.260 73.260 70.800 2.460 19287
1612 1 6 . 1 1 29 29 THR H H 29 6.990 6.990 7.573 -0.583 19287
1613 1 6 . 1 1 30 30 CYS N N 30 118.340 118.340 118.788 -0.448 19287
1614 1 6 . 1 1 30 30 CYS HA H 30 5.462 5.462 5.546 -0.084 19287
1615 1 6 . 1 1 30 30 CYS C C 30 173.320 173.320 173.473 -0.153 19287
1616 1 6 . 1 1 30 30 CYS CA C 30 57.750 57.750 57.111 0.639 19287
1617 1 6 . 1 1 30 30 CYS CB C 30 50.680 50.680 31.229 19.451 19287
1618 1 6 . 1 1 30 30 CYS H H 30 8.954 8.954 8.629 0.325 19287
1619 1 6 . 1 1 31 31 HIS N N 31 118.930 118.930 120.425 -1.495 19287
1620 1 6 . 1 1 31 31 HIS HA H 31 4.780 4.780 5.112 -0.332 19287
1621 1 6 . 1 1 31 31 HIS C C 31 172.790 172.790 173.858 -1.068 19287
1622 1 6 . 1 1 31 31 HIS CA C 31 53.530 53.530 55.273 -1.743 19287
1623 1 6 . 1 1 31 31 HIS CB C 31 33.040 33.040 33.500 -0.460 19287
1624 1 6 . 1 1 31 31 HIS H H 31 9.010 9.010 9.498 -0.488 19287
1625 1 6 . 1 1 32 32 SER N N 32 117.600 117.600 118.692 -1.092 19287
1626 1 6 . 1 1 32 32 SER HA H 32 4.700 4.700 4.219 0.481 19287
1627 1 6 . 1 1 32 32 SER C C 32 174.930 174.930 173.704 1.226 19287
1628 1 6 . 1 1 32 32 SER CA C 32 57.980 57.980 58.703 -0.723 19287
1629 1 6 . 1 1 32 32 SER CB C 32 64.440 64.440 63.455 0.985 19287
1630 1 6 . 1 1 32 32 SER H H 32 8.740 8.740 7.979 0.761 19287
1631 1 6 . 1 1 33 33 PHE N N 33 120.690 120.690 119.792 0.898 19287
1632 1 6 . 1 1 33 33 PHE HA H 33 4.790 4.790 5.029 -0.239 19287
1633 1 6 . 1 1 33 33 PHE C C 33 171.810 171.810 173.274 -1.464 19287
1634 1 6 . 1 1 33 33 PHE CA C 33 56.200 56.200 55.948 0.252 19287
1635 1 6 . 1 1 33 33 PHE CB C 33 40.230 40.230 41.253 -1.023 19287
1636 1 6 . 1 1 33 33 PHE H H 33 8.830 8.830 8.953 -0.123 19287
1637 1 6 . 1 1 34 34 THR N N 34 116.650 116.650 111.795 4.855 19287
1638 1 6 . 1 1 34 34 THR HA H 34 3.965 3.965 4.256 -0.291 19287
1639 1 6 . 1 1 34 34 THR C C 34 172.600 172.600 172.402 0.198 19287
1640 1 6 . 1 1 34 34 THR CA C 34 61.980 61.980 60.653 1.327 19287
1641 1 6 . 1 1 34 34 THR CB C 34 68.530 68.530 69.543 -1.014 19287
1642 1 6 . 1 1 34 34 THR H H 34 8.400 8.400 8.250 0.150 19287
1643 1 6 . 1 1 35 35 TYR N N 35 127.790 127.790 125.510 2.280 19287
1644 1 6 . 1 1 35 35 TYR HA H 35 4.500 4.500 4.719 -0.219 19287
1645 1 6 . 1 1 35 35 TYR C C 35 174.200 174.200 175.027 -0.827 19287
1646 1 6 . 1 1 35 35 TYR CA C 35 55.130 55.130 56.159 -1.029 19287
1647 1 6 . 1 1 35 35 TYR CB C 35 39.650 39.650 42.499 -2.849 19287
1648 1 6 . 1 1 35 35 TYR H H 35 8.010 8.010 7.781 0.229 19287
1649 1 6 . 1 1 39 39 GLY N N 39 103.730 103.730 107.597 -3.867 19287
1650 1 6 . 1 1 39 39 GLY C C 39 175.700 175.700 172.654 3.046 19287
1651 1 6 . 1 1 39 39 GLY CA C 39 45.370 45.370 44.130 1.240 19287
1652 1 6 . 1 1 39 39 GLY H H 39 8.500 8.500 7.400 1.100 19287
1653 1 6 . 1 1 40 40 GLY N N 40 110.170 110.170 107.158 3.012 19287
1654 1 6 . 1 1 40 40 GLY C C 40 173.140 173.140 172.845 0.295 19287
1655 1 6 . 1 1 40 40 GLY CA C 40 44.320 44.320 44.652 -0.332 19287
1656 1 6 . 1 1 40 40 GLY H H 40 8.670 8.670 7.738 0.932 19287
1657 1 6 . 1 1 41 41 ASN N N 41 116.960 116.960 117.730 -0.770 19287
1658 1 6 . 1 1 41 41 ASN HA H 41 4.560 4.560 5.047 -0.487 19287
1659 1 6 . 1 1 41 41 ASN C C 41 173.670 173.670 175.846 -2.176 19287
1660 1 6 . 1 1 41 41 ASN CA C 41 51.850 51.850 52.233 -0.383 19287
1661 1 6 . 1 1 41 41 ASN CB C 41 40.230 40.230 40.887 -0.657 19287
1662 1 6 . 1 1 41 41 ASN H H 41 8.790 8.790 8.618 0.172 19287
1663 1 6 . 1 1 42 42 ALA N N 42 113.290 113.290 123.057 -9.767 19287
1664 1 6 . 1 1 42 42 ALA HA H 42 3.720 3.720 4.027 -0.307 19287
1665 1 6 . 1 1 42 42 ALA C C 42 177.220 177.220 178.226 -1.006 19287
1666 1 6 . 1 1 42 42 ALA CA C 42 52.810 52.810 54.670 -1.860 19287
1667 1 6 . 1 1 42 42 ALA CB C 42 17.980 17.980 18.625 -0.645 19287
1668 1 6 . 1 1 42 42 ALA H H 42 7.590 7.590 8.707 -1.117 19287
1669 1 6 . 1 1 43 43 ASN N N 43 117.710 117.710 115.657 2.053 19287
1670 1 6 . 1 1 43 43 ASN HA H 43 4.700 4.700 4.463 0.237 19287
1671 1 6 . 1 1 43 43 ASN C C 43 173.660 173.660 175.150 -1.490 19287
1672 1 6 . 1 1 43 43 ASN CA C 43 50.630 50.630 54.750 -4.120 19287
1673 1 6 . 1 1 43 43 ASN CB C 43 34.840 34.840 37.996 -3.156 19287
1674 1 6 . 1 1 43 43 ASN H H 43 7.900 7.900 8.061 -0.161 19287
1675 1 6 . 1 1 44 44 ARG N N 44 120.690 120.690 120.523 0.167 19287
1676 1 6 . 1 1 44 44 ARG HA H 44 4.692 4.692 4.622 0.070 19287
1677 1 6 . 1 1 44 44 ARG C C 44 173.530 173.530 174.740 -1.210 19287
1678 1 6 . 1 1 44 44 ARG CA C 44 56.660 56.660 56.809 -0.149 19287
1679 1 6 . 1 1 44 44 ARG CB C 44 31.450 31.450 30.110 1.340 19287
1680 1 6 . 1 1 44 44 ARG H H 44 6.860 6.860 7.308 -0.448 19287
1681 1 6 . 1 1 45 45 PHE N N 45 123.690 123.690 121.734 1.956 19287
1682 1 6 . 1 1 45 45 PHE HA H 45 4.810 4.810 4.900 -0.090 19287
1683 1 6 . 1 1 45 45 PHE C C 45 175.420 175.420 175.446 -0.026 19287
1684 1 6 . 1 1 45 45 PHE CA C 45 55.670 55.670 56.761 -1.091 19287
1685 1 6 . 1 1 45 45 PHE CB C 45 43.790 43.790 42.905 0.885 19287
1686 1 6 . 1 1 45 45 PHE H H 45 9.340 9.340 9.108 0.232 19287
1687 1 6 . 1 1 46 46 ARG N N 46 120.920 120.920 118.005 2.915 19287
1688 1 6 . 1 1 46 46 ARG HA H 46 4.397 4.397 4.560 -0.163 19287
1689 1 6 . 1 1 46 46 ARG C C 46 176.560 176.560 175.768 0.792 19287
1690 1 6 . 1 1 46 46 ARG CA C 46 58.210 58.210 55.588 2.622 19287
1691 1 6 . 1 1 46 46 ARG CB C 46 30.900 30.900 30.811 0.089 19287
1692 1 6 . 1 1 46 46 ARG H H 46 9.080 9.080 8.711 0.369 19287
1693 1 6 . 1 1 47 47 THR N N 47 102.800 102.800 111.924 -9.124 19287
1694 1 6 . 1 1 47 47 THR HA H 47 4.660 4.660 3.785 0.875 19287
1695 1 6 . 1 1 47 47 THR C C 47 174.110 174.110 173.234 0.876 19287
1696 1 6 . 1 1 47 47 THR CA C 47 58.170 58.170 59.241 -1.071 19287
1697 1 6 . 1 1 47 47 THR CB C 47 72.380 72.380 71.154 1.226 19287
1698 1 6 . 1 1 47 47 THR H H 47 7.230 7.230 7.270 -0.040 19287
1699 1 6 . 1 1 48 48 ILE N N 48 123.200 123.200 124.010 -0.810 19287
1700 1 6 . 1 1 48 48 ILE HA H 48 2.901 2.901 3.693 -0.792 19287
1701 1 6 . 1 1 48 48 ILE C C 48 176.420 176.420 175.881 0.539 19287
1702 1 6 . 1 1 48 48 ILE CA C 48 64.000 64.000 63.513 0.487 19287
1703 1 6 . 1 1 48 48 ILE CB C 48 37.060 37.060 38.121 -1.061 19287
1704 1 6 . 1 1 48 48 ILE H H 48 8.110 8.110 7.925 0.185 19287
1705 1 6 . 1 1 49 49 ASP N N 49 119.560 119.560 120.315 -0.755 19287
1706 1 6 . 1 1 49 49 ASP HA H 49 4.130 4.130 4.259 -0.129 19287
1707 1 6 . 1 1 49 49 ASP C C 49 177.740 177.740 178.006 -0.266 19287
1708 1 6 . 1 1 49 49 ASP CA C 49 56.690 56.690 57.918 -1.228 19287
1709 1 6 . 1 1 49 49 ASP CB C 49 39.970 39.970 40.266 -0.295 19287
1710 1 6 . 1 1 49 49 ASP H H 49 7.700 7.700 7.620 0.080 19287
1711 1 6 . 1 1 50 50 GLU N N 50 117.720 117.720 119.081 -1.361 19287
1712 1 6 . 1 1 50 50 GLU HA H 50 3.710 3.710 4.077 -0.367 19287
1713 1 6 . 1 1 50 50 GLU C C 50 177.550 177.550 178.527 -0.977 19287
1714 1 6 . 1 1 50 50 GLU CA C 50 58.550 58.550 58.833 -0.283 19287
1715 1 6 . 1 1 50 50 GLU CB C 50 29.190 29.190 29.216 -0.026 19287
1716 1 6 . 1 1 50 50 GLU H H 50 7.410 7.410 7.896 -0.486 19287
1717 1 6 . 1 1 51 51 CYS N N 51 120.260 120.260 119.234 1.026 19287
1718 1 6 . 1 1 51 51 CYS HA H 51 1.650 1.650 2.812 -1.162 19287
1719 1 6 . 1 1 51 51 CYS C C 51 175.070 175.070 176.225 -1.155 19287
1720 1 6 . 1 1 51 51 CYS CA C 51 59.120 59.120 61.066 -1.946 19287
1721 1 6 . 1 1 51 51 CYS CB C 51 43.000 43.000 25.964 17.036 19287
1722 1 6 . 1 1 51 51 CYS H H 51 6.760 6.760 7.753 -0.993 19287
1723 1 6 . 1 1 52 52 ASN N N 52 120.160 120.160 119.734 0.426 19287
1724 1 6 . 1 1 52 52 ASN HA H 52 4.090 4.090 4.405 -0.315 19287
1725 1 6 . 1 1 52 52 ASN C C 52 177.820 177.820 177.816 0.004 19287
1726 1 6 . 1 1 52 52 ASN CA C 52 55.060 55.060 55.795 -0.735 19287
1727 1 6 . 1 1 52 52 ASN CB C 52 37.500 37.500 38.066 -0.566 19287
1728 1 6 . 1 1 52 52 ASN H H 52 8.650 8.650 8.455 0.195 19287
1729 1 6 . 1 1 53 53 ARG N N 53 117.000 117.000 117.936 -0.936 19287
1730 1 6 . 1 1 53 53 ARG HA H 53 3.770 3.770 4.070 -0.300 19287
1731 1 6 . 1 1 53 53 ARG C C 53 177.360 177.360 177.990 -0.630 19287
1732 1 6 . 1 1 53 53 ARG CA C 53 58.490 58.490 58.737 -0.247 19287
1733 1 6 . 1 1 53 53 ARG CB C 53 30.180 30.180 29.476 0.704 19287
1734 1 6 . 1 1 53 53 ARG H H 53 7.900 7.900 8.110 -0.210 19287
1735 1 6 . 1 1 54 54 THR N N 54 112.080 112.080 111.939 0.141 19287
1736 1 6 . 1 1 54 54 THR HA H 54 3.838 3.838 4.405 -0.567 19287
1737 1 6 . 1 1 54 54 THR C C 54 174.990 174.990 174.309 0.681 19287
1738 1 6 . 1 1 54 54 THR CA C 54 65.740 65.740 63.021 2.719 19287
1739 1 6 . 1 1 54 54 THR CB C 54 68.870 68.870 69.935 -1.065 19287
1740 1 6 . 1 1 54 54 THR H H 54 7.260 7.260 7.846 -0.586 19287
1741 1 6 . 1 1 55 55 CYS N N 55 112.540 112.540 116.867 -4.327 19287
1742 1 6 . 1 1 55 55 CYS HA H 55 4.400 4.400 4.400 0.000 19287
1743 1 6 . 1 1 55 55 CYS C C 55 172.940 172.940 174.340 -1.400 19287
1744 1 6 . 1 1 55 55 CYS CA C 55 54.230 54.230 58.628 -4.398 19287
1745 1 6 . 1 1 55 55 CYS CB C 55 42.930 42.930 29.450 13.480 19287
1746 1 6 . 1 1 55 55 CYS H H 55 7.590 7.590 7.379 0.211 19287
1747 1 6 . 1 1 56 56 VAL N N 56 119.720 119.720 123.929 -4.209 19287
1748 1 6 . 1 1 56 56 VAL HA H 56 3.631 3.631 3.965 -0.334 19287
1749 1 6 . 1 1 56 56 VAL C C 56 176.710 176.710 176.173 0.537 19287
1750 1 6 . 1 1 56 56 VAL CA C 56 64.540 64.540 63.860 0.680 19287
1751 1 6 . 1 1 56 56 VAL CB C 56 30.970 30.970 32.005 -1.035 19287
1752 1 6 . 1 1 56 56 VAL H H 56 7.280 7.280 7.689 -0.409 19287
1753 1 7 . 1 1 2 2 PRO HA H 2 4.017 4.017 4.388 -0.371 19287
1754 1 7 . 1 1 2 2 PRO C C 2 177.920 177.920 177.397 0.523 19287
1755 1 7 . 1 1 2 2 PRO CA C 2 62.800 62.800 62.178 0.622 19287
1756 1 7 . 1 1 2 2 PRO CB C 2 32.050 32.050 32.625 -0.575 19287
1757 1 7 . 1 1 3 3 ARG N N 3 122.340 122.340 122.390 -0.050 19287
1758 1 7 . 1 1 3 3 ARG HA H 3 3.786 3.786 3.937 -0.151 19287
1759 1 7 . 1 1 3 3 ARG C C 3 178.950 178.950 178.060 0.890 19287
1760 1 7 . 1 1 3 3 ARG CA C 3 58.410 58.410 58.246 0.164 19287
1761 1 7 . 1 1 3 3 ARG CB C 3 29.220 29.220 29.487 -0.267 19287
1762 1 7 . 1 1 3 3 ARG H H 3 8.550 8.550 8.757 -0.207 19287
1763 1 7 . 1 1 4 4 PHE N N 4 113.010 113.010 116.872 -3.862 19287
1764 1 7 . 1 1 4 4 PHE HA H 4 4.300 4.300 4.501 -0.201 19287
1765 1 7 . 1 1 4 4 PHE C C 4 176.070 176.070 176.197 -0.127 19287
1766 1 7 . 1 1 4 4 PHE CA C 4 58.220 58.220 58.749 -0.529 19287
1767 1 7 . 1 1 4 4 PHE CB C 4 37.310 37.310 38.080 -0.770 19287
1768 1 7 . 1 1 4 4 PHE H H 4 7.150 7.150 7.930 -0.780 19287
1769 1 7 . 1 1 5 5 CYS N N 5 118.600 118.600 116.892 1.708 19287
1770 1 7 . 1 1 5 5 CYS HA H 5 4.130 4.130 4.205 -0.075 19287
1771 1 7 . 1 1 5 5 CYS C C 5 173.450 173.450 174.641 -1.191 19287
1772 1 7 . 1 1 5 5 CYS CA C 5 57.960 57.960 60.485 -2.525 19287
1773 1 7 . 1 1 5 5 CYS CB C 5 39.210 39.210 25.452 13.758 19287
1774 1 7 . 1 1 5 5 CYS H H 5 7.090 7.090 7.224 -0.134 19287
1775 1 7 . 1 1 6 6 GLU N N 6 110.710 110.710 117.874 -7.164 19287
1776 1 7 . 1 1 6 6 GLU HA H 6 4.182 4.182 4.381 -0.199 19287
1777 1 7 . 1 1 6 6 GLU C C 6 176.310 176.310 176.272 0.038 19287
1778 1 7 . 1 1 6 6 GLU CA C 6 55.510 55.510 55.051 0.459 19287
1779 1 7 . 1 1 6 6 GLU CB C 6 28.160 28.160 29.320 -1.160 19287
1780 1 7 . 1 1 6 6 GLU H H 6 7.300 7.300 7.440 -0.140 19287
1781 1 7 . 1 1 7 7 LEU N N 7 119.090 119.090 120.930 -1.840 19287
1782 1 7 . 1 1 7 7 LEU HA H 7 4.160 4.160 4.390 -0.230 19287
1783 1 7 . 1 1 7 7 LEU C C 7 176.630 176.630 175.806 0.824 19287
1784 1 7 . 1 1 7 7 LEU CA C 7 54.510 54.510 54.346 0.164 19287
1785 1 7 . 1 1 7 7 LEU CB C 7 42.330 42.330 42.990 -0.660 19287
1786 1 7 . 1 1 7 7 LEU H H 7 7.210 7.210 7.088 0.121 19287
1787 1 7 . 1 1 8 8 ALA N N 8 124.490 124.490 121.848 2.642 19287
1788 1 7 . 1 1 8 8 ALA HA H 8 4.250 4.250 4.687 -0.437 19287
1789 1 7 . 1 1 8 8 ALA C C 8 174.710 174.710 175.146 -0.436 19287
1790 1 7 . 1 1 8 8 ALA CA C 8 50.210 50.210 48.741 1.469 19287
1791 1 7 . 1 1 8 8 ALA CB C 8 16.930 16.930 19.430 -2.499 19287
1792 1 7 . 1 1 8 8 ALA H H 8 8.280 8.280 8.326 -0.046 19287
1793 1 7 . 1 1 9 9 PRO HA H 9 4.180 4.180 4.511 -0.331 19287
1794 1 7 . 1 1 9 9 PRO C C 9 176.700 176.700 176.937 -0.237 19287
1795 1 7 . 1 1 9 9 PRO CA C 9 61.490 61.490 63.088 -1.598 19287
1796 1 7 . 1 1 9 9 PRO CB C 9 30.360 30.360 32.109 -1.749 19287
1797 1 7 . 1 1 10 10 SER N N 10 112.100 112.100 121.733 -9.633 19287
1798 1 7 . 1 1 10 10 SER HA H 10 4.630 4.630 4.442 0.188 19287
1799 1 7 . 1 1 10 10 SER C C 10 174.190 174.190 174.952 -0.762 19287
1800 1 7 . 1 1 10 10 SER CA C 10 55.360 55.360 56.334 -0.974 19287
1801 1 7 . 1 1 10 10 SER CB C 10 64.550 64.550 62.048 2.502 19287
1802 1 7 . 1 1 10 10 SER H H 10 7.450 7.450 8.856 -1.406 19287
1803 1 7 . 1 1 11 11 ALA N N 11 129.980 129.980 123.562 6.418 19287
1804 1 7 . 1 1 11 11 ALA HA H 11 4.496 4.496 4.106 0.390 19287
1805 1 7 . 1 1 11 11 ALA C C 11 178.510 178.510 178.361 0.149 19287
1806 1 7 . 1 1 11 11 ALA CA C 11 54.810 54.810 53.690 1.120 19287
1807 1 7 . 1 1 11 11 ALA CB C 11 19.910 19.910 18.899 1.011 19287
1808 1 7 . 1 1 11 11 ALA H H 11 9.210 9.210 7.817 1.393 19287
1809 1 7 . 1 1 12 12 GLY N N 12 104.410 104.410 104.546 -0.136 19287
1810 1 7 . 1 1 12 12 GLY C C 12 174.850 174.850 175.612 -0.762 19287
1811 1 7 . 1 1 12 12 GLY CA C 12 44.450 44.450 44.913 -0.462 19287
1812 1 7 . 1 1 12 12 GLY H H 12 8.190 8.190 8.409 -0.219 19287
1813 1 7 . 1 1 14 14 CYS HA H 14 4.250 4.250 4.580 -0.330 19287
1814 1 7 . 1 1 14 14 CYS C C 14 172.410 172.410 173.752 -1.342 19287
1815 1 7 . 1 1 14 14 CYS CA C 14 59.750 59.750 57.453 2.297 19287
1816 1 7 . 1 1 14 14 CYS CB C 14 39.130 39.130 29.558 9.572 19287
1817 1 7 . 1 1 15 15 PHE N N 15 116.000 116.000 123.583 -7.583 19287
1818 1 7 . 1 1 15 15 PHE HA H 15 4.380 4.380 4.546 -0.166 19287
1819 1 7 . 1 1 15 15 PHE C C 15 174.300 174.300 174.820 -0.520 19287
1820 1 7 . 1 1 15 15 PHE CA C 15 56.830 56.830 57.921 -1.091 19287
1821 1 7 . 1 1 15 15 PHE CB C 15 39.440 39.440 38.832 0.608 19287
1822 1 7 . 1 1 15 15 PHE H H 15 7.960 7.960 8.571 -0.611 19287
1823 1 7 . 1 1 16 16 ALA N N 16 125.630 125.630 130.810 -5.180 19287
1824 1 7 . 1 1 16 16 ALA HA H 16 4.320 4.320 4.675 -0.355 19287
1825 1 7 . 1 1 16 16 ALA C C 16 174.300 174.300 174.566 -0.266 19287
1826 1 7 . 1 1 16 16 ALA CA C 16 50.130 50.130 51.925 -1.796 19287
1827 1 7 . 1 1 16 16 ALA CB C 16 19.180 19.180 21.697 -2.517 19287
1828 1 7 . 1 1 16 16 ALA H H 16 7.800 7.800 8.293 -0.493 19287
1829 1 7 . 1 1 17 17 PHE N N 17 116.330 116.330 124.949 -8.619 19287
1830 1 7 . 1 1 17 17 PHE HA H 17 4.390 4.390 5.366 -0.976 19287
1831 1 7 . 1 1 17 17 PHE C C 17 175.310 175.310 173.960 1.350 19287
1832 1 7 . 1 1 17 17 PHE CA C 17 57.160 57.160 54.991 2.169 19287
1833 1 7 . 1 1 17 17 PHE CB C 17 39.380 39.380 40.795 -1.415 19287
1834 1 7 . 1 1 17 17 PHE H H 17 7.330 7.330 8.648 -1.318 19287
1835 1 7 . 1 1 18 18 VAL N N 18 122.890 122.890 125.032 -2.142 19287
1836 1 7 . 1 1 18 18 VAL HA H 18 4.475 4.475 4.578 -0.103 19287
1837 1 7 . 1 1 18 18 VAL C C 18 173.590 173.590 173.521 0.069 19287
1838 1 7 . 1 1 18 18 VAL CA C 18 58.900 58.900 58.250 0.650 19287
1839 1 7 . 1 1 18 18 VAL CB C 18 33.900 33.900 34.568 -0.668 19287
1840 1 7 . 1 1 18 18 VAL H H 18 8.680 8.680 9.007 -0.327 19287
1841 1 7 . 1 1 19 19 PRO HA H 19 4.275 4.275 4.671 -0.397 19287
1842 1 7 . 1 1 19 19 PRO C C 19 176.940 176.940 176.471 0.469 19287
1843 1 7 . 1 1 19 19 PRO CA C 19 64.060 64.060 62.591 1.469 19287
1844 1 7 . 1 1 19 19 PRO CB C 19 31.710 31.710 31.308 0.402 19287
1845 1 7 . 1 1 20 20 SER N N 20 120.230 120.230 119.525 0.705 19287
1846 1 7 . 1 1 20 20 SER HA H 20 4.780 4.780 4.726 0.054 19287
1847 1 7 . 1 1 20 20 SER C C 20 170.900 170.900 173.040 -2.140 19287
1848 1 7 . 1 1 20 20 SER CA C 20 57.450 57.450 57.204 0.246 19287
1849 1 7 . 1 1 20 20 SER CB C 20 67.910 67.910 66.829 1.081 19287
1850 1 7 . 1 1 20 20 SER H H 20 8.390 8.390 7.915 0.475 19287
1851 1 7 . 1 1 21 21 TYR N N 21 118.220 118.220 118.811 -0.591 19287
1852 1 7 . 1 1 21 21 TYR HA H 21 5.600 5.600 5.129 0.471 19287
1853 1 7 . 1 1 21 21 TYR C C 21 173.770 173.770 175.153 -1.383 19287
1854 1 7 . 1 1 21 21 TYR CA C 21 57.740 57.740 58.196 -0.456 19287
1855 1 7 . 1 1 21 21 TYR CB C 21 42.660 42.660 41.949 0.711 19287
1856 1 7 . 1 1 21 21 TYR H H 21 9.020 9.020 8.477 0.543 19287
1857 1 7 . 1 1 22 22 TYR N N 22 119.260 119.260 125.236 -5.976 19287
1858 1 7 . 1 1 22 22 TYR HA H 22 5.110 5.110 4.706 0.404 19287
1859 1 7 . 1 1 22 22 TYR C C 22 172.610 172.610 174.020 -1.410 19287
1860 1 7 . 1 1 22 22 TYR CA C 22 55.380 55.380 55.947 -0.567 19287
1861 1 7 . 1 1 22 22 TYR CB C 22 41.550 41.550 42.703 -1.153 19287
1862 1 7 . 1 1 22 22 TYR H H 22 9.410 9.410 9.547 -0.137 19287
1863 1 7 . 1 1 23 23 TYR N N 23 123.200 123.200 126.508 -3.308 19287
1864 1 7 . 1 1 23 23 TYR HA H 23 4.382 4.382 5.002 -0.620 19287
1865 1 7 . 1 1 23 23 TYR C C 23 173.250 173.250 174.004 -0.754 19287
1866 1 7 . 1 1 23 23 TYR CA C 23 58.360 58.360 56.677 1.683 19287
1867 1 7 . 1 1 23 23 TYR CB C 23 39.570 39.570 41.412 -1.842 19287
1868 1 7 . 1 1 23 23 TYR H H 23 10.190 10.190 8.573 1.617 19287
1869 1 7 . 1 1 24 24 ASN N N 24 126.280 126.280 126.597 -0.317 19287
1870 1 7 . 1 1 24 24 ASN HA H 24 4.550 4.550 4.920 -0.370 19287
1871 1 7 . 1 1 24 24 ASN C C 24 174.000 174.000 175.359 -1.359 19287
1872 1 7 . 1 1 24 24 ASN CA C 24 51.360 51.360 52.083 -0.723 19287
1873 1 7 . 1 1 24 24 ASN CB C 24 40.040 40.040 39.218 0.823 19287
1874 1 7 . 1 1 24 24 ASN H H 24 7.890 7.890 8.477 -0.587 19287
1875 1 7 . 1 1 25 25 GLN N N 25 122.760 122.760 122.093 0.667 19287
1876 1 7 . 1 1 25 25 GLN HA H 25 3.691 3.691 3.812 -0.121 19287
1877 1 7 . 1 1 25 25 GLN C C 25 175.670 175.670 177.189 -1.519 19287
1878 1 7 . 1 1 25 25 GLN CA C 25 57.480 57.480 58.538 -1.058 19287
1879 1 7 . 1 1 25 25 GLN CB C 25 28.120 28.120 27.782 0.338 19287
1880 1 7 . 1 1 25 25 GLN H H 25 8.440 8.440 8.239 0.201 19287
1881 1 7 . 1 1 26 26 TYR N N 26 119.190 119.190 119.414 -0.224 19287
1882 1 7 . 1 1 26 26 TYR HA H 26 4.160 4.160 4.292 -0.132 19287
1883 1 7 . 1 1 26 26 TYR C C 26 176.520 176.520 176.823 -0.303 19287
1884 1 7 . 1 1 26 26 TYR CA C 26 60.170 60.170 59.899 0.271 19287
1885 1 7 . 1 1 26 26 TYR CB C 26 36.880 36.880 37.637 -0.757 19287
1886 1 7 . 1 1 26 26 TYR H H 26 7.810 7.810 7.474 0.336 19287
1887 1 7 . 1 1 27 27 SER N N 27 109.600 109.600 111.715 -2.115 19287
1888 1 7 . 1 1 27 27 SER HA H 27 4.330 4.330 4.591 -0.261 19287
1889 1 7 . 1 1 27 27 SER C C 27 174.830 174.830 173.862 0.968 19287
1890 1 7 . 1 1 27 27 SER CA C 27 57.490 57.490 57.407 0.083 19287
1891 1 7 . 1 1 27 27 SER CB C 27 64.640 64.640 64.078 0.562 19287
1892 1 7 . 1 1 27 27 SER H H 27 7.350 7.350 7.613 -0.263 19287
1893 1 7 . 1 1 28 28 ASN N N 28 119.830 119.830 118.509 1.321 19287
1894 1 7 . 1 1 28 28 ASN HA H 28 4.060 4.060 4.361 -0.301 19287
1895 1 7 . 1 1 28 28 ASN C C 28 173.040 173.040 174.142 -1.102 19287
1896 1 7 . 1 1 28 28 ASN CA C 28 53.830 53.830 54.755 -0.925 19287
1897 1 7 . 1 1 28 28 ASN CB C 28 37.400 37.400 38.248 -0.848 19287
1898 1 7 . 1 1 28 28 ASN H H 28 7.930 7.930 8.040 -0.110 19287
1899 1 7 . 1 1 29 29 THR N N 29 103.070 103.070 111.657 -8.587 19287
1900 1 7 . 1 1 29 29 THR HA H 29 4.441 4.441 4.686 -0.245 19287
1901 1 7 . 1 1 29 29 THR C C 29 172.980 172.980 171.999 0.981 19287
1902 1 7 . 1 1 29 29 THR CA C 29 58.920 58.920 61.352 -2.432 19287
1903 1 7 . 1 1 29 29 THR CB C 29 73.260 73.260 71.330 1.930 19287
1904 1 7 . 1 1 29 29 THR H H 29 6.990 6.990 7.531 -0.541 19287
1905 1 7 . 1 1 30 30 CYS N N 30 118.340 118.340 119.358 -1.018 19287
1906 1 7 . 1 1 30 30 CYS HA H 30 5.462 5.462 5.544 -0.082 19287
1907 1 7 . 1 1 30 30 CYS C C 30 173.320 173.320 173.707 -0.387 19287
1908 1 7 . 1 1 30 30 CYS CA C 30 57.750 57.750 57.818 -0.068 19287
1909 1 7 . 1 1 30 30 CYS CB C 30 50.680 50.680 32.236 18.445 19287
1910 1 7 . 1 1 30 30 CYS H H 30 8.954 8.954 8.664 0.290 19287
1911 1 7 . 1 1 31 31 HIS N N 31 118.930 118.930 119.498 -0.568 19287
1912 1 7 . 1 1 31 31 HIS HA H 31 4.780 4.780 5.024 -0.244 19287
1913 1 7 . 1 1 31 31 HIS C C 31 172.790 172.790 173.445 -0.655 19287
1914 1 7 . 1 1 31 31 HIS CA C 31 53.530 53.530 55.656 -2.126 19287
1915 1 7 . 1 1 31 31 HIS CB C 31 33.040 33.040 33.395 -0.355 19287
1916 1 7 . 1 1 31 31 HIS H H 31 9.010 9.010 9.684 -0.674 19287
1917 1 7 . 1 1 32 32 SER N N 32 117.600 117.600 120.712 -3.112 19287
1918 1 7 . 1 1 32 32 SER HA H 32 4.700 4.700 4.287 0.413 19287
1919 1 7 . 1 1 32 32 SER C C 32 174.930 174.930 173.662 1.268 19287
1920 1 7 . 1 1 32 32 SER CA C 32 57.980 57.980 58.679 -0.699 19287
1921 1 7 . 1 1 32 32 SER CB C 32 64.440 64.440 63.203 1.237 19287
1922 1 7 . 1 1 32 32 SER H H 32 8.740 8.740 8.190 0.550 19287
1923 1 7 . 1 1 33 33 PHE N N 33 120.690 120.690 119.845 0.845 19287
1924 1 7 . 1 1 33 33 PHE HA H 33 4.790 4.790 5.009 -0.219 19287
1925 1 7 . 1 1 33 33 PHE C C 33 171.810 171.810 173.413 -1.603 19287
1926 1 7 . 1 1 33 33 PHE CA C 33 56.200 56.200 55.774 0.426 19287
1927 1 7 . 1 1 33 33 PHE CB C 33 40.230 40.230 41.559 -1.329 19287
1928 1 7 . 1 1 33 33 PHE H H 33 8.830 8.830 8.906 -0.076 19287
1929 1 7 . 1 1 34 34 THR N N 34 116.650 116.650 111.515 5.135 19287
1930 1 7 . 1 1 34 34 THR HA H 34 3.965 3.965 4.259 -0.294 19287
1931 1 7 . 1 1 34 34 THR C C 34 172.600 172.600 172.665 -0.065 19287
1932 1 7 . 1 1 34 34 THR CA C 34 61.980 61.980 60.902 1.078 19287
1933 1 7 . 1 1 34 34 THR CB C 34 68.530 68.530 69.447 -0.917 19287
1934 1 7 . 1 1 34 34 THR H H 34 8.400 8.400 8.167 0.233 19287
1935 1 7 . 1 1 35 35 TYR N N 35 127.790 127.790 126.813 0.977 19287
1936 1 7 . 1 1 35 35 TYR HA H 35 4.500 4.500 4.678 -0.178 19287
1937 1 7 . 1 1 35 35 TYR C C 35 174.200 174.200 173.563 0.637 19287
1938 1 7 . 1 1 35 35 TYR CA C 35 55.130 55.130 55.998 -0.868 19287
1939 1 7 . 1 1 35 35 TYR CB C 35 39.650 39.650 42.170 -2.520 19287
1940 1 7 . 1 1 35 35 TYR H H 35 8.010 8.010 8.483 -0.473 19287
1941 1 7 . 1 1 39 39 GLY N N 39 103.730 103.730 114.256 -10.526 19287
1942 1 7 . 1 1 39 39 GLY C C 39 175.700 175.700 173.905 1.795 19287
1943 1 7 . 1 1 39 39 GLY CA C 39 45.370 45.370 44.800 0.570 19287
1944 1 7 . 1 1 39 39 GLY H H 39 8.500 8.500 8.404 0.096 19287
1945 1 7 . 1 1 40 40 GLY N N 40 110.170 110.170 112.478 -2.308 19287
1946 1 7 . 1 1 40 40 GLY C C 40 173.140 173.140 173.227 -0.087 19287
1947 1 7 . 1 1 40 40 GLY CA C 40 44.320 44.320 44.981 -0.661 19287
1948 1 7 . 1 1 40 40 GLY H H 40 8.670 8.670 8.219 0.451 19287
1949 1 7 . 1 1 41 41 ASN N N 41 116.960 116.960 117.222 -0.262 19287
1950 1 7 . 1 1 41 41 ASN HA H 41 4.560 4.560 4.967 -0.407 19287
1951 1 7 . 1 1 41 41 ASN C C 41 173.670 173.670 175.402 -1.732 19287
1952 1 7 . 1 1 41 41 ASN CA C 41 51.850 51.850 51.918 -0.068 19287
1953 1 7 . 1 1 41 41 ASN CB C 41 40.230 40.230 42.107 -1.877 19287
1954 1 7 . 1 1 41 41 ASN H H 41 8.790 8.790 8.723 0.067 19287
1955 1 7 . 1 1 42 42 ALA N N 42 113.290 113.290 121.778 -8.488 19287
1956 1 7 . 1 1 42 42 ALA HA H 42 3.720 3.720 4.153 -0.433 19287
1957 1 7 . 1 1 42 42 ALA C C 42 177.220 177.220 177.974 -0.754 19287
1958 1 7 . 1 1 42 42 ALA CA C 42 52.810 52.810 54.592 -1.782 19287
1959 1 7 . 1 1 42 42 ALA CB C 42 17.980 17.980 18.850 -0.870 19287
1960 1 7 . 1 1 42 42 ALA H H 42 7.590 7.590 8.605 -1.015 19287
1961 1 7 . 1 1 43 43 ASN N N 43 117.710 117.710 114.046 3.664 19287
1962 1 7 . 1 1 43 43 ASN HA H 43 4.700 4.700 4.610 0.090 19287
1963 1 7 . 1 1 43 43 ASN C C 43 173.660 173.660 174.124 -0.464 19287
1964 1 7 . 1 1 43 43 ASN CA C 43 50.630 50.630 53.671 -3.041 19287
1965 1 7 . 1 1 43 43 ASN CB C 43 34.840 34.840 37.833 -2.993 19287
1966 1 7 . 1 1 43 43 ASN H H 43 7.900 7.900 8.118 -0.218 19287
1967 1 7 . 1 1 44 44 ARG N N 44 120.690 120.690 120.232 0.458 19287
1968 1 7 . 1 1 44 44 ARG HA H 44 4.692 4.692 4.440 0.252 19287
1969 1 7 . 1 1 44 44 ARG C C 44 173.530 173.530 174.089 -0.559 19287
1970 1 7 . 1 1 44 44 ARG CA C 44 56.660 56.660 55.408 1.252 19287
1971 1 7 . 1 1 44 44 ARG CB C 44 31.450 31.450 30.291 1.159 19287
1972 1 7 . 1 1 44 44 ARG H H 44 6.860 6.860 6.935 -0.075 19287
1973 1 7 . 1 1 45 45 PHE N N 45 123.690 123.690 122.565 1.125 19287
1974 1 7 . 1 1 45 45 PHE HA H 45 4.810 4.810 4.950 -0.140 19287
1975 1 7 . 1 1 45 45 PHE C C 45 175.420 175.420 175.580 -0.160 19287
1976 1 7 . 1 1 45 45 PHE CA C 45 55.670 55.670 55.945 -0.275 19287
1977 1 7 . 1 1 45 45 PHE CB C 45 43.790 43.790 41.551 2.239 19287
1978 1 7 . 1 1 45 45 PHE H H 45 9.340 9.340 8.182 1.158 19287
1979 1 7 . 1 1 46 46 ARG N N 46 120.920 120.920 117.258 3.662 19287
1980 1 7 . 1 1 46 46 ARG HA H 46 4.397 4.397 4.579 -0.182 19287
1981 1 7 . 1 1 46 46 ARG C C 46 176.560 176.560 175.913 0.647 19287
1982 1 7 . 1 1 46 46 ARG CA C 46 58.210 58.210 56.103 2.107 19287
1983 1 7 . 1 1 46 46 ARG CB C 46 30.900 30.900 30.506 0.394 19287
1984 1 7 . 1 1 46 46 ARG H H 46 9.080 9.080 8.719 0.361 19287
1985 1 7 . 1 1 47 47 THR N N 47 102.800 102.800 112.038 -9.238 19287
1986 1 7 . 1 1 47 47 THR HA H 47 4.660 4.660 4.007 0.653 19287
1987 1 7 . 1 1 47 47 THR C C 47 174.110 174.110 173.436 0.674 19287
1988 1 7 . 1 1 47 47 THR CA C 47 58.170 58.170 59.822 -1.652 19287
1989 1 7 . 1 1 47 47 THR CB C 47 72.380 72.380 70.627 1.752 19287
1990 1 7 . 1 1 47 47 THR H H 47 7.230 7.230 7.389 -0.159 19287
1991 1 7 . 1 1 48 48 ILE N N 48 123.200 123.200 125.285 -2.085 19287
1992 1 7 . 1 1 48 48 ILE HA H 48 2.901 2.901 3.800 -0.899 19287
1993 1 7 . 1 1 48 48 ILE C C 48 176.420 176.420 176.273 0.147 19287
1994 1 7 . 1 1 48 48 ILE CA C 48 64.000 64.000 63.209 0.791 19287
1995 1 7 . 1 1 48 48 ILE CB C 48 37.060 37.060 38.147 -1.087 19287
1996 1 7 . 1 1 48 48 ILE H H 48 8.110 8.110 7.937 0.173 19287
1997 1 7 . 1 1 49 49 ASP N N 49 119.560 119.560 119.034 0.526 19287
1998 1 7 . 1 1 49 49 ASP HA H 49 4.130 4.130 4.306 -0.176 19287
1999 1 7 . 1 1 49 49 ASP C C 49 177.740 177.740 177.911 -0.171 19287
2000 1 7 . 1 1 49 49 ASP CA C 49 56.690 56.690 57.310 -0.620 19287
2001 1 7 . 1 1 49 49 ASP CB C 49 39.970 39.970 40.873 -0.903 19287
2002 1 7 . 1 1 49 49 ASP H H 49 7.700 7.700 7.740 -0.040 19287
2003 1 7 . 1 1 50 50 GLU N N 50 117.720 117.720 119.502 -1.782 19287
2004 1 7 . 1 1 50 50 GLU HA H 50 3.710 3.710 4.204 -0.494 19287
2005 1 7 . 1 1 50 50 GLU C C 50 177.550 177.550 178.366 -0.816 19287
2006 1 7 . 1 1 50 50 GLU CA C 50 58.550 58.550 58.801 -0.251 19287
2007 1 7 . 1 1 50 50 GLU CB C 50 29.190 29.190 29.985 -0.794 19287
2008 1 7 . 1 1 50 50 GLU H H 50 7.410 7.410 7.617 -0.207 19287
2009 1 7 . 1 1 51 51 CYS N N 51 120.260 120.260 117.018 3.242 19287
2010 1 7 . 1 1 51 51 CYS HA H 51 1.650 1.650 3.803 -2.153 19287
2011 1 7 . 1 1 51 51 CYS C C 51 175.070 175.070 176.631 -1.561 19287
2012 1 7 . 1 1 51 51 CYS CA C 51 59.120 59.120 60.409 -1.289 19287
2013 1 7 . 1 1 51 51 CYS CB C 51 43.000 43.000 26.348 16.652 19287
2014 1 7 . 1 1 51 51 CYS H H 51 6.760 6.760 7.814 -1.054 19287
2015 1 7 . 1 1 52 52 ASN N N 52 120.160 120.160 120.775 -0.615 19287
2016 1 7 . 1 1 52 52 ASN HA H 52 4.090 4.090 4.476 -0.386 19287
2017 1 7 . 1 1 52 52 ASN C C 52 177.820 177.820 177.700 0.120 19287
2018 1 7 . 1 1 52 52 ASN CA C 52 55.060 55.060 55.848 -0.788 19287
2019 1 7 . 1 1 52 52 ASN CB C 52 37.500 37.500 38.390 -0.890 19287
2020 1 7 . 1 1 52 52 ASN H H 52 8.650 8.650 8.523 0.127 19287
2021 1 7 . 1 1 53 53 ARG N N 53 117.000 117.000 118.156 -1.156 19287
2022 1 7 . 1 1 53 53 ARG HA H 53 3.770 3.770 4.066 -0.296 19287
2023 1 7 . 1 1 53 53 ARG C C 53 177.360 177.360 177.481 -0.121 19287
2024 1 7 . 1 1 53 53 ARG CA C 53 58.490 58.490 58.637 -0.147 19287
2025 1 7 . 1 1 53 53 ARG CB C 53 30.180 30.180 29.197 0.983 19287
2026 1 7 . 1 1 53 53 ARG H H 53 7.900 7.900 7.558 0.342 19287
2027 1 7 . 1 1 54 54 THR N N 54 112.080 112.080 112.018 0.062 19287
2028 1 7 . 1 1 54 54 THR HA H 54 3.838 3.838 4.456 -0.618 19287
2029 1 7 . 1 1 54 54 THR C C 54 174.990 174.990 174.424 0.566 19287
2030 1 7 . 1 1 54 54 THR CA C 54 65.740 65.740 63.267 2.473 19287
2031 1 7 . 1 1 54 54 THR CB C 54 68.870 68.870 70.082 -1.212 19287
2032 1 7 . 1 1 54 54 THR H H 54 7.260 7.260 7.586 -0.326 19287
2033 1 7 . 1 1 55 55 CYS N N 55 112.540 112.540 117.181 -4.641 19287
2034 1 7 . 1 1 55 55 CYS HA H 55 4.400 4.400 4.431 -0.031 19287
2035 1 7 . 1 1 55 55 CYS C C 55 172.940 172.940 174.136 -1.196 19287
2036 1 7 . 1 1 55 55 CYS CA C 55 54.230 54.230 58.678 -4.447 19287
2037 1 7 . 1 1 55 55 CYS CB C 55 42.930 42.930 29.513 13.417 19287
2038 1 7 . 1 1 55 55 CYS H H 55 7.590 7.590 7.420 0.170 19287
2039 1 7 . 1 1 56 56 VAL N N 56 119.720 119.720 123.512 -3.792 19287
2040 1 7 . 1 1 56 56 VAL HA H 56 3.631 3.631 4.014 -0.383 19287
2041 1 7 . 1 1 56 56 VAL C C 56 176.710 176.710 176.336 0.374 19287
2042 1 7 . 1 1 56 56 VAL CA C 56 64.540 64.540 63.783 0.756 19287
2043 1 7 . 1 1 56 56 VAL CB C 56 30.970 30.970 32.040 -1.070 19287
2044 1 7 . 1 1 56 56 VAL H H 56 7.280 7.280 7.618 -0.338 19287
2045 1 8 . 1 1 2 2 PRO HA H 2 4.017 4.017 4.330 -0.313 19287
2046 1 8 . 1 1 2 2 PRO C C 2 177.920 177.920 177.935 -0.015 19287
2047 1 8 . 1 1 2 2 PRO CA C 2 62.800 62.800 62.289 0.511 19287
2048 1 8 . 1 1 2 2 PRO CB C 2 32.050 32.050 32.355 -0.305 19287
2049 1 8 . 1 1 3 3 ARG N N 3 122.340 122.340 122.546 -0.206 19287
2050 1 8 . 1 1 3 3 ARG HA H 3 3.786 3.786 4.122 -0.336 19287
2051 1 8 . 1 1 3 3 ARG C C 3 178.950 178.950 176.132 2.818 19287
2052 1 8 . 1 1 3 3 ARG CA C 3 58.410 58.410 57.991 0.419 19287
2053 1 8 . 1 1 3 3 ARG CB C 3 29.220 29.220 28.896 0.324 19287
2054 1 8 . 1 1 3 3 ARG H H 3 8.550 8.550 8.781 -0.231 19287
2055 1 8 . 1 1 4 4 PHE N N 4 113.010 113.010 115.512 -2.502 19287
2056 1 8 . 1 1 4 4 PHE HA H 4 4.300 4.300 4.654 -0.354 19287
2057 1 8 . 1 1 4 4 PHE C C 4 176.070 176.070 176.337 -0.267 19287
2058 1 8 . 1 1 4 4 PHE CA C 4 58.220 58.220 57.026 1.194 19287
2059 1 8 . 1 1 4 4 PHE CB C 4 37.310 37.310 38.117 -0.807 19287
2060 1 8 . 1 1 4 4 PHE H H 4 7.150 7.150 7.371 -0.221 19287
2061 1 8 . 1 1 5 5 CYS N N 5 118.600 118.600 118.880 -0.280 19287
2062 1 8 . 1 1 5 5 CYS HA H 5 4.130 4.130 4.192 -0.062 19287
2063 1 8 . 1 1 5 5 CYS C C 5 173.450 173.450 174.680 -1.230 19287
2064 1 8 . 1 1 5 5 CYS CA C 5 57.960 57.960 60.064 -2.104 19287
2065 1 8 . 1 1 5 5 CYS CB C 5 39.210 39.210 25.852 13.358 19287
2066 1 8 . 1 1 5 5 CYS H H 5 7.090 7.090 7.314 -0.224 19287
2067 1 8 . 1 1 6 6 GLU N N 6 110.710 110.710 118.213 -7.503 19287
2068 1 8 . 1 1 6 6 GLU HA H 6 4.182 4.182 4.345 -0.163 19287
2069 1 8 . 1 1 6 6 GLU C C 6 176.310 176.310 176.215 0.095 19287
2070 1 8 . 1 1 6 6 GLU CA C 6 55.510 55.510 55.612 -0.103 19287
2071 1 8 . 1 1 6 6 GLU CB C 6 28.160 28.160 28.852 -0.692 19287
2072 1 8 . 1 1 6 6 GLU H H 6 7.300 7.300 7.982 -0.682 19287
2073 1 8 . 1 1 7 7 LEU N N 7 119.090 119.090 121.111 -2.021 19287
2074 1 8 . 1 1 7 7 LEU HA H 7 4.160 4.160 4.370 -0.210 19287
2075 1 8 . 1 1 7 7 LEU C C 7 176.630 176.630 176.141 0.489 19287
2076 1 8 . 1 1 7 7 LEU CA C 7 54.510 54.510 54.026 0.484 19287
2077 1 8 . 1 1 7 7 LEU CB C 7 42.330 42.330 42.557 -0.227 19287
2078 1 8 . 1 1 7 7 LEU H H 7 7.210 7.210 7.337 -0.127 19287
2079 1 8 . 1 1 8 8 ALA N N 8 124.490 124.490 122.433 2.057 19287
2080 1 8 . 1 1 8 8 ALA HA H 8 4.250 4.250 4.663 -0.413 19287
2081 1 8 . 1 1 8 8 ALA C C 8 174.710 174.710 175.559 -0.849 19287
2082 1 8 . 1 1 8 8 ALA CA C 8 50.210 50.210 48.789 1.421 19287
2083 1 8 . 1 1 8 8 ALA CB C 8 16.930 16.930 19.527 -2.597 19287
2084 1 8 . 1 1 8 8 ALA H H 8 8.280 8.280 8.272 0.008 19287
2085 1 8 . 1 1 9 9 PRO HA H 9 4.180 4.180 4.664 -0.484 19287
2086 1 8 . 1 1 9 9 PRO C C 9 176.700 176.700 176.479 0.221 19287
2087 1 8 . 1 1 9 9 PRO CA C 9 61.490 61.490 62.902 -1.412 19287
2088 1 8 . 1 1 9 9 PRO CB C 9 30.360 30.360 32.036 -1.676 19287
2089 1 8 . 1 1 10 10 SER N N 10 112.100 112.100 122.644 -10.544 19287
2090 1 8 . 1 1 10 10 SER HA H 10 4.630 4.630 4.441 0.189 19287
2091 1 8 . 1 1 10 10 SER C C 10 174.190 174.190 175.132 -0.942 19287
2092 1 8 . 1 1 10 10 SER CA C 10 55.360 55.360 56.171 -0.811 19287
2093 1 8 . 1 1 10 10 SER CB C 10 64.550 64.550 61.976 2.574 19287
2094 1 8 . 1 1 10 10 SER H H 10 7.450 7.450 8.627 -1.177 19287
2095 1 8 . 1 1 11 11 ALA N N 11 129.980 129.980 125.421 4.559 19287
2096 1 8 . 1 1 11 11 ALA HA H 11 4.496 4.496 3.943 0.553 19287
2097 1 8 . 1 1 11 11 ALA C C 11 178.510 178.510 179.037 -0.527 19287
2098 1 8 . 1 1 11 11 ALA CA C 11 54.810 54.810 54.652 0.158 19287
2099 1 8 . 1 1 11 11 ALA CB C 11 19.910 19.910 18.658 1.252 19287
2100 1 8 . 1 1 11 11 ALA H H 11 9.210 9.210 8.155 1.055 19287
2101 1 8 . 1 1 12 12 GLY N N 12 104.410 104.410 106.189 -1.779 19287
2102 1 8 . 1 1 12 12 GLY C C 12 174.850 174.850 175.773 -0.923 19287
2103 1 8 . 1 1 12 12 GLY CA C 12 44.450 44.450 46.333 -1.883 19287
2104 1 8 . 1 1 12 12 GLY H H 12 8.190 8.190 8.763 -0.573 19287
2105 1 8 . 1 1 14 14 CYS HA H 14 4.250 4.250 4.621 -0.371 19287
2106 1 8 . 1 1 14 14 CYS C C 14 172.410 172.410 173.457 -1.047 19287
2107 1 8 . 1 1 14 14 CYS CA C 14 59.750 59.750 58.276 1.474 19287
2108 1 8 . 1 1 14 14 CYS CB C 14 39.130 39.130 31.032 8.098 19287
2109 1 8 . 1 1 15 15 PHE N N 15 116.000 116.000 123.663 -7.663 19287
2110 1 8 . 1 1 15 15 PHE HA H 15 4.380 4.380 4.651 -0.271 19287
2111 1 8 . 1 1 15 15 PHE C C 15 174.300 174.300 173.587 0.713 19287
2112 1 8 . 1 1 15 15 PHE CA C 15 56.830 56.830 57.750 -0.920 19287
2113 1 8 . 1 1 15 15 PHE CB C 15 39.440 39.440 40.133 -0.693 19287
2114 1 8 . 1 1 15 15 PHE H H 15 7.960 7.960 8.783 -0.823 19287
2115 1 8 . 1 1 16 16 ALA N N 16 125.630 125.630 129.539 -3.909 19287
2116 1 8 . 1 1 16 16 ALA HA H 16 4.320 4.320 4.372 -0.052 19287
2117 1 8 . 1 1 16 16 ALA C C 16 174.300 174.300 174.710 -0.410 19287
2118 1 8 . 1 1 16 16 ALA CA C 16 50.130 50.130 51.456 -1.326 19287
2119 1 8 . 1 1 16 16 ALA CB C 16 19.180 19.180 21.702 -2.522 19287
2120 1 8 . 1 1 16 16 ALA H H 16 7.800 7.800 7.782 0.018 19287
2121 1 8 . 1 1 17 17 PHE N N 17 116.330 116.330 122.563 -6.233 19287
2122 1 8 . 1 1 17 17 PHE HA H 17 4.390 4.390 4.901 -0.511 19287
2123 1 8 . 1 1 17 17 PHE C C 17 175.310 175.310 173.895 1.415 19287
2124 1 8 . 1 1 17 17 PHE CA C 17 57.160 57.160 56.038 1.122 19287
2125 1 8 . 1 1 17 17 PHE CB C 17 39.380 39.380 40.531 -1.151 19287
2126 1 8 . 1 1 17 17 PHE H H 17 7.330 7.330 8.398 -1.068 19287
2127 1 8 . 1 1 18 18 VAL N N 18 122.890 122.890 124.734 -1.844 19287
2128 1 8 . 1 1 18 18 VAL HA H 18 4.475 4.475 4.349 0.126 19287
2129 1 8 . 1 1 18 18 VAL C C 18 173.590 173.590 173.412 0.178 19287
2130 1 8 . 1 1 18 18 VAL CA C 18 58.900 58.900 58.385 0.515 19287
2131 1 8 . 1 1 18 18 VAL CB C 18 33.900 33.900 33.620 0.281 19287
2132 1 8 . 1 1 18 18 VAL H H 18 8.680 8.680 8.456 0.224 19287
2133 1 8 . 1 1 19 19 PRO HA H 19 4.275 4.275 4.565 -0.290 19287
2134 1 8 . 1 1 19 19 PRO C C 19 176.940 176.940 176.404 0.536 19287
2135 1 8 . 1 1 19 19 PRO CA C 19 64.060 64.060 62.641 1.419 19287
2136 1 8 . 1 1 19 19 PRO CB C 19 31.710 31.710 31.061 0.649 19287
2137 1 8 . 1 1 20 20 SER N N 20 120.230 120.230 119.244 0.986 19287
2138 1 8 . 1 1 20 20 SER HA H 20 4.780 4.780 4.588 0.192 19287
2139 1 8 . 1 1 20 20 SER C C 20 170.900 170.900 172.995 -2.095 19287
2140 1 8 . 1 1 20 20 SER CA C 20 57.450 57.450 57.147 0.304 19287
2141 1 8 . 1 1 20 20 SER CB C 20 67.910 67.910 66.127 1.783 19287
2142 1 8 . 1 1 20 20 SER H H 20 8.390 8.390 7.815 0.575 19287
2143 1 8 . 1 1 21 21 TYR N N 21 118.220 118.220 118.690 -0.470 19287
2144 1 8 . 1 1 21 21 TYR HA H 21 5.600 5.600 5.036 0.564 19287
2145 1 8 . 1 1 21 21 TYR C C 21 173.770 173.770 175.228 -1.458 19287
2146 1 8 . 1 1 21 21 TYR CA C 21 57.740 57.740 58.286 -0.546 19287
2147 1 8 . 1 1 21 21 TYR CB C 21 42.660 42.660 41.865 0.795 19287
2148 1 8 . 1 1 21 21 TYR H H 21 9.020 9.020 8.560 0.460 19287
2149 1 8 . 1 1 22 22 TYR N N 22 119.260 119.260 123.766 -4.506 19287
2150 1 8 . 1 1 22 22 TYR HA H 22 5.110 5.110 4.945 0.165 19287
2151 1 8 . 1 1 22 22 TYR C C 22 172.610 172.610 173.778 -1.168 19287
2152 1 8 . 1 1 22 22 TYR CA C 22 55.380 55.380 56.525 -1.145 19287
2153 1 8 . 1 1 22 22 TYR CB C 22 41.550 41.550 43.002 -1.452 19287
2154 1 8 . 1 1 22 22 TYR H H 22 9.410 9.410 9.531 -0.121 19287
2155 1 8 . 1 1 23 23 TYR N N 23 123.200 123.200 124.434 -1.234 19287
2156 1 8 . 1 1 23 23 TYR HA H 23 4.382 4.382 5.076 -0.694 19287
2157 1 8 . 1 1 23 23 TYR C C 23 173.250 173.250 173.717 -0.467 19287
2158 1 8 . 1 1 23 23 TYR CA C 23 58.360 58.360 56.996 1.364 19287
2159 1 8 . 1 1 23 23 TYR CB C 23 39.570 39.570 41.119 -1.549 19287
2160 1 8 . 1 1 23 23 TYR H H 23 10.190 10.190 8.541 1.649 19287
2161 1 8 . 1 1 24 24 ASN N N 24 126.280 126.280 127.300 -1.020 19287
2162 1 8 . 1 1 24 24 ASN HA H 24 4.550 4.550 5.043 -0.493 19287
2163 1 8 . 1 1 24 24 ASN C C 24 174.000 174.000 175.501 -1.501 19287
2164 1 8 . 1 1 24 24 ASN CA C 24 51.360 51.360 51.926 -0.566 19287
2165 1 8 . 1 1 24 24 ASN CB C 24 40.040 40.040 39.284 0.756 19287
2166 1 8 . 1 1 24 24 ASN H H 24 7.890 7.890 8.923 -1.033 19287
2167 1 8 . 1 1 25 25 GLN N N 25 122.760 122.760 124.369 -1.609 19287
2168 1 8 . 1 1 25 25 GLN HA H 25 3.691 3.691 3.648 0.043 19287
2169 1 8 . 1 1 25 25 GLN C C 25 175.670 175.670 175.914 -0.244 19287
2170 1 8 . 1 1 25 25 GLN CA C 25 57.480 57.480 57.974 -0.494 19287
2171 1 8 . 1 1 25 25 GLN CB C 25 28.120 28.120 27.654 0.466 19287
2172 1 8 . 1 1 25 25 GLN H H 25 8.440 8.440 8.497 -0.057 19287
2173 1 8 . 1 1 26 26 TYR N N 26 119.190 119.190 118.333 0.857 19287
2174 1 8 . 1 1 26 26 TYR HA H 26 4.160 4.160 4.312 -0.152 19287
2175 1 8 . 1 1 26 26 TYR C C 26 176.520 176.520 177.458 -0.938 19287
2176 1 8 . 1 1 26 26 TYR CA C 26 60.170 60.170 59.755 0.415 19287
2177 1 8 . 1 1 26 26 TYR CB C 26 36.880 36.880 38.124 -1.244 19287
2178 1 8 . 1 1 26 26 TYR H H 26 7.810 7.810 7.934 -0.124 19287
2179 1 8 . 1 1 27 27 SER N N 27 109.600 109.600 112.157 -2.557 19287
2180 1 8 . 1 1 27 27 SER HA H 27 4.330 4.330 4.469 -0.139 19287
2181 1 8 . 1 1 27 27 SER C C 27 174.830 174.830 174.027 0.803 19287
2182 1 8 . 1 1 27 27 SER CA C 27 57.490 57.490 57.654 -0.164 19287
2183 1 8 . 1 1 27 27 SER CB C 27 64.640 64.640 64.046 0.594 19287
2184 1 8 . 1 1 27 27 SER H H 27 7.350 7.350 7.697 -0.347 19287
2185 1 8 . 1 1 28 28 ASN N N 28 119.830 119.830 118.915 0.915 19287
2186 1 8 . 1 1 28 28 ASN HA H 28 4.060 4.060 4.355 -0.295 19287
2187 1 8 . 1 1 28 28 ASN C C 28 173.040 173.040 174.071 -1.031 19287
2188 1 8 . 1 1 28 28 ASN CA C 28 53.830 53.830 54.432 -0.602 19287
2189 1 8 . 1 1 28 28 ASN CB C 28 37.400 37.400 37.830 -0.430 19287
2190 1 8 . 1 1 28 28 ASN H H 28 7.930 7.930 7.700 0.230 19287
2191 1 8 . 1 1 29 29 THR N N 29 103.070 103.070 111.124 -8.054 19287
2192 1 8 . 1 1 29 29 THR HA H 29 4.441 4.441 4.695 -0.254 19287
2193 1 8 . 1 1 29 29 THR C C 29 172.980 172.980 172.168 0.812 19287
2194 1 8 . 1 1 29 29 THR CA C 29 58.920 58.920 61.032 -2.112 19287
2195 1 8 . 1 1 29 29 THR CB C 29 73.260 73.260 71.304 1.956 19287
2196 1 8 . 1 1 29 29 THR H H 29 6.990 6.990 7.622 -0.632 19287
2197 1 8 . 1 1 30 30 CYS N N 30 118.340 118.340 120.024 -1.684 19287
2198 1 8 . 1 1 30 30 CYS HA H 30 5.462 5.462 5.471 -0.009 19287
2199 1 8 . 1 1 30 30 CYS C C 30 173.320 173.320 173.794 -0.474 19287
2200 1 8 . 1 1 30 30 CYS CA C 30 57.750 57.750 57.807 -0.057 19287
2201 1 8 . 1 1 30 30 CYS CB C 30 50.680 50.680 31.926 18.754 19287
2202 1 8 . 1 1 30 30 CYS H H 30 8.954 8.954 8.693 0.261 19287
2203 1 8 . 1 1 31 31 HIS N N 31 118.930 118.930 120.327 -1.397 19287
2204 1 8 . 1 1 31 31 HIS HA H 31 4.780 4.780 5.122 -0.342 19287
2205 1 8 . 1 1 31 31 HIS C C 31 172.790 172.790 173.734 -0.944 19287
2206 1 8 . 1 1 31 31 HIS CA C 31 53.530 53.530 55.614 -2.084 19287
2207 1 8 . 1 1 31 31 HIS CB C 31 33.040 33.040 33.238 -0.198 19287
2208 1 8 . 1 1 31 31 HIS H H 31 9.010 9.010 9.374 -0.364 19287
2209 1 8 . 1 1 32 32 SER N N 32 117.600 117.600 120.152 -2.552 19287
2210 1 8 . 1 1 32 32 SER HA H 32 4.700 4.700 4.149 0.551 19287
2211 1 8 . 1 1 32 32 SER C C 32 174.930 174.930 173.644 1.286 19287
2212 1 8 . 1 1 32 32 SER CA C 32 57.980 57.980 58.508 -0.528 19287
2213 1 8 . 1 1 32 32 SER CB C 32 64.440 64.440 63.417 1.023 19287
2214 1 8 . 1 1 32 32 SER H H 32 8.740 8.740 8.246 0.494 19287
2215 1 8 . 1 1 33 33 PHE N N 33 120.690 120.690 119.714 0.976 19287
2216 1 8 . 1 1 33 33 PHE HA H 33 4.790 4.790 4.974 -0.184 19287
2217 1 8 . 1 1 33 33 PHE C C 33 171.810 171.810 173.652 -1.842 19287
2218 1 8 . 1 1 33 33 PHE CA C 33 56.200 56.200 55.714 0.486 19287
2219 1 8 . 1 1 33 33 PHE CB C 33 40.230 40.230 41.185 -0.955 19287
2220 1 8 . 1 1 33 33 PHE H H 33 8.830 8.830 8.793 0.037 19287
2221 1 8 . 1 1 34 34 THR N N 34 116.650 116.650 112.714 3.936 19287
2222 1 8 . 1 1 34 34 THR HA H 34 3.965 3.965 4.454 -0.489 19287
2223 1 8 . 1 1 34 34 THR C C 34 172.600 172.600 172.785 -0.185 19287
2224 1 8 . 1 1 34 34 THR CA C 34 61.980 61.980 61.238 0.742 19287
2225 1 8 . 1 1 34 34 THR CB C 34 68.530 68.530 69.376 -0.846 19287
2226 1 8 . 1 1 34 34 THR H H 34 8.400 8.400 8.424 -0.024 19287
2227 1 8 . 1 1 35 35 TYR N N 35 127.790 127.790 125.835 1.955 19287
2228 1 8 . 1 1 35 35 TYR HA H 35 4.500 4.500 4.739 -0.239 19287
2229 1 8 . 1 1 35 35 TYR C C 35 174.200 174.200 173.604 0.596 19287
2230 1 8 . 1 1 35 35 TYR CA C 35 55.130 55.130 57.163 -2.034 19287
2231 1 8 . 1 1 35 35 TYR CB C 35 39.650 39.650 41.472 -1.822 19287
2232 1 8 . 1 1 35 35 TYR H H 35 8.010 8.010 7.979 0.031 19287
2233 1 8 . 1 1 39 39 GLY N N 39 103.730 103.730 109.354 -5.624 19287
2234 1 8 . 1 1 39 39 GLY C C 39 175.700 175.700 173.864 1.836 19287
2235 1 8 . 1 1 39 39 GLY CA C 39 45.370 45.370 44.516 0.854 19287
2236 1 8 . 1 1 39 39 GLY H H 39 8.500 8.500 8.226 0.274 19287
2237 1 8 . 1 1 40 40 GLY N N 40 110.170 110.170 111.206 -1.036 19287
2238 1 8 . 1 1 40 40 GLY C C 40 173.140 173.140 173.204 -0.064 19287
2239 1 8 . 1 1 40 40 GLY CA C 40 44.320 44.320 44.882 -0.562 19287
2240 1 8 . 1 1 40 40 GLY H H 40 8.670 8.670 8.376 0.294 19287
2241 1 8 . 1 1 41 41 ASN N N 41 116.960 116.960 117.701 -0.741 19287
2242 1 8 . 1 1 41 41 ASN HA H 41 4.560 4.560 4.992 -0.432 19287
2243 1 8 . 1 1 41 41 ASN C C 41 173.670 173.670 175.991 -2.321 19287
2244 1 8 . 1 1 41 41 ASN CA C 41 51.850 51.850 52.458 -0.608 19287
2245 1 8 . 1 1 41 41 ASN CB C 41 40.230 40.230 41.389 -1.159 19287
2246 1 8 . 1 1 41 41 ASN H H 41 8.790 8.790 8.738 0.052 19287
2247 1 8 . 1 1 42 42 ALA N N 42 113.290 113.290 122.933 -9.643 19287
2248 1 8 . 1 1 42 42 ALA HA H 42 3.720 3.720 4.152 -0.432 19287
2249 1 8 . 1 1 42 42 ALA C C 42 177.220 177.220 178.352 -1.132 19287
2250 1 8 . 1 1 42 42 ALA CA C 42 52.810 52.810 54.761 -1.950 19287
2251 1 8 . 1 1 42 42 ALA CB C 42 17.980 17.980 18.521 -0.541 19287
2252 1 8 . 1 1 42 42 ALA H H 42 7.590 7.590 8.706 -1.116 19287
2253 1 8 . 1 1 43 43 ASN N N 43 117.710 117.710 116.041 1.669 19287
2254 1 8 . 1 1 43 43 ASN HA H 43 4.700 4.700 4.675 0.025 19287
2255 1 8 . 1 1 43 43 ASN C C 43 173.660 173.660 175.499 -1.839 19287
2256 1 8 . 1 1 43 43 ASN CA C 43 50.630 50.630 54.542 -3.912 19287
2257 1 8 . 1 1 43 43 ASN CB C 43 34.840 34.840 38.000 -3.160 19287
2258 1 8 . 1 1 43 43 ASN H H 43 7.900 7.900 8.190 -0.290 19287
2259 1 8 . 1 1 44 44 ARG N N 44 120.690 120.690 121.346 -0.656 19287
2260 1 8 . 1 1 44 44 ARG HA H 44 4.692 4.692 4.304 0.388 19287
2261 1 8 . 1 1 44 44 ARG C C 44 173.530 173.530 175.032 -1.502 19287
2262 1 8 . 1 1 44 44 ARG CA C 44 56.660 56.660 57.145 -0.485 19287
2263 1 8 . 1 1 44 44 ARG CB C 44 31.450 31.450 29.741 1.709 19287
2264 1 8 . 1 1 44 44 ARG H H 44 6.860 6.860 7.703 -0.843 19287
2265 1 8 . 1 1 45 45 PHE N N 45 123.690 123.690 124.107 -0.417 19287
2266 1 8 . 1 1 45 45 PHE HA H 45 4.810 4.810 4.880 -0.070 19287
2267 1 8 . 1 1 45 45 PHE C C 45 175.420 175.420 175.412 0.008 19287
2268 1 8 . 1 1 45 45 PHE CA C 45 55.670 55.670 56.596 -0.926 19287
2269 1 8 . 1 1 45 45 PHE CB C 45 43.790 43.790 43.408 0.382 19287
2270 1 8 . 1 1 45 45 PHE H H 45 9.340 9.340 8.449 0.891 19287
2271 1 8 . 1 1 46 46 ARG N N 46 120.920 120.920 118.352 2.568 19287
2272 1 8 . 1 1 46 46 ARG HA H 46 4.397 4.397 4.447 -0.050 19287
2273 1 8 . 1 1 46 46 ARG C C 46 176.560 176.560 176.233 0.327 19287
2274 1 8 . 1 1 46 46 ARG CA C 46 58.210 58.210 55.864 2.346 19287
2275 1 8 . 1 1 46 46 ARG CB C 46 30.900 30.900 30.505 0.396 19287
2276 1 8 . 1 1 46 46 ARG H H 46 9.080 9.080 8.624 0.456 19287
2277 1 8 . 1 1 47 47 THR N N 47 102.800 102.800 111.927 -9.127 19287
2278 1 8 . 1 1 47 47 THR HA H 47 4.660 4.660 4.335 0.325 19287
2279 1 8 . 1 1 47 47 THR C C 47 174.110 174.110 173.589 0.521 19287
2280 1 8 . 1 1 47 47 THR CA C 47 58.170 58.170 59.968 -1.798 19287
2281 1 8 . 1 1 47 47 THR CB C 47 72.380 72.380 70.627 1.753 19287
2282 1 8 . 1 1 47 47 THR H H 47 7.230 7.230 7.482 -0.252 19287
2283 1 8 . 1 1 48 48 ILE N N 48 123.200 123.200 124.723 -1.523 19287
2284 1 8 . 1 1 48 48 ILE HA H 48 2.901 2.901 3.574 -0.673 19287
2285 1 8 . 1 1 48 48 ILE C C 48 176.420 176.420 176.059 0.361 19287
2286 1 8 . 1 1 48 48 ILE CA C 48 64.000 64.000 63.534 0.466 19287
2287 1 8 . 1 1 48 48 ILE CB C 48 37.060 37.060 37.955 -0.895 19287
2288 1 8 . 1 1 48 48 ILE H H 48 8.110 8.110 7.901 0.209 19287
2289 1 8 . 1 1 49 49 ASP N N 49 119.560 119.560 119.861 -0.301 19287
2290 1 8 . 1 1 49 49 ASP HA H 49 4.130 4.130 4.293 -0.163 19287
2291 1 8 . 1 1 49 49 ASP C C 49 177.740 177.740 178.261 -0.521 19287
2292 1 8 . 1 1 49 49 ASP CA C 49 56.690 56.690 58.364 -1.673 19287
2293 1 8 . 1 1 49 49 ASP CB C 49 39.970 39.970 40.708 -0.738 19287
2294 1 8 . 1 1 49 49 ASP H H 49 7.700 7.700 7.729 -0.029 19287
2295 1 8 . 1 1 50 50 GLU N N 50 117.720 117.720 119.509 -1.789 19287
2296 1 8 . 1 1 50 50 GLU HA H 50 3.710 3.710 4.318 -0.608 19287
2297 1 8 . 1 1 50 50 GLU C C 50 177.550 177.550 178.725 -1.175 19287
2298 1 8 . 1 1 50 50 GLU CA C 50 58.550 58.550 58.798 -0.248 19287
2299 1 8 . 1 1 50 50 GLU CB C 50 29.190 29.190 29.899 -0.709 19287
2300 1 8 . 1 1 50 50 GLU H H 50 7.410 7.410 7.602 -0.192 19287
2301 1 8 . 1 1 51 51 CYS N N 51 120.260 120.260 120.108 0.152 19287
2302 1 8 . 1 1 51 51 CYS HA H 51 1.650 1.650 3.588 -1.938 19287
2303 1 8 . 1 1 51 51 CYS C C 51 175.070 175.070 176.407 -1.337 19287
2304 1 8 . 1 1 51 51 CYS CA C 51 59.120 59.120 61.742 -2.622 19287
2305 1 8 . 1 1 51 51 CYS CB C 51 43.000 43.000 26.397 16.603 19287
2306 1 8 . 1 1 51 51 CYS H H 51 6.760 6.760 8.238 -1.478 19287
2307 1 8 . 1 1 52 52 ASN N N 52 120.160 120.160 119.259 0.901 19287
2308 1 8 . 1 1 52 52 ASN HA H 52 4.090 4.090 4.468 -0.378 19287
2309 1 8 . 1 1 52 52 ASN C C 52 177.820 177.820 177.637 0.183 19287
2310 1 8 . 1 1 52 52 ASN CA C 52 55.060 55.060 56.142 -1.082 19287
2311 1 8 . 1 1 52 52 ASN CB C 52 37.500 37.500 38.195 -0.695 19287
2312 1 8 . 1 1 52 52 ASN H H 52 8.650 8.650 8.644 0.006 19287
2313 1 8 . 1 1 53 53 ARG N N 53 117.000 117.000 118.546 -1.546 19287
2314 1 8 . 1 1 53 53 ARG HA H 53 3.770 3.770 4.071 -0.301 19287
2315 1 8 . 1 1 53 53 ARG C C 53 177.360 177.360 177.682 -0.322 19287
2316 1 8 . 1 1 53 53 ARG CA C 53 58.490 58.490 58.711 -0.221 19287
2317 1 8 . 1 1 53 53 ARG CB C 53 30.180 30.180 29.349 0.832 19287
2318 1 8 . 1 1 53 53 ARG H H 53 7.900 7.900 7.570 0.330 19287
2319 1 8 . 1 1 54 54 THR N N 54 112.080 112.080 112.294 -0.214 19287
2320 1 8 . 1 1 54 54 THR HA H 54 3.838 3.838 4.486 -0.648 19287
2321 1 8 . 1 1 54 54 THR C C 54 174.990 174.990 174.517 0.473 19287
2322 1 8 . 1 1 54 54 THR CA C 54 65.740 65.740 63.801 1.938 19287
2323 1 8 . 1 1 54 54 THR CB C 54 68.870 68.870 70.156 -1.286 19287
2324 1 8 . 1 1 54 54 THR H H 54 7.260 7.260 7.836 -0.576 19287
2325 1 8 . 1 1 55 55 CYS N N 55 112.540 112.540 117.320 -4.780 19287
2326 1 8 . 1 1 55 55 CYS HA H 55 4.400 4.400 4.455 -0.055 19287
2327 1 8 . 1 1 55 55 CYS C C 55 172.940 172.940 174.008 -1.068 19287
2328 1 8 . 1 1 55 55 CYS CA C 55 54.230 54.230 58.602 -4.372 19287
2329 1 8 . 1 1 55 55 CYS CB C 55 42.930 42.930 29.413 13.517 19287
2330 1 8 . 1 1 55 55 CYS H H 55 7.590 7.590 7.537 0.053 19287
2331 1 8 . 1 1 56 56 VAL N N 56 119.720 119.720 123.710 -3.990 19287
2332 1 8 . 1 1 56 56 VAL HA H 56 3.631 3.631 4.484 -0.853 19287
2333 1 8 . 1 1 56 56 VAL C C 56 176.710 176.710 176.422 0.288 19287
2334 1 8 . 1 1 56 56 VAL CA C 56 64.540 64.540 62.754 1.786 19287
2335 1 8 . 1 1 56 56 VAL CB C 56 30.970 30.970 30.846 0.124 19287
2336 1 8 . 1 1 56 56 VAL H H 56 7.280 7.280 7.863 -0.583 19287
2337 1 9 . 1 1 2 2 PRO HA H 2 4.017 4.017 4.461 -0.444 19287
2338 1 9 . 1 1 2 2 PRO C C 2 177.920 177.920 177.616 0.304 19287
2339 1 9 . 1 1 2 2 PRO CA C 2 62.800 62.800 62.430 0.370 19287
2340 1 9 . 1 1 2 2 PRO CB C 2 32.050 32.050 32.612 -0.562 19287
2341 1 9 . 1 1 3 3 ARG N N 3 122.340 122.340 123.841 -1.501 19287
2342 1 9 . 1 1 3 3 ARG HA H 3 3.786 3.786 4.121 -0.335 19287
2343 1 9 . 1 1 3 3 ARG C C 3 178.950 178.950 178.400 0.550 19287
2344 1 9 . 1 1 3 3 ARG CA C 3 58.410 58.410 58.141 0.269 19287
2345 1 9 . 1 1 3 3 ARG CB C 3 29.220 29.220 29.392 -0.172 19287
2346 1 9 . 1 1 3 3 ARG H H 3 8.550 8.550 8.769 -0.219 19287
2347 1 9 . 1 1 4 4 PHE N N 4 113.010 113.010 117.076 -4.066 19287
2348 1 9 . 1 1 4 4 PHE HA H 4 4.300 4.300 4.461 -0.161 19287
2349 1 9 . 1 1 4 4 PHE C C 4 176.070 176.070 176.675 -0.605 19287
2350 1 9 . 1 1 4 4 PHE CA C 4 58.220 58.220 58.559 -0.339 19287
2351 1 9 . 1 1 4 4 PHE CB C 4 37.310 37.310 37.840 -0.530 19287
2352 1 9 . 1 1 4 4 PHE H H 4 7.150 7.150 7.841 -0.691 19287
2353 1 9 . 1 1 5 5 CYS N N 5 118.600 118.600 118.075 0.525 19287
2354 1 9 . 1 1 5 5 CYS HA H 5 4.130 4.130 4.175 -0.045 19287
2355 1 9 . 1 1 5 5 CYS C C 5 173.450 173.450 175.027 -1.577 19287
2356 1 9 . 1 1 5 5 CYS CA C 5 57.960 57.960 60.690 -2.730 19287
2357 1 9 . 1 1 5 5 CYS CB C 5 39.210 39.210 25.667 13.543 19287
2358 1 9 . 1 1 5 5 CYS H H 5 7.090 7.090 7.488 -0.398 19287
2359 1 9 . 1 1 6 6 GLU N N 6 110.710 110.710 118.724 -8.014 19287
2360 1 9 . 1 1 6 6 GLU HA H 6 4.182 4.182 4.396 -0.214 19287
2361 1 9 . 1 1 6 6 GLU C C 6 176.310 176.310 176.376 -0.066 19287
2362 1 9 . 1 1 6 6 GLU CA C 6 55.510 55.510 55.860 -0.350 19287
2363 1 9 . 1 1 6 6 GLU CB C 6 28.160 28.160 29.246 -1.086 19287
2364 1 9 . 1 1 6 6 GLU H H 6 7.300 7.300 7.627 -0.327 19287
2365 1 9 . 1 1 7 7 LEU N N 7 119.090 119.090 121.233 -2.143 19287
2366 1 9 . 1 1 7 7 LEU HA H 7 4.160 4.160 4.302 -0.142 19287
2367 1 9 . 1 1 7 7 LEU C C 7 176.630 176.630 176.271 0.359 19287
2368 1 9 . 1 1 7 7 LEU CA C 7 54.510 54.510 54.181 0.329 19287
2369 1 9 . 1 1 7 7 LEU CB C 7 42.330 42.330 42.385 -0.055 19287
2370 1 9 . 1 1 7 7 LEU H H 7 7.210 7.210 7.339 -0.129 19287
2371 1 9 . 1 1 8 8 ALA N N 8 124.490 124.490 122.229 2.261 19287
2372 1 9 . 1 1 8 8 ALA HA H 8 4.250 4.250 4.706 -0.456 19287
2373 1 9 . 1 1 8 8 ALA C C 8 174.710 174.710 176.240 -1.530 19287
2374 1 9 . 1 1 8 8 ALA CA C 8 50.210 50.210 49.063 1.147 19287
2375 1 9 . 1 1 8 8 ALA CB C 8 16.930 16.930 19.466 -2.536 19287
2376 1 9 . 1 1 8 8 ALA H H 8 8.280 8.280 8.304 -0.024 19287
2377 1 9 . 1 1 9 9 PRO HA H 9 4.180 4.180 4.794 -0.614 19287
2378 1 9 . 1 1 9 9 PRO C C 9 176.700 176.700 176.087 0.613 19287
2379 1 9 . 1 1 9 9 PRO CA C 9 61.490 61.490 62.759 -1.269 19287
2380 1 9 . 1 1 9 9 PRO CB C 9 30.360 30.360 30.498 -0.138 19287
2381 1 9 . 1 1 10 10 SER N N 10 112.100 112.100 117.939 -5.839 19287
2382 1 9 . 1 1 10 10 SER HA H 10 4.630 4.630 4.372 0.258 19287
2383 1 9 . 1 1 10 10 SER C C 10 174.190 174.190 175.447 -1.257 19287
2384 1 9 . 1 1 10 10 SER CA C 10 55.360 55.360 57.583 -2.223 19287
2385 1 9 . 1 1 10 10 SER CB C 10 64.550 64.550 63.095 1.455 19287
2386 1 9 . 1 1 10 10 SER H H 10 7.450 7.450 8.132 -0.682 19287
2387 1 9 . 1 1 11 11 ALA N N 11 129.980 129.980 130.414 -0.434 19287
2388 1 9 . 1 1 11 11 ALA HA H 11 4.496 4.496 4.022 0.474 19287
2389 1 9 . 1 1 11 11 ALA C C 11 178.510 178.510 178.083 0.427 19287
2390 1 9 . 1 1 11 11 ALA CA C 11 54.810 54.810 53.784 1.026 19287
2391 1 9 . 1 1 11 11 ALA CB C 11 19.910 19.910 18.845 1.065 19287
2392 1 9 . 1 1 11 11 ALA H H 11 9.210 9.210 8.252 0.958 19287
2393 1 9 . 1 1 12 12 GLY N N 12 104.410 104.410 103.652 0.758 19287
2394 1 9 . 1 1 12 12 GLY C C 12 174.850 174.850 175.631 -0.781 19287
2395 1 9 . 1 1 12 12 GLY CA C 12 44.450 44.450 45.099 -0.649 19287
2396 1 9 . 1 1 12 12 GLY H H 12 8.190 8.190 8.300 -0.110 19287
2397 1 9 . 1 1 14 14 CYS HA H 14 4.250 4.250 4.652 -0.402 19287
2398 1 9 . 1 1 14 14 CYS C C 14 172.410 172.410 173.106 -0.696 19287
2399 1 9 . 1 1 14 14 CYS CA C 14 59.750 59.750 58.133 1.617 19287
2400 1 9 . 1 1 14 14 CYS CB C 14 39.130 39.130 29.058 10.072 19287
2401 1 9 . 1 1 15 15 PHE N N 15 116.000 116.000 127.819 -11.819 19287
2402 1 9 . 1 1 15 15 PHE HA H 15 4.380 4.380 4.815 -0.435 19287
2403 1 9 . 1 1 15 15 PHE C C 15 174.300 174.300 174.247 0.053 19287
2404 1 9 . 1 1 15 15 PHE CA C 15 56.830 56.830 58.511 -1.681 19287
2405 1 9 . 1 1 15 15 PHE CB C 15 39.440 39.440 39.278 0.162 19287
2406 1 9 . 1 1 15 15 PHE H H 15 7.960 7.960 8.792 -0.832 19287
2407 1 9 . 1 1 16 16 ALA N N 16 125.630 125.630 130.605 -4.975 19287
2408 1 9 . 1 1 16 16 ALA HA H 16 4.320 4.320 4.470 -0.150 19287
2409 1 9 . 1 1 16 16 ALA C C 16 174.300 174.300 175.257 -0.957 19287
2410 1 9 . 1 1 16 16 ALA CA C 16 50.130 50.130 51.755 -1.625 19287
2411 1 9 . 1 1 16 16 ALA CB C 16 19.180 19.180 22.300 -3.120 19287
2412 1 9 . 1 1 16 16 ALA H H 16 7.800 7.800 7.768 0.032 19287
2413 1 9 . 1 1 17 17 PHE N N 17 116.330 116.330 122.081 -5.751 19287
2414 1 9 . 1 1 17 17 PHE HA H 17 4.390 4.390 4.774 -0.384 19287
2415 1 9 . 1 1 17 17 PHE C C 17 175.310 175.310 173.743 1.567 19287
2416 1 9 . 1 1 17 17 PHE CA C 17 57.160 57.160 55.516 1.645 19287
2417 1 9 . 1 1 17 17 PHE CB C 17 39.380 39.380 40.124 -0.744 19287
2418 1 9 . 1 1 17 17 PHE H H 17 7.330 7.330 8.216 -0.886 19287
2419 1 9 . 1 1 18 18 VAL N N 18 122.890 122.890 124.519 -1.629 19287
2420 1 9 . 1 1 18 18 VAL HA H 18 4.475 4.475 4.463 0.012 19287
2421 1 9 . 1 1 18 18 VAL C C 18 173.590 173.590 173.305 0.285 19287
2422 1 9 . 1 1 18 18 VAL CA C 18 58.900 58.900 58.063 0.837 19287
2423 1 9 . 1 1 18 18 VAL CB C 18 33.900 33.900 34.743 -0.843 19287
2424 1 9 . 1 1 18 18 VAL H H 18 8.680 8.680 8.746 -0.066 19287
2425 1 9 . 1 1 19 19 PRO HA H 19 4.275 4.275 4.666 -0.391 19287
2426 1 9 . 1 1 19 19 PRO C C 19 176.940 176.940 176.292 0.648 19287
2427 1 9 . 1 1 19 19 PRO CA C 19 64.060 64.060 62.586 1.474 19287
2428 1 9 . 1 1 19 19 PRO CB C 19 31.710 31.710 31.352 0.358 19287
2429 1 9 . 1 1 20 20 SER N N 20 120.230 120.230 118.181 2.049 19287
2430 1 9 . 1 1 20 20 SER HA H 20 4.780 4.780 4.712 0.068 19287
2431 1 9 . 1 1 20 20 SER C C 20 170.900 170.900 172.853 -1.953 19287
2432 1 9 . 1 1 20 20 SER CA C 20 57.450 57.450 56.184 1.266 19287
2433 1 9 . 1 1 20 20 SER CB C 20 67.910 67.910 66.019 1.891 19287
2434 1 9 . 1 1 20 20 SER H H 20 8.390 8.390 8.473 -0.083 19287
2435 1 9 . 1 1 21 21 TYR N N 21 118.220 118.220 119.645 -1.425 19287
2436 1 9 . 1 1 21 21 TYR HA H 21 5.600 5.600 4.880 0.720 19287
2437 1 9 . 1 1 21 21 TYR C C 21 173.770 173.770 174.657 -0.887 19287
2438 1 9 . 1 1 21 21 TYR CA C 21 57.740 57.740 57.995 -0.255 19287
2439 1 9 . 1 1 21 21 TYR CB C 21 42.660 42.660 41.796 0.864 19287
2440 1 9 . 1 1 21 21 TYR H H 21 9.020 9.020 8.263 0.757 19287
2441 1 9 . 1 1 22 22 TYR N N 22 119.260 119.260 125.255 -5.995 19287
2442 1 9 . 1 1 22 22 TYR HA H 22 5.110 5.110 4.616 0.494 19287
2443 1 9 . 1 1 22 22 TYR C C 22 172.610 172.610 173.935 -1.325 19287
2444 1 9 . 1 1 22 22 TYR CA C 22 55.380 55.380 56.285 -0.905 19287
2445 1 9 . 1 1 22 22 TYR CB C 22 41.550 41.550 41.710 -0.160 19287
2446 1 9 . 1 1 22 22 TYR H H 22 9.410 9.410 9.621 -0.211 19287
2447 1 9 . 1 1 23 23 TYR N N 23 123.200 123.200 129.124 -5.924 19287
2448 1 9 . 1 1 23 23 TYR HA H 23 4.382 4.382 4.691 -0.309 19287
2449 1 9 . 1 1 23 23 TYR C C 23 173.250 173.250 174.495 -1.245 19287
2450 1 9 . 1 1 23 23 TYR CA C 23 58.360 58.360 57.938 0.422 19287
2451 1 9 . 1 1 23 23 TYR CB C 23 39.570 39.570 39.646 -0.076 19287
2452 1 9 . 1 1 23 23 TYR H H 23 10.190 10.190 9.021 1.169 19287
2453 1 9 . 1 1 24 24 ASN N N 24 126.280 126.280 127.559 -1.279 19287
2454 1 9 . 1 1 24 24 ASN HA H 24 4.550 4.550 4.894 -0.344 19287
2455 1 9 . 1 1 24 24 ASN C C 24 174.000 174.000 175.303 -1.303 19287
2456 1 9 . 1 1 24 24 ASN CA C 24 51.360 51.360 51.964 -0.604 19287
2457 1 9 . 1 1 24 24 ASN CB C 24 40.040 40.040 39.143 0.897 19287
2458 1 9 . 1 1 24 24 ASN H H 24 7.890 7.890 8.593 -0.703 19287
2459 1 9 . 1 1 25 25 GLN N N 25 122.760 122.760 122.315 0.445 19287
2460 1 9 . 1 1 25 25 GLN HA H 25 3.691 3.691 3.621 0.070 19287
2461 1 9 . 1 1 25 25 GLN C C 25 175.670 175.670 177.067 -1.397 19287
2462 1 9 . 1 1 25 25 GLN CA C 25 57.480 57.480 58.326 -0.846 19287
2463 1 9 . 1 1 25 25 GLN CB C 25 28.120 28.120 27.605 0.515 19287
2464 1 9 . 1 1 25 25 GLN H H 25 8.440 8.440 8.051 0.389 19287
2465 1 9 . 1 1 26 26 TYR N N 26 119.190 119.190 119.975 -0.785 19287
2466 1 9 . 1 1 26 26 TYR HA H 26 4.160 4.160 4.214 -0.054 19287
2467 1 9 . 1 1 26 26 TYR C C 26 176.520 176.520 176.984 -0.464 19287
2468 1 9 . 1 1 26 26 TYR CA C 26 60.170 60.170 60.221 -0.051 19287
2469 1 9 . 1 1 26 26 TYR CB C 26 36.880 36.880 37.744 -0.864 19287
2470 1 9 . 1 1 26 26 TYR H H 26 7.810 7.810 7.656 0.154 19287
2471 1 9 . 1 1 27 27 SER N N 27 109.600 109.600 113.032 -3.432 19287
2472 1 9 . 1 1 27 27 SER HA H 27 4.330 4.330 4.485 -0.155 19287
2473 1 9 . 1 1 27 27 SER C C 27 174.830 174.830 173.910 0.920 19287
2474 1 9 . 1 1 27 27 SER CA C 27 57.490 57.490 57.701 -0.211 19287
2475 1 9 . 1 1 27 27 SER CB C 27 64.640 64.640 63.874 0.766 19287
2476 1 9 . 1 1 27 27 SER H H 27 7.350 7.350 7.836 -0.486 19287
2477 1 9 . 1 1 28 28 ASN N N 28 119.830 119.830 119.194 0.636 19287
2478 1 9 . 1 1 28 28 ASN HA H 28 4.060 4.060 4.278 -0.218 19287
2479 1 9 . 1 1 28 28 ASN C C 28 173.040 173.040 173.831 -0.791 19287
2480 1 9 . 1 1 28 28 ASN CA C 28 53.830 53.830 54.505 -0.675 19287
2481 1 9 . 1 1 28 28 ASN CB C 28 37.400 37.400 37.882 -0.482 19287
2482 1 9 . 1 1 28 28 ASN H H 28 7.930 7.930 7.957 -0.027 19287
2483 1 9 . 1 1 29 29 THR N N 29 103.070 103.070 112.216 -9.146 19287
2484 1 9 . 1 1 29 29 THR HA H 29 4.441 4.441 4.678 -0.237 19287
2485 1 9 . 1 1 29 29 THR C C 29 172.980 172.980 171.935 1.045 19287
2486 1 9 . 1 1 29 29 THR CA C 29 58.920 58.920 61.618 -2.698 19287
2487 1 9 . 1 1 29 29 THR CB C 29 73.260 73.260 70.745 2.515 19287
2488 1 9 . 1 1 29 29 THR H H 29 6.990 6.990 7.635 -0.645 19287
2489 1 9 . 1 1 30 30 CYS N N 30 118.340 118.340 118.883 -0.543 19287
2490 1 9 . 1 1 30 30 CYS HA H 30 5.462 5.462 5.447 0.015 19287
2491 1 9 . 1 1 30 30 CYS C C 30 173.320 173.320 173.550 -0.230 19287
2492 1 9 . 1 1 30 30 CYS CA C 30 57.750 57.750 57.580 0.171 19287
2493 1 9 . 1 1 30 30 CYS CB C 30 50.680 50.680 31.638 19.042 19287
2494 1 9 . 1 1 30 30 CYS H H 30 8.954 8.954 8.632 0.322 19287
2495 1 9 . 1 1 31 31 HIS N N 31 118.930 118.930 120.363 -1.433 19287
2496 1 9 . 1 1 31 31 HIS HA H 31 4.780 4.780 5.068 -0.288 19287
2497 1 9 . 1 1 31 31 HIS C C 31 172.790 172.790 173.832 -1.042 19287
2498 1 9 . 1 1 31 31 HIS CA C 31 53.530 53.530 55.601 -2.071 19287
2499 1 9 . 1 1 31 31 HIS CB C 31 33.040 33.040 32.936 0.104 19287
2500 1 9 . 1 1 31 31 HIS H H 31 9.010 9.010 9.553 -0.543 19287
2501 1 9 . 1 1 32 32 SER N N 32 117.600 117.600 120.817 -3.217 19287
2502 1 9 . 1 1 32 32 SER HA H 32 4.700 4.700 4.368 0.332 19287
2503 1 9 . 1 1 32 32 SER C C 32 174.930 174.930 173.893 1.037 19287
2504 1 9 . 1 1 32 32 SER CA C 32 57.980 57.980 60.006 -2.026 19287
2505 1 9 . 1 1 32 32 SER CB C 32 64.440 64.440 63.297 1.143 19287
2506 1 9 . 1 1 32 32 SER H H 32 8.740 8.740 8.281 0.459 19287
2507 1 9 . 1 1 33 33 PHE N N 33 120.690 120.690 121.446 -0.756 19287
2508 1 9 . 1 1 33 33 PHE HA H 33 4.790 4.790 5.040 -0.250 19287
2509 1 9 . 1 1 33 33 PHE C C 33 171.810 171.810 173.551 -1.741 19287
2510 1 9 . 1 1 33 33 PHE CA C 33 56.200 56.200 56.078 0.122 19287
2511 1 9 . 1 1 33 33 PHE CB C 33 40.230 40.230 41.504 -1.274 19287
2512 1 9 . 1 1 33 33 PHE H H 33 8.830 8.830 9.089 -0.259 19287
2513 1 9 . 1 1 34 34 THR N N 34 116.650 116.650 111.724 4.926 19287
2514 1 9 . 1 1 34 34 THR HA H 34 3.965 3.965 4.201 -0.236 19287
2515 1 9 . 1 1 34 34 THR C C 34 172.600 172.600 172.486 0.114 19287
2516 1 9 . 1 1 34 34 THR CA C 34 61.980 61.980 60.815 1.165 19287
2517 1 9 . 1 1 34 34 THR CB C 34 68.530 68.530 69.739 -1.209 19287
2518 1 9 . 1 1 34 34 THR H H 34 8.400 8.400 8.173 0.227 19287
2519 1 9 . 1 1 35 35 TYR N N 35 127.790 127.790 125.333 2.457 19287
2520 1 9 . 1 1 35 35 TYR HA H 35 4.500 4.500 4.668 -0.168 19287
2521 1 9 . 1 1 35 35 TYR C C 35 174.200 174.200 174.187 0.013 19287
2522 1 9 . 1 1 35 35 TYR CA C 35 55.130 55.130 56.925 -1.795 19287
2523 1 9 . 1 1 35 35 TYR CB C 35 39.650 39.650 42.459 -2.809 19287
2524 1 9 . 1 1 35 35 TYR H H 35 8.010 8.010 8.342 -0.332 19287
2525 1 9 . 1 1 39 39 GLY N N 39 103.730 103.730 108.641 -4.911 19287
2526 1 9 . 1 1 39 39 GLY C C 39 175.700 175.700 172.600 3.100 19287
2527 1 9 . 1 1 39 39 GLY CA C 39 45.370 45.370 44.190 1.180 19287
2528 1 9 . 1 1 39 39 GLY H H 39 8.500 8.500 7.478 1.022 19287
2529 1 9 . 1 1 40 40 GLY N N 40 110.170 110.170 108.602 1.568 19287
2530 1 9 . 1 1 40 40 GLY C C 40 173.140 173.140 172.543 0.597 19287
2531 1 9 . 1 1 40 40 GLY CA C 40 44.320 44.320 44.496 -0.176 19287
2532 1 9 . 1 1 40 40 GLY H H 40 8.670 8.670 7.736 0.934 19287
2533 1 9 . 1 1 41 41 ASN N N 41 116.960 116.960 117.823 -0.863 19287
2534 1 9 . 1 1 41 41 ASN HA H 41 4.560 4.560 4.996 -0.436 19287
2535 1 9 . 1 1 41 41 ASN C C 41 173.670 173.670 175.988 -2.318 19287
2536 1 9 . 1 1 41 41 ASN CA C 41 51.850 51.850 52.127 -0.278 19287
2537 1 9 . 1 1 41 41 ASN CB C 41 40.230 40.230 39.765 0.465 19287
2538 1 9 . 1 1 41 41 ASN H H 41 8.790 8.790 8.797 -0.007 19287
2539 1 9 . 1 1 42 42 ALA N N 42 113.290 113.290 122.358 -9.068 19287
2540 1 9 . 1 1 42 42 ALA HA H 42 3.720 3.720 4.076 -0.356 19287
2541 1 9 . 1 1 42 42 ALA C C 42 177.220 177.220 178.264 -1.044 19287
2542 1 9 . 1 1 42 42 ALA CA C 42 52.810 52.810 54.645 -1.835 19287
2543 1 9 . 1 1 42 42 ALA CB C 42 17.980 17.980 18.389 -0.409 19287
2544 1 9 . 1 1 42 42 ALA H H 42 7.590 7.590 8.635 -1.045 19287
2545 1 9 . 1 1 43 43 ASN N N 43 117.710 117.710 115.383 2.327 19287
2546 1 9 . 1 1 43 43 ASN HA H 43 4.700 4.700 4.704 -0.004 19287
2547 1 9 . 1 1 43 43 ASN C C 43 173.660 173.660 175.291 -1.631 19287
2548 1 9 . 1 1 43 43 ASN CA C 43 50.630 50.630 53.705 -3.075 19287
2549 1 9 . 1 1 43 43 ASN CB C 43 34.840 34.840 37.959 -3.119 19287
2550 1 9 . 1 1 43 43 ASN H H 43 7.900 7.900 8.174 -0.274 19287
2551 1 9 . 1 1 44 44 ARG N N 44 120.690 120.690 120.087 0.603 19287
2552 1 9 . 1 1 44 44 ARG HA H 44 4.692 4.692 4.158 0.534 19287
2553 1 9 . 1 1 44 44 ARG C C 44 173.530 173.530 175.069 -1.539 19287
2554 1 9 . 1 1 44 44 ARG CA C 44 56.660 56.660 57.036 -0.376 19287
2555 1 9 . 1 1 44 44 ARG CB C 44 31.450 31.450 30.056 1.394 19287
2556 1 9 . 1 1 44 44 ARG H H 44 6.860 6.860 7.292 -0.432 19287
2557 1 9 . 1 1 45 45 PHE N N 45 123.690 123.690 122.452 1.238 19287
2558 1 9 . 1 1 45 45 PHE HA H 45 4.810 4.810 4.861 -0.051 19287
2559 1 9 . 1 1 45 45 PHE C C 45 175.420 175.420 174.165 1.255 19287
2560 1 9 . 1 1 45 45 PHE CA C 45 55.670 55.670 56.972 -1.302 19287
2561 1 9 . 1 1 45 45 PHE CB C 45 43.790 43.790 43.181 0.609 19287
2562 1 9 . 1 1 45 45 PHE H H 45 9.340 9.340 8.049 1.291 19287
2563 1 9 . 1 1 46 46 ARG N N 46 120.920 120.920 117.437 3.483 19287
2564 1 9 . 1 1 46 46 ARG HA H 46 4.397 4.397 4.627 -0.230 19287
2565 1 9 . 1 1 46 46 ARG C C 46 176.560 176.560 175.207 1.353 19287
2566 1 9 . 1 1 46 46 ARG CA C 46 58.210 58.210 55.453 2.757 19287
2567 1 9 . 1 1 46 46 ARG CB C 46 30.900 30.900 31.156 -0.256 19287
2568 1 9 . 1 1 46 46 ARG H H 46 9.080 9.080 8.665 0.415 19287
2569 1 9 . 1 1 47 47 THR N N 47 102.800 102.800 112.677 -9.877 19287
2570 1 9 . 1 1 47 47 THR HA H 47 4.660 4.660 4.005 0.655 19287
2571 1 9 . 1 1 47 47 THR C C 47 174.110 174.110 173.449 0.661 19287
2572 1 9 . 1 1 47 47 THR CA C 47 58.170 58.170 59.648 -1.478 19287
2573 1 9 . 1 1 47 47 THR CB C 47 72.380 72.380 70.301 2.079 19287
2574 1 9 . 1 1 47 47 THR H H 47 7.230 7.230 7.320 -0.090 19287
2575 1 9 . 1 1 48 48 ILE N N 48 123.200 123.200 125.544 -2.344 19287
2576 1 9 . 1 1 48 48 ILE HA H 48 2.901 2.901 3.417 -0.516 19287
2577 1 9 . 1 1 48 48 ILE C C 48 176.420 176.420 175.908 0.512 19287
2578 1 9 . 1 1 48 48 ILE CA C 48 64.000 64.000 63.363 0.637 19287
2579 1 9 . 1 1 48 48 ILE CB C 48 37.060 37.060 38.078 -1.018 19287
2580 1 9 . 1 1 48 48 ILE H H 48 8.110 8.110 7.922 0.188 19287
2581 1 9 . 1 1 49 49 ASP N N 49 119.560 119.560 119.426 0.134 19287
2582 1 9 . 1 1 49 49 ASP HA H 49 4.130 4.130 4.284 -0.154 19287
2583 1 9 . 1 1 49 49 ASP C C 49 177.740 177.740 178.708 -0.968 19287
2584 1 9 . 1 1 49 49 ASP CA C 49 56.690 56.690 57.411 -0.721 19287
2585 1 9 . 1 1 49 49 ASP CB C 49 39.970 39.970 39.997 -0.027 19287
2586 1 9 . 1 1 49 49 ASP H H 49 7.700 7.700 7.694 0.006 19287
2587 1 9 . 1 1 50 50 GLU N N 50 117.720 117.720 119.839 -2.119 19287
2588 1 9 . 1 1 50 50 GLU HA H 50 3.710 3.710 4.285 -0.575 19287
2589 1 9 . 1 1 50 50 GLU C C 50 177.550 177.550 178.468 -0.918 19287
2590 1 9 . 1 1 50 50 GLU CA C 50 58.550 58.550 58.353 0.197 19287
2591 1 9 . 1 1 50 50 GLU CB C 50 29.190 29.190 29.797 -0.607 19287
2592 1 9 . 1 1 50 50 GLU H H 50 7.410 7.410 7.669 -0.259 19287
2593 1 9 . 1 1 51 51 CYS N N 51 120.260 120.260 119.936 0.324 19287
2594 1 9 . 1 1 51 51 CYS HA H 51 1.650 1.650 3.066 -1.416 19287
2595 1 9 . 1 1 51 51 CYS C C 51 175.070 175.070 176.187 -1.117 19287
2596 1 9 . 1 1 51 51 CYS CA C 51 59.120 59.120 61.162 -2.042 19287
2597 1 9 . 1 1 51 51 CYS CB C 51 43.000 43.000 25.880 17.120 19287
2598 1 9 . 1 1 51 51 CYS H H 51 6.760 6.760 7.734 -0.974 19287
2599 1 9 . 1 1 52 52 ASN N N 52 120.160 120.160 119.754 0.406 19287
2600 1 9 . 1 1 52 52 ASN HA H 52 4.090 4.090 4.372 -0.282 19287
2601 1 9 . 1 1 52 52 ASN C C 52 177.820 177.820 177.600 0.220 19287
2602 1 9 . 1 1 52 52 ASN CA C 52 55.060 55.060 56.232 -1.172 19287
2603 1 9 . 1 1 52 52 ASN CB C 52 37.500 37.500 38.194 -0.694 19287
2604 1 9 . 1 1 52 52 ASN H H 52 8.650 8.650 8.638 0.012 19287
2605 1 9 . 1 1 53 53 ARG N N 53 117.000 117.000 118.226 -1.226 19287
2606 1 9 . 1 1 53 53 ARG HA H 53 3.770 3.770 4.051 -0.281 19287
2607 1 9 . 1 1 53 53 ARG C C 53 177.360 177.360 177.581 -0.221 19287
2608 1 9 . 1 1 53 53 ARG CA C 53 58.490 58.490 58.701 -0.211 19287
2609 1 9 . 1 1 53 53 ARG CB C 53 30.180 30.180 29.345 0.835 19287
2610 1 9 . 1 1 53 53 ARG H H 53 7.900 7.900 7.517 0.383 19287
2611 1 9 . 1 1 54 54 THR N N 54 112.080 112.080 112.071 0.009 19287
2612 1 9 . 1 1 54 54 THR HA H 54 3.838 3.838 4.496 -0.658 19287
2613 1 9 . 1 1 54 54 THR C C 54 174.990 174.990 175.090 -0.100 19287
2614 1 9 . 1 1 54 54 THR CA C 54 65.740 65.740 64.188 1.552 19287
2615 1 9 . 1 1 54 54 THR CB C 54 68.870 68.870 70.453 -1.583 19287
2616 1 9 . 1 1 54 54 THR H H 54 7.260 7.260 7.533 -0.273 19287
2617 1 9 . 1 1 55 55 CYS N N 55 112.540 112.540 118.093 -5.553 19287
2618 1 9 . 1 1 55 55 CYS HA H 55 4.400 4.400 4.564 -0.164 19287
2619 1 9 . 1 1 55 55 CYS C C 55 172.940 172.940 174.309 -1.369 19287
2620 1 9 . 1 1 55 55 CYS CA C 55 54.230 54.230 58.487 -4.257 19287
2621 1 9 . 1 1 55 55 CYS CB C 55 42.930 42.930 29.223 13.707 19287
2622 1 9 . 1 1 55 55 CYS H H 55 7.590 7.590 8.212 -0.622 19287
2623 1 9 . 1 1 56 56 VAL N N 56 119.720 119.720 123.051 -3.331 19287
2624 1 9 . 1 1 56 56 VAL HA H 56 3.631 3.631 4.213 -0.582 19287
2625 1 9 . 1 1 56 56 VAL C C 56 176.710 176.710 176.094 0.616 19287
2626 1 9 . 1 1 56 56 VAL CA C 56 64.540 64.540 62.017 2.523 19287
2627 1 9 . 1 1 56 56 VAL CB C 56 30.970 30.970 29.995 0.975 19287
2628 1 9 . 1 1 56 56 VAL H H 56 7.280 7.280 8.049 -0.769 19287
2629 1 10 . 1 1 2 2 PRO HA H 2 4.017 4.017 4.396 -0.379 19287
2630 1 10 . 1 1 2 2 PRO C C 2 177.920 177.920 177.505 0.415 19287
2631 1 10 . 1 1 2 2 PRO CA C 2 62.800 62.800 62.349 0.452 19287
2632 1 10 . 1 1 2 2 PRO CB C 2 32.050 32.050 32.725 -0.675 19287
2633 1 10 . 1 1 3 3 ARG N N 3 122.340 122.340 121.440 0.900 19287
2634 1 10 . 1 1 3 3 ARG HA H 3 3.786 3.786 4.265 -0.479 19287
2635 1 10 . 1 1 3 3 ARG C C 3 178.950 178.950 177.881 1.069 19287
2636 1 10 . 1 1 3 3 ARG CA C 3 58.410 58.410 57.726 0.684 19287
2637 1 10 . 1 1 3 3 ARG CB C 3 29.220 29.220 29.502 -0.282 19287
2638 1 10 . 1 1 3 3 ARG H H 3 8.550 8.550 8.786 -0.236 19287
2639 1 10 . 1 1 4 4 PHE N N 4 113.010 113.010 117.498 -4.488 19287
2640 1 10 . 1 1 4 4 PHE HA H 4 4.300 4.300 4.640 -0.340 19287
2641 1 10 . 1 1 4 4 PHE C C 4 176.070 176.070 176.502 -0.432 19287
2642 1 10 . 1 1 4 4 PHE CA C 4 58.220 58.220 58.210 0.010 19287
2643 1 10 . 1 1 4 4 PHE CB C 4 37.310 37.310 38.152 -0.842 19287
2644 1 10 . 1 1 4 4 PHE H H 4 7.150 7.150 7.730 -0.580 19287
2645 1 10 . 1 1 5 5 CYS N N 5 118.600 118.600 117.167 1.433 19287
2646 1 10 . 1 1 5 5 CYS HA H 5 4.130 4.130 4.061 0.069 19287
2647 1 10 . 1 1 5 5 CYS C C 5 173.450 173.450 174.750 -1.300 19287
2648 1 10 . 1 1 5 5 CYS CA C 5 57.960 57.960 60.451 -2.491 19287
2649 1 10 . 1 1 5 5 CYS CB C 5 39.210 39.210 25.419 13.791 19287
2650 1 10 . 1 1 5 5 CYS H H 5 7.090 7.090 7.291 -0.201 19287
2651 1 10 . 1 1 6 6 GLU N N 6 110.710 110.710 118.076 -7.366 19287
2652 1 10 . 1 1 6 6 GLU HA H 6 4.182 4.182 4.339 -0.157 19287
2653 1 10 . 1 1 6 6 GLU C C 6 176.310 176.310 176.215 0.095 19287
2654 1 10 . 1 1 6 6 GLU CA C 6 55.510 55.510 55.378 0.132 19287
2655 1 10 . 1 1 6 6 GLU CB C 6 28.160 28.160 29.431 -1.271 19287
2656 1 10 . 1 1 6 6 GLU H H 6 7.300 7.300 7.547 -0.247 19287
2657 1 10 . 1 1 7 7 LEU N N 7 119.090 119.090 121.318 -2.228 19287
2658 1 10 . 1 1 7 7 LEU HA H 7 4.160 4.160 4.246 -0.086 19287
2659 1 10 . 1 1 7 7 LEU C C 7 176.630 176.630 175.900 0.730 19287
2660 1 10 . 1 1 7 7 LEU CA C 7 54.510 54.510 54.484 0.025 19287
2661 1 10 . 1 1 7 7 LEU CB C 7 42.330 42.330 42.656 -0.326 19287
2662 1 10 . 1 1 7 7 LEU H H 7 7.210 7.210 7.150 0.060 19287
2663 1 10 . 1 1 8 8 ALA N N 8 124.490 124.490 121.308 3.182 19287
2664 1 10 . 1 1 8 8 ALA HA H 8 4.250 4.250 4.659 -0.409 19287
2665 1 10 . 1 1 8 8 ALA C C 8 174.710 174.710 175.512 -0.802 19287
2666 1 10 . 1 1 8 8 ALA CA C 8 50.210 50.210 48.899 1.311 19287
2667 1 10 . 1 1 8 8 ALA CB C 8 16.930 16.930 19.232 -2.302 19287
2668 1 10 . 1 1 8 8 ALA H H 8 8.280 8.280 8.228 0.052 19287
2669 1 10 . 1 1 9 9 PRO HA H 9 4.180 4.180 4.736 -0.556 19287
2670 1 10 . 1 1 9 9 PRO C C 9 176.700 176.700 176.678 0.022 19287
2671 1 10 . 1 1 9 9 PRO CA C 9 61.490 61.490 62.706 -1.216 19287
2672 1 10 . 1 1 9 9 PRO CB C 9 30.360 30.360 31.701 -1.341 19287
2673 1 10 . 1 1 10 10 SER N N 10 112.100 112.100 122.540 -10.440 19287
2674 1 10 . 1 1 10 10 SER HA H 10 4.630 4.630 4.383 0.247 19287
2675 1 10 . 1 1 10 10 SER C C 10 174.190 174.190 175.117 -0.927 19287
2676 1 10 . 1 1 10 10 SER CA C 10 55.360 55.360 58.782 -3.422 19287
2677 1 10 . 1 1 10 10 SER CB C 10 64.550 64.550 61.240 3.310 19287
2678 1 10 . 1 1 10 10 SER H H 10 7.450 7.450 8.368 -0.918 19287
2679 1 10 . 1 1 11 11 ALA N N 11 129.980 129.980 125.706 4.274 19287
2680 1 10 . 1 1 11 11 ALA HA H 11 4.496 4.496 4.121 0.375 19287
2681 1 10 . 1 1 11 11 ALA C C 11 178.510 178.510 179.042 -0.532 19287
2682 1 10 . 1 1 11 11 ALA CA C 11 54.810 54.810 53.765 1.045 19287
2683 1 10 . 1 1 11 11 ALA CB C 11 19.910 19.910 18.961 0.949 19287
2684 1 10 . 1 1 11 11 ALA H H 11 9.210 9.210 8.591 0.619 19287
2685 1 10 . 1 1 12 12 GLY N N 12 104.410 104.410 104.998 -0.588 19287
2686 1 10 . 1 1 12 12 GLY C C 12 174.850 174.850 175.549 -0.699 19287
2687 1 10 . 1 1 12 12 GLY CA C 12 44.450 44.450 45.039 -0.589 19287
2688 1 10 . 1 1 12 12 GLY H H 12 8.190 8.190 8.071 0.119 19287
2689 1 10 . 1 1 14 14 CYS HA H 14 4.250 4.250 4.533 -0.283 19287
2690 1 10 . 1 1 14 14 CYS C C 14 172.410 172.410 173.791 -1.381 19287
2691 1 10 . 1 1 14 14 CYS CA C 14 59.750 59.750 59.556 0.194 19287
2692 1 10 . 1 1 14 14 CYS CB C 14 39.130 39.130 28.140 10.990 19287
2693 1 10 . 1 1 15 15 PHE N N 15 116.000 116.000 124.753 -8.753 19287
2694 1 10 . 1 1 15 15 PHE HA H 15 4.380 4.380 4.401 -0.021 19287
2695 1 10 . 1 1 15 15 PHE C C 15 174.300 174.300 174.820 -0.520 19287
2696 1 10 . 1 1 15 15 PHE CA C 15 56.830 56.830 57.769 -0.939 19287
2697 1 10 . 1 1 15 15 PHE CB C 15 39.440 39.440 39.200 0.240 19287
2698 1 10 . 1 1 15 15 PHE H H 15 7.960 7.960 8.688 -0.728 19287
2699 1 10 . 1 1 16 16 ALA N N 16 125.630 125.630 130.224 -4.594 19287
2700 1 10 . 1 1 16 16 ALA HA H 16 4.320 4.320 4.663 -0.343 19287
2701 1 10 . 1 1 16 16 ALA C C 16 174.300 174.300 175.519 -1.219 19287
2702 1 10 . 1 1 16 16 ALA CA C 16 50.130 50.130 51.474 -1.344 19287
2703 1 10 . 1 1 16 16 ALA CB C 16 19.180 19.180 21.519 -2.339 19287
2704 1 10 . 1 1 16 16 ALA H H 16 7.800 7.800 7.711 0.089 19287
2705 1 10 . 1 1 17 17 PHE N N 17 116.330 116.330 122.209 -5.879 19287
2706 1 10 . 1 1 17 17 PHE HA H 17 4.390 4.390 4.742 -0.352 19287
2707 1 10 . 1 1 17 17 PHE C C 17 175.310 175.310 174.070 1.240 19287
2708 1 10 . 1 1 17 17 PHE CA C 17 57.160 57.160 55.293 1.867 19287
2709 1 10 . 1 1 17 17 PHE CB C 17 39.380 39.380 41.006 -1.626 19287
2710 1 10 . 1 1 17 17 PHE H H 17 7.330 7.330 8.416 -1.086 19287
2711 1 10 . 1 1 18 18 VAL N N 18 122.890 122.890 124.639 -1.749 19287
2712 1 10 . 1 1 18 18 VAL HA H 18 4.475 4.475 4.649 -0.174 19287
2713 1 10 . 1 1 18 18 VAL C C 18 173.590 173.590 173.441 0.149 19287
2714 1 10 . 1 1 18 18 VAL CA C 18 58.900 58.900 58.591 0.309 19287
2715 1 10 . 1 1 18 18 VAL CB C 18 33.900 33.900 34.174 -0.274 19287
2716 1 10 . 1 1 18 18 VAL H H 18 8.680 8.680 8.583 0.097 19287
2717 1 10 . 1 1 19 19 PRO HA H 19 4.275 4.275 4.649 -0.374 19287
2718 1 10 . 1 1 19 19 PRO C C 19 176.940 176.940 176.585 0.355 19287
2719 1 10 . 1 1 19 19 PRO CA C 19 64.060 64.060 62.448 1.612 19287
2720 1 10 . 1 1 19 19 PRO CB C 19 31.710 31.710 31.818 -0.108 19287
2721 1 10 . 1 1 20 20 SER N N 20 120.230 120.230 118.787 1.443 19287
2722 1 10 . 1 1 20 20 SER HA H 20 4.780 4.780 4.725 0.055 19287
2723 1 10 . 1 1 20 20 SER C C 20 170.900 170.900 172.957 -2.057 19287
2724 1 10 . 1 1 20 20 SER CA C 20 57.450 57.450 57.118 0.332 19287
2725 1 10 . 1 1 20 20 SER CB C 20 67.910 67.910 66.594 1.316 19287
2726 1 10 . 1 1 20 20 SER H H 20 8.390 8.390 7.916 0.474 19287
2727 1 10 . 1 1 21 21 TYR N N 21 118.220 118.220 118.926 -0.706 19287
2728 1 10 . 1 1 21 21 TYR HA H 21 5.600 5.600 5.096 0.504 19287
2729 1 10 . 1 1 21 21 TYR C C 21 173.770 173.770 175.191 -1.421 19287
2730 1 10 . 1 1 21 21 TYR CA C 21 57.740 57.740 58.243 -0.503 19287
2731 1 10 . 1 1 21 21 TYR CB C 21 42.660 42.660 42.159 0.501 19287
2732 1 10 . 1 1 21 21 TYR H H 21 9.020 9.020 8.940 0.080 19287
2733 1 10 . 1 1 22 22 TYR N N 22 119.260 119.260 125.444 -6.184 19287
2734 1 10 . 1 1 22 22 TYR HA H 22 5.110 5.110 4.680 0.430 19287
2735 1 10 . 1 1 22 22 TYR C C 22 172.610 172.610 173.898 -1.288 19287
2736 1 10 . 1 1 22 22 TYR CA C 22 55.380 55.380 56.099 -0.719 19287
2737 1 10 . 1 1 22 22 TYR CB C 22 41.550 41.550 41.474 0.076 19287
2738 1 10 . 1 1 22 22 TYR H H 22 9.410 9.410 9.633 -0.223 19287
2739 1 10 . 1 1 23 23 TYR N N 23 123.200 123.200 130.053 -6.853 19287
2740 1 10 . 1 1 23 23 TYR HA H 23 4.382 4.382 4.865 -0.483 19287
2741 1 10 . 1 1 23 23 TYR C C 23 173.250 173.250 174.431 -1.181 19287
2742 1 10 . 1 1 23 23 TYR CA C 23 58.360 58.360 58.117 0.243 19287
2743 1 10 . 1 1 23 23 TYR CB C 23 39.570 39.570 39.580 -0.010 19287
2744 1 10 . 1 1 23 23 TYR H H 23 10.190 10.190 9.185 1.005 19287
2745 1 10 . 1 1 24 24 ASN N N 24 126.280 126.280 127.842 -1.562 19287
2746 1 10 . 1 1 24 24 ASN HA H 24 4.550 4.550 4.913 -0.363 19287
2747 1 10 . 1 1 24 24 ASN C C 24 174.000 174.000 175.199 -1.199 19287
2748 1 10 . 1 1 24 24 ASN CA C 24 51.360 51.360 52.014 -0.654 19287
2749 1 10 . 1 1 24 24 ASN CB C 24 40.040 40.040 39.349 0.691 19287
2750 1 10 . 1 1 24 24 ASN H H 24 7.890 7.890 8.435 -0.545 19287
2751 1 10 . 1 1 25 25 GLN N N 25 122.760 122.760 123.135 -0.375 19287
2752 1 10 . 1 1 25 25 GLN HA H 25 3.691 3.691 3.648 0.043 19287
2753 1 10 . 1 1 25 25 GLN C C 25 175.670 175.670 176.894 -1.224 19287
2754 1 10 . 1 1 25 25 GLN CA C 25 57.480 57.480 58.468 -0.988 19287
2755 1 10 . 1 1 25 25 GLN CB C 25 28.120 28.120 27.872 0.249 19287
2756 1 10 . 1 1 25 25 GLN H H 25 8.440 8.440 8.239 0.201 19287
2757 1 10 . 1 1 26 26 TYR N N 26 119.190 119.190 119.357 -0.167 19287
2758 1 10 . 1 1 26 26 TYR HA H 26 4.160 4.160 4.334 -0.174 19287
2759 1 10 . 1 1 26 26 TYR C C 26 176.520 176.520 176.647 -0.127 19287
2760 1 10 . 1 1 26 26 TYR CA C 26 60.170 60.170 59.434 0.736 19287
2761 1 10 . 1 1 26 26 TYR CB C 26 36.880 36.880 37.848 -0.968 19287
2762 1 10 . 1 1 26 26 TYR H H 26 7.810 7.810 7.716 0.094 19287
2763 1 10 . 1 1 27 27 SER N N 27 109.600 109.600 112.203 -2.603 19287
2764 1 10 . 1 1 27 27 SER HA H 27 4.330 4.330 4.534 -0.204 19287
2765 1 10 . 1 1 27 27 SER C C 27 174.830 174.830 173.896 0.934 19287
2766 1 10 . 1 1 27 27 SER CA C 27 57.490 57.490 57.431 0.059 19287
2767 1 10 . 1 1 27 27 SER CB C 27 64.640 64.640 63.960 0.680 19287
2768 1 10 . 1 1 27 27 SER H H 27 7.350 7.350 7.433 -0.083 19287
2769 1 10 . 1 1 28 28 ASN N N 28 119.830 119.830 119.554 0.276 19287
2770 1 10 . 1 1 28 28 ASN HA H 28 4.060 4.060 4.340 -0.280 19287
2771 1 10 . 1 1 28 28 ASN C C 28 173.040 173.040 174.503 -1.463 19287
2772 1 10 . 1 1 28 28 ASN CA C 28 53.830 53.830 54.639 -0.808 19287
2773 1 10 . 1 1 28 28 ASN CB C 28 37.400 37.400 38.070 -0.670 19287
2774 1 10 . 1 1 28 28 ASN H H 28 7.930 7.930 7.896 0.034 19287
2775 1 10 . 1 1 29 29 THR N N 29 103.070 103.070 110.315 -7.245 19287
2776 1 10 . 1 1 29 29 THR HA H 29 4.441 4.441 4.682 -0.241 19287
2777 1 10 . 1 1 29 29 THR C C 29 172.980 172.980 171.984 0.996 19287
2778 1 10 . 1 1 29 29 THR CA C 29 58.920 58.920 61.061 -2.141 19287
2779 1 10 . 1 1 29 29 THR CB C 29 73.260 73.260 70.786 2.474 19287
2780 1 10 . 1 1 29 29 THR H H 29 6.990 6.990 7.818 -0.828 19287
2781 1 10 . 1 1 30 30 CYS N N 30 118.340 118.340 120.354 -2.014 19287
2782 1 10 . 1 1 30 30 CYS HA H 30 5.462 5.462 5.474 -0.012 19287
2783 1 10 . 1 1 30 30 CYS C C 30 173.320 173.320 173.343 -0.023 19287
2784 1 10 . 1 1 30 30 CYS CA C 30 57.750 57.750 57.580 0.170 19287
2785 1 10 . 1 1 30 30 CYS CB C 30 50.680 50.680 31.032 19.648 19287
2786 1 10 . 1 1 30 30 CYS H H 30 8.954 8.954 8.626 0.328 19287
2787 1 10 . 1 1 31 31 HIS N N 31 118.930 118.930 121.912 -2.982 19287
2788 1 10 . 1 1 31 31 HIS HA H 31 4.780 4.780 5.056 -0.276 19287
2789 1 10 . 1 1 31 31 HIS C C 31 172.790 172.790 173.569 -0.779 19287
2790 1 10 . 1 1 31 31 HIS CA C 31 53.530 53.530 55.574 -2.044 19287
2791 1 10 . 1 1 31 31 HIS CB C 31 33.040 33.040 32.956 0.084 19287
2792 1 10 . 1 1 31 31 HIS H H 31 9.010 9.010 9.626 -0.616 19287
2793 1 10 . 1 1 32 32 SER N N 32 117.600 117.600 120.997 -3.397 19287
2794 1 10 . 1 1 32 32 SER HA H 32 4.700 4.700 4.213 0.487 19287
2795 1 10 . 1 1 32 32 SER C C 32 174.930 174.930 173.756 1.174 19287
2796 1 10 . 1 1 32 32 SER CA C 32 57.980 57.980 59.060 -1.080 19287
2797 1 10 . 1 1 32 32 SER CB C 32 64.440 64.440 63.369 1.071 19287
2798 1 10 . 1 1 32 32 SER H H 32 8.740 8.740 8.276 0.464 19287
2799 1 10 . 1 1 33 33 PHE N N 33 120.690 120.690 120.308 0.382 19287
2800 1 10 . 1 1 33 33 PHE HA H 33 4.790 4.790 4.987 -0.197 19287
2801 1 10 . 1 1 33 33 PHE C C 33 171.810 171.810 173.745 -1.935 19287
2802 1 10 . 1 1 33 33 PHE CA C 33 56.200 56.200 55.797 0.403 19287
2803 1 10 . 1 1 33 33 PHE CB C 33 40.230 40.230 40.992 -0.762 19287
2804 1 10 . 1 1 33 33 PHE H H 33 8.830 8.830 9.026 -0.196 19287
2805 1 10 . 1 1 34 34 THR N N 34 116.650 116.650 112.138 4.512 19287
2806 1 10 . 1 1 34 34 THR HA H 34 3.965 3.965 4.260 -0.295 19287
2807 1 10 . 1 1 34 34 THR C C 34 172.600 172.600 172.467 0.133 19287
2808 1 10 . 1 1 34 34 THR CA C 34 61.980 61.980 61.153 0.827 19287
2809 1 10 . 1 1 34 34 THR CB C 34 68.530 68.530 69.709 -1.179 19287
2810 1 10 . 1 1 34 34 THR H H 34 8.400 8.400 8.139 0.261 19287
2811 1 10 . 1 1 35 35 TYR N N 35 127.790 127.790 124.953 2.837 19287
2812 1 10 . 1 1 35 35 TYR HA H 35 4.500 4.500 4.614 -0.114 19287
2813 1 10 . 1 1 35 35 TYR C C 35 174.200 174.200 174.031 0.169 19287
2814 1 10 . 1 1 35 35 TYR CA C 35 55.130 55.130 56.622 -1.492 19287
2815 1 10 . 1 1 35 35 TYR CB C 35 39.650 39.650 42.057 -2.407 19287
2816 1 10 . 1 1 35 35 TYR H H 35 8.010 8.010 8.403 -0.393 19287
2817 1 10 . 1 1 39 39 GLY N N 39 103.730 103.730 109.061 -5.331 19287
2818 1 10 . 1 1 39 39 GLY C C 39 175.700 175.700 175.093 0.607 19287
2819 1 10 . 1 1 39 39 GLY CA C 39 45.370 45.370 45.289 0.081 19287
2820 1 10 . 1 1 39 39 GLY H H 39 8.500 8.500 8.630 -0.130 19287
2821 1 10 . 1 1 40 40 GLY N N 40 110.170 110.170 111.122 -0.952 19287
2822 1 10 . 1 1 40 40 GLY C C 40 173.140 173.140 174.604 -1.464 19287
2823 1 10 . 1 1 40 40 GLY CA C 40 44.320 44.320 44.813 -0.493 19287
2824 1 10 . 1 1 40 40 GLY H H 40 8.670 8.670 7.670 1.000 19287
2825 1 10 . 1 1 41 41 ASN N N 41 116.960 116.960 120.489 -3.529 19287
2826 1 10 . 1 1 41 41 ASN HA H 41 4.560 4.560 4.757 -0.197 19287
2827 1 10 . 1 1 41 41 ASN C C 41 173.670 173.670 176.501 -2.831 19287
2828 1 10 . 1 1 41 41 ASN CA C 41 51.850 51.850 52.852 -1.002 19287
2829 1 10 . 1 1 41 41 ASN CB C 41 40.230 40.230 40.464 -0.234 19287
2830 1 10 . 1 1 41 41 ASN H H 41 8.790 8.790 8.367 0.423 19287
2831 1 10 . 1 1 42 42 ALA N N 42 113.290 113.290 122.247 -8.957 19287
2832 1 10 . 1 1 42 42 ALA HA H 42 3.720 3.720 4.131 -0.411 19287
2833 1 10 . 1 1 42 42 ALA C C 42 177.220 177.220 178.511 -1.291 19287
2834 1 10 . 1 1 42 42 ALA CA C 42 52.810 52.810 54.719 -1.909 19287
2835 1 10 . 1 1 42 42 ALA CB C 42 17.980 17.980 18.683 -0.703 19287
2836 1 10 . 1 1 42 42 ALA H H 42 7.590 7.590 8.740 -1.150 19287
2837 1 10 . 1 1 43 43 ASN N N 43 117.710 117.710 115.561 2.149 19287
2838 1 10 . 1 1 43 43 ASN HA H 43 4.700 4.700 4.625 0.075 19287
2839 1 10 . 1 1 43 43 ASN C C 43 173.660 173.660 175.349 -1.689 19287
2840 1 10 . 1 1 43 43 ASN CA C 43 50.630 50.630 54.109 -3.479 19287
2841 1 10 . 1 1 43 43 ASN CB C 43 34.840 34.840 38.211 -3.371 19287
2842 1 10 . 1 1 43 43 ASN H H 43 7.900 7.900 8.104 -0.204 19287
2843 1 10 . 1 1 44 44 ARG N N 44 120.690 120.690 120.392 0.298 19287
2844 1 10 . 1 1 44 44 ARG HA H 44 4.692 4.692 4.554 0.138 19287
2845 1 10 . 1 1 44 44 ARG C C 44 173.530 173.530 174.976 -1.446 19287
2846 1 10 . 1 1 44 44 ARG CA C 44 56.660 56.660 56.517 0.143 19287
2847 1 10 . 1 1 44 44 ARG CB C 44 31.450 31.450 29.670 1.780 19287
2848 1 10 . 1 1 44 44 ARG H H 44 6.860 6.860 7.326 -0.466 19287
2849 1 10 . 1 1 45 45 PHE N N 45 123.690 123.690 123.101 0.589 19287
2850 1 10 . 1 1 45 45 PHE HA H 45 4.810 4.810 4.893 -0.083 19287
2851 1 10 . 1 1 45 45 PHE C C 45 175.420 175.420 175.422 -0.002 19287
2852 1 10 . 1 1 45 45 PHE CA C 45 55.670 55.670 56.940 -1.270 19287
2853 1 10 . 1 1 45 45 PHE CB C 45 43.790 43.790 43.545 0.245 19287
2854 1 10 . 1 1 45 45 PHE H H 45 9.340 9.340 8.754 0.586 19287
2855 1 10 . 1 1 46 46 ARG N N 46 120.920 120.920 118.331 2.589 19287
2856 1 10 . 1 1 46 46 ARG HA H 46 4.397 4.397 4.687 -0.290 19287
2857 1 10 . 1 1 46 46 ARG C C 46 176.560 176.560 175.359 1.201 19287
2858 1 10 . 1 1 46 46 ARG CA C 46 58.210 58.210 55.347 2.863 19287
2859 1 10 . 1 1 46 46 ARG CB C 46 30.900 30.900 31.025 -0.125 19287
2860 1 10 . 1 1 46 46 ARG H H 46 9.080 9.080 8.824 0.256 19287
2861 1 10 . 1 1 47 47 THR N N 47 102.800 102.800 112.576 -9.776 19287
2862 1 10 . 1 1 47 47 THR HA H 47 4.660 4.660 4.239 0.421 19287
2863 1 10 . 1 1 47 47 THR C C 47 174.110 174.110 173.255 0.855 19287
2864 1 10 . 1 1 47 47 THR CA C 47 58.170 58.170 59.580 -1.410 19287
2865 1 10 . 1 1 47 47 THR CB C 47 72.380 72.380 71.230 1.150 19287
2866 1 10 . 1 1 47 47 THR H H 47 7.230 7.230 7.442 -0.212 19287
2867 1 10 . 1 1 48 48 ILE N N 48 123.200 123.200 124.901 -1.701 19287
2868 1 10 . 1 1 48 48 ILE HA H 48 2.901 2.901 3.617 -0.716 19287
2869 1 10 . 1 1 48 48 ILE C C 48 176.420 176.420 175.433 0.987 19287
2870 1 10 . 1 1 48 48 ILE CA C 48 64.000 64.000 62.781 1.219 19287
2871 1 10 . 1 1 48 48 ILE CB C 48 37.060 37.060 38.114 -1.054 19287
2872 1 10 . 1 1 48 48 ILE H H 48 8.110 8.110 8.031 0.079 19287
2873 1 10 . 1 1 49 49 ASP N N 49 119.560 119.560 119.564 -0.004 19287
2874 1 10 . 1 1 49 49 ASP HA H 49 4.130 4.130 4.288 -0.158 19287
2875 1 10 . 1 1 49 49 ASP C C 49 177.740 177.740 178.570 -0.830 19287
2876 1 10 . 1 1 49 49 ASP CA C 49 56.690 56.690 57.478 -0.788 19287
2877 1 10 . 1 1 49 49 ASP CB C 49 39.970 39.970 39.918 0.052 19287
2878 1 10 . 1 1 49 49 ASP H H 49 7.700 7.700 7.787 -0.087 19287
2879 1 10 . 1 1 50 50 GLU N N 50 117.720 117.720 119.956 -2.236 19287
2880 1 10 . 1 1 50 50 GLU HA H 50 3.710 3.710 4.242 -0.532 19287
2881 1 10 . 1 1 50 50 GLU C C 50 177.550 177.550 178.185 -0.635 19287
2882 1 10 . 1 1 50 50 GLU CA C 50 58.550 58.550 58.495 0.055 19287
2883 1 10 . 1 1 50 50 GLU CB C 50 29.190 29.190 29.773 -0.583 19287
2884 1 10 . 1 1 50 50 GLU H H 50 7.410 7.410 7.572 -0.162 19287
2885 1 10 . 1 1 51 51 CYS N N 51 120.260 120.260 120.128 0.132 19287
2886 1 10 . 1 1 51 51 CYS HA H 51 1.650 1.650 3.006 -1.356 19287
2887 1 10 . 1 1 51 51 CYS C C 51 175.070 175.070 176.227 -1.157 19287
2888 1 10 . 1 1 51 51 CYS CA C 51 59.120 59.120 61.901 -2.780 19287
2889 1 10 . 1 1 51 51 CYS CB C 51 43.000 43.000 26.165 16.835 19287
2890 1 10 . 1 1 51 51 CYS H H 51 6.760 6.760 7.553 -0.793 19287
2891 1 10 . 1 1 52 52 ASN N N 52 120.160 120.160 119.233 0.927 19287
2892 1 10 . 1 1 52 52 ASN HA H 52 4.090 4.090 4.389 -0.299 19287
2893 1 10 . 1 1 52 52 ASN C C 52 177.820 177.820 177.339 0.481 19287
2894 1 10 . 1 1 52 52 ASN CA C 52 55.060 55.060 56.331 -1.271 19287
2895 1 10 . 1 1 52 52 ASN CB C 52 37.500 37.500 37.872 -0.372 19287
2896 1 10 . 1 1 52 52 ASN H H 52 8.650 8.650 8.626 0.024 19287
2897 1 10 . 1 1 53 53 ARG N N 53 117.000 117.000 118.569 -1.569 19287
2898 1 10 . 1 1 53 53 ARG HA H 53 3.770 3.770 4.039 -0.269 19287
2899 1 10 . 1 1 53 53 ARG C C 53 177.360 177.360 177.605 -0.245 19287
2900 1 10 . 1 1 53 53 ARG CA C 53 58.490 58.490 58.640 -0.150 19287
2901 1 10 . 1 1 53 53 ARG CB C 53 30.180 30.180 29.290 0.890 19287
2902 1 10 . 1 1 53 53 ARG H H 53 7.900 7.900 7.515 0.385 19287
2903 1 10 . 1 1 54 54 THR N N 54 112.080 112.080 112.438 -0.358 19287
2904 1 10 . 1 1 54 54 THR HA H 54 3.838 3.838 4.437 -0.599 19287
2905 1 10 . 1 1 54 54 THR C C 54 174.990 174.990 174.775 0.215 19287
2906 1 10 . 1 1 54 54 THR CA C 54 65.740 65.740 64.326 1.413 19287
2907 1 10 . 1 1 54 54 THR CB C 54 68.870 68.870 70.305 -1.435 19287
2908 1 10 . 1 1 54 54 THR H H 54 7.260 7.260 7.766 -0.506 19287
2909 1 10 . 1 1 55 55 CYS N N 55 112.540 112.540 117.765 -5.225 19287
2910 1 10 . 1 1 55 55 CYS HA H 55 4.400 4.400 4.491 -0.091 19287
2911 1 10 . 1 1 55 55 CYS C C 55 172.940 172.940 173.883 -0.943 19287
2912 1 10 . 1 1 55 55 CYS CA C 55 54.230 54.230 58.415 -4.185 19287
2913 1 10 . 1 1 55 55 CYS CB C 55 42.930 42.930 29.426 13.504 19287
2914 1 10 . 1 1 55 55 CYS H H 55 7.590 7.590 7.850 -0.260 19287
2915 1 10 . 1 1 56 56 VAL N N 56 119.720 119.720 122.722 -3.002 19287
2916 1 10 . 1 1 56 56 VAL HA H 56 3.631 3.631 4.269 -0.638 19287
2917 1 10 . 1 1 56 56 VAL C C 56 176.710 176.710 176.226 0.484 19287
2918 1 10 . 1 1 56 56 VAL CA C 56 64.540 64.540 62.086 2.454 19287
2919 1 10 . 1 1 56 56 VAL CB C 56 30.970 30.970 30.591 0.379 19287
2920 1 10 . 1 1 56 56 VAL H H 56 7.280 7.280 7.938 -0.658 19287
2921 1 11 . 1 1 2 2 PRO HA H 2 4.017 4.017 4.561 -0.544 19287
2922 1 11 . 1 1 2 2 PRO C C 2 177.920 177.920 177.495 0.425 19287
2923 1 11 . 1 1 2 2 PRO CA C 2 62.800 62.800 62.191 0.609 19287
2924 1 11 . 1 1 2 2 PRO CB C 2 32.050 32.050 33.170 -1.120 19287
2925 1 11 . 1 1 3 3 ARG N N 3 122.340 122.340 122.489 -0.149 19287
2926 1 11 . 1 1 3 3 ARG HA H 3 3.786 3.786 4.216 -0.430 19287
2927 1 11 . 1 1 3 3 ARG C C 3 178.950 178.950 178.451 0.499 19287
2928 1 11 . 1 1 3 3 ARG CA C 3 58.410 58.410 58.315 0.095 19287
2929 1 11 . 1 1 3 3 ARG CB C 3 29.220 29.220 29.148 0.072 19287
2930 1 11 . 1 1 3 3 ARG H H 3 8.550 8.550 8.916 -0.366 19287
2931 1 11 . 1 1 4 4 PHE N N 4 113.010 113.010 118.119 -5.109 19287
2932 1 11 . 1 1 4 4 PHE HA H 4 4.300 4.300 4.451 -0.151 19287
2933 1 11 . 1 1 4 4 PHE C C 4 176.070 176.070 176.267 -0.197 19287
2934 1 11 . 1 1 4 4 PHE CA C 4 58.220 58.220 58.903 -0.683 19287
2935 1 11 . 1 1 4 4 PHE CB C 4 37.310 37.310 37.659 -0.349 19287
2936 1 11 . 1 1 4 4 PHE H H 4 7.150 7.150 8.014 -0.864 19287
2937 1 11 . 1 1 5 5 CYS N N 5 118.600 118.600 116.534 2.066 19287
2938 1 11 . 1 1 5 5 CYS HA H 5 4.130 4.130 4.274 -0.144 19287
2939 1 11 . 1 1 5 5 CYS C C 5 173.450 173.450 174.977 -1.527 19287
2940 1 11 . 1 1 5 5 CYS CA C 5 57.960 57.960 60.006 -2.046 19287
2941 1 11 . 1 1 5 5 CYS CB C 5 39.210 39.210 25.513 13.697 19287
2942 1 11 . 1 1 5 5 CYS H H 5 7.090 7.090 7.198 -0.108 19287
2943 1 11 . 1 1 6 6 GLU N N 6 110.710 110.710 117.950 -7.240 19287
2944 1 11 . 1 1 6 6 GLU HA H 6 4.182 4.182 4.383 -0.201 19287
2945 1 11 . 1 1 6 6 GLU C C 6 176.310 176.310 176.254 0.056 19287
2946 1 11 . 1 1 6 6 GLU CA C 6 55.510 55.510 55.419 0.091 19287
2947 1 11 . 1 1 6 6 GLU CB C 6 28.160 28.160 29.405 -1.245 19287
2948 1 11 . 1 1 6 6 GLU H H 6 7.300 7.300 7.631 -0.331 19287
2949 1 11 . 1 1 7 7 LEU N N 7 119.090 119.090 121.208 -2.118 19287
2950 1 11 . 1 1 7 7 LEU HA H 7 4.160 4.160 4.331 -0.171 19287
2951 1 11 . 1 1 7 7 LEU C C 7 176.630 176.630 176.149 0.481 19287
2952 1 11 . 1 1 7 7 LEU CA C 7 54.510 54.510 54.072 0.438 19287
2953 1 11 . 1 1 7 7 LEU CB C 7 42.330 42.330 42.332 -0.002 19287
2954 1 11 . 1 1 7 7 LEU H H 7 7.210 7.210 7.314 -0.104 19287
2955 1 11 . 1 1 8 8 ALA N N 8 124.490 124.490 122.383 2.107 19287
2956 1 11 . 1 1 8 8 ALA HA H 8 4.250 4.250 4.603 -0.353 19287
2957 1 11 . 1 1 8 8 ALA C C 8 174.710 174.710 175.562 -0.852 19287
2958 1 11 . 1 1 8 8 ALA CA C 8 50.210 50.210 48.783 1.427 19287
2959 1 11 . 1 1 8 8 ALA CB C 8 16.930 16.930 19.371 -2.441 19287
2960 1 11 . 1 1 8 8 ALA H H 8 8.280 8.280 8.249 0.031 19287
2961 1 11 . 1 1 9 9 PRO HA H 9 4.180 4.180 4.636 -0.456 19287
2962 1 11 . 1 1 9 9 PRO C C 9 176.700 176.700 176.477 0.223 19287
2963 1 11 . 1 1 9 9 PRO CA C 9 61.490 61.490 62.785 -1.295 19287
2964 1 11 . 1 1 9 9 PRO CB C 9 30.360 30.360 31.886 -1.526 19287
2965 1 11 . 1 1 10 10 SER N N 10 112.100 112.100 121.210 -9.110 19287
2966 1 11 . 1 1 10 10 SER HA H 10 4.630 4.630 4.422 0.208 19287
2967 1 11 . 1 1 10 10 SER C C 10 174.190 174.190 175.230 -1.040 19287
2968 1 11 . 1 1 10 10 SER CA C 10 55.360 55.360 56.666 -1.306 19287
2969 1 11 . 1 1 10 10 SER CB C 10 64.550 64.550 62.413 2.136 19287
2970 1 11 . 1 1 10 10 SER H H 10 7.450 7.450 8.386 -0.936 19287
2971 1 11 . 1 1 11 11 ALA N N 11 129.980 129.980 128.468 1.512 19287
2972 1 11 . 1 1 11 11 ALA HA H 11 4.496 4.496 4.068 0.428 19287
2973 1 11 . 1 1 11 11 ALA C C 11 178.510 178.510 177.691 0.819 19287
2974 1 11 . 1 1 11 11 ALA CA C 11 54.810 54.810 53.550 1.260 19287
2975 1 11 . 1 1 11 11 ALA CB C 11 19.910 19.910 18.995 0.915 19287
2976 1 11 . 1 1 11 11 ALA H H 11 9.210 9.210 8.051 1.159 19287
2977 1 11 . 1 1 12 12 GLY N N 12 104.410 104.410 103.666 0.744 19287
2978 1 11 . 1 1 12 12 GLY C C 12 174.850 174.850 175.754 -0.904 19287
2979 1 11 . 1 1 12 12 GLY CA C 12 44.450 44.450 45.329 -0.879 19287
2980 1 11 . 1 1 12 12 GLY H H 12 8.190 8.190 8.047 0.143 19287
2981 1 11 . 1 1 14 14 CYS HA H 14 4.250 4.250 4.701 -0.451 19287
2982 1 11 . 1 1 14 14 CYS C C 14 172.410 172.410 172.345 0.065 19287
2983 1 11 . 1 1 14 14 CYS CA C 14 59.750 59.750 58.233 1.517 19287
2984 1 11 . 1 1 14 14 CYS CB C 14 39.130 39.130 30.338 8.792 19287
2985 1 11 . 1 1 15 15 PHE N N 15 116.000 116.000 123.124 -7.124 19287
2986 1 11 . 1 1 15 15 PHE HA H 15 4.380 4.380 4.736 -0.356 19287
2987 1 11 . 1 1 15 15 PHE C C 15 174.300 174.300 173.655 0.645 19287
2988 1 11 . 1 1 15 15 PHE CA C 15 56.830 56.830 57.234 -0.404 19287
2989 1 11 . 1 1 15 15 PHE CB C 15 39.440 39.440 39.797 -0.357 19287
2990 1 11 . 1 1 15 15 PHE H H 15 7.960 7.960 8.629 -0.669 19287
2991 1 11 . 1 1 16 16 ALA N N 16 125.630 125.630 129.622 -3.992 19287
2992 1 11 . 1 1 16 16 ALA HA H 16 4.320 4.320 4.651 -0.331 19287
2993 1 11 . 1 1 16 16 ALA C C 16 174.300 174.300 174.529 -0.229 19287
2994 1 11 . 1 1 16 16 ALA CA C 16 50.130 50.130 51.605 -1.474 19287
2995 1 11 . 1 1 16 16 ALA CB C 16 19.180 19.180 21.762 -2.582 19287
2996 1 11 . 1 1 16 16 ALA H H 16 7.800 7.800 7.868 -0.068 19287
2997 1 11 . 1 1 17 17 PHE N N 17 116.330 116.330 122.636 -6.306 19287
2998 1 11 . 1 1 17 17 PHE HA H 17 4.390 4.390 4.933 -0.543 19287
2999 1 11 . 1 1 17 17 PHE C C 17 175.310 175.310 173.948 1.362 19287
3000 1 11 . 1 1 17 17 PHE CA C 17 57.160 57.160 55.797 1.363 19287
3001 1 11 . 1 1 17 17 PHE CB C 17 39.380 39.380 40.383 -1.003 19287
3002 1 11 . 1 1 17 17 PHE H H 17 7.330 7.330 8.478 -1.148 19287
3003 1 11 . 1 1 18 18 VAL N N 18 122.890 122.890 124.716 -1.826 19287
3004 1 11 . 1 1 18 18 VAL HA H 18 4.475 4.475 4.353 0.122 19287
3005 1 11 . 1 1 18 18 VAL C C 18 173.590 173.590 173.417 0.173 19287
3006 1 11 . 1 1 18 18 VAL CA C 18 58.900 58.900 58.366 0.534 19287
3007 1 11 . 1 1 18 18 VAL CB C 18 33.900 33.900 33.545 0.355 19287
3008 1 11 . 1 1 18 18 VAL H H 18 8.680 8.680 8.720 -0.040 19287
3009 1 11 . 1 1 19 19 PRO HA H 19 4.275 4.275 4.496 -0.221 19287
3010 1 11 . 1 1 19 19 PRO C C 19 176.940 176.940 176.376 0.564 19287
3011 1 11 . 1 1 19 19 PRO CA C 19 64.060 64.060 62.647 1.413 19287
3012 1 11 . 1 1 19 19 PRO CB C 19 31.710 31.710 31.066 0.644 19287
3013 1 11 . 1 1 20 20 SER N N 20 120.230 120.230 119.053 1.177 19287
3014 1 11 . 1 1 20 20 SER HA H 20 4.780 4.780 4.653 0.127 19287
3015 1 11 . 1 1 20 20 SER C C 20 170.900 170.900 173.046 -2.146 19287
3016 1 11 . 1 1 20 20 SER CA C 20 57.450 57.450 57.111 0.339 19287
3017 1 11 . 1 1 20 20 SER CB C 20 67.910 67.910 66.231 1.679 19287
3018 1 11 . 1 1 20 20 SER H H 20 8.390 8.390 7.740 0.650 19287
3019 1 11 . 1 1 21 21 TYR N N 21 118.220 118.220 118.864 -0.644 19287
3020 1 11 . 1 1 21 21 TYR HA H 21 5.600 5.600 5.109 0.491 19287
3021 1 11 . 1 1 21 21 TYR C C 21 173.770 173.770 175.058 -1.288 19287
3022 1 11 . 1 1 21 21 TYR CA C 21 57.740 57.740 58.312 -0.572 19287
3023 1 11 . 1 1 21 21 TYR CB C 21 42.660 42.660 42.071 0.589 19287
3024 1 11 . 1 1 21 21 TYR H H 21 9.020 9.020 8.396 0.624 19287
3025 1 11 . 1 1 22 22 TYR N N 22 119.260 119.260 124.822 -5.562 19287
3026 1 11 . 1 1 22 22 TYR HA H 22 5.110 5.110 4.897 0.213 19287
3027 1 11 . 1 1 22 22 TYR C C 22 172.610 172.610 173.962 -1.352 19287
3028 1 11 . 1 1 22 22 TYR CA C 22 55.380 55.380 55.426 -0.046 19287
3029 1 11 . 1 1 22 22 TYR CB C 22 41.550 41.550 42.821 -1.271 19287
3030 1 11 . 1 1 22 22 TYR H H 22 9.410 9.410 9.727 -0.317 19287
3031 1 11 . 1 1 23 23 TYR N N 23 123.200 123.200 127.170 -3.970 19287
3032 1 11 . 1 1 23 23 TYR HA H 23 4.382 4.382 5.196 -0.814 19287
3033 1 11 . 1 1 23 23 TYR C C 23 173.250 173.250 174.371 -1.121 19287
3034 1 11 . 1 1 23 23 TYR CA C 23 58.360 58.360 56.733 1.627 19287
3035 1 11 . 1 1 23 23 TYR CB C 23 39.570 39.570 41.194 -1.624 19287
3036 1 11 . 1 1 23 23 TYR H H 23 10.190 10.190 8.333 1.857 19287
3037 1 11 . 1 1 24 24 ASN N N 24 126.280 126.280 127.127 -0.847 19287
3038 1 11 . 1 1 24 24 ASN HA H 24 4.550 4.550 4.949 -0.399 19287
3039 1 11 . 1 1 24 24 ASN C C 24 174.000 174.000 175.328 -1.328 19287
3040 1 11 . 1 1 24 24 ASN CA C 24 51.360 51.360 51.407 -0.047 19287
3041 1 11 . 1 1 24 24 ASN CB C 24 40.040 40.040 38.553 1.488 19287
3042 1 11 . 1 1 24 24 ASN H H 24 7.890 7.890 8.826 -0.936 19287
3043 1 11 . 1 1 25 25 GLN N N 25 122.760 122.760 123.849 -1.089 19287
3044 1 11 . 1 1 25 25 GLN HA H 25 3.691 3.691 3.572 0.119 19287
3045 1 11 . 1 1 25 25 GLN C C 25 175.670 175.670 176.650 -0.980 19287
3046 1 11 . 1 1 25 25 GLN CA C 25 57.480 57.480 58.281 -0.800 19287
3047 1 11 . 1 1 25 25 GLN CB C 25 28.120 28.120 27.760 0.360 19287
3048 1 11 . 1 1 25 25 GLN H H 25 8.440 8.440 8.139 0.301 19287
3049 1 11 . 1 1 26 26 TYR N N 26 119.190 119.190 119.238 -0.048 19287
3050 1 11 . 1 1 26 26 TYR HA H 26 4.160 4.160 4.370 -0.210 19287
3051 1 11 . 1 1 26 26 TYR C C 26 176.520 176.520 176.689 -0.169 19287
3052 1 11 . 1 1 26 26 TYR CA C 26 60.170 60.170 59.255 0.915 19287
3053 1 11 . 1 1 26 26 TYR CB C 26 36.880 36.880 37.919 -1.039 19287
3054 1 11 . 1 1 26 26 TYR H H 26 7.810 7.810 7.611 0.199 19287
3055 1 11 . 1 1 27 27 SER N N 27 109.600 109.600 112.321 -2.721 19287
3056 1 11 . 1 1 27 27 SER HA H 27 4.330 4.330 4.605 -0.275 19287
3057 1 11 . 1 1 27 27 SER C C 27 174.830 174.830 173.873 0.957 19287
3058 1 11 . 1 1 27 27 SER CA C 27 57.490 57.490 57.516 -0.026 19287
3059 1 11 . 1 1 27 27 SER CB C 27 64.640 64.640 64.038 0.602 19287
3060 1 11 . 1 1 27 27 SER H H 27 7.350 7.350 7.618 -0.268 19287
3061 1 11 . 1 1 28 28 ASN N N 28 119.830 119.830 119.037 0.793 19287
3062 1 11 . 1 1 28 28 ASN HA H 28 4.060 4.060 4.331 -0.271 19287
3063 1 11 . 1 1 28 28 ASN C C 28 173.040 173.040 174.364 -1.324 19287
3064 1 11 . 1 1 28 28 ASN CA C 28 53.830 53.830 54.521 -0.691 19287
3065 1 11 . 1 1 28 28 ASN CB C 28 37.400 37.400 38.151 -0.751 19287
3066 1 11 . 1 1 28 28 ASN H H 28 7.930 7.930 7.761 0.169 19287
3067 1 11 . 1 1 29 29 THR N N 29 103.070 103.070 110.658 -7.588 19287
3068 1 11 . 1 1 29 29 THR HA H 29 4.441 4.441 4.662 -0.221 19287
3069 1 11 . 1 1 29 29 THR C C 29 172.980 172.980 172.009 0.971 19287
3070 1 11 . 1 1 29 29 THR CA C 29 58.920 58.920 61.435 -2.515 19287
3071 1 11 . 1 1 29 29 THR CB C 29 73.260 73.260 70.783 2.477 19287
3072 1 11 . 1 1 29 29 THR H H 29 6.990 6.990 7.676 -0.686 19287
3073 1 11 . 1 1 30 30 CYS N N 30 118.340 118.340 118.479 -0.139 19287
3074 1 11 . 1 1 30 30 CYS HA H 30 5.462 5.462 5.624 -0.162 19287
3075 1 11 . 1 1 30 30 CYS C C 30 173.320 173.320 173.579 -0.259 19287
3076 1 11 . 1 1 30 30 CYS CA C 30 57.750 57.750 57.511 0.239 19287
3077 1 11 . 1 1 30 30 CYS CB C 30 50.680 50.680 31.878 18.802 19287
3078 1 11 . 1 1 30 30 CYS H H 30 8.954 8.954 8.696 0.258 19287
3079 1 11 . 1 1 31 31 HIS N N 31 118.930 118.930 119.633 -0.703 19287
3080 1 11 . 1 1 31 31 HIS HA H 31 4.780 4.780 5.080 -0.300 19287
3081 1 11 . 1 1 31 31 HIS C C 31 172.790 172.790 173.608 -0.818 19287
3082 1 11 . 1 1 31 31 HIS CA C 31 53.530 53.530 55.361 -1.831 19287
3083 1 11 . 1 1 31 31 HIS CB C 31 33.040 33.040 33.392 -0.352 19287
3084 1 11 . 1 1 31 31 HIS H H 31 9.010 9.010 9.629 -0.619 19287
3085 1 11 . 1 1 32 32 SER N N 32 117.600 117.600 119.289 -1.689 19287
3086 1 11 . 1 1 32 32 SER HA H 32 4.700 4.700 4.232 0.468 19287
3087 1 11 . 1 1 32 32 SER C C 32 174.930 174.930 173.805 1.125 19287
3088 1 11 . 1 1 32 32 SER CA C 32 57.980 57.980 59.083 -1.103 19287
3089 1 11 . 1 1 32 32 SER CB C 32 64.440 64.440 63.092 1.348 19287
3090 1 11 . 1 1 32 32 SER H H 32 8.740 8.740 8.133 0.607 19287
3091 1 11 . 1 1 33 33 PHE N N 33 120.690 120.690 120.610 0.080 19287
3092 1 11 . 1 1 33 33 PHE HA H 33 4.790 4.790 5.005 -0.215 19287
3093 1 11 . 1 1 33 33 PHE C C 33 171.810 171.810 173.791 -1.981 19287
3094 1 11 . 1 1 33 33 PHE CA C 33 56.200 56.200 55.877 0.324 19287
3095 1 11 . 1 1 33 33 PHE CB C 33 40.230 40.230 41.329 -1.099 19287
3096 1 11 . 1 1 33 33 PHE H H 33 8.830 8.830 8.917 -0.087 19287
3097 1 11 . 1 1 34 34 THR N N 34 116.650 116.650 112.432 4.218 19287
3098 1 11 . 1 1 34 34 THR HA H 34 3.965 3.965 4.356 -0.391 19287
3099 1 11 . 1 1 34 34 THR C C 34 172.600 172.600 172.430 0.170 19287
3100 1 11 . 1 1 34 34 THR CA C 34 61.980 61.980 60.965 1.015 19287
3101 1 11 . 1 1 34 34 THR CB C 34 68.530 68.530 69.544 -1.014 19287
3102 1 11 . 1 1 34 34 THR H H 34 8.400 8.400 8.191 0.209 19287
3103 1 11 . 1 1 35 35 TYR N N 35 127.790 127.790 125.256 2.534 19287
3104 1 11 . 1 1 35 35 TYR HA H 35 4.500 4.500 4.586 -0.086 19287
3105 1 11 . 1 1 35 35 TYR C C 35 174.200 174.200 174.482 -0.282 19287
3106 1 11 . 1 1 35 35 TYR CA C 35 55.130 55.130 56.838 -1.708 19287
3107 1 11 . 1 1 35 35 TYR CB C 35 39.650 39.650 42.025 -2.375 19287
3108 1 11 . 1 1 35 35 TYR H H 35 8.010 8.010 7.854 0.156 19287
3109 1 11 . 1 1 39 39 GLY N N 39 103.730 103.730 110.249 -6.519 19287
3110 1 11 . 1 1 39 39 GLY C C 39 175.700 175.700 173.586 2.114 19287
3111 1 11 . 1 1 39 39 GLY CA C 39 45.370 45.370 44.847 0.523 19287
3112 1 11 . 1 1 39 39 GLY H H 39 8.500 8.500 8.318 0.182 19287
3113 1 11 . 1 1 40 40 GLY N N 40 110.170 110.170 106.576 3.594 19287
3114 1 11 . 1 1 40 40 GLY C C 40 173.140 173.140 173.125 0.015 19287
3115 1 11 . 1 1 40 40 GLY CA C 40 44.320 44.320 44.810 -0.491 19287
3116 1 11 . 1 1 40 40 GLY H H 40 8.670 8.670 7.922 0.748 19287
3117 1 11 . 1 1 41 41 ASN N N 41 116.960 116.960 117.859 -0.899 19287
3118 1 11 . 1 1 41 41 ASN HA H 41 4.560 4.560 4.894 -0.334 19287
3119 1 11 . 1 1 41 41 ASN C C 41 173.670 173.670 175.552 -1.882 19287
3120 1 11 . 1 1 41 41 ASN CA C 41 51.850 51.850 52.032 -0.182 19287
3121 1 11 . 1 1 41 41 ASN CB C 41 40.230 40.230 40.302 -0.072 19287
3122 1 11 . 1 1 41 41 ASN H H 41 8.790 8.790 8.677 0.113 19287
3123 1 11 . 1 1 42 42 ALA N N 42 113.290 113.290 121.467 -8.177 19287
3124 1 11 . 1 1 42 42 ALA HA H 42 3.720 3.720 4.113 -0.393 19287
3125 1 11 . 1 1 42 42 ALA C C 42 177.220 177.220 177.895 -0.675 19287
3126 1 11 . 1 1 42 42 ALA CA C 42 52.810 52.810 54.631 -1.821 19287
3127 1 11 . 1 1 42 42 ALA CB C 42 17.980 17.980 18.956 -0.976 19287
3128 1 11 . 1 1 42 42 ALA H H 42 7.590 7.590 8.548 -0.958 19287
3129 1 11 . 1 1 43 43 ASN N N 43 117.710 117.710 115.260 2.450 19287
3130 1 11 . 1 1 43 43 ASN HA H 43 4.700 4.700 4.539 0.161 19287
3131 1 11 . 1 1 43 43 ASN C C 43 173.660 173.660 174.100 -0.440 19287
3132 1 11 . 1 1 43 43 ASN CA C 43 50.630 50.630 53.578 -2.948 19287
3133 1 11 . 1 1 43 43 ASN CB C 43 34.840 34.840 38.356 -3.516 19287
3134 1 11 . 1 1 43 43 ASN H H 43 7.900 7.900 8.009 -0.109 19287
3135 1 11 . 1 1 44 44 ARG N N 44 120.690 120.690 119.329 1.361 19287
3136 1 11 . 1 1 44 44 ARG HA H 44 4.692 4.692 4.247 0.445 19287
3137 1 11 . 1 1 44 44 ARG C C 44 173.530 173.530 174.565 -1.035 19287
3138 1 11 . 1 1 44 44 ARG CA C 44 56.660 56.660 55.535 1.125 19287
3139 1 11 . 1 1 44 44 ARG CB C 44 31.450 31.450 29.512 1.938 19287
3140 1 11 . 1 1 44 44 ARG H H 44 6.860 6.860 6.816 0.044 19287
3141 1 11 . 1 1 45 45 PHE N N 45 123.690 123.690 123.256 0.434 19287
3142 1 11 . 1 1 45 45 PHE HA H 45 4.810 4.810 4.957 -0.147 19287
3143 1 11 . 1 1 45 45 PHE C C 45 175.420 175.420 175.931 -0.511 19287
3144 1 11 . 1 1 45 45 PHE CA C 45 55.670 55.670 55.681 -0.011 19287
3145 1 11 . 1 1 45 45 PHE CB C 45 43.790 43.790 41.727 2.063 19287
3146 1 11 . 1 1 45 45 PHE H H 45 9.340 9.340 8.232 1.108 19287
3147 1 11 . 1 1 46 46 ARG N N 46 120.920 120.920 117.820 3.100 19287
3148 1 11 . 1 1 46 46 ARG HA H 46 4.397 4.397 4.515 -0.118 19287
3149 1 11 . 1 1 46 46 ARG C C 46 176.560 176.560 176.489 0.071 19287
3150 1 11 . 1 1 46 46 ARG CA C 46 58.210 58.210 56.075 2.135 19287
3151 1 11 . 1 1 46 46 ARG CB C 46 30.900 30.900 30.550 0.350 19287
3152 1 11 . 1 1 46 46 ARG H H 46 9.080 9.080 8.810 0.270 19287
3153 1 11 . 1 1 47 47 THR N N 47 102.800 102.800 111.646 -8.846 19287
3154 1 11 . 1 1 47 47 THR HA H 47 4.660 4.660 4.382 0.278 19287
3155 1 11 . 1 1 47 47 THR C C 47 174.110 174.110 173.459 0.651 19287
3156 1 11 . 1 1 47 47 THR CA C 47 58.170 58.170 60.133 -1.963 19287
3157 1 11 . 1 1 47 47 THR CB C 47 72.380 72.380 70.567 1.813 19287
3158 1 11 . 1 1 47 47 THR H H 47 7.230 7.230 7.455 -0.225 19287
3159 1 11 . 1 1 48 48 ILE N N 48 123.200 123.200 124.465 -1.265 19287
3160 1 11 . 1 1 48 48 ILE HA H 48 2.901 2.901 3.801 -0.900 19287
3161 1 11 . 1 1 48 48 ILE C C 48 176.420 176.420 175.745 0.675 19287
3162 1 11 . 1 1 48 48 ILE CA C 48 64.000 64.000 62.803 1.197 19287
3163 1 11 . 1 1 48 48 ILE CB C 48 37.060 37.060 38.171 -1.111 19287
3164 1 11 . 1 1 48 48 ILE H H 48 8.110 8.110 7.942 0.168 19287
3165 1 11 . 1 1 49 49 ASP N N 49 119.560 119.560 118.978 0.582 19287
3166 1 11 . 1 1 49 49 ASP HA H 49 4.130 4.130 4.314 -0.184 19287
3167 1 11 . 1 1 49 49 ASP C C 49 177.740 177.740 178.405 -0.665 19287
3168 1 11 . 1 1 49 49 ASP CA C 49 56.690 56.690 57.398 -0.708 19287
3169 1 11 . 1 1 49 49 ASP CB C 49 39.970 39.970 40.091 -0.121 19287
3170 1 11 . 1 1 49 49 ASP H H 49 7.700 7.700 7.723 -0.023 19287
3171 1 11 . 1 1 50 50 GLU N N 50 117.720 117.720 119.762 -2.042 19287
3172 1 11 . 1 1 50 50 GLU HA H 50 3.710 3.710 4.237 -0.527 19287
3173 1 11 . 1 1 50 50 GLU C C 50 177.550 177.550 178.484 -0.934 19287
3174 1 11 . 1 1 50 50 GLU CA C 50 58.550 58.550 58.639 -0.089 19287
3175 1 11 . 1 1 50 50 GLU CB C 50 29.190 29.190 29.824 -0.634 19287
3176 1 11 . 1 1 50 50 GLU H H 50 7.410 7.410 7.676 -0.266 19287
3177 1 11 . 1 1 51 51 CYS N N 51 120.260 120.260 117.387 2.873 19287
3178 1 11 . 1 1 51 51 CYS HA H 51 1.650 1.650 3.772 -2.122 19287
3179 1 11 . 1 1 51 51 CYS C C 51 175.070 175.070 176.607 -1.537 19287
3180 1 11 . 1 1 51 51 CYS CA C 51 59.120 59.120 60.524 -1.404 19287
3181 1 11 . 1 1 51 51 CYS CB C 51 43.000 43.000 26.213 16.787 19287
3182 1 11 . 1 1 51 51 CYS H H 51 6.760 6.760 7.795 -1.035 19287
3183 1 11 . 1 1 52 52 ASN N N 52 120.160 120.160 120.657 -0.497 19287
3184 1 11 . 1 1 52 52 ASN HA H 52 4.090 4.090 4.453 -0.363 19287
3185 1 11 . 1 1 52 52 ASN C C 52 177.820 177.820 177.593 0.227 19287
3186 1 11 . 1 1 52 52 ASN CA C 52 55.060 55.060 56.022 -0.961 19287
3187 1 11 . 1 1 52 52 ASN CB C 52 37.500 37.500 38.381 -0.881 19287
3188 1 11 . 1 1 52 52 ASN H H 52 8.650 8.650 8.534 0.116 19287
3189 1 11 . 1 1 53 53 ARG N N 53 117.000 117.000 118.546 -1.546 19287
3190 1 11 . 1 1 53 53 ARG HA H 53 3.770 3.770 4.031 -0.261 19287
3191 1 11 . 1 1 53 53 ARG C C 53 177.360 177.360 177.578 -0.218 19287
3192 1 11 . 1 1 53 53 ARG CA C 53 58.490 58.490 58.717 -0.227 19287
3193 1 11 . 1 1 53 53 ARG CB C 53 30.180 30.180 29.387 0.793 19287
3194 1 11 . 1 1 53 53 ARG H H 53 7.900 7.900 7.582 0.318 19287
3195 1 11 . 1 1 54 54 THR N N 54 112.080 112.080 111.865 0.215 19287
3196 1 11 . 1 1 54 54 THR HA H 54 3.838 3.838 4.441 -0.603 19287
3197 1 11 . 1 1 54 54 THR C C 54 174.990 174.990 174.357 0.633 19287
3198 1 11 . 1 1 54 54 THR CA C 54 65.740 65.740 63.273 2.467 19287
3199 1 11 . 1 1 54 54 THR CB C 54 68.870 68.870 70.126 -1.256 19287
3200 1 11 . 1 1 54 54 THR H H 54 7.260 7.260 7.819 -0.559 19287
3201 1 11 . 1 1 55 55 CYS N N 55 112.540 112.540 117.386 -4.846 19287
3202 1 11 . 1 1 55 55 CYS HA H 55 4.400 4.400 4.434 -0.034 19287
3203 1 11 . 1 1 55 55 CYS C C 55 172.940 172.940 174.389 -1.449 19287
3204 1 11 . 1 1 55 55 CYS CA C 55 54.230 54.230 58.703 -4.473 19287
3205 1 11 . 1 1 55 55 CYS CB C 55 42.930 42.930 29.550 13.380 19287
3206 1 11 . 1 1 55 55 CYS H H 55 7.590 7.590 7.424 0.166 19287
3207 1 11 . 1 1 56 56 VAL N N 56 119.720 119.720 123.374 -3.654 19287
3208 1 11 . 1 1 56 56 VAL HA H 56 3.631 3.631 4.134 -0.503 19287
3209 1 11 . 1 1 56 56 VAL C C 56 176.710 176.710 175.704 1.006 19287
3210 1 11 . 1 1 56 56 VAL CA C 56 64.540 64.540 63.001 1.539 19287
3211 1 11 . 1 1 56 56 VAL CB C 56 30.970 30.970 30.568 0.402 19287
3212 1 11 . 1 1 56 56 VAL H H 56 7.280 7.280 8.040 -0.760 19287
3213 1 12 . 1 1 2 2 PRO HA H 2 4.017 4.017 4.434 -0.417 19287
3214 1 12 . 1 1 2 2 PRO C C 2 177.920 177.920 177.443 0.477 19287
3215 1 12 . 1 1 2 2 PRO CA C 2 62.800 62.800 62.306 0.494 19287
3216 1 12 . 1 1 2 2 PRO CB C 2 32.050 32.050 32.654 -0.604 19287
3217 1 12 . 1 1 3 3 ARG N N 3 122.340 122.340 121.456 0.884 19287
3218 1 12 . 1 1 3 3 ARG HA H 3 3.786 3.786 4.227 -0.441 19287
3219 1 12 . 1 1 3 3 ARG C C 3 178.950 178.950 178.329 0.621 19287
3220 1 12 . 1 1 3 3 ARG CA C 3 58.410 58.410 58.134 0.276 19287
3221 1 12 . 1 1 3 3 ARG CB C 3 29.220 29.220 29.474 -0.254 19287
3222 1 12 . 1 1 3 3 ARG H H 3 8.550 8.550 8.804 -0.254 19287
3223 1 12 . 1 1 4 4 PHE N N 4 113.010 113.010 117.764 -4.754 19287
3224 1 12 . 1 1 4 4 PHE HA H 4 4.300 4.300 4.542 -0.242 19287
3225 1 12 . 1 1 4 4 PHE C C 4 176.070 176.070 175.475 0.595 19287
3226 1 12 . 1 1 4 4 PHE CA C 4 58.220 58.220 58.758 -0.538 19287
3227 1 12 . 1 1 4 4 PHE CB C 4 37.310 37.310 38.339 -1.028 19287
3228 1 12 . 1 1 4 4 PHE H H 4 7.150 7.150 7.926 -0.776 19287
3229 1 12 . 1 1 5 5 CYS N N 5 118.600 118.600 113.132 5.468 19287
3230 1 12 . 1 1 5 5 CYS HA H 5 4.130 4.130 4.315 -0.185 19287
3231 1 12 . 1 1 5 5 CYS C C 5 173.450 173.450 174.961 -1.511 19287
3232 1 12 . 1 1 5 5 CYS CA C 5 57.960 57.960 57.041 0.919 19287
3233 1 12 . 1 1 5 5 CYS CB C 5 39.210 39.210 26.370 12.840 19287
3234 1 12 . 1 1 5 5 CYS H H 5 7.090 7.090 7.004 0.086 19287
3235 1 12 . 1 1 6 6 GLU N N 6 110.710 110.710 119.806 -9.096 19287
3236 1 12 . 1 1 6 6 GLU HA H 6 4.182 4.182 4.444 -0.262 19287
3237 1 12 . 1 1 6 6 GLU C C 6 176.310 176.310 176.111 0.199 19287
3238 1 12 . 1 1 6 6 GLU CA C 6 55.510 55.510 55.141 0.369 19287
3239 1 12 . 1 1 6 6 GLU CB C 6 28.160 28.160 29.041 -0.881 19287
3240 1 12 . 1 1 6 6 GLU H H 6 7.300 7.300 7.597 -0.297 19287
3241 1 12 . 1 1 7 7 LEU N N 7 119.090 119.090 120.186 -1.096 19287
3242 1 12 . 1 1 7 7 LEU HA H 7 4.160 4.160 4.440 -0.280 19287
3243 1 12 . 1 1 7 7 LEU C C 7 176.630 176.630 175.548 1.082 19287
3244 1 12 . 1 1 7 7 LEU CA C 7 54.510 54.510 53.997 0.513 19287
3245 1 12 . 1 1 7 7 LEU CB C 7 42.330 42.330 43.256 -0.926 19287
3246 1 12 . 1 1 7 7 LEU H H 7 7.210 7.210 7.210 0.000 19287
3247 1 12 . 1 1 8 8 ALA N N 8 124.490 124.490 120.331 4.159 19287
3248 1 12 . 1 1 8 8 ALA HA H 8 4.250 4.250 4.920 -0.670 19287
3249 1 12 . 1 1 8 8 ALA C C 8 174.710 174.710 175.996 -1.286 19287
3250 1 12 . 1 1 8 8 ALA CA C 8 50.210 50.210 48.677 1.533 19287
3251 1 12 . 1 1 8 8 ALA CB C 8 16.930 16.930 19.490 -2.560 19287
3252 1 12 . 1 1 8 8 ALA H H 8 8.280 8.280 8.102 0.178 19287
3253 1 12 . 1 1 9 9 PRO HA H 9 4.180 4.180 4.747 -0.567 19287
3254 1 12 . 1 1 9 9 PRO C C 9 176.700 176.700 176.336 0.364 19287
3255 1 12 . 1 1 9 9 PRO CA C 9 61.490 61.490 62.349 -0.859 19287
3256 1 12 . 1 1 9 9 PRO CB C 9 30.360 30.360 30.222 0.138 19287
3257 1 12 . 1 1 10 10 SER N N 10 112.100 112.100 117.140 -5.040 19287
3258 1 12 . 1 1 10 10 SER HA H 10 4.630 4.630 4.298 0.332 19287
3259 1 12 . 1 1 10 10 SER C C 10 174.190 174.190 174.805 -0.615 19287
3260 1 12 . 1 1 10 10 SER CA C 10 55.360 55.360 58.646 -3.286 19287
3261 1 12 . 1 1 10 10 SER CB C 10 64.550 64.550 63.507 1.043 19287
3262 1 12 . 1 1 10 10 SER H H 10 7.450 7.450 8.090 -0.640 19287
3263 1 12 . 1 1 11 11 ALA N N 11 129.980 129.980 129.524 0.456 19287
3264 1 12 . 1 1 11 11 ALA HA H 11 4.496 4.496 4.140 0.356 19287
3265 1 12 . 1 1 11 11 ALA C C 11 178.510 178.510 177.923 0.587 19287
3266 1 12 . 1 1 11 11 ALA CA C 11 54.810 54.810 52.387 2.423 19287
3267 1 12 . 1 1 11 11 ALA CB C 11 19.910 19.910 19.111 0.799 19287
3268 1 12 . 1 1 11 11 ALA H H 11 9.210 9.210 8.222 0.988 19287
3269 1 12 . 1 1 12 12 GLY N N 12 104.410 104.410 105.249 -0.839 19287
3270 1 12 . 1 1 12 12 GLY C C 12 174.850 174.850 175.547 -0.697 19287
3271 1 12 . 1 1 12 12 GLY CA C 12 44.450 44.450 45.704 -1.254 19287
3272 1 12 . 1 1 12 12 GLY H H 12 8.190 8.190 8.179 0.011 19287
3273 1 12 . 1 1 14 14 CYS HA H 14 4.250 4.250 4.738 -0.488 19287
3274 1 12 . 1 1 14 14 CYS C C 14 172.410 172.410 173.844 -1.434 19287
3275 1 12 . 1 1 14 14 CYS CA C 14 59.750 59.750 57.638 2.112 19287
3276 1 12 . 1 1 14 14 CYS CB C 14 39.130 39.130 30.624 8.506 19287
3277 1 12 . 1 1 15 15 PHE N N 15 116.000 116.000 123.383 -7.383 19287
3278 1 12 . 1 1 15 15 PHE HA H 15 4.380 4.380 4.808 -0.428 19287
3279 1 12 . 1 1 15 15 PHE C C 15 174.300 174.300 174.166 0.134 19287
3280 1 12 . 1 1 15 15 PHE CA C 15 56.830 56.830 56.957 -0.127 19287
3281 1 12 . 1 1 15 15 PHE CB C 15 39.440 39.440 39.149 0.291 19287
3282 1 12 . 1 1 15 15 PHE H H 15 7.960 7.960 8.808 -0.848 19287
3283 1 12 . 1 1 16 16 ALA N N 16 125.630 125.630 131.647 -6.017 19287
3284 1 12 . 1 1 16 16 ALA HA H 16 4.320 4.320 4.217 0.103 19287
3285 1 12 . 1 1 16 16 ALA C C 16 174.300 174.300 175.149 -0.849 19287
3286 1 12 . 1 1 16 16 ALA CA C 16 50.130 50.130 51.541 -1.411 19287
3287 1 12 . 1 1 16 16 ALA CB C 16 19.180 19.180 21.641 -2.461 19287
3288 1 12 . 1 1 16 16 ALA H H 16 7.800 7.800 7.968 -0.168 19287
3289 1 12 . 1 1 17 17 PHE N N 17 116.330 116.330 123.450 -7.120 19287
3290 1 12 . 1 1 17 17 PHE HA H 17 4.390 4.390 4.973 -0.583 19287
3291 1 12 . 1 1 17 17 PHE C C 17 175.310 175.310 173.808 1.502 19287
3292 1 12 . 1 1 17 17 PHE CA C 17 57.160 57.160 55.937 1.223 19287
3293 1 12 . 1 1 17 17 PHE CB C 17 39.380 39.380 41.336 -1.956 19287
3294 1 12 . 1 1 17 17 PHE H H 17 7.330 7.330 8.248 -0.918 19287
3295 1 12 . 1 1 18 18 VAL N N 18 122.890 122.890 124.290 -1.400 19287
3296 1 12 . 1 1 18 18 VAL HA H 18 4.475 4.475 4.381 0.094 19287
3297 1 12 . 1 1 18 18 VAL C C 18 173.590 173.590 173.210 0.380 19287
3298 1 12 . 1 1 18 18 VAL CA C 18 58.900 58.900 58.077 0.823 19287
3299 1 12 . 1 1 18 18 VAL CB C 18 33.900 33.900 34.340 -0.440 19287
3300 1 12 . 1 1 18 18 VAL H H 18 8.680 8.680 8.688 -0.008 19287
3301 1 12 . 1 1 19 19 PRO HA H 19 4.275 4.275 4.576 -0.301 19287
3302 1 12 . 1 1 19 19 PRO C C 19 176.940 176.940 176.341 0.599 19287
3303 1 12 . 1 1 19 19 PRO CA C 19 64.060 64.060 62.570 1.490 19287
3304 1 12 . 1 1 19 19 PRO CB C 19 31.710 31.710 31.765 -0.055 19287
3305 1 12 . 1 1 20 20 SER N N 20 120.230 120.230 117.237 2.993 19287
3306 1 12 . 1 1 20 20 SER HA H 20 4.780 4.780 4.761 0.019 19287
3307 1 12 . 1 1 20 20 SER C C 20 170.900 170.900 173.141 -2.241 19287
3308 1 12 . 1 1 20 20 SER CA C 20 57.450 57.450 56.037 1.413 19287
3309 1 12 . 1 1 20 20 SER CB C 20 67.910 67.910 66.139 1.770 19287
3310 1 12 . 1 1 20 20 SER H H 20 8.390 8.390 8.195 0.195 19287
3311 1 12 . 1 1 21 21 TYR N N 21 118.220 118.220 119.628 -1.408 19287
3312 1 12 . 1 1 21 21 TYR HA H 21 5.600 5.600 5.152 0.448 19287
3313 1 12 . 1 1 21 21 TYR C C 21 173.770 173.770 174.894 -1.124 19287
3314 1 12 . 1 1 21 21 TYR CA C 21 57.740 57.740 57.888 -0.148 19287
3315 1 12 . 1 1 21 21 TYR CB C 21 42.660 42.660 42.103 0.557 19287
3316 1 12 . 1 1 21 21 TYR H H 21 9.020 9.020 8.282 0.738 19287
3317 1 12 . 1 1 22 22 TYR N N 22 119.260 119.260 125.352 -6.092 19287
3318 1 12 . 1 1 22 22 TYR HA H 22 5.110 5.110 4.709 0.401 19287
3319 1 12 . 1 1 22 22 TYR C C 22 172.610 172.610 173.987 -1.377 19287
3320 1 12 . 1 1 22 22 TYR CA C 22 55.380 55.380 56.373 -0.993 19287
3321 1 12 . 1 1 22 22 TYR CB C 22 41.550 41.550 41.686 -0.136 19287
3322 1 12 . 1 1 22 22 TYR H H 22 9.410 9.410 9.588 -0.178 19287
3323 1 12 . 1 1 23 23 TYR N N 23 123.200 123.200 130.056 -6.856 19287
3324 1 12 . 1 1 23 23 TYR HA H 23 4.382 4.382 4.823 -0.441 19287
3325 1 12 . 1 1 23 23 TYR C C 23 173.250 173.250 174.405 -1.155 19287
3326 1 12 . 1 1 23 23 TYR CA C 23 58.360 58.360 57.801 0.559 19287
3327 1 12 . 1 1 23 23 TYR CB C 23 39.570 39.570 39.446 0.124 19287
3328 1 12 . 1 1 23 23 TYR H H 23 10.190 10.190 8.803 1.387 19287
3329 1 12 . 1 1 24 24 ASN N N 24 126.280 126.280 127.374 -1.094 19287
3330 1 12 . 1 1 24 24 ASN HA H 24 4.550 4.550 4.748 -0.198 19287
3331 1 12 . 1 1 24 24 ASN C C 24 174.000 174.000 175.221 -1.221 19287
3332 1 12 . 1 1 24 24 ASN CA C 24 51.360 51.360 51.733 -0.373 19287
3333 1 12 . 1 1 24 24 ASN CB C 24 40.040 40.040 39.290 0.750 19287
3334 1 12 . 1 1 24 24 ASN H H 24 7.890 7.890 8.607 -0.717 19287
3335 1 12 . 1 1 25 25 GLN N N 25 122.760 122.760 123.012 -0.252 19287
3336 1 12 . 1 1 25 25 GLN HA H 25 3.691 3.691 3.807 -0.116 19287
3337 1 12 . 1 1 25 25 GLN C C 25 175.670 175.670 176.775 -1.105 19287
3338 1 12 . 1 1 25 25 GLN CA C 25 57.480 57.480 58.139 -0.659 19287
3339 1 12 . 1 1 25 25 GLN CB C 25 28.120 28.120 27.730 0.390 19287
3340 1 12 . 1 1 25 25 GLN H H 25 8.440 8.440 7.929 0.511 19287
3341 1 12 . 1 1 26 26 TYR N N 26 119.190 119.190 119.420 -0.230 19287
3342 1 12 . 1 1 26 26 TYR HA H 26 4.160 4.160 4.281 -0.121 19287
3343 1 12 . 1 1 26 26 TYR C C 26 176.520 176.520 176.743 -0.223 19287
3344 1 12 . 1 1 26 26 TYR CA C 26 60.170 60.170 59.934 0.236 19287
3345 1 12 . 1 1 26 26 TYR CB C 26 36.880 36.880 37.708 -0.828 19287
3346 1 12 . 1 1 26 26 TYR H H 26 7.810 7.810 7.644 0.166 19287
3347 1 12 . 1 1 27 27 SER N N 27 109.600 109.600 111.781 -2.181 19287
3348 1 12 . 1 1 27 27 SER HA H 27 4.330 4.330 4.598 -0.268 19287
3349 1 12 . 1 1 27 27 SER C C 27 174.830 174.830 173.860 0.970 19287
3350 1 12 . 1 1 27 27 SER CA C 27 57.490 57.490 57.315 0.175 19287
3351 1 12 . 1 1 27 27 SER CB C 27 64.640 64.640 64.133 0.507 19287
3352 1 12 . 1 1 27 27 SER H H 27 7.350 7.350 7.573 -0.223 19287
3353 1 12 . 1 1 28 28 ASN N N 28 119.830 119.830 119.033 0.797 19287
3354 1 12 . 1 1 28 28 ASN HA H 28 4.060 4.060 4.390 -0.330 19287
3355 1 12 . 1 1 28 28 ASN C C 28 173.040 173.040 174.171 -1.131 19287
3356 1 12 . 1 1 28 28 ASN CA C 28 53.830 53.830 54.727 -0.897 19287
3357 1 12 . 1 1 28 28 ASN CB C 28 37.400 37.400 38.096 -0.696 19287
3358 1 12 . 1 1 28 28 ASN H H 28 7.930 7.930 7.932 -0.002 19287
3359 1 12 . 1 1 29 29 THR N N 29 103.070 103.070 112.178 -9.108 19287
3360 1 12 . 1 1 29 29 THR HA H 29 4.441 4.441 4.752 -0.311 19287
3361 1 12 . 1 1 29 29 THR C C 29 172.980 172.980 171.861 1.119 19287
3362 1 12 . 1 1 29 29 THR CA C 29 58.920 58.920 61.490 -2.570 19287
3363 1 12 . 1 1 29 29 THR CB C 29 73.260 73.260 71.443 1.817 19287
3364 1 12 . 1 1 29 29 THR H H 29 6.990 6.990 7.727 -0.737 19287
3365 1 12 . 1 1 30 30 CYS N N 30 118.340 118.340 121.162 -2.822 19287
3366 1 12 . 1 1 30 30 CYS HA H 30 5.462 5.462 5.520 -0.058 19287
3367 1 12 . 1 1 30 30 CYS C C 30 173.320 173.320 173.406 -0.086 19287
3368 1 12 . 1 1 30 30 CYS CA C 30 57.750 57.750 57.739 0.011 19287
3369 1 12 . 1 1 30 30 CYS CB C 30 50.680 50.680 30.716 19.964 19287
3370 1 12 . 1 1 30 30 CYS H H 30 8.954 8.954 8.666 0.288 19287
3371 1 12 . 1 1 31 31 HIS N N 31 118.930 118.930 123.863 -4.933 19287
3372 1 12 . 1 1 31 31 HIS HA H 31 4.780 4.780 5.073 -0.293 19287
3373 1 12 . 1 1 31 31 HIS C C 31 172.790 172.790 173.637 -0.847 19287
3374 1 12 . 1 1 31 31 HIS CA C 31 53.530 53.530 55.381 -1.851 19287
3375 1 12 . 1 1 31 31 HIS CB C 31 33.040 33.040 33.250 -0.210 19287
3376 1 12 . 1 1 31 31 HIS H H 31 9.010 9.010 9.718 -0.708 19287
3377 1 12 . 1 1 32 32 SER N N 32 117.600 117.600 120.431 -2.831 19287
3378 1 12 . 1 1 32 32 SER HA H 32 4.700 4.700 4.273 0.427 19287
3379 1 12 . 1 1 32 32 SER C C 32 174.930 174.930 173.836 1.094 19287
3380 1 12 . 1 1 32 32 SER CA C 32 57.980 57.980 59.161 -1.181 19287
3381 1 12 . 1 1 32 32 SER CB C 32 64.440 64.440 63.165 1.275 19287
3382 1 12 . 1 1 32 32 SER H H 32 8.740 8.740 8.307 0.433 19287
3383 1 12 . 1 1 33 33 PHE N N 33 120.690 120.690 120.138 0.552 19287
3384 1 12 . 1 1 33 33 PHE HA H 33 4.790 4.790 5.021 -0.231 19287
3385 1 12 . 1 1 33 33 PHE C C 33 171.810 171.810 173.796 -1.986 19287
3386 1 12 . 1 1 33 33 PHE CA C 33 56.200 56.200 56.072 0.128 19287
3387 1 12 . 1 1 33 33 PHE CB C 33 40.230 40.230 41.277 -1.047 19287
3388 1 12 . 1 1 33 33 PHE H H 33 8.830 8.830 8.941 -0.111 19287
3389 1 12 . 1 1 34 34 THR N N 34 116.650 116.650 112.191 4.459 19287
3390 1 12 . 1 1 34 34 THR HA H 34 3.965 3.965 4.179 -0.214 19287
3391 1 12 . 1 1 34 34 THR C C 34 172.600 172.600 172.473 0.127 19287
3392 1 12 . 1 1 34 34 THR CA C 34 61.980 61.980 61.158 0.822 19287
3393 1 12 . 1 1 34 34 THR CB C 34 68.530 68.530 69.657 -1.127 19287
3394 1 12 . 1 1 34 34 THR H H 34 8.400 8.400 8.092 0.308 19287
3395 1 12 . 1 1 35 35 TYR N N 35 127.790 127.790 125.444 2.346 19287
3396 1 12 . 1 1 35 35 TYR HA H 35 4.500 4.500 4.709 -0.209 19287
3397 1 12 . 1 1 35 35 TYR C C 35 174.200 174.200 173.996 0.204 19287
3398 1 12 . 1 1 35 35 TYR CA C 35 55.130 55.130 56.699 -1.569 19287
3399 1 12 . 1 1 35 35 TYR CB C 35 39.650 39.650 41.848 -2.198 19287
3400 1 12 . 1 1 35 35 TYR H H 35 8.010 8.010 8.505 -0.495 19287
3401 1 12 . 1 1 39 39 GLY N N 39 103.730 103.730 110.601 -6.871 19287
3402 1 12 . 1 1 39 39 GLY C C 39 175.700 175.700 174.514 1.186 19287
3403 1 12 . 1 1 39 39 GLY CA C 39 45.370 45.370 45.560 -0.190 19287
3404 1 12 . 1 1 39 39 GLY H H 39 8.500 8.500 8.527 -0.027 19287
3405 1 12 . 1 1 40 40 GLY N N 40 110.170 110.170 113.116 -2.946 19287
3406 1 12 . 1 1 40 40 GLY C C 40 173.140 173.140 175.110 -1.970 19287
3407 1 12 . 1 1 40 40 GLY CA C 40 44.320 44.320 45.045 -0.726 19287
3408 1 12 . 1 1 40 40 GLY H H 40 8.670 8.670 7.938 0.732 19287
3409 1 12 . 1 1 41 41 ASN N N 41 116.960 116.960 124.153 -7.193 19287
3410 1 12 . 1 1 41 41 ASN HA H 41 4.560 4.560 4.533 0.027 19287
3411 1 12 . 1 1 41 41 ASN C C 41 173.670 173.670 176.580 -2.910 19287
3412 1 12 . 1 1 41 41 ASN CA C 41 51.850 51.850 53.322 -1.472 19287
3413 1 12 . 1 1 41 41 ASN CB C 41 40.230 40.230 39.494 0.736 19287
3414 1 12 . 1 1 41 41 ASN H H 41 8.790 8.790 8.260 0.530 19287
3415 1 12 . 1 1 42 42 ALA N N 42 113.290 113.290 121.923 -8.633 19287
3416 1 12 . 1 1 42 42 ALA HA H 42 3.720 3.720 4.033 -0.313 19287
3417 1 12 . 1 1 42 42 ALA C C 42 177.220 177.220 178.473 -1.253 19287
3418 1 12 . 1 1 42 42 ALA CA C 42 52.810 52.810 54.331 -1.521 19287
3419 1 12 . 1 1 42 42 ALA CB C 42 17.980 17.980 18.277 -0.298 19287
3420 1 12 . 1 1 42 42 ALA H H 42 7.590 7.590 8.582 -0.992 19287
3421 1 12 . 1 1 43 43 ASN N N 43 117.710 117.710 114.862 2.848 19287
3422 1 12 . 1 1 43 43 ASN HA H 43 4.700 4.700 4.372 0.328 19287
3423 1 12 . 1 1 43 43 ASN C C 43 173.660 173.660 175.170 -1.510 19287
3424 1 12 . 1 1 43 43 ASN CA C 43 50.630 50.630 53.720 -3.090 19287
3425 1 12 . 1 1 43 43 ASN CB C 43 34.840 34.840 38.349 -3.509 19287
3426 1 12 . 1 1 43 43 ASN H H 43 7.900 7.900 8.043 -0.143 19287
3427 1 12 . 1 1 44 44 ARG N N 44 120.690 120.690 119.982 0.708 19287
3428 1 12 . 1 1 44 44 ARG HA H 44 4.692 4.692 4.043 0.649 19287
3429 1 12 . 1 1 44 44 ARG C C 44 173.530 173.530 174.880 -1.350 19287
3430 1 12 . 1 1 44 44 ARG CA C 44 56.660 56.660 57.009 -0.349 19287
3431 1 12 . 1 1 44 44 ARG CB C 44 31.450 31.450 30.309 1.141 19287
3432 1 12 . 1 1 44 44 ARG H H 44 6.860 6.860 6.991 -0.131 19287
3433 1 12 . 1 1 45 45 PHE N N 45 123.690 123.690 122.825 0.865 19287
3434 1 12 . 1 1 45 45 PHE HA H 45 4.810 4.810 4.892 -0.082 19287
3435 1 12 . 1 1 45 45 PHE C C 45 175.420 175.420 174.796 0.624 19287
3436 1 12 . 1 1 45 45 PHE CA C 45 55.670 55.670 56.761 -1.091 19287
3437 1 12 . 1 1 45 45 PHE CB C 45 43.790 43.790 43.300 0.490 19287
3438 1 12 . 1 1 45 45 PHE H H 45 9.340 9.340 8.062 1.278 19287
3439 1 12 . 1 1 46 46 ARG N N 46 120.920 120.920 118.233 2.687 19287
3440 1 12 . 1 1 46 46 ARG HA H 46 4.397 4.397 4.653 -0.256 19287
3441 1 12 . 1 1 46 46 ARG C C 46 176.560 176.560 175.448 1.112 19287
3442 1 12 . 1 1 46 46 ARG CA C 46 58.210 58.210 55.494 2.716 19287
3443 1 12 . 1 1 46 46 ARG CB C 46 30.900 30.900 31.081 -0.181 19287
3444 1 12 . 1 1 46 46 ARG H H 46 9.080 9.080 8.709 0.371 19287
3445 1 12 . 1 1 47 47 THR N N 47 102.800 102.800 112.088 -9.288 19287
3446 1 12 . 1 1 47 47 THR HA H 47 4.660 4.660 4.157 0.503 19287
3447 1 12 . 1 1 47 47 THR C C 47 174.110 174.110 173.278 0.832 19287
3448 1 12 . 1 1 47 47 THR CA C 47 58.170 58.170 59.344 -1.174 19287
3449 1 12 . 1 1 47 47 THR CB C 47 72.380 72.380 71.149 1.231 19287
3450 1 12 . 1 1 47 47 THR H H 47 7.230 7.230 7.301 -0.071 19287
3451 1 12 . 1 1 48 48 ILE N N 48 123.200 123.200 123.796 -0.596 19287
3452 1 12 . 1 1 48 48 ILE HA H 48 2.901 2.901 3.470 -0.569 19287
3453 1 12 . 1 1 48 48 ILE C C 48 176.420 176.420 175.663 0.757 19287
3454 1 12 . 1 1 48 48 ILE CA C 48 64.000 64.000 63.255 0.745 19287
3455 1 12 . 1 1 48 48 ILE CB C 48 37.060 37.060 38.025 -0.965 19287
3456 1 12 . 1 1 48 48 ILE H H 48 8.110 8.110 7.931 0.179 19287
3457 1 12 . 1 1 49 49 ASP N N 49 119.560 119.560 119.686 -0.126 19287
3458 1 12 . 1 1 49 49 ASP HA H 49 4.130 4.130 4.219 -0.089 19287
3459 1 12 . 1 1 49 49 ASP C C 49 177.740 177.740 178.116 -0.376 19287
3460 1 12 . 1 1 49 49 ASP CA C 49 56.690 56.690 57.652 -0.962 19287
3461 1 12 . 1 1 49 49 ASP CB C 49 39.970 39.970 40.518 -0.548 19287
3462 1 12 . 1 1 49 49 ASP H H 49 7.700 7.700 7.665 0.035 19287
3463 1 12 . 1 1 50 50 GLU N N 50 117.720 117.720 118.965 -1.245 19287
3464 1 12 . 1 1 50 50 GLU HA H 50 3.710 3.710 4.155 -0.445 19287
3465 1 12 . 1 1 50 50 GLU C C 50 177.550 177.550 178.411 -0.861 19287
3466 1 12 . 1 1 50 50 GLU CA C 50 58.550 58.550 58.465 0.085 19287
3467 1 12 . 1 1 50 50 GLU CB C 50 29.190 29.190 29.564 -0.373 19287
3468 1 12 . 1 1 50 50 GLU H H 50 7.410 7.410 7.591 -0.181 19287
3469 1 12 . 1 1 51 51 CYS N N 51 120.260 120.260 119.310 0.950 19287
3470 1 12 . 1 1 51 51 CYS HA H 51 1.650 1.650 2.687 -1.037 19287
3471 1 12 . 1 1 51 51 CYS C C 51 175.070 175.070 175.930 -0.860 19287
3472 1 12 . 1 1 51 51 CYS CA C 51 59.120 59.120 61.073 -1.953 19287
3473 1 12 . 1 1 51 51 CYS CB C 51 43.000 43.000 25.788 17.212 19287
3474 1 12 . 1 1 51 51 CYS H H 51 6.760 6.760 7.605 -0.845 19287
3475 1 12 . 1 1 52 52 ASN N N 52 120.160 120.160 119.428 0.732 19287
3476 1 12 . 1 1 52 52 ASN HA H 52 4.090 4.090 4.348 -0.258 19287
3477 1 12 . 1 1 52 52 ASN C C 52 177.820 177.820 177.504 0.316 19287
3478 1 12 . 1 1 52 52 ASN CA C 52 55.060 55.060 56.042 -0.982 19287
3479 1 12 . 1 1 52 52 ASN CB C 52 37.500 37.500 37.702 -0.202 19287
3480 1 12 . 1 1 52 52 ASN H H 52 8.650 8.650 8.462 0.188 19287
3481 1 12 . 1 1 53 53 ARG N N 53 117.000 117.000 118.370 -1.370 19287
3482 1 12 . 1 1 53 53 ARG HA H 53 3.770 3.770 4.021 -0.251 19287
3483 1 12 . 1 1 53 53 ARG C C 53 177.360 177.360 177.545 -0.185 19287
3484 1 12 . 1 1 53 53 ARG CA C 53 58.490 58.490 58.710 -0.220 19287
3485 1 12 . 1 1 53 53 ARG CB C 53 30.180 30.180 29.213 0.967 19287
3486 1 12 . 1 1 53 53 ARG H H 53 7.900 7.900 7.607 0.293 19287
3487 1 12 . 1 1 54 54 THR N N 54 112.080 112.080 112.115 -0.035 19287
3488 1 12 . 1 1 54 54 THR HA H 54 3.838 3.838 4.466 -0.628 19287
3489 1 12 . 1 1 54 54 THR C C 54 174.990 174.990 174.553 0.437 19287
3490 1 12 . 1 1 54 54 THR CA C 54 65.740 65.740 63.508 2.232 19287
3491 1 12 . 1 1 54 54 THR CB C 54 68.870 68.870 70.205 -1.335 19287
3492 1 12 . 1 1 54 54 THR H H 54 7.260 7.260 7.569 -0.309 19287
3493 1 12 . 1 1 55 55 CYS N N 55 112.540 112.540 117.184 -4.644 19287
3494 1 12 . 1 1 55 55 CYS HA H 55 4.400 4.400 4.418 -0.018 19287
3495 1 12 . 1 1 55 55 CYS C C 55 172.940 172.940 174.067 -1.127 19287
3496 1 12 . 1 1 55 55 CYS CA C 55 54.230 54.230 58.112 -3.882 19287
3497 1 12 . 1 1 55 55 CYS CB C 55 42.930 42.930 29.353 13.577 19287
3498 1 12 . 1 1 55 55 CYS H H 55 7.590 7.590 7.394 0.196 19287
3499 1 12 . 1 1 56 56 VAL N N 56 119.720 119.720 123.522 -3.802 19287
3500 1 12 . 1 1 56 56 VAL HA H 56 3.631 3.631 4.019 -0.388 19287
3501 1 12 . 1 1 56 56 VAL C C 56 176.710 176.710 176.432 0.278 19287
3502 1 12 . 1 1 56 56 VAL CA C 56 64.540 64.540 63.507 1.033 19287
3503 1 12 . 1 1 56 56 VAL CB C 56 30.970 30.970 31.430 -0.460 19287
3504 1 12 . 1 1 56 56 VAL H H 56 7.280 7.280 7.786 -0.506 19287
3505 1 13 . 1 1 2 2 PRO HA H 2 4.017 4.017 4.430 -0.413 19287
3506 1 13 . 1 1 2 2 PRO C C 2 177.920 177.920 177.910 0.010 19287
3507 1 13 . 1 1 2 2 PRO CA C 2 62.800 62.800 62.470 0.330 19287
3508 1 13 . 1 1 2 2 PRO CB C 2 32.050 32.050 32.657 -0.607 19287
3509 1 13 . 1 1 3 3 ARG N N 3 122.340 122.340 120.652 1.688 19287
3510 1 13 . 1 1 3 3 ARG HA H 3 3.786 3.786 4.294 -0.508 19287
3511 1 13 . 1 1 3 3 ARG C C 3 178.950 178.950 175.605 3.345 19287
3512 1 13 . 1 1 3 3 ARG CA C 3 58.410 58.410 57.673 0.737 19287
3513 1 13 . 1 1 3 3 ARG CB C 3 29.220 29.220 28.706 0.514 19287
3514 1 13 . 1 1 3 3 ARG H H 3 8.550 8.550 8.810 -0.260 19287
3515 1 13 . 1 1 4 4 PHE N N 4 113.010 113.010 116.577 -3.567 19287
3516 1 13 . 1 1 4 4 PHE HA H 4 4.300 4.300 4.569 -0.269 19287
3517 1 13 . 1 1 4 4 PHE C C 4 176.070 176.070 176.019 0.051 19287
3518 1 13 . 1 1 4 4 PHE CA C 4 58.220 58.220 57.181 1.039 19287
3519 1 13 . 1 1 4 4 PHE CB C 4 37.310 37.310 37.842 -0.531 19287
3520 1 13 . 1 1 4 4 PHE H H 4 7.150 7.150 7.447 -0.297 19287
3521 1 13 . 1 1 5 5 CYS N N 5 118.600 118.600 113.767 4.833 19287
3522 1 13 . 1 1 5 5 CYS HA H 5 4.130 4.130 4.413 -0.283 19287
3523 1 13 . 1 1 5 5 CYS C C 5 173.450 173.450 175.227 -1.777 19287
3524 1 13 . 1 1 5 5 CYS CA C 5 57.960 57.960 57.777 0.183 19287
3525 1 13 . 1 1 5 5 CYS CB C 5 39.210 39.210 26.672 12.538 19287
3526 1 13 . 1 1 5 5 CYS H H 5 7.090 7.090 7.000 0.090 19287
3527 1 13 . 1 1 6 6 GLU N N 6 110.710 110.710 119.452 -8.742 19287
3528 1 13 . 1 1 6 6 GLU HA H 6 4.182 4.182 4.414 -0.232 19287
3529 1 13 . 1 1 6 6 GLU C C 6 176.310 176.310 176.031 0.279 19287
3530 1 13 . 1 1 6 6 GLU CA C 6 55.510 55.510 55.180 0.330 19287
3531 1 13 . 1 1 6 6 GLU CB C 6 28.160 28.160 28.626 -0.466 19287
3532 1 13 . 1 1 6 6 GLU H H 6 7.300 7.300 8.116 -0.816 19287
3533 1 13 . 1 1 7 7 LEU N N 7 119.090 119.090 120.658 -1.568 19287
3534 1 13 . 1 1 7 7 LEU HA H 7 4.160 4.160 4.407 -0.247 19287
3535 1 13 . 1 1 7 7 LEU C C 7 176.630 176.630 176.063 0.567 19287
3536 1 13 . 1 1 7 7 LEU CA C 7 54.510 54.510 53.668 0.842 19287
3537 1 13 . 1 1 7 7 LEU CB C 7 42.330 42.330 42.670 -0.340 19287
3538 1 13 . 1 1 7 7 LEU H H 7 7.210 7.210 7.400 -0.190 19287
3539 1 13 . 1 1 8 8 ALA N N 8 124.490 124.490 122.362 2.128 19287
3540 1 13 . 1 1 8 8 ALA HA H 8 4.250 4.250 4.780 -0.530 19287
3541 1 13 . 1 1 8 8 ALA C C 8 174.710 174.710 175.708 -0.998 19287
3542 1 13 . 1 1 8 8 ALA CA C 8 50.210 50.210 48.665 1.545 19287
3543 1 13 . 1 1 8 8 ALA CB C 8 16.930 16.930 19.355 -2.425 19287
3544 1 13 . 1 1 8 8 ALA H H 8 8.280 8.280 8.236 0.044 19287
3545 1 13 . 1 1 9 9 PRO HA H 9 4.180 4.180 4.648 -0.468 19287
3546 1 13 . 1 1 9 9 PRO C C 9 176.700 176.700 176.359 0.341 19287
3547 1 13 . 1 1 9 9 PRO CA C 9 61.490 61.490 62.982 -1.492 19287
3548 1 13 . 1 1 9 9 PRO CB C 9 30.360 30.360 32.116 -1.756 19287
3549 1 13 . 1 1 10 10 SER N N 10 112.100 112.100 121.162 -9.062 19287
3550 1 13 . 1 1 10 10 SER HA H 10 4.630 4.630 4.426 0.204 19287
3551 1 13 . 1 1 10 10 SER C C 10 174.190 174.190 175.040 -0.850 19287
3552 1 13 . 1 1 10 10 SER CA C 10 55.360 55.360 56.825 -1.466 19287
3553 1 13 . 1 1 10 10 SER CB C 10 64.550 64.550 62.515 2.035 19287
3554 1 13 . 1 1 10 10 SER H H 10 7.450 7.450 8.463 -1.013 19287
3555 1 13 . 1 1 11 11 ALA N N 11 129.980 129.980 128.696 1.284 19287
3556 1 13 . 1 1 11 11 ALA HA H 11 4.496 4.496 4.164 0.332 19287
3557 1 13 . 1 1 11 11 ALA C C 11 178.510 178.510 178.769 -0.259 19287
3558 1 13 . 1 1 11 11 ALA CA C 11 54.810 54.810 53.297 1.513 19287
3559 1 13 . 1 1 11 11 ALA CB C 11 19.910 19.910 18.899 1.011 19287
3560 1 13 . 1 1 11 11 ALA H H 11 9.210 9.210 8.209 1.001 19287
3561 1 13 . 1 1 12 12 GLY N N 12 104.410 104.410 105.430 -1.020 19287
3562 1 13 . 1 1 12 12 GLY C C 12 174.850 174.850 175.578 -0.728 19287
3563 1 13 . 1 1 12 12 GLY CA C 12 44.450 44.450 44.930 -0.480 19287
3564 1 13 . 1 1 12 12 GLY H H 12 8.190 8.190 8.280 -0.090 19287
3565 1 13 . 1 1 14 14 CYS HA H 14 4.250 4.250 4.636 -0.386 19287
3566 1 13 . 1 1 14 14 CYS C C 14 172.410 172.410 173.438 -1.028 19287
3567 1 13 . 1 1 14 14 CYS CA C 14 59.750 59.750 57.934 1.816 19287
3568 1 13 . 1 1 14 14 CYS CB C 14 39.130 39.130 30.421 8.709 19287
3569 1 13 . 1 1 15 15 PHE N N 15 116.000 116.000 123.909 -7.909 19287
3570 1 13 . 1 1 15 15 PHE HA H 15 4.380 4.380 4.624 -0.244 19287
3571 1 13 . 1 1 15 15 PHE C C 15 174.300 174.300 174.601 -0.301 19287
3572 1 13 . 1 1 15 15 PHE CA C 15 56.830 56.830 57.844 -1.014 19287
3573 1 13 . 1 1 15 15 PHE CB C 15 39.440 39.440 38.903 0.537 19287
3574 1 13 . 1 1 15 15 PHE H H 15 7.960 7.960 8.679 -0.719 19287
3575 1 13 . 1 1 16 16 ALA N N 16 125.630 125.630 130.616 -4.986 19287
3576 1 13 . 1 1 16 16 ALA HA H 16 4.320 4.320 4.632 -0.312 19287
3577 1 13 . 1 1 16 16 ALA C C 16 174.300 174.300 175.416 -1.116 19287
3578 1 13 . 1 1 16 16 ALA CA C 16 50.130 50.130 51.910 -1.780 19287
3579 1 13 . 1 1 16 16 ALA CB C 16 19.180 19.180 21.818 -2.638 19287
3580 1 13 . 1 1 16 16 ALA H H 16 7.800 7.800 8.093 -0.293 19287
3581 1 13 . 1 1 17 17 PHE N N 17 116.330 116.330 121.359 -5.029 19287
3582 1 13 . 1 1 17 17 PHE HA H 17 4.390 4.390 4.619 -0.229 19287
3583 1 13 . 1 1 17 17 PHE C C 17 175.310 175.310 174.215 1.095 19287
3584 1 13 . 1 1 17 17 PHE CA C 17 57.160 57.160 56.196 0.964 19287
3585 1 13 . 1 1 17 17 PHE CB C 17 39.380 39.380 40.018 -0.638 19287
3586 1 13 . 1 1 17 17 PHE H H 17 7.330 7.330 8.346 -1.016 19287
3587 1 13 . 1 1 18 18 VAL N N 18 122.890 122.890 124.455 -1.565 19287
3588 1 13 . 1 1 18 18 VAL HA H 18 4.475 4.475 4.783 -0.308 19287
3589 1 13 . 1 1 18 18 VAL C C 18 173.590 173.590 173.740 -0.150 19287
3590 1 13 . 1 1 18 18 VAL CA C 18 58.900 58.900 58.802 0.098 19287
3591 1 13 . 1 1 18 18 VAL CB C 18 33.900 33.900 33.706 0.194 19287
3592 1 13 . 1 1 18 18 VAL H H 18 8.680 8.680 8.778 -0.098 19287
3593 1 13 . 1 1 19 19 PRO HA H 19 4.275 4.275 4.636 -0.361 19287
3594 1 13 . 1 1 19 19 PRO C C 19 176.940 176.940 176.486 0.454 19287
3595 1 13 . 1 1 19 19 PRO CA C 19 64.060 64.060 62.921 1.139 19287
3596 1 13 . 1 1 19 19 PRO CB C 19 31.710 31.710 31.621 0.089 19287
3597 1 13 . 1 1 20 20 SER N N 20 120.230 120.230 119.322 0.908 19287
3598 1 13 . 1 1 20 20 SER HA H 20 4.780 4.780 4.781 -0.001 19287
3599 1 13 . 1 1 20 20 SER C C 20 170.900 170.900 173.292 -2.392 19287
3600 1 13 . 1 1 20 20 SER CA C 20 57.450 57.450 57.271 0.179 19287
3601 1 13 . 1 1 20 20 SER CB C 20 67.910 67.910 66.559 1.351 19287
3602 1 13 . 1 1 20 20 SER H H 20 8.390 8.390 7.885 0.505 19287
3603 1 13 . 1 1 21 21 TYR N N 21 118.220 118.220 118.491 -0.271 19287
3604 1 13 . 1 1 21 21 TYR HA H 21 5.600 5.600 5.271 0.329 19287
3605 1 13 . 1 1 21 21 TYR C C 21 173.770 173.770 175.434 -1.664 19287
3606 1 13 . 1 1 21 21 TYR CA C 21 57.740 57.740 58.233 -0.493 19287
3607 1 13 . 1 1 21 21 TYR CB C 21 42.660 42.660 41.744 0.916 19287
3608 1 13 . 1 1 21 21 TYR H H 21 9.020 9.020 8.997 0.023 19287
3609 1 13 . 1 1 22 22 TYR N N 22 119.260 119.260 123.104 -3.844 19287
3610 1 13 . 1 1 22 22 TYR HA H 22 5.110 5.110 4.710 0.400 19287
3611 1 13 . 1 1 22 22 TYR C C 22 172.610 172.610 174.229 -1.619 19287
3612 1 13 . 1 1 22 22 TYR CA C 22 55.380 55.380 56.036 -0.656 19287
3613 1 13 . 1 1 22 22 TYR CB C 22 41.550 41.550 42.963 -1.413 19287
3614 1 13 . 1 1 22 22 TYR H H 22 9.410 9.410 9.713 -0.303 19287
3615 1 13 . 1 1 23 23 TYR N N 23 123.200 123.200 123.723 -0.523 19287
3616 1 13 . 1 1 23 23 TYR HA H 23 4.382 4.382 4.893 -0.511 19287
3617 1 13 . 1 1 23 23 TYR C C 23 173.250 173.250 174.104 -0.854 19287
3618 1 13 . 1 1 23 23 TYR CA C 23 58.360 58.360 56.808 1.552 19287
3619 1 13 . 1 1 23 23 TYR CB C 23 39.570 39.570 40.898 -1.328 19287
3620 1 13 . 1 1 23 23 TYR H H 23 10.190 10.190 8.166 2.024 19287
3621 1 13 . 1 1 24 24 ASN N N 24 126.280 126.280 128.136 -1.856 19287
3622 1 13 . 1 1 24 24 ASN HA H 24 4.550 4.550 4.926 -0.376 19287
3623 1 13 . 1 1 24 24 ASN C C 24 174.000 174.000 175.364 -1.364 19287
3624 1 13 . 1 1 24 24 ASN CA C 24 51.360 51.360 51.645 -0.285 19287
3625 1 13 . 1 1 24 24 ASN CB C 24 40.040 40.040 38.552 1.488 19287
3626 1 13 . 1 1 24 24 ASN H H 24 7.890 7.890 8.659 -0.769 19287
3627 1 13 . 1 1 25 25 GLN N N 25 122.760 122.760 123.040 -0.280 19287
3628 1 13 . 1 1 25 25 GLN HA H 25 3.691 3.691 3.618 0.073 19287
3629 1 13 . 1 1 25 25 GLN C C 25 175.670 175.670 176.859 -1.189 19287
3630 1 13 . 1 1 25 25 GLN CA C 25 57.480 57.480 58.338 -0.858 19287
3631 1 13 . 1 1 25 25 GLN CB C 25 28.120 28.120 27.428 0.692 19287
3632 1 13 . 1 1 25 25 GLN H H 25 8.440 8.440 7.872 0.568 19287
3633 1 13 . 1 1 26 26 TYR N N 26 119.190 119.190 119.634 -0.444 19287
3634 1 13 . 1 1 26 26 TYR HA H 26 4.160 4.160 4.268 -0.108 19287
3635 1 13 . 1 1 26 26 TYR C C 26 176.520 176.520 177.110 -0.590 19287
3636 1 13 . 1 1 26 26 TYR CA C 26 60.170 60.170 60.137 0.033 19287
3637 1 13 . 1 1 26 26 TYR CB C 26 36.880 36.880 37.613 -0.733 19287
3638 1 13 . 1 1 26 26 TYR H H 26 7.810 7.810 7.543 0.267 19287
3639 1 13 . 1 1 27 27 SER N N 27 109.600 109.600 112.477 -2.877 19287
3640 1 13 . 1 1 27 27 SER HA H 27 4.330 4.330 4.502 -0.172 19287
3641 1 13 . 1 1 27 27 SER C C 27 174.830 174.830 174.305 0.525 19287
3642 1 13 . 1 1 27 27 SER CA C 27 57.490 57.490 57.311 0.179 19287
3643 1 13 . 1 1 27 27 SER CB C 27 64.640 64.640 63.874 0.766 19287
3644 1 13 . 1 1 27 27 SER H H 27 7.350 7.350 7.682 -0.332 19287
3645 1 13 . 1 1 28 28 ASN N N 28 119.830 119.830 119.598 0.232 19287
3646 1 13 . 1 1 28 28 ASN HA H 28 4.060 4.060 4.405 -0.345 19287
3647 1 13 . 1 1 28 28 ASN C C 28 173.040 173.040 174.066 -1.026 19287
3648 1 13 . 1 1 28 28 ASN CA C 28 53.830 53.830 54.734 -0.904 19287
3649 1 13 . 1 1 28 28 ASN CB C 28 37.400 37.400 38.127 -0.727 19287
3650 1 13 . 1 1 28 28 ASN H H 28 7.930 7.930 7.991 -0.061 19287
3651 1 13 . 1 1 29 29 THR N N 29 103.070 103.070 111.891 -8.821 19287
3652 1 13 . 1 1 29 29 THR HA H 29 4.441 4.441 4.723 -0.282 19287
3653 1 13 . 1 1 29 29 THR C C 29 172.980 172.980 172.060 0.920 19287
3654 1 13 . 1 1 29 29 THR CA C 29 58.920 58.920 61.488 -2.568 19287
3655 1 13 . 1 1 29 29 THR CB C 29 73.260 73.260 71.178 2.082 19287
3656 1 13 . 1 1 29 29 THR H H 29 6.990 6.990 7.837 -0.847 19287
3657 1 13 . 1 1 30 30 CYS N N 30 118.340 118.340 118.875 -0.535 19287
3658 1 13 . 1 1 30 30 CYS HA H 30 5.462 5.462 5.302 0.160 19287
3659 1 13 . 1 1 30 30 CYS C C 30 173.320 173.320 173.485 -0.165 19287
3660 1 13 . 1 1 30 30 CYS CA C 30 57.750 57.750 57.361 0.389 19287
3661 1 13 . 1 1 30 30 CYS CB C 30 50.680 50.680 31.593 19.087 19287
3662 1 13 . 1 1 30 30 CYS H H 30 8.954 8.954 8.633 0.321 19287
3663 1 13 . 1 1 31 31 HIS N N 31 118.930 118.930 120.125 -1.195 19287
3664 1 13 . 1 1 31 31 HIS HA H 31 4.780 4.780 4.985 -0.205 19287
3665 1 13 . 1 1 31 31 HIS C C 31 172.790 172.790 173.513 -0.723 19287
3666 1 13 . 1 1 31 31 HIS CA C 31 53.530 53.530 55.454 -1.924 19287
3667 1 13 . 1 1 31 31 HIS CB C 31 33.040 33.040 33.371 -0.331 19287
3668 1 13 . 1 1 31 31 HIS H H 31 9.010 9.010 9.253 -0.243 19287
3669 1 13 . 1 1 32 32 SER N N 32 117.600 117.600 118.129 -0.529 19287
3670 1 13 . 1 1 32 32 SER HA H 32 4.700 4.700 4.283 0.417 19287
3671 1 13 . 1 1 32 32 SER C C 32 174.930 174.930 173.671 1.259 19287
3672 1 13 . 1 1 32 32 SER CA C 32 57.980 57.980 58.558 -0.578 19287
3673 1 13 . 1 1 32 32 SER CB C 32 64.440 64.440 63.515 0.925 19287
3674 1 13 . 1 1 32 32 SER H H 32 8.740 8.740 7.815 0.925 19287
3675 1 13 . 1 1 33 33 PHE N N 33 120.690 120.690 118.790 1.900 19287
3676 1 13 . 1 1 33 33 PHE HA H 33 4.790 4.790 4.966 -0.176 19287
3677 1 13 . 1 1 33 33 PHE C C 33 171.810 171.810 173.594 -1.784 19287
3678 1 13 . 1 1 33 33 PHE CA C 33 56.200 56.200 55.848 0.352 19287
3679 1 13 . 1 1 33 33 PHE CB C 33 40.230 40.230 41.161 -0.931 19287
3680 1 13 . 1 1 33 33 PHE H H 33 8.830 8.830 9.105 -0.275 19287
3681 1 13 . 1 1 34 34 THR N N 34 116.650 116.650 112.481 4.169 19287
3682 1 13 . 1 1 34 34 THR HA H 34 3.965 3.965 4.316 -0.351 19287
3683 1 13 . 1 1 34 34 THR C C 34 172.600 172.600 172.336 0.264 19287
3684 1 13 . 1 1 34 34 THR CA C 34 61.980 61.980 60.811 1.169 19287
3685 1 13 . 1 1 34 34 THR CB C 34 68.530 68.530 69.324 -0.794 19287
3686 1 13 . 1 1 34 34 THR H H 34 8.400 8.400 8.168 0.232 19287
3687 1 13 . 1 1 35 35 TYR N N 35 127.790 127.790 124.934 2.856 19287
3688 1 13 . 1 1 35 35 TYR HA H 35 4.500 4.500 4.493 0.007 19287
3689 1 13 . 1 1 35 35 TYR C C 35 174.200 174.200 175.093 -0.893 19287
3690 1 13 . 1 1 35 35 TYR CA C 35 55.130 55.130 56.645 -1.515 19287
3691 1 13 . 1 1 35 35 TYR CB C 35 39.650 39.650 42.213 -2.563 19287
3692 1 13 . 1 1 35 35 TYR H H 35 8.010 8.010 7.813 0.197 19287
3693 1 13 . 1 1 39 39 GLY N N 39 103.730 103.730 105.758 -2.028 19287
3694 1 13 . 1 1 39 39 GLY C C 39 175.700 175.700 172.832 2.868 19287
3695 1 13 . 1 1 39 39 GLY CA C 39 45.370 45.370 44.526 0.843 19287
3696 1 13 . 1 1 39 39 GLY H H 39 8.500 8.500 7.354 1.146 19287
3697 1 13 . 1 1 40 40 GLY N N 40 110.170 110.170 107.215 2.955 19287
3698 1 13 . 1 1 40 40 GLY C C 40 173.140 173.140 172.629 0.511 19287
3699 1 13 . 1 1 40 40 GLY CA C 40 44.320 44.320 44.594 -0.274 19287
3700 1 13 . 1 1 40 40 GLY H H 40 8.670 8.670 7.805 0.865 19287
3701 1 13 . 1 1 41 41 ASN N N 41 116.960 116.960 117.755 -0.795 19287
3702 1 13 . 1 1 41 41 ASN HA H 41 4.560 4.560 4.930 -0.370 19287
3703 1 13 . 1 1 41 41 ASN C C 41 173.670 173.670 175.605 -1.935 19287
3704 1 13 . 1 1 41 41 ASN CA C 41 51.850 51.850 52.000 -0.150 19287
3705 1 13 . 1 1 41 41 ASN CB C 41 40.230 40.230 39.907 0.323 19287
3706 1 13 . 1 1 41 41 ASN H H 41 8.790 8.790 8.761 0.029 19287
3707 1 13 . 1 1 42 42 ALA N N 42 113.290 113.290 122.683 -9.393 19287
3708 1 13 . 1 1 42 42 ALA HA H 42 3.720 3.720 4.050 -0.330 19287
3709 1 13 . 1 1 42 42 ALA C C 42 177.220 177.220 178.412 -1.192 19287
3710 1 13 . 1 1 42 42 ALA CA C 42 52.810 52.810 54.602 -1.792 19287
3711 1 13 . 1 1 42 42 ALA CB C 42 17.980 17.980 18.447 -0.467 19287
3712 1 13 . 1 1 42 42 ALA H H 42 7.590 7.590 8.640 -1.050 19287
3713 1 13 . 1 1 43 43 ASN N N 43 117.710 117.710 115.330 2.380 19287
3714 1 13 . 1 1 43 43 ASN HA H 43 4.700 4.700 4.488 0.212 19287
3715 1 13 . 1 1 43 43 ASN C C 43 173.660 173.660 175.057 -1.397 19287
3716 1 13 . 1 1 43 43 ASN CA C 43 50.630 50.630 54.153 -3.523 19287
3717 1 13 . 1 1 43 43 ASN CB C 43 34.840 34.840 38.472 -3.632 19287
3718 1 13 . 1 1 43 43 ASN H H 43 7.900 7.900 8.113 -0.213 19287
3719 1 13 . 1 1 44 44 ARG N N 44 120.690 120.690 120.100 0.590 19287
3720 1 13 . 1 1 44 44 ARG HA H 44 4.692 4.692 4.575 0.117 19287
3721 1 13 . 1 1 44 44 ARG C C 44 173.530 173.530 175.097 -1.567 19287
3722 1 13 . 1 1 44 44 ARG CA C 44 56.660 56.660 57.041 -0.381 19287
3723 1 13 . 1 1 44 44 ARG CB C 44 31.450 31.450 30.175 1.275 19287
3724 1 13 . 1 1 44 44 ARG H H 44 6.860 6.860 7.102 -0.242 19287
3725 1 13 . 1 1 45 45 PHE N N 45 123.690 123.690 122.721 0.969 19287
3726 1 13 . 1 1 45 45 PHE HA H 45 4.810 4.810 4.886 -0.076 19287
3727 1 13 . 1 1 45 45 PHE C C 45 175.420 175.420 175.349 0.071 19287
3728 1 13 . 1 1 45 45 PHE CA C 45 55.670 55.670 56.889 -1.219 19287
3729 1 13 . 1 1 45 45 PHE CB C 45 43.790 43.790 43.271 0.519 19287
3730 1 13 . 1 1 45 45 PHE H H 45 9.340 9.340 9.015 0.325 19287
3731 1 13 . 1 1 46 46 ARG N N 46 120.920 120.920 118.654 2.266 19287
3732 1 13 . 1 1 46 46 ARG HA H 46 4.397 4.397 4.616 -0.219 19287
3733 1 13 . 1 1 46 46 ARG C C 46 176.560 176.560 175.671 0.889 19287
3734 1 13 . 1 1 46 46 ARG CA C 46 58.210 58.210 56.314 1.896 19287
3735 1 13 . 1 1 46 46 ARG CB C 46 30.900 30.900 30.604 0.296 19287
3736 1 13 . 1 1 46 46 ARG H H 46 9.080 9.080 8.754 0.326 19287
3737 1 13 . 1 1 47 47 THR N N 47 102.800 102.800 112.631 -9.831 19287
3738 1 13 . 1 1 47 47 THR HA H 47 4.660 4.660 3.397 1.263 19287
3739 1 13 . 1 1 47 47 THR C C 47 174.110 174.110 172.997 1.113 19287
3740 1 13 . 1 1 47 47 THR CA C 47 58.170 58.170 60.037 -1.867 19287
3741 1 13 . 1 1 47 47 THR CB C 47 72.380 72.380 70.403 1.977 19287
3742 1 13 . 1 1 47 47 THR H H 47 7.230 7.230 7.403 -0.173 19287
3743 1 13 . 1 1 48 48 ILE N N 48 123.200 123.200 123.792 -0.592 19287
3744 1 13 . 1 1 48 48 ILE HA H 48 2.901 2.901 3.741 -0.840 19287
3745 1 13 . 1 1 48 48 ILE C C 48 176.420 176.420 175.829 0.591 19287
3746 1 13 . 1 1 48 48 ILE CA C 48 64.000 64.000 63.199 0.801 19287
3747 1 13 . 1 1 48 48 ILE CB C 48 37.060 37.060 38.399 -1.339 19287
3748 1 13 . 1 1 48 48 ILE H H 48 8.110 8.110 8.170 -0.060 19287
3749 1 13 . 1 1 49 49 ASP N N 49 119.560 119.560 120.051 -0.491 19287
3750 1 13 . 1 1 49 49 ASP HA H 49 4.130 4.130 4.320 -0.190 19287
3751 1 13 . 1 1 49 49 ASP C C 49 177.740 177.740 178.725 -0.985 19287
3752 1 13 . 1 1 49 49 ASP CA C 49 56.690 56.690 57.581 -0.891 19287
3753 1 13 . 1 1 49 49 ASP CB C 49 39.970 39.970 39.921 0.049 19287
3754 1 13 . 1 1 49 49 ASP H H 49 7.700 7.700 7.704 -0.004 19287
3755 1 13 . 1 1 50 50 GLU N N 50 117.720 117.720 119.850 -2.130 19287
3756 1 13 . 1 1 50 50 GLU HA H 50 3.710 3.710 4.231 -0.521 19287
3757 1 13 . 1 1 50 50 GLU C C 50 177.550 177.550 178.392 -0.842 19287
3758 1 13 . 1 1 50 50 GLU CA C 50 58.550 58.550 58.795 -0.246 19287
3759 1 13 . 1 1 50 50 GLU CB C 50 29.190 29.190 29.789 -0.599 19287
3760 1 13 . 1 1 50 50 GLU H H 50 7.410 7.410 7.650 -0.240 19287
3761 1 13 . 1 1 51 51 CYS N N 51 120.260 120.260 119.262 0.998 19287
3762 1 13 . 1 1 51 51 CYS HA H 51 1.650 1.650 3.063 -1.413 19287
3763 1 13 . 1 1 51 51 CYS C C 51 175.070 175.070 176.010 -0.940 19287
3764 1 13 . 1 1 51 51 CYS CA C 51 59.120 59.120 61.277 -2.157 19287
3765 1 13 . 1 1 51 51 CYS CB C 51 43.000 43.000 25.571 17.429 19287
3766 1 13 . 1 1 51 51 CYS H H 51 6.760 6.760 7.531 -0.771 19287
3767 1 13 . 1 1 52 52 ASN N N 52 120.160 120.160 119.336 0.824 19287
3768 1 13 . 1 1 52 52 ASN HA H 52 4.090 4.090 4.356 -0.266 19287
3769 1 13 . 1 1 52 52 ASN C C 52 177.820 177.820 177.573 0.247 19287
3770 1 13 . 1 1 52 52 ASN CA C 52 55.060 55.060 56.206 -1.146 19287
3771 1 13 . 1 1 52 52 ASN CB C 52 37.500 37.500 38.140 -0.640 19287
3772 1 13 . 1 1 52 52 ASN H H 52 8.650 8.650 8.552 0.098 19287
3773 1 13 . 1 1 53 53 ARG N N 53 117.000 117.000 118.189 -1.189 19287
3774 1 13 . 1 1 53 53 ARG HA H 53 3.770 3.770 4.057 -0.287 19287
3775 1 13 . 1 1 53 53 ARG C C 53 177.360 177.360 177.560 -0.200 19287
3776 1 13 . 1 1 53 53 ARG CA C 53 58.490 58.490 58.661 -0.171 19287
3777 1 13 . 1 1 53 53 ARG CB C 53 30.180 30.180 29.409 0.771 19287
3778 1 13 . 1 1 53 53 ARG H H 53 7.900 7.900 7.557 0.343 19287
3779 1 13 . 1 1 54 54 THR N N 54 112.080 112.080 112.248 -0.168 19287
3780 1 13 . 1 1 54 54 THR HA H 54 3.838 3.838 4.491 -0.653 19287
3781 1 13 . 1 1 54 54 THR C C 54 174.990 174.990 174.655 0.335 19287
3782 1 13 . 1 1 54 54 THR CA C 54 65.740 65.740 63.677 2.063 19287
3783 1 13 . 1 1 54 54 THR CB C 54 68.870 68.870 70.523 -1.653 19287
3784 1 13 . 1 1 54 54 THR H H 54 7.260 7.260 7.658 -0.398 19287
3785 1 13 . 1 1 55 55 CYS N N 55 112.540 112.540 118.008 -5.468 19287
3786 1 13 . 1 1 55 55 CYS HA H 55 4.400 4.400 4.478 -0.078 19287
3787 1 13 . 1 1 55 55 CYS C C 55 172.940 172.940 173.807 -0.867 19287
3788 1 13 . 1 1 55 55 CYS CA C 55 54.230 54.230 58.326 -4.096 19287
3789 1 13 . 1 1 55 55 CYS CB C 55 42.930 42.930 29.092 13.838 19287
3790 1 13 . 1 1 55 55 CYS H H 55 7.590 7.590 8.104 -0.514 19287
3791 1 13 . 1 1 56 56 VAL N N 56 119.720 119.720 123.092 -3.372 19287
3792 1 13 . 1 1 56 56 VAL HA H 56 3.631 3.631 4.184 -0.553 19287
3793 1 13 . 1 1 56 56 VAL C C 56 176.710 176.710 175.823 0.887 19287
3794 1 13 . 1 1 56 56 VAL CA C 56 64.540 64.540 62.482 2.058 19287
3795 1 13 . 1 1 56 56 VAL CB C 56 30.970 30.970 31.672 -0.702 19287
3796 1 13 . 1 1 56 56 VAL H H 56 7.280 7.280 7.988 -0.708 19287
3797 1 14 . 1 1 2 2 PRO HA H 2 4.017 4.017 4.497 -0.480 19287
3798 1 14 . 1 1 2 2 PRO C C 2 177.920 177.920 177.781 0.139 19287
3799 1 14 . 1 1 2 2 PRO CA C 2 62.800 62.800 62.372 0.428 19287
3800 1 14 . 1 1 2 2 PRO CB C 2 32.050 32.050 32.835 -0.785 19287
3801 1 14 . 1 1 3 3 ARG N N 3 122.340 122.340 123.446 -1.106 19287
3802 1 14 . 1 1 3 3 ARG HA H 3 3.786 3.786 4.343 -0.557 19287
3803 1 14 . 1 1 3 3 ARG C C 3 178.950 178.950 177.559 1.391 19287
3804 1 14 . 1 1 3 3 ARG CA C 3 58.410 58.410 58.248 0.161 19287
3805 1 14 . 1 1 3 3 ARG CB C 3 29.220 29.220 29.101 0.119 19287
3806 1 14 . 1 1 3 3 ARG H H 3 8.550 8.550 8.918 -0.368 19287
3807 1 14 . 1 1 4 4 PHE N N 4 113.010 113.010 117.303 -4.293 19287
3808 1 14 . 1 1 4 4 PHE HA H 4 4.300 4.300 4.508 -0.208 19287
3809 1 14 . 1 1 4 4 PHE C C 4 176.070 176.070 176.214 -0.144 19287
3810 1 14 . 1 1 4 4 PHE CA C 4 58.220 58.220 58.285 -0.065 19287
3811 1 14 . 1 1 4 4 PHE CB C 4 37.310 37.310 37.632 -0.321 19287
3812 1 14 . 1 1 4 4 PHE H H 4 7.150 7.150 7.786 -0.636 19287
3813 1 14 . 1 1 5 5 CYS N N 5 118.600 118.600 117.580 1.020 19287
3814 1 14 . 1 1 5 5 CYS HA H 5 4.130 4.130 4.194 -0.064 19287
3815 1 14 . 1 1 5 5 CYS C C 5 173.450 173.450 174.392 -0.942 19287
3816 1 14 . 1 1 5 5 CYS CA C 5 57.960 57.960 59.391 -1.431 19287
3817 1 14 . 1 1 5 5 CYS CB C 5 39.210 39.210 25.922 13.288 19287
3818 1 14 . 1 1 5 5 CYS H H 5 7.090 7.090 7.320 -0.230 19287
3819 1 14 . 1 1 6 6 GLU N N 6 110.710 110.710 118.674 -7.964 19287
3820 1 14 . 1 1 6 6 GLU HA H 6 4.182 4.182 4.450 -0.268 19287
3821 1 14 . 1 1 6 6 GLU C C 6 176.310 176.310 176.048 0.262 19287
3822 1 14 . 1 1 6 6 GLU CA C 6 55.510 55.510 54.923 0.587 19287
3823 1 14 . 1 1 6 6 GLU CB C 6 28.160 28.160 29.145 -0.985 19287
3824 1 14 . 1 1 6 6 GLU H H 6 7.300 7.300 7.501 -0.201 19287
3825 1 14 . 1 1 7 7 LEU N N 7 119.090 119.090 120.802 -1.712 19287
3826 1 14 . 1 1 7 7 LEU HA H 7 4.160 4.160 4.344 -0.184 19287
3827 1 14 . 1 1 7 7 LEU C C 7 176.630 176.630 175.873 0.757 19287
3828 1 14 . 1 1 7 7 LEU CA C 7 54.510 54.510 54.352 0.158 19287
3829 1 14 . 1 1 7 7 LEU CB C 7 42.330 42.330 42.958 -0.628 19287
3830 1 14 . 1 1 7 7 LEU H H 7 7.210 7.210 7.146 0.064 19287
3831 1 14 . 1 1 8 8 ALA N N 8 124.490 124.490 121.788 2.702 19287
3832 1 14 . 1 1 8 8 ALA HA H 8 4.250 4.250 4.696 -0.446 19287
3833 1 14 . 1 1 8 8 ALA C C 8 174.710 174.710 175.104 -0.394 19287
3834 1 14 . 1 1 8 8 ALA CA C 8 50.210 50.210 48.677 1.533 19287
3835 1 14 . 1 1 8 8 ALA CB C 8 16.930 16.930 19.455 -2.525 19287
3836 1 14 . 1 1 8 8 ALA H H 8 8.280 8.280 8.200 0.080 19287
3837 1 14 . 1 1 9 9 PRO HA H 9 4.180 4.180 4.687 -0.507 19287
3838 1 14 . 1 1 9 9 PRO C C 9 176.700 176.700 176.377 0.323 19287
3839 1 14 . 1 1 9 9 PRO CA C 9 61.490 61.490 62.800 -1.310 19287
3840 1 14 . 1 1 9 9 PRO CB C 9 30.360 30.360 31.841 -1.481 19287
3841 1 14 . 1 1 10 10 SER N N 10 112.100 112.100 121.322 -9.222 19287
3842 1 14 . 1 1 10 10 SER HA H 10 4.630 4.630 4.375 0.255 19287
3843 1 14 . 1 1 10 10 SER C C 10 174.190 174.190 174.854 -0.664 19287
3844 1 14 . 1 1 10 10 SER CA C 10 55.360 55.360 56.605 -1.245 19287
3845 1 14 . 1 1 10 10 SER CB C 10 64.550 64.550 62.406 2.144 19287
3846 1 14 . 1 1 10 10 SER H H 10 7.450 7.450 8.484 -1.034 19287
3847 1 14 . 1 1 11 11 ALA N N 11 129.980 129.980 127.496 2.484 19287
3848 1 14 . 1 1 11 11 ALA HA H 11 4.496 4.496 4.211 0.285 19287
3849 1 14 . 1 1 11 11 ALA C C 11 178.510 178.510 177.531 0.979 19287
3850 1 14 . 1 1 11 11 ALA CA C 11 54.810 54.810 53.341 1.469 19287
3851 1 14 . 1 1 11 11 ALA CB C 11 19.910 19.910 19.006 0.904 19287
3852 1 14 . 1 1 11 11 ALA H H 11 9.210 9.210 7.870 1.340 19287
3853 1 14 . 1 1 12 12 GLY N N 12 104.410 104.410 103.546 0.864 19287
3854 1 14 . 1 1 12 12 GLY C C 12 174.850 174.850 175.510 -0.660 19287
3855 1 14 . 1 1 12 12 GLY CA C 12 44.450 44.450 44.203 0.247 19287
3856 1 14 . 1 1 12 12 GLY H H 12 8.190 8.190 8.063 0.126 19287
3857 1 14 . 1 1 14 14 CYS HA H 14 4.250 4.250 4.644 -0.394 19287
3858 1 14 . 1 1 14 14 CYS C C 14 172.410 172.410 173.973 -1.563 19287
3859 1 14 . 1 1 14 14 CYS CA C 14 59.750 59.750 57.990 1.760 19287
3860 1 14 . 1 1 14 14 CYS CB C 14 39.130 39.130 30.430 8.700 19287
3861 1 14 . 1 1 15 15 PHE N N 15 116.000 116.000 124.684 -8.684 19287
3862 1 14 . 1 1 15 15 PHE HA H 15 4.380 4.380 4.627 -0.247 19287
3863 1 14 . 1 1 15 15 PHE C C 15 174.300 174.300 174.866 -0.566 19287
3864 1 14 . 1 1 15 15 PHE CA C 15 56.830 56.830 58.022 -1.192 19287
3865 1 14 . 1 1 15 15 PHE CB C 15 39.440 39.440 39.128 0.312 19287
3866 1 14 . 1 1 15 15 PHE H H 15 7.960 7.960 8.705 -0.745 19287
3867 1 14 . 1 1 16 16 ALA N N 16 125.630 125.630 130.785 -5.155 19287
3868 1 14 . 1 1 16 16 ALA HA H 16 4.320 4.320 4.617 -0.297 19287
3869 1 14 . 1 1 16 16 ALA C C 16 174.300 174.300 175.341 -1.041 19287
3870 1 14 . 1 1 16 16 ALA CA C 16 50.130 50.130 52.031 -1.901 19287
3871 1 14 . 1 1 16 16 ALA CB C 16 19.180 19.180 22.008 -2.828 19287
3872 1 14 . 1 1 16 16 ALA H H 16 7.800 7.800 8.070 -0.270 19287
3873 1 14 . 1 1 17 17 PHE N N 17 116.330 116.330 122.272 -5.942 19287
3874 1 14 . 1 1 17 17 PHE HA H 17 4.390 4.390 4.749 -0.359 19287
3875 1 14 . 1 1 17 17 PHE C C 17 175.310 175.310 173.825 1.485 19287
3876 1 14 . 1 1 17 17 PHE CA C 17 57.160 57.160 55.218 1.942 19287
3877 1 14 . 1 1 17 17 PHE CB C 17 39.380 39.380 39.786 -0.406 19287
3878 1 14 . 1 1 17 17 PHE H H 17 7.330 7.330 8.418 -1.088 19287
3879 1 14 . 1 1 18 18 VAL N N 18 122.890 122.890 124.657 -1.767 19287
3880 1 14 . 1 1 18 18 VAL HA H 18 4.475 4.475 4.647 -0.172 19287
3881 1 14 . 1 1 18 18 VAL C C 18 173.590 173.590 173.526 0.064 19287
3882 1 14 . 1 1 18 18 VAL CA C 18 58.900 58.900 58.519 0.381 19287
3883 1 14 . 1 1 18 18 VAL CB C 18 33.900 33.900 34.411 -0.511 19287
3884 1 14 . 1 1 18 18 VAL H H 18 8.680 8.680 8.535 0.145 19287
3885 1 14 . 1 1 19 19 PRO HA H 19 4.275 4.275 4.795 -0.520 19287
3886 1 14 . 1 1 19 19 PRO C C 19 176.940 176.940 176.524 0.416 19287
3887 1 14 . 1 1 19 19 PRO CA C 19 64.060 64.060 62.500 1.560 19287
3888 1 14 . 1 1 19 19 PRO CB C 19 31.710 31.710 31.459 0.251 19287
3889 1 14 . 1 1 20 20 SER N N 20 120.230 120.230 119.382 0.848 19287
3890 1 14 . 1 1 20 20 SER HA H 20 4.780 4.780 4.779 0.001 19287
3891 1 14 . 1 1 20 20 SER C C 20 170.900 170.900 173.306 -2.406 19287
3892 1 14 . 1 1 20 20 SER CA C 20 57.450 57.450 57.049 0.401 19287
3893 1 14 . 1 1 20 20 SER CB C 20 67.910 67.910 66.803 1.107 19287
3894 1 14 . 1 1 20 20 SER H H 20 8.390 8.390 8.482 -0.092 19287
3895 1 14 . 1 1 21 21 TYR N N 21 118.220 118.220 119.130 -0.910 19287
3896 1 14 . 1 1 21 21 TYR HA H 21 5.600 5.600 5.131 0.469 19287
3897 1 14 . 1 1 21 21 TYR C C 21 173.770 173.770 175.198 -1.428 19287
3898 1 14 . 1 1 21 21 TYR CA C 21 57.740 57.740 58.160 -0.420 19287
3899 1 14 . 1 1 21 21 TYR CB C 21 42.660 42.660 42.023 0.637 19287
3900 1 14 . 1 1 21 21 TYR H H 21 9.020 9.020 8.719 0.301 19287
3901 1 14 . 1 1 22 22 TYR N N 22 119.260 119.260 125.547 -6.287 19287
3902 1 14 . 1 1 22 22 TYR HA H 22 5.110 5.110 4.728 0.382 19287
3903 1 14 . 1 1 22 22 TYR C C 22 172.610 172.610 173.736 -1.126 19287
3904 1 14 . 1 1 22 22 TYR CA C 22 55.380 55.380 56.070 -0.690 19287
3905 1 14 . 1 1 22 22 TYR CB C 22 41.550 41.550 41.878 -0.328 19287
3906 1 14 . 1 1 22 22 TYR H H 22 9.410 9.410 9.587 -0.177 19287
3907 1 14 . 1 1 23 23 TYR N N 23 123.200 123.200 130.144 -6.944 19287
3908 1 14 . 1 1 23 23 TYR HA H 23 4.382 4.382 4.828 -0.446 19287
3909 1 14 . 1 1 23 23 TYR C C 23 173.250 173.250 174.217 -0.967 19287
3910 1 14 . 1 1 23 23 TYR CA C 23 58.360 58.360 57.686 0.674 19287
3911 1 14 . 1 1 23 23 TYR CB C 23 39.570 39.570 39.821 -0.251 19287
3912 1 14 . 1 1 23 23 TYR H H 23 10.190 10.190 8.856 1.334 19287
3913 1 14 . 1 1 24 24 ASN N N 24 126.280 126.280 127.144 -0.864 19287
3914 1 14 . 1 1 24 24 ASN HA H 24 4.550 4.550 4.860 -0.310 19287
3915 1 14 . 1 1 24 24 ASN C C 24 174.000 174.000 174.997 -0.997 19287
3916 1 14 . 1 1 24 24 ASN CA C 24 51.360 51.360 51.557 -0.197 19287
3917 1 14 . 1 1 24 24 ASN CB C 24 40.040 40.040 38.969 1.071 19287
3918 1 14 . 1 1 24 24 ASN H H 24 7.890 7.890 8.813 -0.923 19287
3919 1 14 . 1 1 25 25 GLN N N 25 122.760 122.760 124.121 -1.361 19287
3920 1 14 . 1 1 25 25 GLN HA H 25 3.691 3.691 3.589 0.102 19287
3921 1 14 . 1 1 25 25 GLN C C 25 175.670 175.670 176.619 -0.949 19287
3922 1 14 . 1 1 25 25 GLN CA C 25 57.480 57.480 58.294 -0.814 19287
3923 1 14 . 1 1 25 25 GLN CB C 25 28.120 28.120 27.858 0.263 19287
3924 1 14 . 1 1 25 25 GLN H H 25 8.440 8.440 8.189 0.251 19287
3925 1 14 . 1 1 26 26 TYR N N 26 119.190 119.190 119.880 -0.690 19287
3926 1 14 . 1 1 26 26 TYR HA H 26 4.160 4.160 4.251 -0.091 19287
3927 1 14 . 1 1 26 26 TYR C C 26 176.520 176.520 177.165 -0.645 19287
3928 1 14 . 1 1 26 26 TYR CA C 26 60.170 60.170 59.893 0.277 19287
3929 1 14 . 1 1 26 26 TYR CB C 26 36.880 36.880 37.478 -0.598 19287
3930 1 14 . 1 1 26 26 TYR H H 26 7.810 7.810 7.531 0.279 19287
3931 1 14 . 1 1 27 27 SER N N 27 109.600 109.600 111.744 -2.144 19287
3932 1 14 . 1 1 27 27 SER HA H 27 4.330 4.330 4.488 -0.158 19287
3933 1 14 . 1 1 27 27 SER C C 27 174.830 174.830 174.246 0.584 19287
3934 1 14 . 1 1 27 27 SER CA C 27 57.490 57.490 57.538 -0.048 19287
3935 1 14 . 1 1 27 27 SER CB C 27 64.640 64.640 63.744 0.896 19287
3936 1 14 . 1 1 27 27 SER H H 27 7.350 7.350 7.704 -0.354 19287
3937 1 14 . 1 1 28 28 ASN N N 28 119.830 119.830 118.866 0.964 19287
3938 1 14 . 1 1 28 28 ASN HA H 28 4.060 4.060 4.407 -0.347 19287
3939 1 14 . 1 1 28 28 ASN C C 28 173.040 173.040 174.154 -1.114 19287
3940 1 14 . 1 1 28 28 ASN CA C 28 53.830 53.830 54.599 -0.768 19287
3941 1 14 . 1 1 28 28 ASN CB C 28 37.400 37.400 38.220 -0.820 19287
3942 1 14 . 1 1 28 28 ASN H H 28 7.930 7.930 7.921 0.009 19287
3943 1 14 . 1 1 29 29 THR N N 29 103.070 103.070 111.729 -8.659 19287
3944 1 14 . 1 1 29 29 THR HA H 29 4.441 4.441 4.747 -0.306 19287
3945 1 14 . 1 1 29 29 THR C C 29 172.980 172.980 171.811 1.169 19287
3946 1 14 . 1 1 29 29 THR CA C 29 58.920 58.920 61.419 -2.499 19287
3947 1 14 . 1 1 29 29 THR CB C 29 73.260 73.260 71.623 1.637 19287
3948 1 14 . 1 1 29 29 THR H H 29 6.990 6.990 7.800 -0.810 19287
3949 1 14 . 1 1 30 30 CYS N N 30 118.340 118.340 120.394 -2.054 19287
3950 1 14 . 1 1 30 30 CYS HA H 30 5.462 5.462 5.523 -0.061 19287
3951 1 14 . 1 1 30 30 CYS C C 30 173.320 173.320 173.645 -0.325 19287
3952 1 14 . 1 1 30 30 CYS CA C 30 57.750 57.750 57.374 0.376 19287
3953 1 14 . 1 1 30 30 CYS CB C 30 50.680 50.680 30.190 20.490 19287
3954 1 14 . 1 1 30 30 CYS H H 30 8.954 8.954 8.676 0.278 19287
3955 1 14 . 1 1 31 31 HIS N N 31 118.930 118.930 123.252 -4.322 19287
3956 1 14 . 1 1 31 31 HIS HA H 31 4.780 4.780 5.124 -0.344 19287
3957 1 14 . 1 1 31 31 HIS C C 31 172.790 172.790 173.607 -0.817 19287
3958 1 14 . 1 1 31 31 HIS CA C 31 53.530 53.530 55.330 -1.800 19287
3959 1 14 . 1 1 31 31 HIS CB C 31 33.040 33.040 33.403 -0.362 19287
3960 1 14 . 1 1 31 31 HIS H H 31 9.010 9.010 9.581 -0.571 19287
3961 1 14 . 1 1 32 32 SER N N 32 117.600 117.600 120.443 -2.843 19287
3962 1 14 . 1 1 32 32 SER HA H 32 4.700 4.700 4.378 0.322 19287
3963 1 14 . 1 1 32 32 SER C C 32 174.930 174.930 173.697 1.233 19287
3964 1 14 . 1 1 32 32 SER CA C 32 57.980 57.980 58.247 -0.267 19287
3965 1 14 . 1 1 32 32 SER CB C 32 64.440 64.440 63.362 1.078 19287
3966 1 14 . 1 1 32 32 SER H H 32 8.740 8.740 7.914 0.826 19287
3967 1 14 . 1 1 33 33 PHE N N 33 120.690 120.690 120.486 0.204 19287
3968 1 14 . 1 1 33 33 PHE HA H 33 4.790 4.790 5.069 -0.279 19287
3969 1 14 . 1 1 33 33 PHE C C 33 171.810 171.810 173.405 -1.595 19287
3970 1 14 . 1 1 33 33 PHE CA C 33 56.200 56.200 55.640 0.560 19287
3971 1 14 . 1 1 33 33 PHE CB C 33 40.230 40.230 41.090 -0.860 19287
3972 1 14 . 1 1 33 33 PHE H H 33 8.830 8.830 9.007 -0.177 19287
3973 1 14 . 1 1 34 34 THR N N 34 116.650 116.650 111.372 5.278 19287
3974 1 14 . 1 1 34 34 THR HA H 34 3.965 3.965 4.256 -0.291 19287
3975 1 14 . 1 1 34 34 THR C C 34 172.600 172.600 172.600 0.000 19287
3976 1 14 . 1 1 34 34 THR CA C 34 61.980 61.980 60.858 1.122 19287
3977 1 14 . 1 1 34 34 THR CB C 34 68.530 68.530 69.139 -0.609 19287
3978 1 14 . 1 1 34 34 THR H H 34 8.400 8.400 8.282 0.118 19287
3979 1 14 . 1 1 35 35 TYR N N 35 127.790 127.790 127.737 0.053 19287
3980 1 14 . 1 1 35 35 TYR HA H 35 4.500 4.500 4.689 -0.189 19287
3981 1 14 . 1 1 35 35 TYR C C 35 174.200 174.200 175.236 -1.036 19287
3982 1 14 . 1 1 35 35 TYR CA C 35 55.130 55.130 55.828 -0.698 19287
3983 1 14 . 1 1 35 35 TYR CB C 35 39.650 39.650 42.091 -2.441 19287
3984 1 14 . 1 1 35 35 TYR H H 35 8.010 8.010 8.600 -0.590 19287
3985 1 14 . 1 1 39 39 GLY N N 39 103.730 103.730 108.550 -4.820 19287
3986 1 14 . 1 1 39 39 GLY C C 39 175.700 175.700 173.251 2.449 19287
3987 1 14 . 1 1 39 39 GLY CA C 39 45.370 45.370 44.060 1.310 19287
3988 1 14 . 1 1 39 39 GLY H H 39 8.500 8.500 7.387 1.113 19287
3989 1 14 . 1 1 40 40 GLY N N 40 110.170 110.170 106.758 3.412 19287
3990 1 14 . 1 1 40 40 GLY C C 40 173.140 173.140 173.568 -0.428 19287
3991 1 14 . 1 1 40 40 GLY CA C 40 44.320 44.320 44.480 -0.160 19287
3992 1 14 . 1 1 40 40 GLY H H 40 8.670 8.670 8.025 0.645 19287
3993 1 14 . 1 1 41 41 ASN N N 41 116.960 116.960 118.008 -1.048 19287
3994 1 14 . 1 1 41 41 ASN HA H 41 4.560 4.560 4.964 -0.404 19287
3995 1 14 . 1 1 41 41 ASN C C 41 173.670 173.670 175.856 -2.186 19287
3996 1 14 . 1 1 41 41 ASN CA C 41 51.850 51.850 51.762 0.088 19287
3997 1 14 . 1 1 41 41 ASN CB C 41 40.230 40.230 40.803 -0.573 19287
3998 1 14 . 1 1 41 41 ASN H H 41 8.790 8.790 8.703 0.087 19287
3999 1 14 . 1 1 42 42 ALA N N 42 113.290 113.290 122.355 -9.065 19287
4000 1 14 . 1 1 42 42 ALA HA H 42 3.720 3.720 4.120 -0.400 19287
4001 1 14 . 1 1 42 42 ALA C C 42 177.220 177.220 177.919 -0.699 19287
4002 1 14 . 1 1 42 42 ALA CA C 42 52.810 52.810 54.569 -1.759 19287
4003 1 14 . 1 1 42 42 ALA CB C 42 17.980 17.980 18.487 -0.507 19287
4004 1 14 . 1 1 42 42 ALA H H 42 7.590 7.590 8.735 -1.145 19287
4005 1 14 . 1 1 43 43 ASN N N 43 117.710 117.710 114.279 3.431 19287
4006 1 14 . 1 1 43 43 ASN HA H 43 4.700 4.700 4.695 0.005 19287
4007 1 14 . 1 1 43 43 ASN C C 43 173.660 173.660 175.270 -1.610 19287
4008 1 14 . 1 1 43 43 ASN CA C 43 50.630 50.630 53.682 -3.052 19287
4009 1 14 . 1 1 43 43 ASN CB C 43 34.840 34.840 37.788 -2.948 19287
4010 1 14 . 1 1 43 43 ASN H H 43 7.900 7.900 8.190 -0.290 19287
4011 1 14 . 1 1 44 44 ARG N N 44 120.690 120.690 121.252 -0.562 19287
4012 1 14 . 1 1 44 44 ARG HA H 44 4.692 4.692 4.308 0.384 19287
4013 1 14 . 1 1 44 44 ARG C C 44 173.530 173.530 174.720 -1.190 19287
4014 1 14 . 1 1 44 44 ARG CA C 44 56.660 56.660 57.066 -0.406 19287
4015 1 14 . 1 1 44 44 ARG CB C 44 31.450 31.450 30.533 0.917 19287
4016 1 14 . 1 1 44 44 ARG H H 44 6.860 6.860 7.323 -0.463 19287
4017 1 14 . 1 1 45 45 PHE N N 45 123.690 123.690 123.212 0.478 19287
4018 1 14 . 1 1 45 45 PHE HA H 45 4.810 4.810 4.860 -0.050 19287
4019 1 14 . 1 1 45 45 PHE C C 45 175.420 175.420 175.437 -0.017 19287
4020 1 14 . 1 1 45 45 PHE CA C 45 55.670 55.670 56.895 -1.225 19287
4021 1 14 . 1 1 45 45 PHE CB C 45 43.790 43.790 43.519 0.271 19287
4022 1 14 . 1 1 45 45 PHE H H 45 9.340 9.340 8.231 1.109 19287
4023 1 14 . 1 1 46 46 ARG N N 46 120.920 120.920 119.231 1.689 19287
4024 1 14 . 1 1 46 46 ARG HA H 46 4.397 4.397 4.594 -0.197 19287
4025 1 14 . 1 1 46 46 ARG C C 46 176.560 176.560 175.761 0.799 19287
4026 1 14 . 1 1 46 46 ARG CA C 46 58.210 58.210 56.103 2.107 19287
4027 1 14 . 1 1 46 46 ARG CB C 46 30.900 30.900 30.607 0.293 19287
4028 1 14 . 1 1 46 46 ARG H H 46 9.080 9.080 8.845 0.235 19287
4029 1 14 . 1 1 47 47 THR N N 47 102.800 102.800 111.721 -8.921 19287
4030 1 14 . 1 1 47 47 THR HA H 47 4.660 4.660 3.895 0.765 19287
4031 1 14 . 1 1 47 47 THR C C 47 174.110 174.110 173.138 0.972 19287
4032 1 14 . 1 1 47 47 THR CA C 47 58.170 58.170 59.960 -1.790 19287
4033 1 14 . 1 1 47 47 THR CB C 47 72.380 72.380 70.446 1.934 19287
4034 1 14 . 1 1 47 47 THR H H 47 7.230 7.230 7.253 -0.023 19287
4035 1 14 . 1 1 48 48 ILE N N 48 123.200 123.200 123.658 -0.458 19287
4036 1 14 . 1 1 48 48 ILE HA H 48 2.901 2.901 3.457 -0.556 19287
4037 1 14 . 1 1 48 48 ILE C C 48 176.420 176.420 176.036 0.384 19287
4038 1 14 . 1 1 48 48 ILE CA C 48 64.000 64.000 63.714 0.286 19287
4039 1 14 . 1 1 48 48 ILE CB C 48 37.060 37.060 38.064 -1.004 19287
4040 1 14 . 1 1 48 48 ILE H H 48 8.110 8.110 7.870 0.240 19287
4041 1 14 . 1 1 49 49 ASP N N 49 119.560 119.560 119.419 0.141 19287
4042 1 14 . 1 1 49 49 ASP HA H 49 4.130 4.130 4.258 -0.128 19287
4043 1 14 . 1 1 49 49 ASP C C 49 177.740 177.740 178.346 -0.606 19287
4044 1 14 . 1 1 49 49 ASP CA C 49 56.690 56.690 57.929 -1.239 19287
4045 1 14 . 1 1 49 49 ASP CB C 49 39.970 39.970 40.611 -0.641 19287
4046 1 14 . 1 1 49 49 ASP H H 49 7.700 7.700 7.652 0.048 19287
4047 1 14 . 1 1 50 50 GLU N N 50 117.720 117.720 119.505 -1.785 19287
4048 1 14 . 1 1 50 50 GLU HA H 50 3.710 3.710 4.218 -0.508 19287
4049 1 14 . 1 1 50 50 GLU C C 50 177.550 177.550 178.073 -0.523 19287
4050 1 14 . 1 1 50 50 GLU CA C 50 58.550 58.550 58.599 -0.049 19287
4051 1 14 . 1 1 50 50 GLU CB C 50 29.190 29.190 29.835 -0.645 19287
4052 1 14 . 1 1 50 50 GLU H H 50 7.410 7.410 7.564 -0.154 19287
4053 1 14 . 1 1 51 51 CYS N N 51 120.260 120.260 119.019 1.241 19287
4054 1 14 . 1 1 51 51 CYS HA H 51 1.650 1.650 2.925 -1.275 19287
4055 1 14 . 1 1 51 51 CYS C C 51 175.070 175.070 176.304 -1.234 19287
4056 1 14 . 1 1 51 51 CYS CA C 51 59.120 59.120 61.007 -1.887 19287
4057 1 14 . 1 1 51 51 CYS CB C 51 43.000 43.000 25.886 17.114 19287
4058 1 14 . 1 1 51 51 CYS H H 51 6.760 6.760 7.724 -0.964 19287
4059 1 14 . 1 1 52 52 ASN N N 52 120.160 120.160 119.624 0.536 19287
4060 1 14 . 1 1 52 52 ASN HA H 52 4.090 4.090 4.428 -0.338 19287
4061 1 14 . 1 1 52 52 ASN C C 52 177.820 177.820 177.762 0.058 19287
4062 1 14 . 1 1 52 52 ASN CA C 52 55.060 55.060 55.877 -0.817 19287
4063 1 14 . 1 1 52 52 ASN CB C 52 37.500 37.500 37.746 -0.246 19287
4064 1 14 . 1 1 52 52 ASN H H 52 8.650 8.650 8.543 0.107 19287
4065 1 14 . 1 1 53 53 ARG N N 53 117.000 117.000 118.002 -1.002 19287
4066 1 14 . 1 1 53 53 ARG HA H 53 3.770 3.770 4.081 -0.311 19287
4067 1 14 . 1 1 53 53 ARG C C 53 177.360 177.360 177.845 -0.485 19287
4068 1 14 . 1 1 53 53 ARG CA C 53 58.490 58.490 58.788 -0.298 19287
4069 1 14 . 1 1 53 53 ARG CB C 53 30.180 30.180 29.555 0.625 19287
4070 1 14 . 1 1 53 53 ARG H H 53 7.900 7.900 7.656 0.244 19287
4071 1 14 . 1 1 54 54 THR N N 54 112.080 112.080 111.721 0.359 19287
4072 1 14 . 1 1 54 54 THR HA H 54 3.838 3.838 4.395 -0.557 19287
4073 1 14 . 1 1 54 54 THR C C 54 174.990 174.990 174.175 0.815 19287
4074 1 14 . 1 1 54 54 THR CA C 54 65.740 65.740 64.382 1.358 19287
4075 1 14 . 1 1 54 54 THR CB C 54 68.870 68.870 69.799 -0.929 19287
4076 1 14 . 1 1 54 54 THR H H 54 7.260 7.260 7.827 -0.567 19287
4077 1 14 . 1 1 55 55 CYS N N 55 112.540 112.540 116.948 -4.408 19287
4078 1 14 . 1 1 55 55 CYS HA H 55 4.400 4.400 4.412 -0.012 19287
4079 1 14 . 1 1 55 55 CYS C C 55 172.940 172.940 174.505 -1.565 19287
4080 1 14 . 1 1 55 55 CYS CA C 55 54.230 54.230 58.819 -4.589 19287
4081 1 14 . 1 1 55 55 CYS CB C 55 42.930 42.930 28.643 14.287 19287
4082 1 14 . 1 1 55 55 CYS H H 55 7.590 7.590 7.330 0.260 19287
4083 1 14 . 1 1 56 56 VAL N N 56 119.720 119.720 124.312 -4.592 19287
4084 1 14 . 1 1 56 56 VAL HA H 56 3.631 3.631 3.866 -0.235 19287
4085 1 14 . 1 1 56 56 VAL C C 56 176.710 176.710 175.770 0.940 19287
4086 1 14 . 1 1 56 56 VAL CA C 56 64.540 64.540 64.506 0.034 19287
4087 1 14 . 1 1 56 56 VAL CB C 56 30.970 30.970 30.959 0.011 19287
4088 1 14 . 1 1 56 56 VAL H H 56 7.280 7.280 7.748 -0.468 19287
4089 1 15 . 1 1 2 2 PRO HA H 2 4.017 4.017 4.457 -0.440 19287
4090 1 15 . 1 1 2 2 PRO C C 2 177.920 177.920 177.398 0.522 19287
4091 1 15 . 1 1 2 2 PRO CA C 2 62.800 62.800 62.187 0.613 19287
4092 1 15 . 1 1 2 2 PRO CB C 2 32.050 32.050 32.749 -0.699 19287
4093 1 15 . 1 1 3 3 ARG N N 3 122.340 122.340 120.087 2.253 19287
4094 1 15 . 1 1 3 3 ARG HA H 3 3.786 3.786 3.995 -0.209 19287
4095 1 15 . 1 1 3 3 ARG C C 3 178.950 178.950 178.747 0.203 19287
4096 1 15 . 1 1 3 3 ARG CA C 3 58.410 58.410 58.787 -0.377 19287
4097 1 15 . 1 1 3 3 ARG CB C 3 29.220 29.220 29.720 -0.500 19287
4098 1 15 . 1 1 3 3 ARG H H 3 8.550 8.550 8.733 -0.183 19287
4099 1 15 . 1 1 4 4 PHE N N 4 113.010 113.010 118.124 -5.114 19287
4100 1 15 . 1 1 4 4 PHE HA H 4 4.300 4.300 4.397 -0.097 19287
4101 1 15 . 1 1 4 4 PHE C C 4 176.070 176.070 176.813 -0.743 19287
4102 1 15 . 1 1 4 4 PHE CA C 4 58.220 58.220 59.838 -1.618 19287
4103 1 15 . 1 1 4 4 PHE CB C 4 37.310 37.310 37.824 -0.514 19287
4104 1 15 . 1 1 4 4 PHE H H 4 7.150 7.150 7.994 -0.844 19287
4105 1 15 . 1 1 5 5 CYS N N 5 118.600 118.600 117.724 0.876 19287
4106 1 15 . 1 1 5 5 CYS HA H 5 4.130 4.130 4.125 0.005 19287
4107 1 15 . 1 1 5 5 CYS C C 5 173.450 173.450 174.819 -1.369 19287
4108 1 15 . 1 1 5 5 CYS CA C 5 57.960 57.960 61.138 -3.178 19287
4109 1 15 . 1 1 5 5 CYS CB C 5 39.210 39.210 25.336 13.874 19287
4110 1 15 . 1 1 5 5 CYS H H 5 7.090 7.090 7.120 -0.030 19287
4111 1 15 . 1 1 6 6 GLU N N 6 110.710 110.710 118.507 -7.797 19287
4112 1 15 . 1 1 6 6 GLU HA H 6 4.182 4.182 4.320 -0.138 19287
4113 1 15 . 1 1 6 6 GLU C C 6 176.310 176.310 176.352 -0.042 19287
4114 1 15 . 1 1 6 6 GLU CA C 6 55.510 55.510 55.682 -0.172 19287
4115 1 15 . 1 1 6 6 GLU CB C 6 28.160 28.160 29.278 -1.118 19287
4116 1 15 . 1 1 6 6 GLU H H 6 7.300 7.300 7.632 -0.332 19287
4117 1 15 . 1 1 7 7 LEU N N 7 119.090 119.090 121.061 -1.971 19287
4118 1 15 . 1 1 7 7 LEU HA H 7 4.160 4.160 4.265 -0.105 19287
4119 1 15 . 1 1 7 7 LEU C C 7 176.630 176.630 176.252 0.378 19287
4120 1 15 . 1 1 7 7 LEU CA C 7 54.510 54.510 54.155 0.355 19287
4121 1 15 . 1 1 7 7 LEU CB C 7 42.330 42.330 42.478 -0.148 19287
4122 1 15 . 1 1 7 7 LEU H H 7 7.210 7.210 7.326 -0.116 19287
4123 1 15 . 1 1 8 8 ALA N N 8 124.490 124.490 122.400 2.090 19287
4124 1 15 . 1 1 8 8 ALA HA H 8 4.250 4.250 4.601 -0.351 19287
4125 1 15 . 1 1 8 8 ALA C C 8 174.710 174.710 175.412 -0.702 19287
4126 1 15 . 1 1 8 8 ALA CA C 8 50.210 50.210 48.817 1.393 19287
4127 1 15 . 1 1 8 8 ALA CB C 8 16.930 16.930 19.384 -2.454 19287
4128 1 15 . 1 1 8 8 ALA H H 8 8.280 8.280 8.229 0.051 19287
4129 1 15 . 1 1 9 9 PRO HA H 9 4.180 4.180 4.464 -0.284 19287
4130 1 15 . 1 1 9 9 PRO C C 9 176.700 176.700 176.397 0.303 19287
4131 1 15 . 1 1 9 9 PRO CA C 9 61.490 61.490 62.786 -1.296 19287
4132 1 15 . 1 1 9 9 PRO CB C 9 30.360 30.360 32.314 -1.954 19287
4133 1 15 . 1 1 10 10 SER N N 10 112.100 112.100 122.264 -10.164 19287
4134 1 15 . 1 1 10 10 SER HA H 10 4.630 4.630 4.448 0.182 19287
4135 1 15 . 1 1 10 10 SER C C 10 174.190 174.190 174.812 -0.622 19287
4136 1 15 . 1 1 10 10 SER CA C 10 55.360 55.360 56.007 -0.647 19287
4137 1 15 . 1 1 10 10 SER CB C 10 64.550 64.550 61.883 2.667 19287
4138 1 15 . 1 1 10 10 SER H H 10 7.450 7.450 8.768 -1.318 19287
4139 1 15 . 1 1 11 11 ALA N N 11 129.980 129.980 124.317 5.663 19287
4140 1 15 . 1 1 11 11 ALA HA H 11 4.496 4.496 4.133 0.363 19287
4141 1 15 . 1 1 11 11 ALA C C 11 178.510 178.510 178.991 -0.481 19287
4142 1 15 . 1 1 11 11 ALA CA C 11 54.810 54.810 53.566 1.244 19287
4143 1 15 . 1 1 11 11 ALA CB C 11 19.910 19.910 18.931 0.979 19287
4144 1 15 . 1 1 11 11 ALA H H 11 9.210 9.210 8.070 1.140 19287
4145 1 15 . 1 1 12 12 GLY N N 12 104.410 104.410 105.118 -0.708 19287
4146 1 15 . 1 1 12 12 GLY C C 12 174.850 174.850 175.267 -0.417 19287
4147 1 15 . 1 1 12 12 GLY CA C 12 44.450 44.450 44.756 -0.306 19287
4148 1 15 . 1 1 12 12 GLY H H 12 8.190 8.190 8.418 -0.228 19287
4149 1 15 . 1 1 14 14 CYS HA H 14 4.250 4.250 4.638 -0.388 19287
4150 1 15 . 1 1 14 14 CYS C C 14 172.410 172.410 173.450 -1.040 19287
4151 1 15 . 1 1 14 14 CYS CA C 14 59.750 59.750 58.305 1.445 19287
4152 1 15 . 1 1 14 14 CYS CB C 14 39.130 39.130 30.688 8.442 19287
4153 1 15 . 1 1 15 15 PHE N N 15 116.000 116.000 124.161 -8.161 19287
4154 1 15 . 1 1 15 15 PHE HA H 15 4.380 4.380 4.534 -0.154 19287
4155 1 15 . 1 1 15 15 PHE C C 15 174.300 174.300 174.896 -0.596 19287
4156 1 15 . 1 1 15 15 PHE CA C 15 56.830 56.830 58.099 -1.269 19287
4157 1 15 . 1 1 15 15 PHE CB C 15 39.440 39.440 39.274 0.166 19287
4158 1 15 . 1 1 15 15 PHE H H 15 7.960 7.960 8.641 -0.681 19287
4159 1 15 . 1 1 16 16 ALA N N 16 125.630 125.630 130.143 -4.513 19287
4160 1 15 . 1 1 16 16 ALA HA H 16 4.320 4.320 4.603 -0.283 19287
4161 1 15 . 1 1 16 16 ALA C C 16 174.300 174.300 175.495 -1.195 19287
4162 1 15 . 1 1 16 16 ALA CA C 16 50.130 50.130 51.490 -1.360 19287
4163 1 15 . 1 1 16 16 ALA CB C 16 19.180 19.180 21.351 -2.171 19287
4164 1 15 . 1 1 16 16 ALA H H 16 7.800 7.800 7.886 -0.086 19287
4165 1 15 . 1 1 17 17 PHE N N 17 116.330 116.330 122.369 -6.039 19287
4166 1 15 . 1 1 17 17 PHE HA H 17 4.390 4.390 4.702 -0.312 19287
4167 1 15 . 1 1 17 17 PHE C C 17 175.310 175.310 174.103 1.207 19287
4168 1 15 . 1 1 17 17 PHE CA C 17 57.160 57.160 55.776 1.384 19287
4169 1 15 . 1 1 17 17 PHE CB C 17 39.380 39.380 40.952 -1.572 19287
4170 1 15 . 1 1 17 17 PHE H H 17 7.330 7.330 8.409 -1.079 19287
4171 1 15 . 1 1 18 18 VAL N N 18 122.890 122.890 124.581 -1.691 19287
4172 1 15 . 1 1 18 18 VAL HA H 18 4.475 4.475 4.463 0.012 19287
4173 1 15 . 1 1 18 18 VAL C C 18 173.590 173.590 173.025 0.565 19287
4174 1 15 . 1 1 18 18 VAL CA C 18 58.900 58.900 58.315 0.585 19287
4175 1 15 . 1 1 18 18 VAL CB C 18 33.900 33.900 34.257 -0.357 19287
4176 1 15 . 1 1 18 18 VAL H H 18 8.680 8.680 8.165 0.515 19287
4177 1 15 . 1 1 19 19 PRO HA H 19 4.275 4.275 4.547 -0.272 19287
4178 1 15 . 1 1 19 19 PRO C C 19 176.940 176.940 176.254 0.686 19287
4179 1 15 . 1 1 19 19 PRO CA C 19 64.060 64.060 61.845 2.215 19287
4180 1 15 . 1 1 19 19 PRO CB C 19 31.710 31.710 31.835 -0.125 19287
4181 1 15 . 1 1 20 20 SER N N 20 120.230 120.230 117.419 2.811 19287
4182 1 15 . 1 1 20 20 SER HA H 20 4.780 4.780 4.594 0.186 19287
4183 1 15 . 1 1 20 20 SER C C 20 170.900 170.900 172.973 -2.073 19287
4184 1 15 . 1 1 20 20 SER CA C 20 57.450 57.450 56.011 1.439 19287
4185 1 15 . 1 1 20 20 SER CB C 20 67.910 67.910 65.488 2.422 19287
4186 1 15 . 1 1 20 20 SER H H 20 8.390 8.390 7.858 0.532 19287
4187 1 15 . 1 1 21 21 TYR N N 21 118.220 118.220 119.627 -1.407 19287
4188 1 15 . 1 1 21 21 TYR HA H 21 5.600 5.600 4.866 0.734 19287
4189 1 15 . 1 1 21 21 TYR C C 21 173.770 173.770 174.518 -0.748 19287
4190 1 15 . 1 1 21 21 TYR CA C 21 57.740 57.740 58.208 -0.468 19287
4191 1 15 . 1 1 21 21 TYR CB C 21 42.660 42.660 41.730 0.930 19287
4192 1 15 . 1 1 21 21 TYR H H 21 9.020 9.020 8.651 0.369 19287
4193 1 15 . 1 1 22 22 TYR N N 22 119.260 119.260 124.536 -5.276 19287
4194 1 15 . 1 1 22 22 TYR HA H 22 5.110 5.110 4.539 0.571 19287
4195 1 15 . 1 1 22 22 TYR C C 22 172.610 172.610 173.618 -1.008 19287
4196 1 15 . 1 1 22 22 TYR CA C 22 55.380 55.380 56.107 -0.727 19287
4197 1 15 . 1 1 22 22 TYR CB C 22 41.550 41.550 42.667 -1.117 19287
4198 1 15 . 1 1 22 22 TYR H H 22 9.410 9.410 9.523 -0.113 19287
4199 1 15 . 1 1 23 23 TYR N N 23 123.200 123.200 126.808 -3.608 19287
4200 1 15 . 1 1 23 23 TYR HA H 23 4.382 4.382 4.948 -0.566 19287
4201 1 15 . 1 1 23 23 TYR C C 23 173.250 173.250 174.036 -0.786 19287
4202 1 15 . 1 1 23 23 TYR CA C 23 58.360 58.360 57.585 0.775 19287
4203 1 15 . 1 1 23 23 TYR CB C 23 39.570 39.570 41.003 -1.433 19287
4204 1 15 . 1 1 23 23 TYR H H 23 10.190 10.190 8.723 1.467 19287
4205 1 15 . 1 1 24 24 ASN N N 24 126.280 126.280 126.120 0.160 19287
4206 1 15 . 1 1 24 24 ASN HA H 24 4.550 4.550 5.026 -0.476 19287
4207 1 15 . 1 1 24 24 ASN C C 24 174.000 174.000 175.339 -1.339 19287
4208 1 15 . 1 1 24 24 ASN CA C 24 51.360 51.360 52.078 -0.718 19287
4209 1 15 . 1 1 24 24 ASN CB C 24 40.040 40.040 39.347 0.693 19287
4210 1 15 . 1 1 24 24 ASN H H 24 7.890 7.890 8.374 -0.484 19287
4211 1 15 . 1 1 25 25 GLN N N 25 122.760 122.760 122.305 0.455 19287
4212 1 15 . 1 1 25 25 GLN HA H 25 3.691 3.691 3.849 -0.158 19287
4213 1 15 . 1 1 25 25 GLN C C 25 175.670 175.670 176.749 -1.079 19287
4214 1 15 . 1 1 25 25 GLN CA C 25 57.480 57.480 58.334 -0.854 19287
4215 1 15 . 1 1 25 25 GLN CB C 25 28.120 28.120 27.823 0.297 19287
4216 1 15 . 1 1 25 25 GLN H H 25 8.440 8.440 8.371 0.069 19287
4217 1 15 . 1 1 26 26 TYR N N 26 119.190 119.190 119.382 -0.192 19287
4218 1 15 . 1 1 26 26 TYR HA H 26 4.160 4.160 4.297 -0.137 19287
4219 1 15 . 1 1 26 26 TYR C C 26 176.520 176.520 176.948 -0.428 19287
4220 1 15 . 1 1 26 26 TYR CA C 26 60.170 60.170 60.013 0.157 19287
4221 1 15 . 1 1 26 26 TYR CB C 26 36.880 36.880 37.967 -1.087 19287
4222 1 15 . 1 1 26 26 TYR H H 26 7.810 7.810 7.853 -0.043 19287
4223 1 15 . 1 1 27 27 SER N N 27 109.600 109.600 113.203 -3.603 19287
4224 1 15 . 1 1 27 27 SER HA H 27 4.330 4.330 4.467 -0.137 19287
4225 1 15 . 1 1 27 27 SER C C 27 174.830 174.830 174.127 0.703 19287
4226 1 15 . 1 1 27 27 SER CA C 27 57.490 57.490 57.855 -0.365 19287
4227 1 15 . 1 1 27 27 SER CB C 27 64.640 64.640 64.006 0.634 19287
4228 1 15 . 1 1 27 27 SER H H 27 7.350 7.350 7.768 -0.418 19287
4229 1 15 . 1 1 28 28 ASN N N 28 119.830 119.830 118.273 1.557 19287
4230 1 15 . 1 1 28 28 ASN HA H 28 4.060 4.060 4.310 -0.250 19287
4231 1 15 . 1 1 28 28 ASN C C 28 173.040 173.040 173.988 -0.948 19287
4232 1 15 . 1 1 28 28 ASN CA C 28 53.830 53.830 54.264 -0.434 19287
4233 1 15 . 1 1 28 28 ASN CB C 28 37.400 37.400 37.731 -0.331 19287
4234 1 15 . 1 1 28 28 ASN H H 28 7.930 7.930 7.790 0.140 19287
4235 1 15 . 1 1 29 29 THR N N 29 103.070 103.070 112.544 -9.474 19287
4236 1 15 . 1 1 29 29 THR HA H 29 4.441 4.441 4.638 -0.197 19287
4237 1 15 . 1 1 29 29 THR C C 29 172.980 172.980 171.908 1.072 19287
4238 1 15 . 1 1 29 29 THR CA C 29 58.920 58.920 61.856 -2.936 19287
4239 1 15 . 1 1 29 29 THR CB C 29 73.260 73.260 71.196 2.064 19287
4240 1 15 . 1 1 29 29 THR H H 29 6.990 6.990 7.530 -0.540 19287
4241 1 15 . 1 1 30 30 CYS N N 30 118.340 118.340 119.342 -1.002 19287
4242 1 15 . 1 1 30 30 CYS HA H 30 5.462 5.462 5.366 0.096 19287
4243 1 15 . 1 1 30 30 CYS C C 30 173.320 173.320 173.436 -0.116 19287
4244 1 15 . 1 1 30 30 CYS CA C 30 57.750 57.750 57.636 0.114 19287
4245 1 15 . 1 1 30 30 CYS CB C 30 50.680 50.680 31.335 19.345 19287
4246 1 15 . 1 1 30 30 CYS H H 30 8.954 8.954 8.666 0.288 19287
4247 1 15 . 1 1 31 31 HIS N N 31 118.930 118.930 121.094 -2.164 19287
4248 1 15 . 1 1 31 31 HIS HA H 31 4.780 4.780 5.109 -0.329 19287
4249 1 15 . 1 1 31 31 HIS C C 31 172.790 172.790 174.139 -1.349 19287
4250 1 15 . 1 1 31 31 HIS CA C 31 53.530 53.530 55.109 -1.579 19287
4251 1 15 . 1 1 31 31 HIS CB C 31 33.040 33.040 33.000 0.040 19287
4252 1 15 . 1 1 31 31 HIS H H 31 9.010 9.010 9.681 -0.671 19287
4253 1 15 . 1 1 32 32 SER N N 32 117.600 117.600 120.746 -3.146 19287
4254 1 15 . 1 1 32 32 SER HA H 32 4.700 4.700 4.325 0.375 19287
4255 1 15 . 1 1 32 32 SER C C 32 174.930 174.930 173.863 1.067 19287
4256 1 15 . 1 1 32 32 SER CA C 32 57.980 57.980 60.057 -2.077 19287
4257 1 15 . 1 1 32 32 SER CB C 32 64.440 64.440 63.360 1.080 19287
4258 1 15 . 1 1 32 32 SER H H 32 8.740 8.740 8.440 0.300 19287
4259 1 15 . 1 1 33 33 PHE N N 33 120.690 120.690 121.635 -0.945 19287
4260 1 15 . 1 1 33 33 PHE HA H 33 4.790 4.790 4.936 -0.146 19287
4261 1 15 . 1 1 33 33 PHE C C 33 171.810 171.810 173.639 -1.829 19287
4262 1 15 . 1 1 33 33 PHE CA C 33 56.200 56.200 55.807 0.393 19287
4263 1 15 . 1 1 33 33 PHE CB C 33 40.230 40.230 41.236 -1.006 19287
4264 1 15 . 1 1 33 33 PHE H H 33 8.830 8.830 8.909 -0.079 19287
4265 1 15 . 1 1 34 34 THR N N 34 116.650 116.650 112.241 4.409 19287
4266 1 15 . 1 1 34 34 THR HA H 34 3.965 3.965 4.164 -0.199 19287
4267 1 15 . 1 1 34 34 THR C C 34 172.600 172.600 172.587 0.013 19287
4268 1 15 . 1 1 34 34 THR CA C 34 61.980 61.980 61.126 0.854 19287
4269 1 15 . 1 1 34 34 THR CB C 34 68.530 68.530 69.801 -1.271 19287
4270 1 15 . 1 1 34 34 THR H H 34 8.400 8.400 8.182 0.218 19287
4271 1 15 . 1 1 35 35 TYR N N 35 127.790 127.790 125.436 2.354 19287
4272 1 15 . 1 1 35 35 TYR HA H 35 4.500 4.500 4.760 -0.260 19287
4273 1 15 . 1 1 35 35 TYR C C 35 174.200 174.200 173.927 0.273 19287
4274 1 15 . 1 1 35 35 TYR CA C 35 55.130 55.130 55.993 -0.863 19287
4275 1 15 . 1 1 35 35 TYR CB C 35 39.650 39.650 41.901 -2.251 19287
4276 1 15 . 1 1 35 35 TYR H H 35 8.010 8.010 8.652 -0.642 19287
4277 1 15 . 1 1 39 39 GLY N N 39 103.730 103.730 110.355 -6.625 19287
4278 1 15 . 1 1 39 39 GLY C C 39 175.700 175.700 174.444 1.256 19287
4279 1 15 . 1 1 39 39 GLY CA C 39 45.370 45.370 45.392 -0.022 19287
4280 1 15 . 1 1 39 39 GLY H H 39 8.500 8.500 8.510 -0.010 19287
4281 1 15 . 1 1 40 40 GLY N N 40 110.170 110.170 109.849 0.321 19287
4282 1 15 . 1 1 40 40 GLY C C 40 173.140 173.140 173.203 -0.063 19287
4283 1 15 . 1 1 40 40 GLY CA C 40 44.320 44.320 44.938 -0.618 19287
4284 1 15 . 1 1 40 40 GLY H H 40 8.670 8.670 8.106 0.564 19287
4285 1 15 . 1 1 41 41 ASN N N 41 116.960 116.960 118.049 -1.089 19287
4286 1 15 . 1 1 41 41 ASN HA H 41 4.560 4.560 4.925 -0.365 19287
4287 1 15 . 1 1 41 41 ASN C C 41 173.670 173.670 175.707 -2.037 19287
4288 1 15 . 1 1 41 41 ASN CA C 41 51.850 51.850 52.271 -0.421 19287
4289 1 15 . 1 1 41 41 ASN CB C 41 40.230 40.230 40.669 -0.439 19287
4290 1 15 . 1 1 41 41 ASN H H 41 8.790 8.790 8.360 0.430 19287
4291 1 15 . 1 1 42 42 ALA N N 42 113.290 113.290 122.839 -9.549 19287
4292 1 15 . 1 1 42 42 ALA HA H 42 3.720 3.720 4.161 -0.441 19287
4293 1 15 . 1 1 42 42 ALA C C 42 177.220 177.220 178.278 -1.058 19287
4294 1 15 . 1 1 42 42 ALA CA C 42 52.810 52.810 54.656 -1.846 19287
4295 1 15 . 1 1 42 42 ALA CB C 42 17.980 17.980 18.597 -0.617 19287
4296 1 15 . 1 1 42 42 ALA H H 42 7.590 7.590 8.656 -1.066 19287
4297 1 15 . 1 1 43 43 ASN N N 43 117.710 117.710 115.777 1.933 19287
4298 1 15 . 1 1 43 43 ASN HA H 43 4.700 4.700 4.472 0.228 19287
4299 1 15 . 1 1 43 43 ASN C C 43 173.660 173.660 174.724 -1.064 19287
4300 1 15 . 1 1 43 43 ASN CA C 43 50.630 50.630 54.562 -3.933 19287
4301 1 15 . 1 1 43 43 ASN CB C 43 34.840 34.840 38.111 -3.271 19287
4302 1 15 . 1 1 43 43 ASN H H 43 7.900 7.900 8.057 -0.157 19287
4303 1 15 . 1 1 44 44 ARG N N 44 120.690 120.690 120.112 0.578 19287
4304 1 15 . 1 1 44 44 ARG HA H 44 4.692 4.692 4.003 0.689 19287
4305 1 15 . 1 1 44 44 ARG C C 44 173.530 173.530 174.641 -1.111 19287
4306 1 15 . 1 1 44 44 ARG CA C 44 56.660 56.660 56.566 0.094 19287
4307 1 15 . 1 1 44 44 ARG CB C 44 31.450 31.450 29.540 1.910 19287
4308 1 15 . 1 1 44 44 ARG H H 44 6.860 6.860 7.398 -0.538 19287
4309 1 15 . 1 1 45 45 PHE N N 45 123.690 123.690 122.465 1.225 19287
4310 1 15 . 1 1 45 45 PHE HA H 45 4.810 4.810 4.945 -0.135 19287
4311 1 15 . 1 1 45 45 PHE C C 45 175.420 175.420 175.507 -0.087 19287
4312 1 15 . 1 1 45 45 PHE CA C 45 55.670 55.670 55.837 -0.167 19287
4313 1 15 . 1 1 45 45 PHE CB C 45 43.790 43.790 41.449 2.341 19287
4314 1 15 . 1 1 45 45 PHE H H 45 9.340 9.340 8.076 1.264 19287
4315 1 15 . 1 1 46 46 ARG N N 46 120.920 120.920 117.666 3.254 19287
4316 1 15 . 1 1 46 46 ARG HA H 46 4.397 4.397 4.549 -0.152 19287
4317 1 15 . 1 1 46 46 ARG C C 46 176.560 176.560 176.257 0.303 19287
4318 1 15 . 1 1 46 46 ARG CA C 46 58.210 58.210 56.426 1.784 19287
4319 1 15 . 1 1 46 46 ARG CB C 46 30.900 30.900 30.564 0.336 19287
4320 1 15 . 1 1 46 46 ARG H H 46 9.080 9.080 8.789 0.291 19287
4321 1 15 . 1 1 47 47 THR N N 47 102.800 102.800 111.856 -9.056 19287
4322 1 15 . 1 1 47 47 THR HA H 47 4.660 4.660 4.151 0.509 19287
4323 1 15 . 1 1 47 47 THR C C 47 174.110 174.110 173.247 0.863 19287
4324 1 15 . 1 1 47 47 THR CA C 47 58.170 58.170 60.900 -2.730 19287
4325 1 15 . 1 1 47 47 THR CB C 47 72.380 72.380 70.271 2.109 19287
4326 1 15 . 1 1 47 47 THR H H 47 7.230 7.230 7.511 -0.281 19287
4327 1 15 . 1 1 48 48 ILE N N 48 123.200 123.200 124.842 -1.642 19287
4328 1 15 . 1 1 48 48 ILE HA H 48 2.901 2.901 3.584 -0.683 19287
4329 1 15 . 1 1 48 48 ILE C C 48 176.420 176.420 176.001 0.419 19287
4330 1 15 . 1 1 48 48 ILE CA C 48 64.000 64.000 63.810 0.190 19287
4331 1 15 . 1 1 48 48 ILE CB C 48 37.060 37.060 38.304 -1.244 19287
4332 1 15 . 1 1 48 48 ILE H H 48 8.110 8.110 7.962 0.148 19287
4333 1 15 . 1 1 49 49 ASP N N 49 119.560 119.560 118.894 0.666 19287
4334 1 15 . 1 1 49 49 ASP HA H 49 4.130 4.130 4.223 -0.092 19287
4335 1 15 . 1 1 49 49 ASP C C 49 177.740 177.740 178.590 -0.850 19287
4336 1 15 . 1 1 49 49 ASP CA C 49 56.690 56.690 57.591 -0.901 19287
4337 1 15 . 1 1 49 49 ASP CB C 49 39.970 39.970 40.007 -0.037 19287
4338 1 15 . 1 1 49 49 ASP H H 49 7.700 7.700 8.080 -0.380 19287
4339 1 15 . 1 1 50 50 GLU N N 50 117.720 117.720 119.347 -1.627 19287
4340 1 15 . 1 1 50 50 GLU HA H 50 3.710 3.710 4.268 -0.558 19287
4341 1 15 . 1 1 50 50 GLU C C 50 177.550 177.550 178.160 -0.610 19287
4342 1 15 . 1 1 50 50 GLU CA C 50 58.550 58.550 58.283 0.266 19287
4343 1 15 . 1 1 50 50 GLU CB C 50 29.190 29.190 29.831 -0.641 19287
4344 1 15 . 1 1 50 50 GLU H H 50 7.410 7.410 7.601 -0.191 19287
4345 1 15 . 1 1 51 51 CYS N N 51 120.260 120.260 120.132 0.128 19287
4346 1 15 . 1 1 51 51 CYS HA H 51 1.650 1.650 3.693 -2.043 19287
4347 1 15 . 1 1 51 51 CYS C C 51 175.070 175.070 176.441 -1.371 19287
4348 1 15 . 1 1 51 51 CYS CA C 51 59.120 59.120 61.542 -2.422 19287
4349 1 15 . 1 1 51 51 CYS CB C 51 43.000 43.000 25.957 17.043 19287
4350 1 15 . 1 1 51 51 CYS H H 51 6.760 6.760 7.729 -0.969 19287
4351 1 15 . 1 1 52 52 ASN N N 52 120.160 120.160 119.382 0.778 19287
4352 1 15 . 1 1 52 52 ASN HA H 52 4.090 4.090 4.497 -0.407 19287
4353 1 15 . 1 1 52 52 ASN C C 52 177.820 177.820 177.978 -0.158 19287
4354 1 15 . 1 1 52 52 ASN CA C 52 55.060 55.060 55.831 -0.771 19287
4355 1 15 . 1 1 52 52 ASN CB C 52 37.500 37.500 38.096 -0.597 19287
4356 1 15 . 1 1 52 52 ASN H H 52 8.650 8.650 8.636 0.014 19287
4357 1 15 . 1 1 53 53 ARG N N 53 117.000 117.000 118.489 -1.489 19287
4358 1 15 . 1 1 53 53 ARG HA H 53 3.770 3.770 4.057 -0.287 19287
4359 1 15 . 1 1 53 53 ARG C C 53 177.360 177.360 177.715 -0.355 19287
4360 1 15 . 1 1 53 53 ARG CA C 53 58.490 58.490 58.620 -0.129 19287
4361 1 15 . 1 1 53 53 ARG CB C 53 30.180 30.180 29.495 0.685 19287
4362 1 15 . 1 1 53 53 ARG H H 53 7.900 7.900 7.567 0.333 19287
4363 1 15 . 1 1 54 54 THR N N 54 112.080 112.080 112.272 -0.192 19287
4364 1 15 . 1 1 54 54 THR HA H 54 3.838 3.838 4.458 -0.620 19287
4365 1 15 . 1 1 54 54 THR C C 54 174.990 174.990 174.324 0.666 19287
4366 1 15 . 1 1 54 54 THR CA C 54 65.740 65.740 64.469 1.271 19287
4367 1 15 . 1 1 54 54 THR CB C 54 68.870 68.870 69.876 -1.006 19287
4368 1 15 . 1 1 54 54 THR H H 54 7.260 7.260 8.044 -0.784 19287
4369 1 15 . 1 1 55 55 CYS N N 55 112.540 112.540 117.046 -4.506 19287
4370 1 15 . 1 1 55 55 CYS HA H 55 4.400 4.400 4.470 -0.070 19287
4371 1 15 . 1 1 55 55 CYS C C 55 172.940 172.940 174.240 -1.300 19287
4372 1 15 . 1 1 55 55 CYS CA C 55 54.230 54.230 59.033 -4.803 19287
4373 1 15 . 1 1 55 55 CYS CB C 55 42.930 42.930 28.846 14.085 19287
4374 1 15 . 1 1 55 55 CYS H H 55 7.590 7.590 7.411 0.179 19287
4375 1 15 . 1 1 56 56 VAL N N 56 119.720 119.720 123.592 -3.872 19287
4376 1 15 . 1 1 56 56 VAL HA H 56 3.631 3.631 3.971 -0.340 19287
4377 1 15 . 1 1 56 56 VAL C C 56 176.710 176.710 176.650 0.060 19287
4378 1 15 . 1 1 56 56 VAL CA C 56 64.540 64.540 64.196 0.344 19287
4379 1 15 . 1 1 56 56 VAL CB C 56 30.970 30.970 31.809 -0.839 19287
4380 1 15 . 1 1 56 56 VAL H H 56 7.280 7.280 7.705 -0.425 19287
4381 1 16 . 1 1 2 2 PRO HA H 2 4.017 4.017 4.430 -0.413 19287
4382 1 16 . 1 1 2 2 PRO C C 2 177.920 177.920 177.808 0.112 19287
4383 1 16 . 1 1 2 2 PRO CA C 2 62.800 62.800 62.169 0.631 19287
4384 1 16 . 1 1 2 2 PRO CB C 2 32.050 32.050 32.781 -0.731 19287
4385 1 16 . 1 1 3 3 ARG N N 3 122.340 122.340 122.145 0.195 19287
4386 1 16 . 1 1 3 3 ARG HA H 3 3.786 3.786 4.017 -0.231 19287
4387 1 16 . 1 1 3 3 ARG C C 3 178.950 178.950 178.026 0.924 19287
4388 1 16 . 1 1 3 3 ARG CA C 3 58.410 58.410 58.278 0.132 19287
4389 1 16 . 1 1 3 3 ARG CB C 3 29.220 29.220 29.160 0.060 19287
4390 1 16 . 1 1 3 3 ARG H H 3 8.550 8.550 8.891 -0.341 19287
4391 1 16 . 1 1 4 4 PHE N N 4 113.010 113.010 117.206 -4.196 19287
4392 1 16 . 1 1 4 4 PHE HA H 4 4.300 4.300 4.518 -0.218 19287
4393 1 16 . 1 1 4 4 PHE C C 4 176.070 176.070 176.503 -0.433 19287
4394 1 16 . 1 1 4 4 PHE CA C 4 58.220 58.220 58.604 -0.384 19287
4395 1 16 . 1 1 4 4 PHE CB C 4 37.310 37.310 37.864 -0.554 19287
4396 1 16 . 1 1 4 4 PHE H H 4 7.150 7.150 7.857 -0.707 19287
4397 1 16 . 1 1 5 5 CYS N N 5 118.600 118.600 117.793 0.807 19287
4398 1 16 . 1 1 5 5 CYS HA H 5 4.130 4.130 4.296 -0.166 19287
4399 1 16 . 1 1 5 5 CYS C C 5 173.450 173.450 174.650 -1.200 19287
4400 1 16 . 1 1 5 5 CYS CA C 5 57.960 57.960 60.248 -2.288 19287
4401 1 16 . 1 1 5 5 CYS CB C 5 39.210 39.210 25.283 13.927 19287
4402 1 16 . 1 1 5 5 CYS H H 5 7.090 7.090 7.284 -0.194 19287
4403 1 16 . 1 1 6 6 GLU N N 6 110.710 110.710 117.816 -7.106 19287
4404 1 16 . 1 1 6 6 GLU HA H 6 4.182 4.182 4.408 -0.226 19287
4405 1 16 . 1 1 6 6 GLU C C 6 176.310 176.310 176.313 -0.003 19287
4406 1 16 . 1 1 6 6 GLU CA C 6 55.510 55.510 55.235 0.275 19287
4407 1 16 . 1 1 6 6 GLU CB C 6 28.160 28.160 29.034 -0.874 19287
4408 1 16 . 1 1 6 6 GLU H H 6 7.300 7.300 7.470 -0.170 19287
4409 1 16 . 1 1 7 7 LEU N N 7 119.090 119.090 120.970 -1.880 19287
4410 1 16 . 1 1 7 7 LEU HA H 7 4.160 4.160 4.258 -0.098 19287
4411 1 16 . 1 1 7 7 LEU C C 7 176.630 176.630 176.013 0.617 19287
4412 1 16 . 1 1 7 7 LEU CA C 7 54.510 54.510 54.478 0.032 19287
4413 1 16 . 1 1 7 7 LEU CB C 7 42.330 42.330 42.605 -0.275 19287
4414 1 16 . 1 1 7 7 LEU H H 7 7.210 7.210 7.173 0.037 19287
4415 1 16 . 1 1 8 8 ALA N N 8 124.490 124.490 121.900 2.590 19287
4416 1 16 . 1 1 8 8 ALA HA H 8 4.250 4.250 4.651 -0.401 19287
4417 1 16 . 1 1 8 8 ALA C C 8 174.710 174.710 175.303 -0.593 19287
4418 1 16 . 1 1 8 8 ALA CA C 8 50.210 50.210 48.858 1.352 19287
4419 1 16 . 1 1 8 8 ALA CB C 8 16.930 16.930 19.317 -2.387 19287
4420 1 16 . 1 1 8 8 ALA H H 8 8.280 8.280 8.229 0.051 19287
4421 1 16 . 1 1 9 9 PRO HA H 9 4.180 4.180 4.605 -0.425 19287
4422 1 16 . 1 1 9 9 PRO C C 9 176.700 176.700 176.812 -0.112 19287
4423 1 16 . 1 1 9 9 PRO CA C 9 61.490 61.490 62.608 -1.118 19287
4424 1 16 . 1 1 9 9 PRO CB C 9 30.360 30.360 31.977 -1.617 19287
4425 1 16 . 1 1 10 10 SER N N 10 112.100 112.100 122.760 -10.660 19287
4426 1 16 . 1 1 10 10 SER HA H 10 4.630 4.630 4.417 0.213 19287
4427 1 16 . 1 1 10 10 SER C C 10 174.190 174.190 175.251 -1.061 19287
4428 1 16 . 1 1 10 10 SER CA C 10 55.360 55.360 56.590 -1.230 19287
4429 1 16 . 1 1 10 10 SER CB C 10 64.550 64.550 61.888 2.662 19287
4430 1 16 . 1 1 10 10 SER H H 10 7.450 7.450 9.079 -1.629 19287
4431 1 16 . 1 1 11 11 ALA N N 11 129.980 129.980 124.862 5.118 19287
4432 1 16 . 1 1 11 11 ALA HA H 11 4.496 4.496 3.867 0.629 19287
4433 1 16 . 1 1 11 11 ALA C C 11 178.510 178.510 178.992 -0.482 19287
4434 1 16 . 1 1 11 11 ALA CA C 11 54.810 54.810 54.805 0.005 19287
4435 1 16 . 1 1 11 11 ALA CB C 11 19.910 19.910 18.436 1.474 19287
4436 1 16 . 1 1 11 11 ALA H H 11 9.210 9.210 8.183 1.027 19287
4437 1 16 . 1 1 12 12 GLY N N 12 104.410 104.410 105.777 -1.367 19287
4438 1 16 . 1 1 12 12 GLY C C 12 174.850 174.850 175.775 -0.925 19287
4439 1 16 . 1 1 12 12 GLY CA C 12 44.450 44.450 45.994 -1.544 19287
4440 1 16 . 1 1 12 12 GLY H H 12 8.190 8.190 8.498 -0.308 19287
4441 1 16 . 1 1 14 14 CYS HA H 14 4.250 4.250 4.661 -0.411 19287
4442 1 16 . 1 1 14 14 CYS C C 14 172.410 172.410 172.973 -0.563 19287
4443 1 16 . 1 1 14 14 CYS CA C 14 59.750 59.750 58.664 1.086 19287
4444 1 16 . 1 1 14 14 CYS CB C 14 39.130 39.130 30.898 8.232 19287
4445 1 16 . 1 1 15 15 PHE N N 15 116.000 116.000 125.994 -9.994 19287
4446 1 16 . 1 1 15 15 PHE HA H 15 4.380 4.380 4.662 -0.282 19287
4447 1 16 . 1 1 15 15 PHE C C 15 174.300 174.300 174.094 0.206 19287
4448 1 16 . 1 1 15 15 PHE CA C 15 56.830 56.830 56.092 0.738 19287
4449 1 16 . 1 1 15 15 PHE CB C 15 39.440 39.440 38.419 1.021 19287
4450 1 16 . 1 1 15 15 PHE H H 15 7.960 7.960 8.654 -0.694 19287
4451 1 16 . 1 1 16 16 ALA N N 16 125.630 125.630 131.082 -5.452 19287
4452 1 16 . 1 1 16 16 ALA HA H 16 4.320 4.320 4.190 0.130 19287
4453 1 16 . 1 1 16 16 ALA C C 16 174.300 174.300 175.286 -0.986 19287
4454 1 16 . 1 1 16 16 ALA CA C 16 50.130 50.130 51.596 -1.466 19287
4455 1 16 . 1 1 16 16 ALA CB C 16 19.180 19.180 21.774 -2.594 19287
4456 1 16 . 1 1 16 16 ALA H H 16 7.800 7.800 8.058 -0.258 19287
4457 1 16 . 1 1 17 17 PHE N N 17 116.330 116.330 121.697 -5.367 19287
4458 1 16 . 1 1 17 17 PHE HA H 17 4.390 4.390 4.761 -0.371 19287
4459 1 16 . 1 1 17 17 PHE C C 17 175.310 175.310 174.004 1.306 19287
4460 1 16 . 1 1 17 17 PHE CA C 17 57.160 57.160 55.639 1.521 19287
4461 1 16 . 1 1 17 17 PHE CB C 17 39.380 39.380 41.270 -1.890 19287
4462 1 16 . 1 1 17 17 PHE H H 17 7.330 7.330 8.326 -0.996 19287
4463 1 16 . 1 1 18 18 VAL N N 18 122.890 122.890 124.995 -2.105 19287
4464 1 16 . 1 1 18 18 VAL HA H 18 4.475 4.475 4.690 -0.215 19287
4465 1 16 . 1 1 18 18 VAL C C 18 173.590 173.590 173.475 0.115 19287
4466 1 16 . 1 1 18 18 VAL CA C 18 58.900 58.900 58.834 0.066 19287
4467 1 16 . 1 1 18 18 VAL CB C 18 33.900 33.900 33.555 0.345 19287
4468 1 16 . 1 1 18 18 VAL H H 18 8.680 8.680 8.729 -0.049 19287
4469 1 16 . 1 1 19 19 PRO HA H 19 4.275 4.275 4.626 -0.351 19287
4470 1 16 . 1 1 19 19 PRO C C 19 176.940 176.940 176.311 0.629 19287
4471 1 16 . 1 1 19 19 PRO CA C 19 64.060 64.060 62.764 1.296 19287
4472 1 16 . 1 1 19 19 PRO CB C 19 31.710 31.710 31.497 0.212 19287
4473 1 16 . 1 1 20 20 SER N N 20 120.230 120.230 117.867 2.363 19287
4474 1 16 . 1 1 20 20 SER HA H 20 4.780 4.780 4.640 0.140 19287
4475 1 16 . 1 1 20 20 SER C C 20 170.900 170.900 173.083 -2.183 19287
4476 1 16 . 1 1 20 20 SER CA C 20 57.450 57.450 56.049 1.401 19287
4477 1 16 . 1 1 20 20 SER CB C 20 67.910 67.910 65.593 2.317 19287
4478 1 16 . 1 1 20 20 SER H H 20 8.390 8.390 7.788 0.602 19287
4479 1 16 . 1 1 21 21 TYR N N 21 118.220 118.220 119.654 -1.434 19287
4480 1 16 . 1 1 21 21 TYR HA H 21 5.600 5.600 5.141 0.459 19287
4481 1 16 . 1 1 21 21 TYR C C 21 173.770 173.770 174.822 -1.052 19287
4482 1 16 . 1 1 21 21 TYR CA C 21 57.740 57.740 58.108 -0.368 19287
4483 1 16 . 1 1 21 21 TYR CB C 21 42.660 42.660 41.789 0.871 19287
4484 1 16 . 1 1 21 21 TYR H H 21 9.020 9.020 8.672 0.348 19287
4485 1 16 . 1 1 22 22 TYR N N 22 119.260 119.260 125.307 -6.047 19287
4486 1 16 . 1 1 22 22 TYR HA H 22 5.110 5.110 4.898 0.212 19287
4487 1 16 . 1 1 22 22 TYR C C 22 172.610 172.610 174.087 -1.477 19287
4488 1 16 . 1 1 22 22 TYR CA C 22 55.380 55.380 55.458 -0.078 19287
4489 1 16 . 1 1 22 22 TYR CB C 22 41.550 41.550 42.675 -1.125 19287
4490 1 16 . 1 1 22 22 TYR H H 22 9.410 9.410 9.660 -0.250 19287
4491 1 16 . 1 1 23 23 TYR N N 23 123.200 123.200 127.948 -4.748 19287
4492 1 16 . 1 1 23 23 TYR HA H 23 4.382 4.382 4.997 -0.615 19287
4493 1 16 . 1 1 23 23 TYR C C 23 173.250 173.250 174.400 -1.150 19287
4494 1 16 . 1 1 23 23 TYR CA C 23 58.360 58.360 57.448 0.912 19287
4495 1 16 . 1 1 23 23 TYR CB C 23 39.570 39.570 40.267 -0.697 19287
4496 1 16 . 1 1 23 23 TYR H H 23 10.190 10.190 8.857 1.333 19287
4497 1 16 . 1 1 24 24 ASN N N 24 126.280 126.280 128.091 -1.811 19287
4498 1 16 . 1 1 24 24 ASN HA H 24 4.550 4.550 4.976 -0.426 19287
4499 1 16 . 1 1 24 24 ASN C C 24 174.000 174.000 175.529 -1.529 19287
4500 1 16 . 1 1 24 24 ASN CA C 24 51.360 51.360 51.564 -0.204 19287
4501 1 16 . 1 1 24 24 ASN CB C 24 40.040 40.040 38.229 1.811 19287
4502 1 16 . 1 1 24 24 ASN H H 24 7.890 7.890 8.655 -0.765 19287
4503 1 16 . 1 1 25 25 GLN N N 25 122.760 122.760 123.182 -0.422 19287
4504 1 16 . 1 1 25 25 GLN HA H 25 3.691 3.691 3.626 0.065 19287
4505 1 16 . 1 1 25 25 GLN C C 25 175.670 175.670 176.886 -1.216 19287
4506 1 16 . 1 1 25 25 GLN CA C 25 57.480 57.480 58.426 -0.946 19287
4507 1 16 . 1 1 25 25 GLN CB C 25 28.120 28.120 27.586 0.534 19287
4508 1 16 . 1 1 25 25 GLN H H 25 8.440 8.440 8.042 0.398 19287
4509 1 16 . 1 1 26 26 TYR N N 26 119.190 119.190 119.034 0.156 19287
4510 1 16 . 1 1 26 26 TYR HA H 26 4.160 4.160 4.313 -0.153 19287
4511 1 16 . 1 1 26 26 TYR C C 26 176.520 176.520 176.658 -0.138 19287
4512 1 16 . 1 1 26 26 TYR CA C 26 60.170 60.170 59.898 0.272 19287
4513 1 16 . 1 1 26 26 TYR CB C 26 36.880 36.880 37.721 -0.841 19287
4514 1 16 . 1 1 26 26 TYR H H 26 7.810 7.810 7.703 0.107 19287
4515 1 16 . 1 1 27 27 SER N N 27 109.600 109.600 112.390 -2.790 19287
4516 1 16 . 1 1 27 27 SER HA H 27 4.330 4.330 4.562 -0.232 19287
4517 1 16 . 1 1 27 27 SER C C 27 174.830 174.830 173.687 1.143 19287
4518 1 16 . 1 1 27 27 SER CA C 27 57.490 57.490 57.457 0.033 19287
4519 1 16 . 1 1 27 27 SER CB C 27 64.640 64.640 64.045 0.595 19287
4520 1 16 . 1 1 27 27 SER H H 27 7.350 7.350 7.564 -0.214 19287
4521 1 16 . 1 1 28 28 ASN N N 28 119.830 119.830 118.669 1.161 19287
4522 1 16 . 1 1 28 28 ASN HA H 28 4.060 4.060 4.322 -0.262 19287
4523 1 16 . 1 1 28 28 ASN C C 28 173.040 173.040 174.395 -1.355 19287
4524 1 16 . 1 1 28 28 ASN CA C 28 53.830 53.830 54.664 -0.834 19287
4525 1 16 . 1 1 28 28 ASN CB C 28 37.400 37.400 38.064 -0.664 19287
4526 1 16 . 1 1 28 28 ASN H H 28 7.930 7.930 7.896 0.034 19287
4527 1 16 . 1 1 29 29 THR N N 29 103.070 103.070 110.012 -6.942 19287
4528 1 16 . 1 1 29 29 THR HA H 29 4.441 4.441 4.689 -0.248 19287
4529 1 16 . 1 1 29 29 THR C C 29 172.980 172.980 172.317 0.663 19287
4530 1 16 . 1 1 29 29 THR CA C 29 58.920 58.920 61.244 -2.324 19287
4531 1 16 . 1 1 29 29 THR CB C 29 73.260 73.260 71.268 1.992 19287
4532 1 16 . 1 1 29 29 THR H H 29 6.990 6.990 7.665 -0.675 19287
4533 1 16 . 1 1 30 30 CYS N N 30 118.340 118.340 118.911 -0.571 19287
4534 1 16 . 1 1 30 30 CYS HA H 30 5.462 5.462 5.668 -0.206 19287
4535 1 16 . 1 1 30 30 CYS C C 30 173.320 173.320 173.681 -0.361 19287
4536 1 16 . 1 1 30 30 CYS CA C 30 57.750 57.750 57.188 0.562 19287
4537 1 16 . 1 1 30 30 CYS CB C 30 50.680 50.680 31.676 19.004 19287
4538 1 16 . 1 1 30 30 CYS H H 30 8.954 8.954 8.605 0.349 19287
4539 1 16 . 1 1 31 31 HIS N N 31 118.930 118.930 119.935 -1.005 19287
4540 1 16 . 1 1 31 31 HIS HA H 31 4.780 4.780 5.098 -0.318 19287
4541 1 16 . 1 1 31 31 HIS C C 31 172.790 172.790 173.598 -0.808 19287
4542 1 16 . 1 1 31 31 HIS CA C 31 53.530 53.530 55.445 -1.915 19287
4543 1 16 . 1 1 31 31 HIS CB C 31 33.040 33.040 33.472 -0.432 19287
4544 1 16 . 1 1 31 31 HIS H H 31 9.010 9.010 9.665 -0.655 19287
4545 1 16 . 1 1 32 32 SER N N 32 117.600 117.600 120.702 -3.102 19287
4546 1 16 . 1 1 32 32 SER HA H 32 4.700 4.700 4.449 0.251 19287
4547 1 16 . 1 1 32 32 SER C C 32 174.930 174.930 173.812 1.118 19287
4548 1 16 . 1 1 32 32 SER CA C 32 57.980 57.980 58.697 -0.717 19287
4549 1 16 . 1 1 32 32 SER CB C 32 64.440 64.440 63.075 1.365 19287
4550 1 16 . 1 1 32 32 SER H H 32 8.740 8.740 8.279 0.461 19287
4551 1 16 . 1 1 33 33 PHE N N 33 120.690 120.690 120.351 0.339 19287
4552 1 16 . 1 1 33 33 PHE HA H 33 4.790 4.790 5.063 -0.273 19287
4553 1 16 . 1 1 33 33 PHE C C 33 171.810 171.810 173.684 -1.874 19287
4554 1 16 . 1 1 33 33 PHE CA C 33 56.200 56.200 55.869 0.331 19287
4555 1 16 . 1 1 33 33 PHE CB C 33 40.230 40.230 42.100 -1.871 19287
4556 1 16 . 1 1 33 33 PHE H H 33 8.830 8.830 8.865 -0.035 19287
4557 1 16 . 1 1 34 34 THR N N 34 116.650 116.650 111.964 4.686 19287
4558 1 16 . 1 1 34 34 THR HA H 34 3.965 3.965 4.413 -0.448 19287
4559 1 16 . 1 1 34 34 THR C C 34 172.600 172.600 172.515 0.085 19287
4560 1 16 . 1 1 34 34 THR CA C 34 61.980 61.980 60.447 1.533 19287
4561 1 16 . 1 1 34 34 THR CB C 34 68.530 68.530 69.763 -1.234 19287
4562 1 16 . 1 1 34 34 THR H H 34 8.400 8.400 8.177 0.223 19287
4563 1 16 . 1 1 35 35 TYR N N 35 127.790 127.790 126.111 1.679 19287
4564 1 16 . 1 1 35 35 TYR HA H 35 4.500 4.500 4.741 -0.241 19287
4565 1 16 . 1 1 35 35 TYR C C 35 174.200 174.200 173.392 0.808 19287
4566 1 16 . 1 1 35 35 TYR CA C 35 55.130 55.130 57.004 -1.874 19287
4567 1 16 . 1 1 35 35 TYR CB C 35 39.650 39.650 42.288 -2.638 19287
4568 1 16 . 1 1 35 35 TYR H H 35 8.010 8.010 8.097 -0.087 19287
4569 1 16 . 1 1 39 39 GLY N N 39 103.730 103.730 108.374 -4.644 19287
4570 1 16 . 1 1 39 39 GLY C C 39 175.700 175.700 172.955 2.745 19287
4571 1 16 . 1 1 39 39 GLY CA C 39 45.370 45.370 44.911 0.459 19287
4572 1 16 . 1 1 39 39 GLY H H 39 8.500 8.500 7.344 1.156 19287
4573 1 16 . 1 1 40 40 GLY N N 40 110.170 110.170 108.296 1.874 19287
4574 1 16 . 1 1 40 40 GLY C C 40 173.140 173.140 172.209 0.931 19287
4575 1 16 . 1 1 40 40 GLY CA C 40 44.320 44.320 44.599 -0.279 19287
4576 1 16 . 1 1 40 40 GLY H H 40 8.670 8.670 7.778 0.892 19287
4577 1 16 . 1 1 41 41 ASN N N 41 116.960 116.960 116.490 0.470 19287
4578 1 16 . 1 1 41 41 ASN HA H 41 4.560 4.560 5.074 -0.514 19287
4579 1 16 . 1 1 41 41 ASN C C 41 173.670 173.670 175.764 -2.094 19287
4580 1 16 . 1 1 41 41 ASN CA C 41 51.850 51.850 52.129 -0.279 19287
4581 1 16 . 1 1 41 41 ASN CB C 41 40.230 40.230 40.005 0.225 19287
4582 1 16 . 1 1 41 41 ASN H H 41 8.790 8.790 8.549 0.241 19287
4583 1 16 . 1 1 42 42 ALA N N 42 113.290 113.290 121.934 -8.644 19287
4584 1 16 . 1 1 42 42 ALA HA H 42 3.720 3.720 4.135 -0.415 19287
4585 1 16 . 1 1 42 42 ALA C C 42 177.220 177.220 178.286 -1.066 19287
4586 1 16 . 1 1 42 42 ALA CA C 42 52.810 52.810 54.789 -1.979 19287
4587 1 16 . 1 1 42 42 ALA CB C 42 17.980 17.980 18.756 -0.776 19287
4588 1 16 . 1 1 42 42 ALA H H 42 7.590 7.590 8.662 -1.072 19287
4589 1 16 . 1 1 43 43 ASN N N 43 117.710 117.710 115.040 2.670 19287
4590 1 16 . 1 1 43 43 ASN HA H 43 4.700 4.700 4.466 0.234 19287
4591 1 16 . 1 1 43 43 ASN C C 43 173.660 173.660 173.859 -0.199 19287
4592 1 16 . 1 1 43 43 ASN CA C 43 50.630 50.630 53.490 -2.860 19287
4593 1 16 . 1 1 43 43 ASN CB C 43 34.840 34.840 38.013 -3.173 19287
4594 1 16 . 1 1 43 43 ASN H H 43 7.900 7.900 8.126 -0.226 19287
4595 1 16 . 1 1 44 44 ARG N N 44 120.690 120.690 119.141 1.549 19287
4596 1 16 . 1 1 44 44 ARG HA H 44 4.692 4.692 4.124 0.568 19287
4597 1 16 . 1 1 44 44 ARG C C 44 173.530 173.530 174.468 -0.938 19287
4598 1 16 . 1 1 44 44 ARG CA C 44 56.660 56.660 56.010 0.650 19287
4599 1 16 . 1 1 44 44 ARG CB C 44 31.450 31.450 29.774 1.676 19287
4600 1 16 . 1 1 44 44 ARG H H 44 6.860 6.860 6.929 -0.069 19287
4601 1 16 . 1 1 45 45 PHE N N 45 123.690 123.690 122.837 0.853 19287
4602 1 16 . 1 1 45 45 PHE HA H 45 4.810 4.810 4.974 -0.164 19287
4603 1 16 . 1 1 45 45 PHE C C 45 175.420 175.420 175.561 -0.141 19287
4604 1 16 . 1 1 45 45 PHE CA C 45 55.670 55.670 55.941 -0.271 19287
4605 1 16 . 1 1 45 45 PHE CB C 45 43.790 43.790 41.448 2.342 19287
4606 1 16 . 1 1 45 45 PHE H H 45 9.340 9.340 8.180 1.160 19287
4607 1 16 . 1 1 46 46 ARG N N 46 120.920 120.920 118.066 2.854 19287
4608 1 16 . 1 1 46 46 ARG HA H 46 4.397 4.397 4.573 -0.176 19287
4609 1 16 . 1 1 46 46 ARG C C 46 176.560 176.560 176.268 0.292 19287
4610 1 16 . 1 1 46 46 ARG CA C 46 58.210 58.210 56.480 1.730 19287
4611 1 16 . 1 1 46 46 ARG CB C 46 30.900 30.900 30.717 0.183 19287
4612 1 16 . 1 1 46 46 ARG H H 46 9.080 9.080 8.774 0.306 19287
4613 1 16 . 1 1 47 47 THR N N 47 102.800 102.800 112.508 -9.708 19287
4614 1 16 . 1 1 47 47 THR HA H 47 4.660 4.660 4.341 0.319 19287
4615 1 16 . 1 1 47 47 THR C C 47 174.110 174.110 173.050 1.060 19287
4616 1 16 . 1 1 47 47 THR CA C 47 58.170 58.170 60.142 -1.972 19287
4617 1 16 . 1 1 47 47 THR CB C 47 72.380 72.380 70.461 1.919 19287
4618 1 16 . 1 1 47 47 THR H H 47 7.230 7.230 7.566 -0.336 19287
4619 1 16 . 1 1 48 48 ILE N N 48 123.200 123.200 123.708 -0.508 19287
4620 1 16 . 1 1 48 48 ILE HA H 48 2.901 2.901 3.601 -0.700 19287
4621 1 16 . 1 1 48 48 ILE C C 48 176.420 176.420 176.149 0.271 19287
4622 1 16 . 1 1 48 48 ILE CA C 48 64.000 64.000 63.226 0.774 19287
4623 1 16 . 1 1 48 48 ILE CB C 48 37.060 37.060 38.014 -0.954 19287
4624 1 16 . 1 1 48 48 ILE H H 48 8.110 8.110 7.922 0.188 19287
4625 1 16 . 1 1 49 49 ASP N N 49 119.560 119.560 119.623 -0.063 19287
4626 1 16 . 1 1 49 49 ASP HA H 49 4.130 4.130 4.238 -0.108 19287
4627 1 16 . 1 1 49 49 ASP C C 49 177.740 177.740 178.160 -0.420 19287
4628 1 16 . 1 1 49 49 ASP CA C 49 56.690 56.690 58.219 -1.529 19287
4629 1 16 . 1 1 49 49 ASP CB C 49 39.970 39.970 40.618 -0.648 19287
4630 1 16 . 1 1 49 49 ASP H H 49 7.700 7.700 7.787 -0.087 19287
4631 1 16 . 1 1 50 50 GLU N N 50 117.720 117.720 119.843 -2.123 19287
4632 1 16 . 1 1 50 50 GLU HA H 50 3.710 3.710 4.179 -0.469 19287
4633 1 16 . 1 1 50 50 GLU C C 50 177.550 177.550 178.312 -0.762 19287
4634 1 16 . 1 1 50 50 GLU CA C 50 58.550 58.550 58.778 -0.228 19287
4635 1 16 . 1 1 50 50 GLU CB C 50 29.190 29.190 29.651 -0.461 19287
4636 1 16 . 1 1 50 50 GLU H H 50 7.410 7.410 7.635 -0.225 19287
4637 1 16 . 1 1 51 51 CYS N N 51 120.260 120.260 119.162 1.098 19287
4638 1 16 . 1 1 51 51 CYS HA H 51 1.650 1.650 3.668 -2.018 19287
4639 1 16 . 1 1 51 51 CYS C C 51 175.070 175.070 176.516 -1.446 19287
4640 1 16 . 1 1 51 51 CYS CA C 51 59.120 59.120 61.761 -2.641 19287
4641 1 16 . 1 1 51 51 CYS CB C 51 43.000 43.000 26.195 16.805 19287
4642 1 16 . 1 1 51 51 CYS H H 51 6.760 6.760 7.947 -1.187 19287
4643 1 16 . 1 1 52 52 ASN N N 52 120.160 120.160 119.331 0.829 19287
4644 1 16 . 1 1 52 52 ASN HA H 52 4.090 4.090 4.475 -0.385 19287
4645 1 16 . 1 1 52 52 ASN C C 52 177.820 177.820 177.700 0.120 19287
4646 1 16 . 1 1 52 52 ASN CA C 52 55.060 55.060 55.993 -0.933 19287
4647 1 16 . 1 1 52 52 ASN CB C 52 37.500 37.500 38.147 -0.647 19287
4648 1 16 . 1 1 52 52 ASN H H 52 8.650 8.650 8.542 0.108 19287
4649 1 16 . 1 1 53 53 ARG N N 53 117.000 117.000 118.300 -1.300 19287
4650 1 16 . 1 1 53 53 ARG HA H 53 3.770 3.770 4.059 -0.289 19287
4651 1 16 . 1 1 53 53 ARG C C 53 177.360 177.360 177.709 -0.349 19287
4652 1 16 . 1 1 53 53 ARG CA C 53 58.490 58.490 58.541 -0.051 19287
4653 1 16 . 1 1 53 53 ARG CB C 53 30.180 30.180 29.469 0.711 19287
4654 1 16 . 1 1 53 53 ARG H H 53 7.900 7.900 7.690 0.210 19287
4655 1 16 . 1 1 54 54 THR N N 54 112.080 112.080 112.098 -0.018 19287
4656 1 16 . 1 1 54 54 THR HA H 54 3.838 3.838 4.465 -0.627 19287
4657 1 16 . 1 1 54 54 THR C C 54 174.990 174.990 174.251 0.739 19287
4658 1 16 . 1 1 54 54 THR CA C 54 65.740 65.740 64.279 1.461 19287
4659 1 16 . 1 1 54 54 THR CB C 54 68.870 68.870 69.978 -1.109 19287
4660 1 16 . 1 1 54 54 THR H H 54 7.260 7.260 7.922 -0.662 19287
4661 1 16 . 1 1 55 55 CYS N N 55 112.540 112.540 116.796 -4.256 19287
4662 1 16 . 1 1 55 55 CYS HA H 55 4.400 4.400 4.433 -0.033 19287
4663 1 16 . 1 1 55 55 CYS C C 55 172.940 172.940 174.015 -1.075 19287
4664 1 16 . 1 1 55 55 CYS CA C 55 54.230 54.230 58.779 -4.549 19287
4665 1 16 . 1 1 55 55 CYS CB C 55 42.930 42.930 29.367 13.563 19287
4666 1 16 . 1 1 55 55 CYS H H 55 7.590 7.590 7.475 0.115 19287
4667 1 16 . 1 1 56 56 VAL N N 56 119.720 119.720 123.642 -3.922 19287
4668 1 16 . 1 1 56 56 VAL HA H 56 3.631 3.631 4.043 -0.412 19287
4669 1 16 . 1 1 56 56 VAL C C 56 176.710 176.710 176.199 0.511 19287
4670 1 16 . 1 1 56 56 VAL CA C 56 64.540 64.540 63.764 0.776 19287
4671 1 16 . 1 1 56 56 VAL CB C 56 30.970 30.970 31.383 -0.413 19287
4672 1 16 . 1 1 56 56 VAL H H 56 7.280 7.280 7.869 -0.589 19287
4673 1 17 . 1 1 2 2 PRO HA H 2 4.017 4.017 4.474 -0.457 19287
4674 1 17 . 1 1 2 2 PRO C C 2 177.920 177.920 177.311 0.609 19287
4675 1 17 . 1 1 2 2 PRO CA C 2 62.800 62.800 62.095 0.705 19287
4676 1 17 . 1 1 2 2 PRO CB C 2 32.050 32.050 32.584 -0.534 19287
4677 1 17 . 1 1 3 3 ARG N N 3 122.340 122.340 119.367 2.973 19287
4678 1 17 . 1 1 3 3 ARG HA H 3 3.786 3.786 4.192 -0.406 19287
4679 1 17 . 1 1 3 3 ARG C C 3 178.950 178.950 178.355 0.595 19287
4680 1 17 . 1 1 3 3 ARG CA C 3 58.410 58.410 57.286 1.124 19287
4681 1 17 . 1 1 3 3 ARG CB C 3 29.220 29.220 29.284 -0.064 19287
4682 1 17 . 1 1 3 3 ARG H H 3 8.550 8.550 8.780 -0.230 19287
4683 1 17 . 1 1 4 4 PHE N N 4 113.010 113.010 119.374 -6.364 19287
4684 1 17 . 1 1 4 4 PHE HA H 4 4.300 4.300 4.403 -0.103 19287
4685 1 17 . 1 1 4 4 PHE C C 4 176.070 176.070 175.687 0.383 19287
4686 1 17 . 1 1 4 4 PHE CA C 4 58.220 58.220 59.410 -1.190 19287
4687 1 17 . 1 1 4 4 PHE CB C 4 37.310 37.310 37.430 -0.120 19287
4688 1 17 . 1 1 4 4 PHE H H 4 7.150 7.150 7.963 -0.813 19287
4689 1 17 . 1 1 5 5 CYS N N 5 118.600 118.600 113.012 5.588 19287
4690 1 17 . 1 1 5 5 CYS HA H 5 4.130 4.130 4.622 -0.492 19287
4691 1 17 . 1 1 5 5 CYS C C 5 173.450 173.450 176.096 -2.646 19287
4692 1 17 . 1 1 5 5 CYS CA C 5 57.960 57.960 57.929 0.030 19287
4693 1 17 . 1 1 5 5 CYS CB C 5 39.210 39.210 27.068 12.142 19287
4694 1 17 . 1 1 5 5 CYS H H 5 7.090 7.090 7.182 -0.092 19287
4695 1 17 . 1 1 6 6 GLU N N 6 110.710 110.710 121.192 -10.482 19287
4696 1 17 . 1 1 6 6 GLU HA H 6 4.182 4.182 4.421 -0.239 19287
4697 1 17 . 1 1 6 6 GLU C C 6 176.310 176.310 176.341 -0.031 19287
4698 1 17 . 1 1 6 6 GLU CA C 6 55.510 55.510 55.529 -0.019 19287
4699 1 17 . 1 1 6 6 GLU CB C 6 28.160 28.160 29.188 -1.028 19287
4700 1 17 . 1 1 6 6 GLU H H 6 7.300 7.300 7.643 -0.343 19287
4701 1 17 . 1 1 7 7 LEU N N 7 119.090 119.090 121.199 -2.109 19287
4702 1 17 . 1 1 7 7 LEU HA H 7 4.160 4.160 4.162 -0.002 19287
4703 1 17 . 1 1 7 7 LEU C C 7 176.630 176.630 176.210 0.420 19287
4704 1 17 . 1 1 7 7 LEU CA C 7 54.510 54.510 54.630 -0.120 19287
4705 1 17 . 1 1 7 7 LEU CB C 7 42.330 42.330 42.206 0.124 19287
4706 1 17 . 1 1 7 7 LEU H H 7 7.210 7.210 7.162 0.048 19287
4707 1 17 . 1 1 8 8 ALA N N 8 124.490 124.490 121.901 2.589 19287
4708 1 17 . 1 1 8 8 ALA HA H 8 4.250 4.250 4.692 -0.442 19287
4709 1 17 . 1 1 8 8 ALA C C 8 174.710 174.710 175.660 -0.950 19287
4710 1 17 . 1 1 8 8 ALA CA C 8 50.210 50.210 48.702 1.508 19287
4711 1 17 . 1 1 8 8 ALA CB C 8 16.930 16.930 19.407 -2.477 19287
4712 1 17 . 1 1 8 8 ALA H H 8 8.280 8.280 8.220 0.060 19287
4713 1 17 . 1 1 9 9 PRO HA H 9 4.180 4.180 4.565 -0.385 19287
4714 1 17 . 1 1 9 9 PRO C C 9 176.700 176.700 176.525 0.175 19287
4715 1 17 . 1 1 9 9 PRO CA C 9 61.490 61.490 62.972 -1.482 19287
4716 1 17 . 1 1 9 9 PRO CB C 9 30.360 30.360 32.355 -1.995 19287
4717 1 17 . 1 1 10 10 SER N N 10 112.100 112.100 121.866 -9.766 19287
4718 1 17 . 1 1 10 10 SER HA H 10 4.630 4.630 4.423 0.207 19287
4719 1 17 . 1 1 10 10 SER C C 10 174.190 174.190 175.008 -0.818 19287
4720 1 17 . 1 1 10 10 SER CA C 10 55.360 55.360 56.300 -0.940 19287
4721 1 17 . 1 1 10 10 SER CB C 10 64.550 64.550 62.112 2.438 19287
4722 1 17 . 1 1 10 10 SER H H 10 7.450 7.450 8.671 -1.221 19287
4723 1 17 . 1 1 11 11 ALA N N 11 129.980 129.980 126.110 3.870 19287
4724 1 17 . 1 1 11 11 ALA HA H 11 4.496 4.496 4.251 0.245 19287
4725 1 17 . 1 1 11 11 ALA C C 11 178.510 178.510 177.525 0.985 19287
4726 1 17 . 1 1 11 11 ALA CA C 11 54.810 54.810 53.384 1.426 19287
4727 1 17 . 1 1 11 11 ALA CB C 11 19.910 19.910 18.925 0.985 19287
4728 1 17 . 1 1 11 11 ALA H H 11 9.210 9.210 8.013 1.197 19287
4729 1 17 . 1 1 12 12 GLY N N 12 104.410 104.410 103.986 0.424 19287
4730 1 17 . 1 1 12 12 GLY C C 12 174.850 174.850 175.430 -0.580 19287
4731 1 17 . 1 1 12 12 GLY CA C 12 44.450 44.450 44.255 0.195 19287
4732 1 17 . 1 1 12 12 GLY H H 12 8.190 8.190 7.898 0.292 19287
4733 1 17 . 1 1 14 14 CYS HA H 14 4.250 4.250 4.572 -0.322 19287
4734 1 17 . 1 1 14 14 CYS C C 14 172.410 172.410 173.598 -1.188 19287
4735 1 17 . 1 1 14 14 CYS CA C 14 59.750 59.750 57.795 1.954 19287
4736 1 17 . 1 1 14 14 CYS CB C 14 39.130 39.130 30.278 8.852 19287
4737 1 17 . 1 1 15 15 PHE N N 15 116.000 116.000 123.943 -7.943 19287
4738 1 17 . 1 1 15 15 PHE HA H 15 4.380 4.380 4.537 -0.157 19287
4739 1 17 . 1 1 15 15 PHE C C 15 174.300 174.300 174.706 -0.406 19287
4740 1 17 . 1 1 15 15 PHE CA C 15 56.830 56.830 58.143 -1.313 19287
4741 1 17 . 1 1 15 15 PHE CB C 15 39.440 39.440 39.391 0.049 19287
4742 1 17 . 1 1 15 15 PHE H H 15 7.960 7.960 8.610 -0.650 19287
4743 1 17 . 1 1 16 16 ALA N N 16 125.630 125.630 130.332 -4.702 19287
4744 1 17 . 1 1 16 16 ALA HA H 16 4.320 4.320 4.450 -0.130 19287
4745 1 17 . 1 1 16 16 ALA C C 16 174.300 174.300 175.344 -1.044 19287
4746 1 17 . 1 1 16 16 ALA CA C 16 50.130 50.130 51.274 -1.144 19287
4747 1 17 . 1 1 16 16 ALA CB C 16 19.180 19.180 21.239 -2.059 19287
4748 1 17 . 1 1 16 16 ALA H H 16 7.800 7.800 7.832 -0.032 19287
4749 1 17 . 1 1 17 17 PHE N N 17 116.330 116.330 122.577 -6.247 19287
4750 1 17 . 1 1 17 17 PHE HA H 17 4.390 4.390 4.660 -0.270 19287
4751 1 17 . 1 1 17 17 PHE C C 17 175.310 175.310 173.886 1.424 19287
4752 1 17 . 1 1 17 17 PHE CA C 17 57.160 57.160 55.871 1.288 19287
4753 1 17 . 1 1 17 17 PHE CB C 17 39.380 39.380 40.876 -1.496 19287
4754 1 17 . 1 1 17 17 PHE H H 17 7.330 7.330 8.291 -0.961 19287
4755 1 17 . 1 1 18 18 VAL N N 18 122.890 122.890 124.782 -1.892 19287
4756 1 17 . 1 1 18 18 VAL HA H 18 4.475 4.475 4.240 0.235 19287
4757 1 17 . 1 1 18 18 VAL C C 18 173.590 173.590 173.226 0.364 19287
4758 1 17 . 1 1 18 18 VAL CA C 18 58.900 58.900 58.309 0.591 19287
4759 1 17 . 1 1 18 18 VAL CB C 18 33.900 33.900 33.501 0.399 19287
4760 1 17 . 1 1 18 18 VAL H H 18 8.680 8.680 8.089 0.591 19287
4761 1 17 . 1 1 19 19 PRO HA H 19 4.275 4.275 4.565 -0.290 19287
4762 1 17 . 1 1 19 19 PRO C C 19 176.940 176.940 176.392 0.548 19287
4763 1 17 . 1 1 19 19 PRO CA C 19 64.060 64.060 62.457 1.603 19287
4764 1 17 . 1 1 19 19 PRO CB C 19 31.710 31.710 31.775 -0.065 19287
4765 1 17 . 1 1 20 20 SER N N 20 120.230 120.230 117.760 2.470 19287
4766 1 17 . 1 1 20 20 SER HA H 20 4.780 4.780 4.663 0.117 19287
4767 1 17 . 1 1 20 20 SER C C 20 170.900 170.900 172.781 -1.881 19287
4768 1 17 . 1 1 20 20 SER CA C 20 57.450 57.450 56.176 1.274 19287
4769 1 17 . 1 1 20 20 SER CB C 20 67.910 67.910 65.793 2.117 19287
4770 1 17 . 1 1 20 20 SER H H 20 8.390 8.390 7.877 0.513 19287
4771 1 17 . 1 1 21 21 TYR N N 21 118.220 118.220 119.654 -1.434 19287
4772 1 17 . 1 1 21 21 TYR HA H 21 5.600 5.600 5.149 0.451 19287
4773 1 17 . 1 1 21 21 TYR C C 21 173.770 173.770 175.034 -1.264 19287
4774 1 17 . 1 1 21 21 TYR CA C 21 57.740 57.740 57.976 -0.236 19287
4775 1 17 . 1 1 21 21 TYR CB C 21 42.660 42.660 42.097 0.563 19287
4776 1 17 . 1 1 21 21 TYR H H 21 9.020 9.020 8.470 0.550 19287
4777 1 17 . 1 1 22 22 TYR N N 22 119.260 119.260 125.480 -6.220 19287
4778 1 17 . 1 1 22 22 TYR HA H 22 5.110 5.110 4.912 0.198 19287
4779 1 17 . 1 1 22 22 TYR C C 22 172.610 172.610 173.885 -1.275 19287
4780 1 17 . 1 1 22 22 TYR CA C 22 55.380 55.380 56.148 -0.768 19287
4781 1 17 . 1 1 22 22 TYR CB C 22 41.550 41.550 41.709 -0.160 19287
4782 1 17 . 1 1 22 22 TYR H H 22 9.410 9.410 9.532 -0.122 19287
4783 1 17 . 1 1 23 23 TYR N N 23 123.200 123.200 130.075 -6.875 19287
4784 1 17 . 1 1 23 23 TYR HA H 23 4.382 4.382 4.873 -0.491 19287
4785 1 17 . 1 1 23 23 TYR C C 23 173.250 173.250 174.493 -1.243 19287
4786 1 17 . 1 1 23 23 TYR CA C 23 58.360 58.360 57.209 1.151 19287
4787 1 17 . 1 1 23 23 TYR CB C 23 39.570 39.570 39.101 0.469 19287
4788 1 17 . 1 1 23 23 TYR H H 23 10.190 10.190 8.674 1.516 19287
4789 1 17 . 1 1 24 24 ASN N N 24 126.280 126.280 128.344 -2.064 19287
4790 1 17 . 1 1 24 24 ASN HA H 24 4.550 4.550 4.792 -0.242 19287
4791 1 17 . 1 1 24 24 ASN C C 24 174.000 174.000 175.273 -1.273 19287
4792 1 17 . 1 1 24 24 ASN CA C 24 51.360 51.360 51.739 -0.379 19287
4793 1 17 . 1 1 24 24 ASN CB C 24 40.040 40.040 38.465 1.575 19287
4794 1 17 . 1 1 24 24 ASN H H 24 7.890 7.890 8.571 -0.681 19287
4795 1 17 . 1 1 25 25 GLN N N 25 122.760 122.760 123.342 -0.582 19287
4796 1 17 . 1 1 25 25 GLN HA H 25 3.691 3.691 3.648 0.043 19287
4797 1 17 . 1 1 25 25 GLN C C 25 175.670 175.670 176.901 -1.231 19287
4798 1 17 . 1 1 25 25 GLN CA C 25 57.480 57.480 58.090 -0.610 19287
4799 1 17 . 1 1 25 25 GLN CB C 25 28.120 28.120 27.617 0.503 19287
4800 1 17 . 1 1 25 25 GLN H H 25 8.440 8.440 7.748 0.692 19287
4801 1 17 . 1 1 26 26 TYR N N 26 119.190 119.190 118.932 0.258 19287
4802 1 17 . 1 1 26 26 TYR HA H 26 4.160 4.160 4.336 -0.176 19287
4803 1 17 . 1 1 26 26 TYR C C 26 176.520 176.520 176.812 -0.292 19287
4804 1 17 . 1 1 26 26 TYR CA C 26 60.170 60.170 59.721 0.449 19287
4805 1 17 . 1 1 26 26 TYR CB C 26 36.880 36.880 37.632 -0.752 19287
4806 1 17 . 1 1 26 26 TYR H H 26 7.810 7.810 7.788 0.022 19287
4807 1 17 . 1 1 27 27 SER N N 27 109.600 109.600 111.997 -2.397 19287
4808 1 17 . 1 1 27 27 SER HA H 27 4.330 4.330 4.569 -0.239 19287
4809 1 17 . 1 1 27 27 SER C C 27 174.830 174.830 174.065 0.765 19287
4810 1 17 . 1 1 27 27 SER CA C 27 57.490 57.490 57.197 0.294 19287
4811 1 17 . 1 1 27 27 SER CB C 27 64.640 64.640 64.002 0.638 19287
4812 1 17 . 1 1 27 27 SER H H 27 7.350 7.350 7.531 -0.181 19287
4813 1 17 . 1 1 28 28 ASN N N 28 119.830 119.830 118.978 0.852 19287
4814 1 17 . 1 1 28 28 ASN HA H 28 4.060 4.060 4.449 -0.389 19287
4815 1 17 . 1 1 28 28 ASN C C 28 173.040 173.040 174.334 -1.294 19287
4816 1 17 . 1 1 28 28 ASN CA C 28 53.830 53.830 54.784 -0.954 19287
4817 1 17 . 1 1 28 28 ASN CB C 28 37.400 37.400 38.014 -0.614 19287
4818 1 17 . 1 1 28 28 ASN H H 28 7.930 7.930 7.851 0.079 19287
4819 1 17 . 1 1 29 29 THR N N 29 103.070 103.070 110.535 -7.465 19287
4820 1 17 . 1 1 29 29 THR HA H 29 4.441 4.441 4.674 -0.233 19287
4821 1 17 . 1 1 29 29 THR C C 29 172.980 172.980 171.813 1.167 19287
4822 1 17 . 1 1 29 29 THR CA C 29 58.920 58.920 61.307 -2.387 19287
4823 1 17 . 1 1 29 29 THR CB C 29 73.260 73.260 70.745 2.515 19287
4824 1 17 . 1 1 29 29 THR H H 29 6.990 6.990 7.667 -0.677 19287
4825 1 17 . 1 1 30 30 CYS N N 30 118.340 118.340 120.679 -2.339 19287
4826 1 17 . 1 1 30 30 CYS HA H 30 5.462 5.462 5.583 -0.121 19287
4827 1 17 . 1 1 30 30 CYS C C 30 173.320 173.320 173.269 0.051 19287
4828 1 17 . 1 1 30 30 CYS CA C 30 57.750 57.750 57.792 -0.042 19287
4829 1 17 . 1 1 30 30 CYS CB C 30 50.680 50.680 30.518 20.162 19287
4830 1 17 . 1 1 30 30 CYS H H 30 8.954 8.954 8.681 0.273 19287
4831 1 17 . 1 1 31 31 HIS N N 31 118.930 118.930 122.709 -3.779 19287
4832 1 17 . 1 1 31 31 HIS HA H 31 4.780 4.780 5.074 -0.294 19287
4833 1 17 . 1 1 31 31 HIS C C 31 172.790 172.790 173.532 -0.742 19287
4834 1 17 . 1 1 31 31 HIS CA C 31 53.530 53.530 55.322 -1.792 19287
4835 1 17 . 1 1 31 31 HIS CB C 31 33.040 33.040 33.400 -0.360 19287
4836 1 17 . 1 1 31 31 HIS H H 31 9.010 9.010 9.618 -0.608 19287
4837 1 17 . 1 1 32 32 SER N N 32 117.600 117.600 120.457 -2.857 19287
4838 1 17 . 1 1 32 32 SER HA H 32 4.700 4.700 4.094 0.606 19287
4839 1 17 . 1 1 32 32 SER C C 32 174.930 174.930 173.653 1.277 19287
4840 1 17 . 1 1 32 32 SER CA C 32 57.980 57.980 58.553 -0.573 19287
4841 1 17 . 1 1 32 32 SER CB C 32 64.440 64.440 63.432 1.008 19287
4842 1 17 . 1 1 32 32 SER H H 32 8.740 8.740 8.201 0.539 19287
4843 1 17 . 1 1 33 33 PHE N N 33 120.690 120.690 120.254 0.436 19287
4844 1 17 . 1 1 33 33 PHE HA H 33 4.790 4.790 5.029 -0.239 19287
4845 1 17 . 1 1 33 33 PHE C C 33 171.810 171.810 173.555 -1.745 19287
4846 1 17 . 1 1 33 33 PHE CA C 33 56.200 56.200 55.921 0.279 19287
4847 1 17 . 1 1 33 33 PHE CB C 33 40.230 40.230 41.576 -1.346 19287
4848 1 17 . 1 1 33 33 PHE H H 33 8.830 8.830 8.955 -0.125 19287
4849 1 17 . 1 1 34 34 THR N N 34 116.650 116.650 111.935 4.715 19287
4850 1 17 . 1 1 34 34 THR HA H 34 3.965 3.965 4.254 -0.289 19287
4851 1 17 . 1 1 34 34 THR C C 34 172.600 172.600 172.534 0.066 19287
4852 1 17 . 1 1 34 34 THR CA C 34 61.980 61.980 60.549 1.431 19287
4853 1 17 . 1 1 34 34 THR CB C 34 68.530 68.530 69.964 -1.434 19287
4854 1 17 . 1 1 34 34 THR H H 34 8.400 8.400 8.196 0.204 19287
4855 1 17 . 1 1 35 35 TYR N N 35 127.790 127.790 126.189 1.601 19287
4856 1 17 . 1 1 35 35 TYR HA H 35 4.500 4.500 4.765 -0.265 19287
4857 1 17 . 1 1 35 35 TYR C C 35 174.200 174.200 173.812 0.388 19287
4858 1 17 . 1 1 35 35 TYR CA C 35 55.130 55.130 56.894 -1.764 19287
4859 1 17 . 1 1 35 35 TYR CB C 35 39.650 39.650 42.095 -2.445 19287
4860 1 17 . 1 1 35 35 TYR H H 35 8.010 8.010 8.367 -0.357 19287
4861 1 17 . 1 1 39 39 GLY N N 39 103.730 103.730 110.283 -6.553 19287
4862 1 17 . 1 1 39 39 GLY C C 39 175.700 175.700 174.366 1.334 19287
4863 1 17 . 1 1 39 39 GLY CA C 39 45.370 45.370 45.551 -0.181 19287
4864 1 17 . 1 1 39 39 GLY H H 39 8.500 8.500 8.525 -0.025 19287
4865 1 17 . 1 1 40 40 GLY N N 40 110.170 110.170 108.557 1.613 19287
4866 1 17 . 1 1 40 40 GLY C C 40 173.140 173.140 173.159 -0.019 19287
4867 1 17 . 1 1 40 40 GLY CA C 40 44.320 44.320 44.852 -0.532 19287
4868 1 17 . 1 1 40 40 GLY H H 40 8.670 8.670 8.110 0.560 19287
4869 1 17 . 1 1 41 41 ASN N N 41 116.960 116.960 118.206 -1.246 19287
4870 1 17 . 1 1 41 41 ASN HA H 41 4.560 4.560 4.876 -0.316 19287
4871 1 17 . 1 1 41 41 ASN C C 41 173.670 173.670 175.544 -1.874 19287
4872 1 17 . 1 1 41 41 ASN CA C 41 51.850 51.850 52.370 -0.520 19287
4873 1 17 . 1 1 41 41 ASN CB C 41 40.230 40.230 40.775 -0.545 19287
4874 1 17 . 1 1 41 41 ASN H H 41 8.790 8.790 8.400 0.390 19287
4875 1 17 . 1 1 42 42 ALA N N 42 113.290 113.290 122.850 -9.560 19287
4876 1 17 . 1 1 42 42 ALA HA H 42 3.720 3.720 4.059 -0.339 19287
4877 1 17 . 1 1 42 42 ALA C C 42 177.220 177.220 178.297 -1.077 19287
4878 1 17 . 1 1 42 42 ALA CA C 42 52.810 52.810 54.445 -1.635 19287
4879 1 17 . 1 1 42 42 ALA CB C 42 17.980 17.980 18.515 -0.535 19287
4880 1 17 . 1 1 42 42 ALA H H 42 7.590 7.590 8.679 -1.089 19287
4881 1 17 . 1 1 43 43 ASN N N 43 117.710 117.710 115.796 1.914 19287
4882 1 17 . 1 1 43 43 ASN HA H 43 4.700 4.700 4.556 0.144 19287
4883 1 17 . 1 1 43 43 ASN C C 43 173.660 173.660 175.166 -1.506 19287
4884 1 17 . 1 1 43 43 ASN CA C 43 50.630 50.630 54.357 -3.727 19287
4885 1 17 . 1 1 43 43 ASN CB C 43 34.840 34.840 37.997 -3.157 19287
4886 1 17 . 1 1 43 43 ASN H H 43 7.900 7.900 8.165 -0.265 19287
4887 1 17 . 1 1 44 44 ARG N N 44 120.690 120.690 120.183 0.507 19287
4888 1 17 . 1 1 44 44 ARG HA H 44 4.692 4.692 4.287 0.405 19287
4889 1 17 . 1 1 44 44 ARG C C 44 173.530 173.530 174.725 -1.195 19287
4890 1 17 . 1 1 44 44 ARG CA C 44 56.660 56.660 57.021 -0.361 19287
4891 1 17 . 1 1 44 44 ARG CB C 44 31.450 31.450 29.945 1.505 19287
4892 1 17 . 1 1 44 44 ARG H H 44 6.860 6.860 7.031 -0.171 19287
4893 1 17 . 1 1 45 45 PHE N N 45 123.690 123.690 122.006 1.684 19287
4894 1 17 . 1 1 45 45 PHE HA H 45 4.810 4.810 4.887 -0.077 19287
4895 1 17 . 1 1 45 45 PHE C C 45 175.420 175.420 175.145 0.275 19287
4896 1 17 . 1 1 45 45 PHE CA C 45 55.670 55.670 56.884 -1.214 19287
4897 1 17 . 1 1 45 45 PHE CB C 45 43.790 43.790 43.422 0.367 19287
4898 1 17 . 1 1 45 45 PHE H H 45 9.340 9.340 8.097 1.243 19287
4899 1 17 . 1 1 46 46 ARG N N 46 120.920 120.920 118.487 2.433 19287
4900 1 17 . 1 1 46 46 ARG HA H 46 4.397 4.397 4.588 -0.191 19287
4901 1 17 . 1 1 46 46 ARG C C 46 176.560 176.560 175.571 0.989 19287
4902 1 17 . 1 1 46 46 ARG CA C 46 58.210 58.210 55.660 2.550 19287
4903 1 17 . 1 1 46 46 ARG CB C 46 30.900 30.900 30.626 0.274 19287
4904 1 17 . 1 1 46 46 ARG H H 46 9.080 9.080 8.707 0.373 19287
4905 1 17 . 1 1 47 47 THR N N 47 102.800 102.800 111.093 -8.293 19287
4906 1 17 . 1 1 47 47 THR HA H 47 4.660 4.660 4.122 0.538 19287
4907 1 17 . 1 1 47 47 THR C C 47 174.110 174.110 173.327 0.783 19287
4908 1 17 . 1 1 47 47 THR CA C 47 58.170 58.170 60.256 -2.086 19287
4909 1 17 . 1 1 47 47 THR CB C 47 72.380 72.380 71.161 1.219 19287
4910 1 17 . 1 1 47 47 THR H H 47 7.230 7.230 7.344 -0.114 19287
4911 1 17 . 1 1 48 48 ILE N N 48 123.200 123.200 123.810 -0.610 19287
4912 1 17 . 1 1 48 48 ILE HA H 48 2.901 2.901 3.666 -0.765 19287
4913 1 17 . 1 1 48 48 ILE C C 48 176.420 176.420 175.396 1.024 19287
4914 1 17 . 1 1 48 48 ILE CA C 48 64.000 64.000 63.045 0.955 19287
4915 1 17 . 1 1 48 48 ILE CB C 48 37.060 37.060 38.197 -1.137 19287
4916 1 17 . 1 1 48 48 ILE H H 48 8.110 8.110 8.007 0.103 19287
4917 1 17 . 1 1 49 49 ASP N N 49 119.560 119.560 119.833 -0.273 19287
4918 1 17 . 1 1 49 49 ASP HA H 49 4.130 4.130 4.263 -0.133 19287
4919 1 17 . 1 1 49 49 ASP C C 49 177.740 177.740 178.515 -0.775 19287
4920 1 17 . 1 1 49 49 ASP CA C 49 56.690 56.690 57.920 -1.230 19287
4921 1 17 . 1 1 49 49 ASP CB C 49 39.970 39.970 40.221 -0.251 19287
4922 1 17 . 1 1 49 49 ASP H H 49 7.700 7.700 7.764 -0.064 19287
4923 1 17 . 1 1 50 50 GLU N N 50 117.720 117.720 119.694 -1.974 19287
4924 1 17 . 1 1 50 50 GLU HA H 50 3.710 3.710 4.205 -0.495 19287
4925 1 17 . 1 1 50 50 GLU C C 50 177.550 177.550 178.191 -0.641 19287
4926 1 17 . 1 1 50 50 GLU CA C 50 58.550 58.550 58.922 -0.372 19287
4927 1 17 . 1 1 50 50 GLU CB C 50 29.190 29.190 29.930 -0.740 19287
4928 1 17 . 1 1 50 50 GLU H H 50 7.410 7.410 7.531 -0.121 19287
4929 1 17 . 1 1 51 51 CYS N N 51 120.260 120.260 119.436 0.824 19287
4930 1 17 . 1 1 51 51 CYS HA H 51 1.650 1.650 2.770 -1.120 19287
4931 1 17 . 1 1 51 51 CYS C C 51 175.070 175.070 176.295 -1.225 19287
4932 1 17 . 1 1 51 51 CYS CA C 51 59.120 59.120 61.381 -2.261 19287
4933 1 17 . 1 1 51 51 CYS CB C 51 43.000 43.000 25.742 17.258 19287
4934 1 17 . 1 1 51 51 CYS H H 51 6.760 6.760 7.611 -0.851 19287
4935 1 17 . 1 1 52 52 ASN N N 52 120.160 120.160 119.136 1.024 19287
4936 1 17 . 1 1 52 52 ASN HA H 52 4.090 4.090 4.385 -0.295 19287
4937 1 17 . 1 1 52 52 ASN C C 52 177.820 177.820 177.314 0.506 19287
4938 1 17 . 1 1 52 52 ASN CA C 52 55.060 55.060 56.165 -1.105 19287
4939 1 17 . 1 1 52 52 ASN CB C 52 37.500 37.500 37.720 -0.220 19287
4940 1 17 . 1 1 52 52 ASN H H 52 8.650 8.650 8.602 0.048 19287
4941 1 17 . 1 1 53 53 ARG N N 53 117.000 117.000 118.648 -1.648 19287
4942 1 17 . 1 1 53 53 ARG HA H 53 3.770 3.770 4.031 -0.261 19287
4943 1 17 . 1 1 53 53 ARG C C 53 177.360 177.360 177.660 -0.300 19287
4944 1 17 . 1 1 53 53 ARG CA C 53 58.490 58.490 58.693 -0.203 19287
4945 1 17 . 1 1 53 53 ARG CB C 53 30.180 30.180 29.355 0.825 19287
4946 1 17 . 1 1 53 53 ARG H H 53 7.900 7.900 7.547 0.353 19287
4947 1 17 . 1 1 54 54 THR N N 54 112.080 112.080 112.438 -0.358 19287
4948 1 17 . 1 1 54 54 THR HA H 54 3.838 3.838 4.475 -0.637 19287
4949 1 17 . 1 1 54 54 THR C C 54 174.990 174.990 174.640 0.350 19287
4950 1 17 . 1 1 54 54 THR CA C 54 65.740 65.740 64.015 1.725 19287
4951 1 17 . 1 1 54 54 THR CB C 54 68.870 68.870 70.512 -1.642 19287
4952 1 17 . 1 1 54 54 THR H H 54 7.260 7.260 7.934 -0.674 19287
4953 1 17 . 1 1 55 55 CYS N N 55 112.540 112.540 117.513 -4.973 19287
4954 1 17 . 1 1 55 55 CYS HA H 55 4.400 4.400 4.365 0.035 19287
4955 1 17 . 1 1 55 55 CYS C C 55 172.940 172.940 173.927 -0.987 19287
4956 1 17 . 1 1 55 55 CYS CA C 55 54.230 54.230 58.199 -3.969 19287
4957 1 17 . 1 1 55 55 CYS CB C 55 42.930 42.930 29.044 13.886 19287
4958 1 17 . 1 1 55 55 CYS H H 55 7.590 7.590 7.794 -0.204 19287
4959 1 17 . 1 1 56 56 VAL N N 56 119.720 119.720 123.234 -3.514 19287
4960 1 17 . 1 1 56 56 VAL HA H 56 3.631 3.631 4.098 -0.468 19287
4961 1 17 . 1 1 56 56 VAL C C 56 176.710 176.710 175.646 1.064 19287
4962 1 17 . 1 1 56 56 VAL CA C 56 64.540 64.540 62.354 2.186 19287
4963 1 17 . 1 1 56 56 VAL CB C 56 30.970 30.970 29.320 1.650 19287
4964 1 17 . 1 1 56 56 VAL H H 56 7.280 7.280 7.916 -0.636 19287
4965 1 18 . 1 1 2 2 PRO HA H 2 4.017 4.017 4.361 -0.344 19287
4966 1 18 . 1 1 2 2 PRO C C 2 177.920 177.920 177.366 0.554 19287
4967 1 18 . 1 1 2 2 PRO CA C 2 62.800 62.800 62.267 0.532 19287
4968 1 18 . 1 1 2 2 PRO CB C 2 32.050 32.050 32.544 -0.494 19287
4969 1 18 . 1 1 3 3 ARG N N 3 122.340 122.340 122.863 -0.523 19287
4970 1 18 . 1 1 3 3 ARG HA H 3 3.786 3.786 4.327 -0.541 19287
4971 1 18 . 1 1 3 3 ARG C C 3 178.950 178.950 178.287 0.663 19287
4972 1 18 . 1 1 3 3 ARG CA C 3 58.410 58.410 58.120 0.290 19287
4973 1 18 . 1 1 3 3 ARG CB C 3 29.220 29.220 29.536 -0.316 19287
4974 1 18 . 1 1 3 3 ARG H H 3 8.550 8.550 8.837 -0.287 19287
4975 1 18 . 1 1 4 4 PHE N N 4 113.010 113.010 116.364 -3.354 19287
4976 1 18 . 1 1 4 4 PHE HA H 4 4.300 4.300 4.562 -0.262 19287
4977 1 18 . 1 1 4 4 PHE C C 4 176.070 176.070 176.604 -0.534 19287
4978 1 18 . 1 1 4 4 PHE CA C 4 58.220 58.220 58.378 -0.158 19287
4979 1 18 . 1 1 4 4 PHE CB C 4 37.310 37.310 37.982 -0.672 19287
4980 1 18 . 1 1 4 4 PHE H H 4 7.150 7.150 7.872 -0.722 19287
4981 1 18 . 1 1 5 5 CYS N N 5 118.600 118.600 118.229 0.371 19287
4982 1 18 . 1 1 5 5 CYS HA H 5 4.130 4.130 4.155 -0.025 19287
4983 1 18 . 1 1 5 5 CYS C C 5 173.450 173.450 174.688 -1.238 19287
4984 1 18 . 1 1 5 5 CYS CA C 5 57.960 57.960 60.252 -2.292 19287
4985 1 18 . 1 1 5 5 CYS CB C 5 39.210 39.210 25.708 13.502 19287
4986 1 18 . 1 1 5 5 CYS H H 5 7.090 7.090 7.266 -0.176 19287
4987 1 18 . 1 1 6 6 GLU N N 6 110.710 110.710 117.509 -6.799 19287
4988 1 18 . 1 1 6 6 GLU HA H 6 4.182 4.182 4.376 -0.194 19287
4989 1 18 . 1 1 6 6 GLU C C 6 176.310 176.310 176.485 -0.175 19287
4990 1 18 . 1 1 6 6 GLU CA C 6 55.510 55.510 55.754 -0.244 19287
4991 1 18 . 1 1 6 6 GLU CB C 6 28.160 28.160 29.677 -1.517 19287
4992 1 18 . 1 1 6 6 GLU H H 6 7.300 7.300 7.473 -0.173 19287
4993 1 18 . 1 1 7 7 LEU N N 7 119.090 119.090 121.263 -2.173 19287
4994 1 18 . 1 1 7 7 LEU HA H 7 4.160 4.160 4.329 -0.169 19287
4995 1 18 . 1 1 7 7 LEU C C 7 176.630 176.630 176.312 0.318 19287
4996 1 18 . 1 1 7 7 LEU CA C 7 54.510 54.510 54.373 0.136 19287
4997 1 18 . 1 1 7 7 LEU CB C 7 42.330 42.330 42.729 -0.399 19287
4998 1 18 . 1 1 7 7 LEU H H 7 7.210 7.210 7.180 0.030 19287
4999 1 18 . 1 1 8 8 ALA N N 8 124.490 124.490 121.335 3.155 19287
5000 1 18 . 1 1 8 8 ALA HA H 8 4.250 4.250 4.862 -0.612 19287
5001 1 18 . 1 1 8 8 ALA C C 8 174.710 174.710 175.778 -1.068 19287
5002 1 18 . 1 1 8 8 ALA CA C 8 50.210 50.210 48.593 1.617 19287
5003 1 18 . 1 1 8 8 ALA CB C 8 16.930 16.930 19.606 -2.676 19287
5004 1 18 . 1 1 8 8 ALA H H 8 8.280 8.280 8.313 -0.033 19287
5005 1 18 . 1 1 9 9 PRO HA H 9 4.180 4.180 4.752 -0.572 19287
5006 1 18 . 1 1 9 9 PRO C C 9 176.700 176.700 176.204 0.496 19287
5007 1 18 . 1 1 9 9 PRO CA C 9 61.490 61.490 62.379 -0.889 19287
5008 1 18 . 1 1 9 9 PRO CB C 9 30.360 30.360 30.386 -0.026 19287
5009 1 18 . 1 1 10 10 SER N N 10 112.100 112.100 117.720 -5.620 19287
5010 1 18 . 1 1 10 10 SER HA H 10 4.630 4.630 4.352 0.278 19287
5011 1 18 . 1 1 10 10 SER C C 10 174.190 174.190 175.430 -1.240 19287
5012 1 18 . 1 1 10 10 SER CA C 10 55.360 55.360 58.196 -2.836 19287
5013 1 18 . 1 1 10 10 SER CB C 10 64.550 64.550 63.726 0.824 19287
5014 1 18 . 1 1 10 10 SER H H 10 7.450 7.450 7.987 -0.537 19287
5015 1 18 . 1 1 11 11 ALA N N 11 129.980 129.980 130.809 -0.829 19287
5016 1 18 . 1 1 11 11 ALA HA H 11 4.496 4.496 4.079 0.417 19287
5017 1 18 . 1 1 11 11 ALA C C 11 178.510 178.510 178.539 -0.029 19287
5018 1 18 . 1 1 11 11 ALA CA C 11 54.810 54.810 53.411 1.399 19287
5019 1 18 . 1 1 11 11 ALA CB C 11 19.910 19.910 18.756 1.154 19287
5020 1 18 . 1 1 11 11 ALA H H 11 9.210 9.210 8.600 0.610 19287
5021 1 18 . 1 1 12 12 GLY N N 12 104.410 104.410 105.505 -1.095 19287
5022 1 18 . 1 1 12 12 GLY C C 12 174.850 174.850 175.597 -0.747 19287
5023 1 18 . 1 1 12 12 GLY CA C 12 44.450 44.450 45.522 -1.072 19287
5024 1 18 . 1 1 12 12 GLY H H 12 8.190 8.190 8.093 0.097 19287
5025 1 18 . 1 1 14 14 CYS HA H 14 4.250 4.250 4.633 -0.383 19287
5026 1 18 . 1 1 14 14 CYS C C 14 172.410 172.410 173.436 -1.026 19287
5027 1 18 . 1 1 14 14 CYS CA C 14 59.750 59.750 58.841 0.909 19287
5028 1 18 . 1 1 14 14 CYS CB C 14 39.130 39.130 30.617 8.512 19287
5029 1 18 . 1 1 15 15 PHE N N 15 116.000 116.000 124.571 -8.571 19287
5030 1 18 . 1 1 15 15 PHE HA H 15 4.380 4.380 4.482 -0.102 19287
5031 1 18 . 1 1 15 15 PHE C C 15 174.300 174.300 174.423 -0.123 19287
5032 1 18 . 1 1 15 15 PHE CA C 15 56.830 56.830 58.182 -1.352 19287
5033 1 18 . 1 1 15 15 PHE CB C 15 39.440 39.440 38.674 0.766 19287
5034 1 18 . 1 1 15 15 PHE H H 15 7.960 7.960 8.636 -0.676 19287
5035 1 18 . 1 1 16 16 ALA N N 16 125.630 125.630 130.536 -4.906 19287
5036 1 18 . 1 1 16 16 ALA HA H 16 4.320 4.320 4.574 -0.254 19287
5037 1 18 . 1 1 16 16 ALA C C 16 174.300 174.300 174.668 -0.368 19287
5038 1 18 . 1 1 16 16 ALA CA C 16 50.130 50.130 51.525 -1.395 19287
5039 1 18 . 1 1 16 16 ALA CB C 16 19.180 19.180 21.811 -2.631 19287
5040 1 18 . 1 1 16 16 ALA H H 16 7.800 7.800 7.892 -0.092 19287
5041 1 18 . 1 1 17 17 PHE N N 17 116.330 116.330 122.369 -6.039 19287
5042 1 18 . 1 1 17 17 PHE HA H 17 4.390 4.390 5.279 -0.889 19287
5043 1 18 . 1 1 17 17 PHE C C 17 175.310 175.310 173.962 1.348 19287
5044 1 18 . 1 1 17 17 PHE CA C 17 57.160 57.160 54.584 2.576 19287
5045 1 18 . 1 1 17 17 PHE CB C 17 39.380 39.380 40.984 -1.604 19287
5046 1 18 . 1 1 17 17 PHE H H 17 7.330 7.330 8.431 -1.101 19287
5047 1 18 . 1 1 18 18 VAL N N 18 122.890 122.890 125.026 -2.136 19287
5048 1 18 . 1 1 18 18 VAL HA H 18 4.475 4.475 4.542 -0.067 19287
5049 1 18 . 1 1 18 18 VAL C C 18 173.590 173.590 173.532 0.058 19287
5050 1 18 . 1 1 18 18 VAL CA C 18 58.900 58.900 58.509 0.391 19287
5051 1 18 . 1 1 18 18 VAL CB C 18 33.900 33.900 33.711 0.189 19287
5052 1 18 . 1 1 18 18 VAL H H 18 8.680 8.680 8.974 -0.294 19287
5053 1 18 . 1 1 19 19 PRO HA H 19 4.275 4.275 4.615 -0.340 19287
5054 1 18 . 1 1 19 19 PRO C C 19 176.940 176.940 176.593 0.347 19287
5055 1 18 . 1 1 19 19 PRO CA C 19 64.060 64.060 62.703 1.357 19287
5056 1 18 . 1 1 19 19 PRO CB C 19 31.710 31.710 31.409 0.301 19287
5057 1 18 . 1 1 20 20 SER N N 20 120.230 120.230 119.310 0.920 19287
5058 1 18 . 1 1 20 20 SER HA H 20 4.780 4.780 4.668 0.112 19287
5059 1 18 . 1 1 20 20 SER C C 20 170.900 170.900 173.118 -2.218 19287
5060 1 18 . 1 1 20 20 SER CA C 20 57.450 57.450 57.286 0.164 19287
5061 1 18 . 1 1 20 20 SER CB C 20 67.910 67.910 66.206 1.704 19287
5062 1 18 . 1 1 20 20 SER H H 20 8.390 8.390 7.858 0.532 19287
5063 1 18 . 1 1 21 21 TYR N N 21 118.220 118.220 118.670 -0.450 19287
5064 1 18 . 1 1 21 21 TYR HA H 21 5.600 5.600 5.131 0.469 19287
5065 1 18 . 1 1 21 21 TYR C C 21 173.770 173.770 175.123 -1.353 19287
5066 1 18 . 1 1 21 21 TYR CA C 21 57.740 57.740 58.254 -0.514 19287
5067 1 18 . 1 1 21 21 TYR CB C 21 42.660 42.660 41.990 0.670 19287
5068 1 18 . 1 1 21 21 TYR H H 21 9.020 9.020 8.778 0.242 19287
5069 1 18 . 1 1 22 22 TYR N N 22 119.260 119.260 124.539 -5.279 19287
5070 1 18 . 1 1 22 22 TYR HA H 22 5.110 5.110 4.808 0.302 19287
5071 1 18 . 1 1 22 22 TYR C C 22 172.610 172.610 173.908 -1.298 19287
5072 1 18 . 1 1 22 22 TYR CA C 22 55.380 55.380 56.013 -0.633 19287
5073 1 18 . 1 1 22 22 TYR CB C 22 41.550 41.550 42.862 -1.312 19287
5074 1 18 . 1 1 22 22 TYR H H 22 9.410 9.410 9.704 -0.294 19287
5075 1 18 . 1 1 23 23 TYR N N 23 123.200 123.200 125.975 -2.775 19287
5076 1 18 . 1 1 23 23 TYR HA H 23 4.382 4.382 5.050 -0.668 19287
5077 1 18 . 1 1 23 23 TYR C C 23 173.250 173.250 174.243 -0.993 19287
5078 1 18 . 1 1 23 23 TYR CA C 23 58.360 58.360 56.532 1.828 19287
5079 1 18 . 1 1 23 23 TYR CB C 23 39.570 39.570 41.017 -1.447 19287
5080 1 18 . 1 1 23 23 TYR H H 23 10.190 10.190 8.100 2.090 19287
5081 1 18 . 1 1 24 24 ASN N N 24 126.280 126.280 127.325 -1.045 19287
5082 1 18 . 1 1 24 24 ASN HA H 24 4.550 4.550 4.886 -0.336 19287
5083 1 18 . 1 1 24 24 ASN C C 24 174.000 174.000 175.323 -1.323 19287
5084 1 18 . 1 1 24 24 ASN CA C 24 51.360 51.360 51.167 0.193 19287
5085 1 18 . 1 1 24 24 ASN CB C 24 40.040 40.040 38.414 1.626 19287
5086 1 18 . 1 1 24 24 ASN H H 24 7.890 7.890 8.712 -0.822 19287
5087 1 18 . 1 1 25 25 GLN N N 25 122.760 122.760 123.577 -0.817 19287
5088 1 18 . 1 1 25 25 GLN HA H 25 3.691 3.691 3.584 0.107 19287
5089 1 18 . 1 1 25 25 GLN C C 25 175.670 175.670 176.755 -1.085 19287
5090 1 18 . 1 1 25 25 GLN CA C 25 57.480 57.480 58.203 -0.723 19287
5091 1 18 . 1 1 25 25 GLN CB C 25 28.120 28.120 27.480 0.640 19287
5092 1 18 . 1 1 25 25 GLN H H 25 8.440 8.440 8.059 0.381 19287
5093 1 18 . 1 1 26 26 TYR N N 26 119.190 119.190 120.005 -0.815 19287
5094 1 18 . 1 1 26 26 TYR HA H 26 4.160 4.160 4.245 -0.085 19287
5095 1 18 . 1 1 26 26 TYR C C 26 176.520 176.520 177.036 -0.516 19287
5096 1 18 . 1 1 26 26 TYR CA C 26 60.170 60.170 59.915 0.255 19287
5097 1 18 . 1 1 26 26 TYR CB C 26 36.880 36.880 37.690 -0.810 19287
5098 1 18 . 1 1 26 26 TYR H H 26 7.810 7.810 7.459 0.351 19287
5099 1 18 . 1 1 27 27 SER N N 27 109.600 109.600 111.698 -2.098 19287
5100 1 18 . 1 1 27 27 SER HA H 27 4.330 4.330 4.552 -0.222 19287
5101 1 18 . 1 1 27 27 SER C C 27 174.830 174.830 174.041 0.789 19287
5102 1 18 . 1 1 27 27 SER CA C 27 57.490 57.490 57.439 0.051 19287
5103 1 18 . 1 1 27 27 SER CB C 27 64.640 64.640 63.836 0.804 19287
5104 1 18 . 1 1 27 27 SER H H 27 7.350 7.350 7.669 -0.319 19287
5105 1 18 . 1 1 28 28 ASN N N 28 119.830 119.830 119.113 0.717 19287
5106 1 18 . 1 1 28 28 ASN HA H 28 4.060 4.060 4.406 -0.346 19287
5107 1 18 . 1 1 28 28 ASN C C 28 173.040 173.040 174.300 -1.260 19287
5108 1 18 . 1 1 28 28 ASN CA C 28 53.830 53.830 54.564 -0.734 19287
5109 1 18 . 1 1 28 28 ASN CB C 28 37.400 37.400 38.080 -0.679 19287
5110 1 18 . 1 1 28 28 ASN H H 28 7.930 7.930 7.959 -0.029 19287
5111 1 18 . 1 1 29 29 THR N N 29 103.070 103.070 110.915 -7.845 19287
5112 1 18 . 1 1 29 29 THR HA H 29 4.441 4.441 4.661 -0.220 19287
5113 1 18 . 1 1 29 29 THR C C 29 172.980 172.980 172.063 0.917 19287
5114 1 18 . 1 1 29 29 THR CA C 29 58.920 58.920 61.307 -2.387 19287
5115 1 18 . 1 1 29 29 THR CB C 29 73.260 73.260 70.845 2.415 19287
5116 1 18 . 1 1 29 29 THR H H 29 6.990 6.990 7.891 -0.901 19287
5117 1 18 . 1 1 30 30 CYS N N 30 118.340 118.340 119.334 -0.994 19287
5118 1 18 . 1 1 30 30 CYS HA H 30 5.462 5.462 5.548 -0.086 19287
5119 1 18 . 1 1 30 30 CYS C C 30 173.320 173.320 173.413 -0.093 19287
5120 1 18 . 1 1 30 30 CYS CA C 30 57.750 57.750 57.828 -0.078 19287
5121 1 18 . 1 1 30 30 CYS CB C 30 50.680 50.680 31.809 18.871 19287
5122 1 18 . 1 1 30 30 CYS H H 30 8.954 8.954 8.685 0.269 19287
5123 1 18 . 1 1 31 31 HIS N N 31 118.930 118.930 120.118 -1.188 19287
5124 1 18 . 1 1 31 31 HIS HA H 31 4.780 4.780 5.082 -0.302 19287
5125 1 18 . 1 1 31 31 HIS C C 31 172.790 172.790 173.630 -0.840 19287
5126 1 18 . 1 1 31 31 HIS CA C 31 53.530 53.530 55.904 -2.374 19287
5127 1 18 . 1 1 31 31 HIS CB C 31 33.040 33.040 33.064 -0.024 19287
5128 1 18 . 1 1 31 31 HIS H H 31 9.010 9.010 9.572 -0.562 19287
5129 1 18 . 1 1 32 32 SER N N 32 117.600 117.600 119.518 -1.918 19287
5130 1 18 . 1 1 32 32 SER HA H 32 4.700 4.700 4.236 0.464 19287
5131 1 18 . 1 1 32 32 SER C C 32 174.930 174.930 173.846 1.084 19287
5132 1 18 . 1 1 32 32 SER CA C 32 57.980 57.980 59.395 -1.415 19287
5133 1 18 . 1 1 32 32 SER CB C 32 64.440 64.440 63.366 1.074 19287
5134 1 18 . 1 1 32 32 SER H H 32 8.740 8.740 7.999 0.741 19287
5135 1 18 . 1 1 33 33 PHE N N 33 120.690 120.690 119.458 1.232 19287
5136 1 18 . 1 1 33 33 PHE HA H 33 4.790 4.790 5.047 -0.257 19287
5137 1 18 . 1 1 33 33 PHE C C 33 171.810 171.810 173.754 -1.944 19287
5138 1 18 . 1 1 33 33 PHE CA C 33 56.200 56.200 56.105 0.095 19287
5139 1 18 . 1 1 33 33 PHE CB C 33 40.230 40.230 41.245 -1.015 19287
5140 1 18 . 1 1 33 33 PHE H H 33 8.830 8.830 8.974 -0.144 19287
5141 1 18 . 1 1 34 34 THR N N 34 116.650 116.650 112.281 4.369 19287
5142 1 18 . 1 1 34 34 THR HA H 34 3.965 3.965 4.521 -0.556 19287
5143 1 18 . 1 1 34 34 THR C C 34 172.600 172.600 172.433 0.167 19287
5144 1 18 . 1 1 34 34 THR CA C 34 61.980 61.980 60.887 1.093 19287
5145 1 18 . 1 1 34 34 THR CB C 34 68.530 68.530 69.803 -1.273 19287
5146 1 18 . 1 1 34 34 THR H H 34 8.400 8.400 8.244 0.156 19287
5147 1 18 . 1 1 35 35 TYR N N 35 127.790 127.790 125.289 2.501 19287
5148 1 18 . 1 1 35 35 TYR HA H 35 4.500 4.500 4.664 -0.164 19287
5149 1 18 . 1 1 35 35 TYR C C 35 174.200 174.200 173.479 0.721 19287
5150 1 18 . 1 1 35 35 TYR CA C 35 55.130 55.130 56.736 -1.606 19287
5151 1 18 . 1 1 35 35 TYR CB C 35 39.650 39.650 41.612 -1.962 19287
5152 1 18 . 1 1 35 35 TYR H H 35 8.010 8.010 8.113 -0.103 19287
5153 1 18 . 1 1 39 39 GLY N N 39 103.730 103.730 105.853 -2.123 19287
5154 1 18 . 1 1 39 39 GLY C C 39 175.700 175.700 175.691 0.009 19287
5155 1 18 . 1 1 39 39 GLY CA C 39 45.370 45.370 44.701 0.669 19287
5156 1 18 . 1 1 39 39 GLY H H 39 8.500 8.500 7.455 1.045 19287
5157 1 18 . 1 1 40 40 GLY N N 40 110.170 110.170 108.950 1.220 19287
5158 1 18 . 1 1 40 40 GLY C C 40 173.140 173.140 174.292 -1.152 19287
5159 1 18 . 1 1 40 40 GLY CA C 40 44.320 44.320 45.674 -1.354 19287
5160 1 18 . 1 1 40 40 GLY H H 40 8.670 8.670 8.481 0.189 19287
5161 1 18 . 1 1 41 41 ASN N N 41 116.960 116.960 116.682 0.278 19287
5162 1 18 . 1 1 41 41 ASN HA H 41 4.560 4.560 4.894 -0.334 19287
5163 1 18 . 1 1 41 41 ASN C C 41 173.670 173.670 175.215 -1.545 19287
5164 1 18 . 1 1 41 41 ASN CA C 41 51.850 51.850 52.321 -0.471 19287
5165 1 18 . 1 1 41 41 ASN CB C 41 40.230 40.230 40.920 -0.691 19287
5166 1 18 . 1 1 41 41 ASN H H 41 8.790 8.790 7.963 0.827 19287
5167 1 18 . 1 1 42 42 ALA N N 42 113.290 113.290 123.016 -9.726 19287
5168 1 18 . 1 1 42 42 ALA HA H 42 3.720 3.720 4.109 -0.389 19287
5169 1 18 . 1 1 42 42 ALA C C 42 177.220 177.220 178.137 -0.917 19287
5170 1 18 . 1 1 42 42 ALA CA C 42 52.810 52.810 54.295 -1.485 19287
5171 1 18 . 1 1 42 42 ALA CB C 42 17.980 17.980 18.523 -0.543 19287
5172 1 18 . 1 1 42 42 ALA H H 42 7.590 7.590 8.691 -1.101 19287
5173 1 18 . 1 1 43 43 ASN N N 43 117.710 117.710 115.457 2.253 19287
5174 1 18 . 1 1 43 43 ASN HA H 43 4.700 4.700 4.613 0.087 19287
5175 1 18 . 1 1 43 43 ASN C C 43 173.660 173.660 175.009 -1.349 19287
5176 1 18 . 1 1 43 43 ASN CA C 43 50.630 50.630 54.082 -3.452 19287
5177 1 18 . 1 1 43 43 ASN CB C 43 34.840 34.840 38.272 -3.432 19287
5178 1 18 . 1 1 43 43 ASN H H 43 7.900 7.900 8.133 -0.233 19287
5179 1 18 . 1 1 44 44 ARG N N 44 120.690 120.690 120.714 -0.024 19287
5180 1 18 . 1 1 44 44 ARG HA H 44 4.692 4.692 4.483 0.209 19287
5181 1 18 . 1 1 44 44 ARG C C 44 173.530 173.530 175.176 -1.646 19287
5182 1 18 . 1 1 44 44 ARG CA C 44 56.660 56.660 56.378 0.282 19287
5183 1 18 . 1 1 44 44 ARG CB C 44 31.450 31.450 29.118 2.332 19287
5184 1 18 . 1 1 44 44 ARG H H 44 6.860 6.860 7.136 -0.276 19287
5185 1 18 . 1 1 45 45 PHE N N 45 123.690 123.690 123.951 -0.261 19287
5186 1 18 . 1 1 45 45 PHE HA H 45 4.810 4.810 4.859 -0.049 19287
5187 1 18 . 1 1 45 45 PHE C C 45 175.420 175.420 175.688 -0.268 19287
5188 1 18 . 1 1 45 45 PHE CA C 45 55.670 55.670 56.921 -1.251 19287
5189 1 18 . 1 1 45 45 PHE CB C 45 43.790 43.790 43.204 0.586 19287
5190 1 18 . 1 1 45 45 PHE H H 45 9.340 9.340 9.167 0.173 19287
5191 1 18 . 1 1 46 46 ARG N N 46 120.920 120.920 119.191 1.729 19287
5192 1 18 . 1 1 46 46 ARG HA H 46 4.397 4.397 4.570 -0.173 19287
5193 1 18 . 1 1 46 46 ARG C C 46 176.560 176.560 175.821 0.739 19287
5194 1 18 . 1 1 46 46 ARG CA C 46 58.210 58.210 56.428 1.782 19287
5195 1 18 . 1 1 46 46 ARG CB C 46 30.900 30.900 30.371 0.529 19287
5196 1 18 . 1 1 46 46 ARG H H 46 9.080 9.080 8.736 0.344 19287
5197 1 18 . 1 1 47 47 THR N N 47 102.800 102.800 112.472 -9.672 19287
5198 1 18 . 1 1 47 47 THR HA H 47 4.660 4.660 4.444 0.216 19287
5199 1 18 . 1 1 47 47 THR C C 47 174.110 174.110 172.738 1.372 19287
5200 1 18 . 1 1 47 47 THR CA C 47 58.170 58.170 61.070 -2.900 19287
5201 1 18 . 1 1 47 47 THR CB C 47 72.380 72.380 70.751 1.629 19287
5202 1 18 . 1 1 47 47 THR H H 47 7.230 7.230 7.694 -0.464 19287
5203 1 18 . 1 1 48 48 ILE N N 48 123.200 123.200 125.727 -2.527 19287
5204 1 18 . 1 1 48 48 ILE HA H 48 2.901 2.901 3.644 -0.743 19287
5205 1 18 . 1 1 48 48 ILE C C 48 176.420 176.420 175.705 0.715 19287
5206 1 18 . 1 1 48 48 ILE CA C 48 64.000 64.000 62.793 1.207 19287
5207 1 18 . 1 1 48 48 ILE CB C 48 37.060 37.060 37.910 -0.850 19287
5208 1 18 . 1 1 48 48 ILE H H 48 8.110 8.110 8.003 0.107 19287
5209 1 18 . 1 1 49 49 ASP N N 49 119.560 119.560 119.503 0.057 19287
5210 1 18 . 1 1 49 49 ASP HA H 49 4.130 4.130 4.319 -0.189 19287
5211 1 18 . 1 1 49 49 ASP C C 49 177.740 177.740 178.290 -0.550 19287
5212 1 18 . 1 1 49 49 ASP CA C 49 56.690 56.690 57.564 -0.874 19287
5213 1 18 . 1 1 49 49 ASP CB C 49 39.970 39.970 40.177 -0.207 19287
5214 1 18 . 1 1 49 49 ASP H H 49 7.700 7.700 7.669 0.031 19287
5215 1 18 . 1 1 50 50 GLU N N 50 117.720 117.720 119.076 -1.356 19287
5216 1 18 . 1 1 50 50 GLU HA H 50 3.710 3.710 4.412 -0.702 19287
5217 1 18 . 1 1 50 50 GLU C C 50 177.550 177.550 178.617 -1.067 19287
5218 1 18 . 1 1 50 50 GLU CA C 50 58.550 58.550 58.229 0.321 19287
5219 1 18 . 1 1 50 50 GLU CB C 50 29.190 29.190 30.055 -0.865 19287
5220 1 18 . 1 1 50 50 GLU H H 50 7.410 7.410 7.732 -0.322 19287
5221 1 18 . 1 1 51 51 CYS N N 51 120.260 120.260 117.560 2.700 19287
5222 1 18 . 1 1 51 51 CYS HA H 51 1.650 1.650 2.856 -1.206 19287
5223 1 18 . 1 1 51 51 CYS C C 51 175.070 175.070 176.307 -1.237 19287
5224 1 18 . 1 1 51 51 CYS CA C 51 59.120 59.120 60.097 -0.977 19287
5225 1 18 . 1 1 51 51 CYS CB C 51 43.000 43.000 26.026 16.974 19287
5226 1 18 . 1 1 51 51 CYS H H 51 6.760 6.760 7.705 -0.945 19287
5227 1 18 . 1 1 52 52 ASN N N 52 120.160 120.160 120.831 -0.671 19287
5228 1 18 . 1 1 52 52 ASN HA H 52 4.090 4.090 4.372 -0.282 19287
5229 1 18 . 1 1 52 52 ASN C C 52 177.820 177.820 177.549 0.271 19287
5230 1 18 . 1 1 52 52 ASN CA C 52 55.060 55.060 55.895 -0.834 19287
5231 1 18 . 1 1 52 52 ASN CB C 52 37.500 37.500 38.193 -0.693 19287
5232 1 18 . 1 1 52 52 ASN H H 52 8.650 8.650 8.493 0.157 19287
5233 1 18 . 1 1 53 53 ARG N N 53 117.000 117.000 118.211 -1.211 19287
5234 1 18 . 1 1 53 53 ARG HA H 53 3.770 3.770 4.049 -0.279 19287
5235 1 18 . 1 1 53 53 ARG C C 53 177.360 177.360 177.522 -0.162 19287
5236 1 18 . 1 1 53 53 ARG CA C 53 58.490 58.490 58.630 -0.140 19287
5237 1 18 . 1 1 53 53 ARG CB C 53 30.180 30.180 29.324 0.856 19287
5238 1 18 . 1 1 53 53 ARG H H 53 7.900 7.900 7.570 0.330 19287
5239 1 18 . 1 1 54 54 THR N N 54 112.080 112.080 112.352 -0.272 19287
5240 1 18 . 1 1 54 54 THR HA H 54 3.838 3.838 4.480 -0.642 19287
5241 1 18 . 1 1 54 54 THR C C 54 174.990 174.990 174.492 0.498 19287
5242 1 18 . 1 1 54 54 THR CA C 54 65.740 65.740 63.547 2.193 19287
5243 1 18 . 1 1 54 54 THR CB C 54 68.870 68.870 70.425 -1.555 19287
5244 1 18 . 1 1 54 54 THR H H 54 7.260 7.260 7.663 -0.403 19287
5245 1 18 . 1 1 55 55 CYS N N 55 112.540 112.540 116.983 -4.443 19287
5246 1 18 . 1 1 55 55 CYS HA H 55 4.400 4.400 4.380 0.020 19287
5247 1 18 . 1 1 55 55 CYS C C 55 172.940 172.940 173.848 -0.908 19287
5248 1 18 . 1 1 55 55 CYS CA C 55 54.230 54.230 58.498 -4.268 19287
5249 1 18 . 1 1 55 55 CYS CB C 55 42.930 42.930 29.197 13.733 19287
5250 1 18 . 1 1 55 55 CYS H H 55 7.590 7.590 7.729 -0.139 19287
5251 1 18 . 1 1 56 56 VAL N N 56 119.720 119.720 123.913 -4.193 19287
5252 1 18 . 1 1 56 56 VAL HA H 56 3.631 3.631 3.999 -0.368 19287
5253 1 18 . 1 1 56 56 VAL C C 56 176.710 176.710 175.653 1.057 19287
5254 1 18 . 1 1 56 56 VAL CA C 56 64.540 64.540 63.349 1.191 19287
5255 1 18 . 1 1 56 56 VAL CB C 56 30.970 30.970 29.780 1.190 19287
5256 1 18 . 1 1 56 56 VAL H H 56 7.280 7.280 7.885 -0.605 19287
5257 1 19 . 1 1 2 2 PRO HA H 2 4.017 4.017 4.452 -0.435 19287
5258 1 19 . 1 1 2 2 PRO C C 2 177.920 177.920 177.788 0.132 19287
5259 1 19 . 1 1 2 2 PRO CA C 2 62.800 62.800 62.526 0.274 19287
5260 1 19 . 1 1 2 2 PRO CB C 2 32.050 32.050 32.459 -0.409 19287
5261 1 19 . 1 1 3 3 ARG N N 3 122.340 122.340 122.151 0.189 19287
5262 1 19 . 1 1 3 3 ARG HA H 3 3.786 3.786 3.989 -0.203 19287
5263 1 19 . 1 1 3 3 ARG C C 3 178.950 178.950 177.991 0.959 19287
5264 1 19 . 1 1 3 3 ARG CA C 3 58.410 58.410 58.086 0.324 19287
5265 1 19 . 1 1 3 3 ARG CB C 3 29.220 29.220 29.442 -0.222 19287
5266 1 19 . 1 1 3 3 ARG H H 3 8.550 8.550 8.675 -0.125 19287
5267 1 19 . 1 1 4 4 PHE N N 4 113.010 113.010 118.122 -5.112 19287
5268 1 19 . 1 1 4 4 PHE HA H 4 4.300 4.300 4.528 -0.228 19287
5269 1 19 . 1 1 4 4 PHE C C 4 176.070 176.070 175.405 0.665 19287
5270 1 19 . 1 1 4 4 PHE CA C 4 58.220 58.220 58.436 -0.216 19287
5271 1 19 . 1 1 4 4 PHE CB C 4 37.310 37.310 38.240 -0.930 19287
5272 1 19 . 1 1 4 4 PHE H H 4 7.150 7.150 7.839 -0.689 19287
5273 1 19 . 1 1 5 5 CYS N N 5 118.600 118.600 113.565 5.035 19287
5274 1 19 . 1 1 5 5 CYS HA H 5 4.130 4.130 4.542 -0.412 19287
5275 1 19 . 1 1 5 5 CYS C C 5 173.450 173.450 175.079 -1.629 19287
5276 1 19 . 1 1 5 5 CYS CA C 5 57.960 57.960 57.146 0.814 19287
5277 1 19 . 1 1 5 5 CYS CB C 5 39.210 39.210 26.480 12.730 19287
5278 1 19 . 1 1 5 5 CYS H H 5 7.090 7.090 7.393 -0.303 19287
5279 1 19 . 1 1 6 6 GLU N N 6 110.710 110.710 119.509 -8.799 19287
5280 1 19 . 1 1 6 6 GLU HA H 6 4.182 4.182 4.508 -0.326 19287
5281 1 19 . 1 1 6 6 GLU C C 6 176.310 176.310 176.303 0.007 19287
5282 1 19 . 1 1 6 6 GLU CA C 6 55.510 55.510 55.038 0.472 19287
5283 1 19 . 1 1 6 6 GLU CB C 6 28.160 28.160 29.466 -1.306 19287
5284 1 19 . 1 1 6 6 GLU H H 6 7.300 7.300 7.530 -0.230 19287
5285 1 19 . 1 1 7 7 LEU N N 7 119.090 119.090 121.037 -1.947 19287
5286 1 19 . 1 1 7 7 LEU HA H 7 4.160 4.160 4.371 -0.211 19287
5287 1 19 . 1 1 7 7 LEU C C 7 176.630 176.630 176.177 0.453 19287
5288 1 19 . 1 1 7 7 LEU CA C 7 54.510 54.510 53.965 0.545 19287
5289 1 19 . 1 1 7 7 LEU CB C 7 42.330 42.330 42.463 -0.133 19287
5290 1 19 . 1 1 7 7 LEU H H 7 7.210 7.210 7.377 -0.167 19287
5291 1 19 . 1 1 8 8 ALA N N 8 124.490 124.490 121.812 2.678 19287
5292 1 19 . 1 1 8 8 ALA HA H 8 4.250 4.250 4.649 -0.399 19287
5293 1 19 . 1 1 8 8 ALA C C 8 174.710 174.710 175.596 -0.886 19287
5294 1 19 . 1 1 8 8 ALA CA C 8 50.210 50.210 48.797 1.413 19287
5295 1 19 . 1 1 8 8 ALA CB C 8 16.930 16.930 19.625 -2.695 19287
5296 1 19 . 1 1 8 8 ALA H H 8 8.280 8.280 8.256 0.024 19287
5297 1 19 . 1 1 9 9 PRO HA H 9 4.180 4.180 4.635 -0.455 19287
5298 1 19 . 1 1 9 9 PRO C C 9 176.700 176.700 176.902 -0.202 19287
5299 1 19 . 1 1 9 9 PRO CA C 9 61.490 61.490 62.862 -1.372 19287
5300 1 19 . 1 1 9 9 PRO CB C 9 30.360 30.360 31.580 -1.220 19287
5301 1 19 . 1 1 10 10 SER N N 10 112.100 112.100 122.578 -10.478 19287
5302 1 19 . 1 1 10 10 SER HA H 10 4.630 4.630 4.356 0.274 19287
5303 1 19 . 1 1 10 10 SER C C 10 174.190 174.190 175.166 -0.976 19287
5304 1 19 . 1 1 10 10 SER CA C 10 55.360 55.360 57.017 -1.657 19287
5305 1 19 . 1 1 10 10 SER CB C 10 64.550 64.550 61.992 2.558 19287
5306 1 19 . 1 1 10 10 SER H H 10 7.450 7.450 8.418 -0.968 19287
5307 1 19 . 1 1 11 11 ALA N N 11 129.980 129.980 123.854 6.126 19287
5308 1 19 . 1 1 11 11 ALA HA H 11 4.496 4.496 3.827 0.669 19287
5309 1 19 . 1 1 11 11 ALA C C 11 178.510 178.510 178.477 0.033 19287
5310 1 19 . 1 1 11 11 ALA CA C 11 54.810 54.810 54.581 0.230 19287
5311 1 19 . 1 1 11 11 ALA CB C 11 19.910 19.910 18.536 1.374 19287
5312 1 19 . 1 1 11 11 ALA H H 11 9.210 9.210 7.997 1.213 19287
5313 1 19 . 1 1 12 12 GLY N N 12 104.410 104.410 104.831 -0.421 19287
5314 1 19 . 1 1 12 12 GLY C C 12 174.850 174.850 176.065 -1.215 19287
5315 1 19 . 1 1 12 12 GLY CA C 12 44.450 44.450 45.944 -1.494 19287
5316 1 19 . 1 1 12 12 GLY H H 12 8.190 8.190 8.475 -0.285 19287
5317 1 19 . 1 1 14 14 CYS HA H 14 4.250 4.250 4.713 -0.463 19287
5318 1 19 . 1 1 14 14 CYS C C 14 172.410 172.410 173.724 -1.314 19287
5319 1 19 . 1 1 14 14 CYS CA C 14 59.750 59.750 57.337 2.413 19287
5320 1 19 . 1 1 14 14 CYS CB C 14 39.130 39.130 30.645 8.485 19287
5321 1 19 . 1 1 15 15 PHE N N 15 116.000 116.000 124.222 -8.222 19287
5322 1 19 . 1 1 15 15 PHE HA H 15 4.380 4.380 4.589 -0.209 19287
5323 1 19 . 1 1 15 15 PHE C C 15 174.300 174.300 174.678 -0.378 19287
5324 1 19 . 1 1 15 15 PHE CA C 15 56.830 56.830 58.661 -1.831 19287
5325 1 19 . 1 1 15 15 PHE CB C 15 39.440 39.440 38.866 0.574 19287
5326 1 19 . 1 1 15 15 PHE H H 15 7.960 7.960 8.784 -0.824 19287
5327 1 19 . 1 1 16 16 ALA N N 16 125.630 125.630 130.563 -4.933 19287
5328 1 19 . 1 1 16 16 ALA HA H 16 4.320 4.320 4.383 -0.063 19287
5329 1 19 . 1 1 16 16 ALA C C 16 174.300 174.300 175.218 -0.918 19287
5330 1 19 . 1 1 16 16 ALA CA C 16 50.130 50.130 51.504 -1.373 19287
5331 1 19 . 1 1 16 16 ALA CB C 16 19.180 19.180 21.706 -2.526 19287
5332 1 19 . 1 1 16 16 ALA H H 16 7.800 7.800 7.957 -0.157 19287
5333 1 19 . 1 1 17 17 PHE N N 17 116.330 116.330 122.687 -6.357 19287
5334 1 19 . 1 1 17 17 PHE HA H 17 4.390 4.390 4.661 -0.271 19287
5335 1 19 . 1 1 17 17 PHE C C 17 175.310 175.310 174.084 1.226 19287
5336 1 19 . 1 1 17 17 PHE CA C 17 57.160 57.160 57.080 0.080 19287
5337 1 19 . 1 1 17 17 PHE CB C 17 39.380 39.380 41.147 -1.767 19287
5338 1 19 . 1 1 17 17 PHE H H 17 7.330 7.330 8.347 -1.017 19287
5339 1 19 . 1 1 18 18 VAL N N 18 122.890 122.890 124.423 -1.533 19287
5340 1 19 . 1 1 18 18 VAL HA H 18 4.475 4.475 4.426 0.049 19287
5341 1 19 . 1 1 18 18 VAL C C 18 173.590 173.590 173.321 0.269 19287
5342 1 19 . 1 1 18 18 VAL CA C 18 58.900 58.900 58.179 0.721 19287
5343 1 19 . 1 1 18 18 VAL CB C 18 33.900 33.900 33.710 0.190 19287
5344 1 19 . 1 1 18 18 VAL H H 18 8.680 8.680 8.126 0.554 19287
5345 1 19 . 1 1 19 19 PRO HA H 19 4.275 4.275 4.345 -0.070 19287
5346 1 19 . 1 1 19 19 PRO C C 19 176.940 176.940 176.327 0.613 19287
5347 1 19 . 1 1 19 19 PRO CA C 19 64.060 64.060 62.663 1.397 19287
5348 1 19 . 1 1 19 19 PRO CB C 19 31.710 31.710 31.410 0.300 19287
5349 1 19 . 1 1 20 20 SER N N 20 120.230 120.230 118.341 1.889 19287
5350 1 19 . 1 1 20 20 SER HA H 20 4.780 4.780 4.683 0.097 19287
5351 1 19 . 1 1 20 20 SER C C 20 170.900 170.900 172.710 -1.810 19287
5352 1 19 . 1 1 20 20 SER CA C 20 57.450 57.450 57.066 0.385 19287
5353 1 19 . 1 1 20 20 SER CB C 20 67.910 67.910 66.403 1.508 19287
5354 1 19 . 1 1 20 20 SER H H 20 8.390 8.390 7.818 0.572 19287
5355 1 19 . 1 1 21 21 TYR N N 21 118.220 118.220 118.973 -0.753 19287
5356 1 19 . 1 1 21 21 TYR HA H 21 5.600 5.600 5.062 0.538 19287
5357 1 19 . 1 1 21 21 TYR C C 21 173.770 173.770 175.449 -1.679 19287
5358 1 19 . 1 1 21 21 TYR CA C 21 57.740 57.740 58.094 -0.354 19287
5359 1 19 . 1 1 21 21 TYR CB C 21 42.660 42.660 41.597 1.063 19287
5360 1 19 . 1 1 21 21 TYR H H 21 9.020 9.020 8.711 0.309 19287
5361 1 19 . 1 1 22 22 TYR N N 22 119.260 119.260 125.289 -6.029 19287
5362 1 19 . 1 1 22 22 TYR HA H 22 5.110 5.110 4.926 0.184 19287
5363 1 19 . 1 1 22 22 TYR C C 22 172.610 172.610 174.263 -1.653 19287
5364 1 19 . 1 1 22 22 TYR CA C 22 55.380 55.380 56.761 -1.381 19287
5365 1 19 . 1 1 22 22 TYR CB C 22 41.550 41.550 42.572 -1.022 19287
5366 1 19 . 1 1 22 22 TYR H H 22 9.410 9.410 9.599 -0.189 19287
5367 1 19 . 1 1 23 23 TYR N N 23 123.200 123.200 126.326 -3.126 19287
5368 1 19 . 1 1 23 23 TYR HA H 23 4.382 4.382 4.774 -0.392 19287
5369 1 19 . 1 1 23 23 TYR C C 23 173.250 173.250 173.873 -0.623 19287
5370 1 19 . 1 1 23 23 TYR CA C 23 58.360 58.360 57.035 1.325 19287
5371 1 19 . 1 1 23 23 TYR CB C 23 39.570 39.570 41.093 -1.523 19287
5372 1 19 . 1 1 23 23 TYR H H 23 10.190 10.190 8.530 1.660 19287
5373 1 19 . 1 1 24 24 ASN N N 24 126.280 126.280 126.518 -0.238 19287
5374 1 19 . 1 1 24 24 ASN HA H 24 4.550 4.550 4.986 -0.436 19287
5375 1 19 . 1 1 24 24 ASN C C 24 174.000 174.000 175.411 -1.411 19287
5376 1 19 . 1 1 24 24 ASN CA C 24 51.360 51.360 51.819 -0.459 19287
5377 1 19 . 1 1 24 24 ASN CB C 24 40.040 40.040 38.928 1.111 19287
5378 1 19 . 1 1 24 24 ASN H H 24 7.890 7.890 8.701 -0.811 19287
5379 1 19 . 1 1 25 25 GLN N N 25 122.760 122.760 122.506 0.254 19287
5380 1 19 . 1 1 25 25 GLN HA H 25 3.691 3.691 3.806 -0.115 19287
5381 1 19 . 1 1 25 25 GLN C C 25 175.670 175.670 177.090 -1.420 19287
5382 1 19 . 1 1 25 25 GLN CA C 25 57.480 57.480 58.430 -0.950 19287
5383 1 19 . 1 1 25 25 GLN CB C 25 28.120 28.120 27.866 0.254 19287
5384 1 19 . 1 1 25 25 GLN H H 25 8.440 8.440 8.182 0.258 19287
5385 1 19 . 1 1 26 26 TYR N N 26 119.190 119.190 119.578 -0.388 19287
5386 1 19 . 1 1 26 26 TYR HA H 26 4.160 4.160 4.229 -0.069 19287
5387 1 19 . 1 1 26 26 TYR C C 26 176.520 176.520 176.783 -0.263 19287
5388 1 19 . 1 1 26 26 TYR CA C 26 60.170 60.170 60.130 0.040 19287
5389 1 19 . 1 1 26 26 TYR CB C 26 36.880 36.880 38.066 -1.186 19287
5390 1 19 . 1 1 26 26 TYR H H 26 7.810 7.810 8.057 -0.247 19287
5391 1 19 . 1 1 27 27 SER N N 27 109.600 109.600 111.945 -2.345 19287
5392 1 19 . 1 1 27 27 SER HA H 27 4.330 4.330 4.601 -0.271 19287
5393 1 19 . 1 1 27 27 SER C C 27 174.830 174.830 173.413 1.417 19287
5394 1 19 . 1 1 27 27 SER CA C 27 57.490 57.490 57.329 0.161 19287
5395 1 19 . 1 1 27 27 SER CB C 27 64.640 64.640 63.824 0.816 19287
5396 1 19 . 1 1 27 27 SER H H 27 7.350 7.350 7.657 -0.307 19287
5397 1 19 . 1 1 28 28 ASN N N 28 119.830 119.830 118.889 0.941 19287
5398 1 19 . 1 1 28 28 ASN HA H 28 4.060 4.060 4.393 -0.333 19287
5399 1 19 . 1 1 28 28 ASN C C 28 173.040 173.040 174.246 -1.206 19287
5400 1 19 . 1 1 28 28 ASN CA C 28 53.830 53.830 54.806 -0.976 19287
5401 1 19 . 1 1 28 28 ASN CB C 28 37.400 37.400 38.183 -0.783 19287
5402 1 19 . 1 1 28 28 ASN H H 28 7.930 7.930 8.045 -0.115 19287
5403 1 19 . 1 1 29 29 THR N N 29 103.070 103.070 111.458 -8.388 19287
5404 1 19 . 1 1 29 29 THR HA H 29 4.441 4.441 4.687 -0.246 19287
5405 1 19 . 1 1 29 29 THR C C 29 172.980 172.980 172.159 0.821 19287
5406 1 19 . 1 1 29 29 THR CA C 29 58.920 58.920 61.646 -2.726 19287
5407 1 19 . 1 1 29 29 THR CB C 29 73.260 73.260 71.424 1.836 19287
5408 1 19 . 1 1 29 29 THR H H 29 6.990 6.990 7.753 -0.763 19287
5409 1 19 . 1 1 30 30 CYS N N 30 118.340 118.340 119.195 -0.855 19287
5410 1 19 . 1 1 30 30 CYS HA H 30 5.462 5.462 5.402 0.060 19287
5411 1 19 . 1 1 30 30 CYS C C 30 173.320 173.320 173.416 -0.096 19287
5412 1 19 . 1 1 30 30 CYS CA C 30 57.750 57.750 57.836 -0.086 19287
5413 1 19 . 1 1 30 30 CYS CB C 30 50.680 50.680 32.018 18.662 19287
5414 1 19 . 1 1 30 30 CYS H H 30 8.954 8.954 8.646 0.308 19287
5415 1 19 . 1 1 31 31 HIS N N 31 118.930 118.930 119.288 -0.358 19287
5416 1 19 . 1 1 31 31 HIS HA H 31 4.780 4.780 5.003 -0.223 19287
5417 1 19 . 1 1 31 31 HIS C C 31 172.790 172.790 173.416 -0.626 19287
5418 1 19 . 1 1 31 31 HIS CA C 31 53.530 53.530 55.575 -2.045 19287
5419 1 19 . 1 1 31 31 HIS CB C 31 33.040 33.040 33.252 -0.212 19287
5420 1 19 . 1 1 31 31 HIS H H 31 9.010 9.010 9.590 -0.580 19287
5421 1 19 . 1 1 32 32 SER N N 32 117.600 117.600 121.096 -3.496 19287
5422 1 19 . 1 1 32 32 SER HA H 32 4.700 4.700 4.136 0.564 19287
5423 1 19 . 1 1 32 32 SER C C 32 174.930 174.930 173.754 1.176 19287
5424 1 19 . 1 1 32 32 SER CA C 32 57.980 57.980 58.498 -0.518 19287
5425 1 19 . 1 1 32 32 SER CB C 32 64.440 64.440 62.788 1.652 19287
5426 1 19 . 1 1 32 32 SER H H 32 8.740 8.740 8.206 0.534 19287
5427 1 19 . 1 1 33 33 PHE N N 33 120.690 120.690 120.737 -0.047 19287
5428 1 19 . 1 1 33 33 PHE HA H 33 4.790 4.790 5.012 -0.222 19287
5429 1 19 . 1 1 33 33 PHE C C 33 171.810 171.810 173.456 -1.646 19287
5430 1 19 . 1 1 33 33 PHE CA C 33 56.200 56.200 55.854 0.346 19287
5431 1 19 . 1 1 33 33 PHE CB C 33 40.230 40.230 41.623 -1.393 19287
5432 1 19 . 1 1 33 33 PHE H H 33 8.830 8.830 8.768 0.062 19287
5433 1 19 . 1 1 34 34 THR N N 34 116.650 116.650 112.030 4.620 19287
5434 1 19 . 1 1 34 34 THR HA H 34 3.965 3.965 4.278 -0.313 19287
5435 1 19 . 1 1 34 34 THR C C 34 172.600 172.600 172.558 0.042 19287
5436 1 19 . 1 1 34 34 THR CA C 34 61.980 61.980 60.727 1.253 19287
5437 1 19 . 1 1 34 34 THR CB C 34 68.530 68.530 69.209 -0.679 19287
5438 1 19 . 1 1 34 34 THR H H 34 8.400 8.400 8.282 0.118 19287
5439 1 19 . 1 1 35 35 TYR N N 35 127.790 127.790 126.285 1.505 19287
5440 1 19 . 1 1 35 35 TYR HA H 35 4.500 4.500 4.716 -0.216 19287
5441 1 19 . 1 1 35 35 TYR C C 35 174.200 174.200 173.724 0.476 19287
5442 1 19 . 1 1 35 35 TYR CA C 35 55.130 55.130 56.498 -1.368 19287
5443 1 19 . 1 1 35 35 TYR CB C 35 39.650 39.650 42.425 -2.775 19287
5444 1 19 . 1 1 35 35 TYR H H 35 8.010 8.010 7.831 0.179 19287
5445 1 19 . 1 1 39 39 GLY N N 39 103.730 103.730 112.586 -8.856 19287
5446 1 19 . 1 1 39 39 GLY C C 39 175.700 175.700 173.261 2.439 19287
5447 1 19 . 1 1 39 39 GLY CA C 39 45.370 45.370 44.629 0.741 19287
5448 1 19 . 1 1 39 39 GLY H H 39 8.500 8.500 8.323 0.177 19287
5449 1 19 . 1 1 40 40 GLY N N 40 110.170 110.170 107.330 2.840 19287
5450 1 19 . 1 1 40 40 GLY C C 40 173.140 173.140 173.308 -0.168 19287
5451 1 19 . 1 1 40 40 GLY CA C 40 44.320 44.320 44.748 -0.428 19287
5452 1 19 . 1 1 40 40 GLY H H 40 8.670 8.670 7.800 0.870 19287
5453 1 19 . 1 1 41 41 ASN N N 41 116.960 116.960 117.527 -0.567 19287
5454 1 19 . 1 1 41 41 ASN HA H 41 4.560 4.560 5.040 -0.480 19287
5455 1 19 . 1 1 41 41 ASN C C 41 173.670 173.670 175.881 -2.211 19287
5456 1 19 . 1 1 41 41 ASN CA C 41 51.850 51.850 52.085 -0.235 19287
5457 1 19 . 1 1 41 41 ASN CB C 41 40.230 40.230 41.081 -0.851 19287
5458 1 19 . 1 1 41 41 ASN H H 41 8.790 8.790 8.829 -0.039 19287
5459 1 19 . 1 1 42 42 ALA N N 42 113.290 113.290 122.505 -9.215 19287
5460 1 19 . 1 1 42 42 ALA HA H 42 3.720 3.720 4.038 -0.318 19287
5461 1 19 . 1 1 42 42 ALA C C 42 177.220 177.220 177.153 0.067 19287
5462 1 19 . 1 1 42 42 ALA CA C 42 52.810 52.810 54.303 -1.494 19287
5463 1 19 . 1 1 42 42 ALA CB C 42 17.980 17.980 18.628 -0.648 19287
5464 1 19 . 1 1 42 42 ALA H H 42 7.590 7.590 8.698 -1.108 19287
5465 1 19 . 1 1 43 43 ASN N N 43 117.710 117.710 112.934 4.776 19287
5466 1 19 . 1 1 43 43 ASN HA H 43 4.700 4.700 4.510 0.190 19287
5467 1 19 . 1 1 43 43 ASN C C 43 173.660 173.660 175.014 -1.354 19287
5468 1 19 . 1 1 43 43 ASN CA C 43 50.630 50.630 53.828 -3.198 19287
5469 1 19 . 1 1 43 43 ASN CB C 43 34.840 34.840 37.755 -2.915 19287
5470 1 19 . 1 1 43 43 ASN H H 43 7.900 7.900 7.970 -0.070 19287
5471 1 19 . 1 1 44 44 ARG N N 44 120.690 120.690 121.033 -0.343 19287
5472 1 19 . 1 1 44 44 ARG HA H 44 4.692 4.692 4.432 0.260 19287
5473 1 19 . 1 1 44 44 ARG C C 44 173.530 173.530 174.449 -0.919 19287
5474 1 19 . 1 1 44 44 ARG CA C 44 56.660 56.660 56.359 0.300 19287
5475 1 19 . 1 1 44 44 ARG CB C 44 31.450 31.450 29.539 1.911 19287
5476 1 19 . 1 1 44 44 ARG H H 44 6.860 6.860 7.047 -0.187 19287
5477 1 19 . 1 1 45 45 PHE N N 45 123.690 123.690 123.019 0.671 19287
5478 1 19 . 1 1 45 45 PHE HA H 45 4.810 4.810 4.883 -0.073 19287
5479 1 19 . 1 1 45 45 PHE C C 45 175.420 175.420 175.564 -0.144 19287
5480 1 19 . 1 1 45 45 PHE CA C 45 55.670 55.670 56.611 -0.941 19287
5481 1 19 . 1 1 45 45 PHE CB C 45 43.790 43.790 42.837 0.954 19287
5482 1 19 . 1 1 45 45 PHE H H 45 9.340 9.340 8.759 0.581 19287
5483 1 19 . 1 1 46 46 ARG N N 46 120.920 120.920 117.618 3.302 19287
5484 1 19 . 1 1 46 46 ARG HA H 46 4.397 4.397 4.505 -0.108 19287
5485 1 19 . 1 1 46 46 ARG C C 46 176.560 176.560 176.174 0.386 19287
5486 1 19 . 1 1 46 46 ARG CA C 46 58.210 58.210 55.779 2.430 19287
5487 1 19 . 1 1 46 46 ARG CB C 46 30.900 30.900 30.563 0.337 19287
5488 1 19 . 1 1 46 46 ARG H H 46 9.080 9.080 8.881 0.199 19287
5489 1 19 . 1 1 47 47 THR N N 47 102.800 102.800 111.985 -9.185 19287
5490 1 19 . 1 1 47 47 THR HA H 47 4.660 4.660 4.188 0.472 19287
5491 1 19 . 1 1 47 47 THR C C 47 174.110 174.110 173.664 0.446 19287
5492 1 19 . 1 1 47 47 THR CA C 47 58.170 58.170 60.355 -2.185 19287
5493 1 19 . 1 1 47 47 THR CB C 47 72.380 72.380 70.491 1.889 19287
5494 1 19 . 1 1 47 47 THR H H 47 7.230 7.230 7.508 -0.278 19287
5495 1 19 . 1 1 48 48 ILE N N 48 123.200 123.200 124.274 -1.074 19287
5496 1 19 . 1 1 48 48 ILE HA H 48 2.901 2.901 3.767 -0.866 19287
5497 1 19 . 1 1 48 48 ILE C C 48 176.420 176.420 176.031 0.389 19287
5498 1 19 . 1 1 48 48 ILE CA C 48 64.000 64.000 62.306 1.694 19287
5499 1 19 . 1 1 48 48 ILE CB C 48 37.060 37.060 38.126 -1.066 19287
5500 1 19 . 1 1 48 48 ILE H H 48 8.110 8.110 8.118 -0.008 19287
5501 1 19 . 1 1 49 49 ASP N N 49 119.560 119.560 119.002 0.558 19287
5502 1 19 . 1 1 49 49 ASP HA H 49 4.130 4.130 4.287 -0.157 19287
5503 1 19 . 1 1 49 49 ASP C C 49 177.740 177.740 178.195 -0.455 19287
5504 1 19 . 1 1 49 49 ASP CA C 49 56.690 56.690 57.300 -0.611 19287
5505 1 19 . 1 1 49 49 ASP CB C 49 39.970 39.970 40.045 -0.075 19287
5506 1 19 . 1 1 49 49 ASP H H 49 7.700 7.700 7.798 -0.098 19287
5507 1 19 . 1 1 50 50 GLU N N 50 117.720 117.720 120.070 -2.350 19287
5508 1 19 . 1 1 50 50 GLU HA H 50 3.710 3.710 4.260 -0.550 19287
5509 1 19 . 1 1 50 50 GLU C C 50 177.550 177.550 178.412 -0.862 19287
5510 1 19 . 1 1 50 50 GLU CA C 50 58.550 58.550 58.194 0.356 19287
5511 1 19 . 1 1 50 50 GLU CB C 50 29.190 29.190 29.890 -0.700 19287
5512 1 19 . 1 1 50 50 GLU H H 50 7.410 7.410 7.585 -0.175 19287
5513 1 19 . 1 1 51 51 CYS N N 51 120.260 120.260 117.093 3.167 19287
5514 1 19 . 1 1 51 51 CYS HA H 51 1.650 1.650 2.946 -1.296 19287
5515 1 19 . 1 1 51 51 CYS C C 51 175.070 175.070 176.486 -1.416 19287
5516 1 19 . 1 1 51 51 CYS CA C 51 59.120 59.120 60.653 -1.533 19287
5517 1 19 . 1 1 51 51 CYS CB C 51 43.000 43.000 25.927 17.073 19287
5518 1 19 . 1 1 51 51 CYS H H 51 6.760 6.760 7.740 -0.980 19287
5519 1 19 . 1 1 52 52 ASN N N 52 120.160 120.160 120.478 -0.318 19287
5520 1 19 . 1 1 52 52 ASN HA H 52 4.090 4.090 4.412 -0.322 19287
5521 1 19 . 1 1 52 52 ASN C C 52 177.820 177.820 177.502 0.318 19287
5522 1 19 . 1 1 52 52 ASN CA C 52 55.060 55.060 55.922 -0.862 19287
5523 1 19 . 1 1 52 52 ASN CB C 52 37.500 37.500 38.345 -0.845 19287
5524 1 19 . 1 1 52 52 ASN H H 52 8.650 8.650 8.457 0.193 19287
5525 1 19 . 1 1 53 53 ARG N N 53 117.000 117.000 118.818 -1.818 19287
5526 1 19 . 1 1 53 53 ARG HA H 53 3.770 3.770 4.021 -0.251 19287
5527 1 19 . 1 1 53 53 ARG C C 53 177.360 177.360 177.681 -0.321 19287
5528 1 19 . 1 1 53 53 ARG CA C 53 58.490 58.490 58.732 -0.242 19287
5529 1 19 . 1 1 53 53 ARG CB C 53 30.180 30.180 29.299 0.881 19287
5530 1 19 . 1 1 53 53 ARG H H 53 7.900 7.900 7.490 0.410 19287
5531 1 19 . 1 1 54 54 THR N N 54 112.080 112.080 112.036 0.044 19287
5532 1 19 . 1 1 54 54 THR HA H 54 3.838 3.838 4.346 -0.508 19287
5533 1 19 . 1 1 54 54 THR C C 54 174.990 174.990 174.146 0.844 19287
5534 1 19 . 1 1 54 54 THR CA C 54 65.740 65.740 63.783 1.957 19287
5535 1 19 . 1 1 54 54 THR CB C 54 68.870 68.870 69.832 -0.962 19287
5536 1 19 . 1 1 54 54 THR H H 54 7.260 7.260 7.873 -0.613 19287
5537 1 19 . 1 1 55 55 CYS N N 55 112.540 112.540 117.006 -4.466 19287
5538 1 19 . 1 1 55 55 CYS HA H 55 4.400 4.400 4.397 0.003 19287
5539 1 19 . 1 1 55 55 CYS C C 55 172.940 172.940 174.192 -1.252 19287
5540 1 19 . 1 1 55 55 CYS CA C 55 54.230 54.230 58.370 -4.140 19287
5541 1 19 . 1 1 55 55 CYS CB C 55 42.930 42.930 29.588 13.342 19287
5542 1 19 . 1 1 55 55 CYS H H 55 7.590 7.590 7.364 0.226 19287
5543 1 19 . 1 1 56 56 VAL N N 56 119.720 119.720 123.557 -3.837 19287
5544 1 19 . 1 1 56 56 VAL HA H 56 3.631 3.631 4.090 -0.459 19287
5545 1 19 . 1 1 56 56 VAL C C 56 176.710 176.710 175.822 0.888 19287
5546 1 19 . 1 1 56 56 VAL CA C 56 64.540 64.540 63.227 1.313 19287
5547 1 19 . 1 1 56 56 VAL CB C 56 30.970 30.970 30.683 0.287 19287
5548 1 19 . 1 1 56 56 VAL H H 56 7.280 7.280 7.990 -0.710 19287
5549 1 20 . 1 1 2 2 PRO HA H 2 4.017 4.017 4.357 -0.340 19287
5550 1 20 . 1 1 2 2 PRO C C 2 177.920 177.920 177.827 0.093 19287
5551 1 20 . 1 1 2 2 PRO CA C 2 62.800 62.800 62.257 0.543 19287
5552 1 20 . 1 1 2 2 PRO CB C 2 32.050 32.050 32.507 -0.457 19287
5553 1 20 . 1 1 3 3 ARG N N 3 122.340 122.340 123.603 -1.263 19287
5554 1 20 . 1 1 3 3 ARG HA H 3 3.786 3.786 3.943 -0.157 19287
5555 1 20 . 1 1 3 3 ARG C C 3 178.950 178.950 177.653 1.297 19287
5556 1 20 . 1 1 3 3 ARG CA C 3 58.410 58.410 58.099 0.311 19287
5557 1 20 . 1 1 3 3 ARG CB C 3 29.220 29.220 29.112 0.108 19287
5558 1 20 . 1 1 3 3 ARG H H 3 8.550 8.550 8.795 -0.245 19287
5559 1 20 . 1 1 4 4 PHE N N 4 113.010 113.010 118.020 -5.010 19287
5560 1 20 . 1 1 4 4 PHE HA H 4 4.300 4.300 4.470 -0.170 19287
5561 1 20 . 1 1 4 4 PHE C C 4 176.070 176.070 176.977 -0.907 19287
5562 1 20 . 1 1 4 4 PHE CA C 4 58.220 58.220 58.256 -0.036 19287
5563 1 20 . 1 1 4 4 PHE CB C 4 37.310 37.310 37.313 -0.003 19287
5564 1 20 . 1 1 4 4 PHE H H 4 7.150 7.150 7.728 -0.578 19287
5565 1 20 . 1 1 5 5 CYS N N 5 118.600 118.600 118.704 -0.104 19287
5566 1 20 . 1 1 5 5 CYS HA H 5 4.130 4.130 4.439 -0.309 19287
5567 1 20 . 1 1 5 5 CYS C C 5 173.450 173.450 174.904 -1.454 19287
5568 1 20 . 1 1 5 5 CYS CA C 5 57.960 57.960 61.195 -3.235 19287
5569 1 20 . 1 1 5 5 CYS CB C 5 39.210 39.210 25.677 13.533 19287
5570 1 20 . 1 1 5 5 CYS H H 5 7.090 7.090 7.438 -0.348 19287
5571 1 20 . 1 1 6 6 GLU N N 6 110.710 110.710 118.178 -7.468 19287
5572 1 20 . 1 1 6 6 GLU HA H 6 4.182 4.182 4.351 -0.169 19287
5573 1 20 . 1 1 6 6 GLU C C 6 176.310 176.310 176.550 -0.240 19287
5574 1 20 . 1 1 6 6 GLU CA C 6 55.510 55.510 55.756 -0.246 19287
5575 1 20 . 1 1 6 6 GLU CB C 6 28.160 28.160 29.121 -0.961 19287
5576 1 20 . 1 1 6 6 GLU H H 6 7.300 7.300 7.638 -0.338 19287
5577 1 20 . 1 1 7 7 LEU N N 7 119.090 119.090 120.903 -1.813 19287
5578 1 20 . 1 1 7 7 LEU HA H 7 4.160 4.160 4.245 -0.085 19287
5579 1 20 . 1 1 7 7 LEU C C 7 176.630 176.630 175.965 0.665 19287
5580 1 20 . 1 1 7 7 LEU CA C 7 54.510 54.510 54.516 -0.006 19287
5581 1 20 . 1 1 7 7 LEU CB C 7 42.330 42.330 42.698 -0.368 19287
5582 1 20 . 1 1 7 7 LEU H H 7 7.210 7.210 7.226 -0.016 19287
5583 1 20 . 1 1 8 8 ALA N N 8 124.490 124.490 121.461 3.029 19287
5584 1 20 . 1 1 8 8 ALA HA H 8 4.250 4.250 4.672 -0.422 19287
5585 1 20 . 1 1 8 8 ALA C C 8 174.710 174.710 175.580 -0.870 19287
5586 1 20 . 1 1 8 8 ALA CA C 8 50.210 50.210 48.743 1.467 19287
5587 1 20 . 1 1 8 8 ALA CB C 8 16.930 16.930 19.303 -2.373 19287
5588 1 20 . 1 1 8 8 ALA H H 8 8.280 8.280 8.194 0.086 19287
5589 1 20 . 1 1 9 9 PRO HA H 9 4.180 4.180 4.562 -0.382 19287
5590 1 20 . 1 1 9 9 PRO C C 9 176.700 176.700 176.870 -0.170 19287
5591 1 20 . 1 1 9 9 PRO CA C 9 61.490 61.490 62.940 -1.450 19287
5592 1 20 . 1 1 9 9 PRO CB C 9 30.360 30.360 31.966 -1.606 19287
5593 1 20 . 1 1 10 10 SER N N 10 112.100 112.100 121.327 -9.227 19287
5594 1 20 . 1 1 10 10 SER HA H 10 4.630 4.630 4.386 0.244 19287
5595 1 20 . 1 1 10 10 SER C C 10 174.190 174.190 174.972 -0.782 19287
5596 1 20 . 1 1 10 10 SER CA C 10 55.360 55.360 56.672 -1.312 19287
5597 1 20 . 1 1 10 10 SER CB C 10 64.550 64.550 62.028 2.522 19287
5598 1 20 . 1 1 10 10 SER H H 10 7.450 7.450 8.461 -1.011 19287
5599 1 20 . 1 1 11 11 ALA N N 11 129.980 129.980 124.174 5.806 19287
5600 1 20 . 1 1 11 11 ALA HA H 11 4.496 4.496 4.004 0.492 19287
5601 1 20 . 1 1 11 11 ALA C C 11 178.510 178.510 178.103 0.407 19287
5602 1 20 . 1 1 11 11 ALA CA C 11 54.810 54.810 53.552 1.258 19287
5603 1 20 . 1 1 11 11 ALA CB C 11 19.910 19.910 18.858 1.052 19287
5604 1 20 . 1 1 11 11 ALA H H 11 9.210 9.210 8.104 1.106 19287
5605 1 20 . 1 1 12 12 GLY N N 12 104.410 104.410 104.099 0.311 19287
5606 1 20 . 1 1 12 12 GLY C C 12 174.850 174.850 175.900 -1.050 19287
5607 1 20 . 1 1 12 12 GLY CA C 12 44.450 44.450 45.548 -1.099 19287
5608 1 20 . 1 1 12 12 GLY H H 12 8.190 8.190 8.442 -0.252 19287
5609 1 20 . 1 1 14 14 CYS HA H 14 4.250 4.250 4.687 -0.437 19287
5610 1 20 . 1 1 14 14 CYS C C 14 172.410 172.410 173.541 -1.131 19287
5611 1 20 . 1 1 14 14 CYS CA C 14 59.750 59.750 58.161 1.589 19287
5612 1 20 . 1 1 14 14 CYS CB C 14 39.130 39.130 30.915 8.216 19287
5613 1 20 . 1 1 15 15 PHE N N 15 116.000 116.000 124.130 -8.130 19287
5614 1 20 . 1 1 15 15 PHE HA H 15 4.380 4.380 4.517 -0.137 19287
5615 1 20 . 1 1 15 15 PHE C C 15 174.300 174.300 174.782 -0.482 19287
5616 1 20 . 1 1 15 15 PHE CA C 15 56.830 56.830 57.917 -1.087 19287
5617 1 20 . 1 1 15 15 PHE CB C 15 39.440 39.440 38.889 0.551 19287
5618 1 20 . 1 1 15 15 PHE H H 15 7.960 7.960 8.815 -0.855 19287
5619 1 20 . 1 1 16 16 ALA N N 16 125.630 125.630 130.005 -4.375 19287
5620 1 20 . 1 1 16 16 ALA HA H 16 4.320 4.320 4.603 -0.283 19287
5621 1 20 . 1 1 16 16 ALA C C 16 174.300 174.300 175.470 -1.170 19287
5622 1 20 . 1 1 16 16 ALA CA C 16 50.130 50.130 51.466 -1.336 19287
5623 1 20 . 1 1 16 16 ALA CB C 16 19.180 19.180 21.498 -2.318 19287
5624 1 20 . 1 1 16 16 ALA H H 16 7.800 7.800 7.864 -0.064 19287
5625 1 20 . 1 1 17 17 PHE N N 17 116.330 116.330 123.632 -7.302 19287
5626 1 20 . 1 1 17 17 PHE HA H 17 4.390 4.390 4.706 -0.316 19287
5627 1 20 . 1 1 17 17 PHE C C 17 175.310 175.310 174.130 1.180 19287
5628 1 20 . 1 1 17 17 PHE CA C 17 57.160 57.160 55.014 2.146 19287
5629 1 20 . 1 1 17 17 PHE CB C 17 39.380 39.380 40.652 -1.272 19287
5630 1 20 . 1 1 17 17 PHE H H 17 7.330 7.330 8.485 -1.155 19287
5631 1 20 . 1 1 18 18 VAL N N 18 122.890 122.890 125.033 -2.143 19287
5632 1 20 . 1 1 18 18 VAL HA H 18 4.475 4.475 4.612 -0.137 19287
5633 1 20 . 1 1 18 18 VAL C C 18 173.590 173.590 173.587 0.003 19287
5634 1 20 . 1 1 18 18 VAL CA C 18 58.900 58.900 58.611 0.289 19287
5635 1 20 . 1 1 18 18 VAL CB C 18 33.900 33.900 33.270 0.630 19287
5636 1 20 . 1 1 18 18 VAL H H 18 8.680 8.680 8.245 0.435 19287
5637 1 20 . 1 1 19 19 PRO HA H 19 4.275 4.275 4.652 -0.377 19287
5638 1 20 . 1 1 19 19 PRO C C 19 176.940 176.940 176.634 0.306 19287
5639 1 20 . 1 1 19 19 PRO CA C 19 64.060 64.060 62.583 1.477 19287
5640 1 20 . 1 1 19 19 PRO CB C 19 31.710 31.710 31.785 -0.075 19287
5641 1 20 . 1 1 20 20 SER N N 20 120.230 120.230 119.526 0.704 19287
5642 1 20 . 1 1 20 20 SER HA H 20 4.780 4.780 4.707 0.073 19287
5643 1 20 . 1 1 20 20 SER C C 20 170.900 170.900 172.993 -2.093 19287
5644 1 20 . 1 1 20 20 SER CA C 20 57.450 57.450 57.237 0.213 19287
5645 1 20 . 1 1 20 20 SER CB C 20 67.910 67.910 66.428 1.482 19287
5646 1 20 . 1 1 20 20 SER H H 20 8.390 8.390 7.921 0.469 19287
5647 1 20 . 1 1 21 21 TYR N N 21 118.220 118.220 118.737 -0.517 19287
5648 1 20 . 1 1 21 21 TYR HA H 21 5.600 5.600 5.180 0.420 19287
5649 1 20 . 1 1 21 21 TYR C C 21 173.770 173.770 175.288 -1.518 19287
5650 1 20 . 1 1 21 21 TYR CA C 21 57.740 57.740 58.360 -0.620 19287
5651 1 20 . 1 1 21 21 TYR CB C 21 42.660 42.660 41.950 0.710 19287
5652 1 20 . 1 1 21 21 TYR H H 21 9.020 9.020 8.728 0.292 19287
5653 1 20 . 1 1 22 22 TYR N N 22 119.260 119.260 125.186 -5.926 19287
5654 1 20 . 1 1 22 22 TYR HA H 22 5.110 5.110 4.958 0.152 19287
5655 1 20 . 1 1 22 22 TYR C C 22 172.610 172.610 174.366 -1.756 19287
5656 1 20 . 1 1 22 22 TYR CA C 22 55.380 55.380 55.633 -0.252 19287
5657 1 20 . 1 1 22 22 TYR CB C 22 41.550 41.550 43.009 -1.459 19287
5658 1 20 . 1 1 22 22 TYR H H 22 9.410 9.410 9.689 -0.279 19287
5659 1 20 . 1 1 23 23 TYR N N 23 123.200 123.200 123.321 -0.121 19287
5660 1 20 . 1 1 23 23 TYR HA H 23 4.382 4.382 4.953 -0.571 19287
5661 1 20 . 1 1 23 23 TYR C C 23 173.250 173.250 173.696 -0.446 19287
5662 1 20 . 1 1 23 23 TYR CA C 23 58.360 58.360 57.085 1.275 19287
5663 1 20 . 1 1 23 23 TYR CB C 23 39.570 39.570 41.936 -2.366 19287
5664 1 20 . 1 1 23 23 TYR H H 23 10.190 10.190 8.352 1.838 19287
5665 1 20 . 1 1 24 24 ASN N N 24 126.280 126.280 125.797 0.483 19287
5666 1 20 . 1 1 24 24 ASN HA H 24 4.550 4.550 4.928 -0.378 19287
5667 1 20 . 1 1 24 24 ASN C C 24 174.000 174.000 175.477 -1.477 19287
5668 1 20 . 1 1 24 24 ASN CA C 24 51.360 51.360 52.113 -0.753 19287
5669 1 20 . 1 1 24 24 ASN CB C 24 40.040 40.040 39.619 0.421 19287
5670 1 20 . 1 1 24 24 ASN H H 24 7.890 7.890 8.532 -0.642 19287
5671 1 20 . 1 1 25 25 GLN N N 25 122.760 122.760 123.902 -1.142 19287
5672 1 20 . 1 1 25 25 GLN HA H 25 3.691 3.691 3.670 0.021 19287
5673 1 20 . 1 1 25 25 GLN C C 25 175.670 175.670 177.203 -1.533 19287
5674 1 20 . 1 1 25 25 GLN CA C 25 57.480 57.480 58.297 -0.817 19287
5675 1 20 . 1 1 25 25 GLN CB C 25 28.120 28.120 27.552 0.568 19287
5676 1 20 . 1 1 25 25 GLN H H 25 8.440 8.440 8.205 0.235 19287
5677 1 20 . 1 1 26 26 TYR N N 26 119.190 119.190 119.962 -0.772 19287
5678 1 20 . 1 1 26 26 TYR HA H 26 4.160 4.160 4.229 -0.069 19287
5679 1 20 . 1 1 26 26 TYR C C 26 176.520 176.520 177.199 -0.679 19287
5680 1 20 . 1 1 26 26 TYR CA C 26 60.170 60.170 60.011 0.159 19287
5681 1 20 . 1 1 26 26 TYR CB C 26 36.880 36.880 37.700 -0.820 19287
5682 1 20 . 1 1 26 26 TYR H H 26 7.810 7.810 7.701 0.109 19287
5683 1 20 . 1 1 27 27 SER N N 27 109.600 109.600 111.814 -2.214 19287
5684 1 20 . 1 1 27 27 SER HA H 27 4.330 4.330 4.553 -0.223 19287
5685 1 20 . 1 1 27 27 SER C C 27 174.830 174.830 174.016 0.814 19287
5686 1 20 . 1 1 27 27 SER CA C 27 57.490 57.490 57.550 -0.060 19287
5687 1 20 . 1 1 27 27 SER CB C 27 64.640 64.640 64.099 0.541 19287
5688 1 20 . 1 1 27 27 SER H H 27 7.350 7.350 7.583 -0.233 19287
5689 1 20 . 1 1 28 28 ASN N N 28 119.830 119.830 119.227 0.603 19287
5690 1 20 . 1 1 28 28 ASN HA H 28 4.060 4.060 4.351 -0.291 19287
5691 1 20 . 1 1 28 28 ASN C C 28 173.040 173.040 174.393 -1.353 19287
5692 1 20 . 1 1 28 28 ASN CA C 28 53.830 53.830 54.696 -0.866 19287
5693 1 20 . 1 1 28 28 ASN CB C 28 37.400 37.400 38.173 -0.773 19287
5694 1 20 . 1 1 28 28 ASN H H 28 7.930 7.930 8.095 -0.165 19287
5695 1 20 . 1 1 29 29 THR N N 29 103.070 103.070 111.085 -8.015 19287
5696 1 20 . 1 1 29 29 THR HA H 29 4.441 4.441 4.722 -0.281 19287
5697 1 20 . 1 1 29 29 THR C C 29 172.980 172.980 172.156 0.824 19287
5698 1 20 . 1 1 29 29 THR CA C 29 58.920 58.920 61.611 -2.691 19287
5699 1 20 . 1 1 29 29 THR CB C 29 73.260 73.260 71.470 1.790 19287
5700 1 20 . 1 1 29 29 THR H H 29 6.990 6.990 7.579 -0.589 19287
5701 1 20 . 1 1 30 30 CYS N N 30 118.340 118.340 118.819 -0.479 19287
5702 1 20 . 1 1 30 30 CYS HA H 30 5.462 5.462 5.107 0.355 19287
5703 1 20 . 1 1 30 30 CYS C C 30 173.320 173.320 173.135 0.185 19287
5704 1 20 . 1 1 30 30 CYS CA C 30 57.750 57.750 57.386 0.363 19287
5705 1 20 . 1 1 30 30 CYS CB C 30 50.680 50.680 31.637 19.043 19287
5706 1 20 . 1 1 30 30 CYS H H 30 8.954 8.954 8.601 0.353 19287
5707 1 20 . 1 1 31 31 HIS N N 31 118.930 118.930 119.349 -0.419 19287
5708 1 20 . 1 1 31 31 HIS HA H 31 4.780 4.780 5.066 -0.286 19287
5709 1 20 . 1 1 31 31 HIS C C 31 172.790 172.790 173.638 -0.848 19287
5710 1 20 . 1 1 31 31 HIS CA C 31 53.530 53.530 55.665 -2.135 19287
5711 1 20 . 1 1 31 31 HIS CB C 31 33.040 33.040 33.447 -0.407 19287
5712 1 20 . 1 1 31 31 HIS H H 31 9.010 9.010 9.254 -0.244 19287
5713 1 20 . 1 1 32 32 SER N N 32 117.600 117.600 119.440 -1.840 19287
5714 1 20 . 1 1 32 32 SER HA H 32 4.700 4.700 4.544 0.156 19287
5715 1 20 . 1 1 32 32 SER C C 32 174.930 174.930 173.706 1.224 19287
5716 1 20 . 1 1 32 32 SER CA C 32 57.980 57.980 58.511 -0.531 19287
5717 1 20 . 1 1 32 32 SER CB C 32 64.440 64.440 63.423 1.017 19287
5718 1 20 . 1 1 32 32 SER H H 32 8.740 8.740 8.181 0.559 19287
5719 1 20 . 1 1 33 33 PHE N N 33 120.690 120.690 120.064 0.626 19287
5720 1 20 . 1 1 33 33 PHE HA H 33 4.790 4.790 5.018 -0.228 19287
5721 1 20 . 1 1 33 33 PHE C C 33 171.810 171.810 173.299 -1.489 19287
5722 1 20 . 1 1 33 33 PHE CA C 33 56.200 56.200 55.877 0.323 19287
5723 1 20 . 1 1 33 33 PHE CB C 33 40.230 40.230 41.075 -0.845 19287
5724 1 20 . 1 1 33 33 PHE H H 33 8.830 8.830 8.953 -0.123 19287
5725 1 20 . 1 1 34 34 THR N N 34 116.650 116.650 111.585 5.065 19287
5726 1 20 . 1 1 34 34 THR HA H 34 3.965 3.965 4.399 -0.434 19287
5727 1 20 . 1 1 34 34 THR C C 34 172.600 172.600 172.509 0.091 19287
5728 1 20 . 1 1 34 34 THR CA C 34 61.980 61.980 60.679 1.301 19287
5729 1 20 . 1 1 34 34 THR CB C 34 68.530 68.530 69.471 -0.941 19287
5730 1 20 . 1 1 34 34 THR H H 34 8.400 8.400 8.189 0.211 19287
5731 1 20 . 1 1 35 35 TYR N N 35 127.790 127.790 125.848 1.942 19287
5732 1 20 . 1 1 35 35 TYR HA H 35 4.500 4.500 4.754 -0.254 19287
5733 1 20 . 1 1 35 35 TYR C C 35 174.200 174.200 173.750 0.450 19287
5734 1 20 . 1 1 35 35 TYR CA C 35 55.130 55.130 56.971 -1.841 19287
5735 1 20 . 1 1 35 35 TYR CB C 35 39.650 39.650 41.971 -2.321 19287
5736 1 20 . 1 1 35 35 TYR H H 35 8.010 8.010 7.995 0.015 19287
5737 1 20 . 1 1 39 39 GLY N N 39 103.730 103.730 109.255 -5.525 19287
5738 1 20 . 1 1 39 39 GLY C C 39 175.700 175.700 174.696 1.004 19287
5739 1 20 . 1 1 39 39 GLY CA C 39 45.370 45.370 45.473 -0.103 19287
5740 1 20 . 1 1 39 39 GLY H H 39 8.500 8.500 8.518 -0.018 19287
5741 1 20 . 1 1 40 40 GLY N N 40 110.170 110.170 112.461 -2.291 19287
5742 1 20 . 1 1 40 40 GLY C C 40 173.140 173.140 173.013 0.127 19287
5743 1 20 . 1 1 40 40 GLY CA C 40 44.320 44.320 44.556 -0.236 19287
5744 1 20 . 1 1 40 40 GLY H H 40 8.670 8.670 8.340 0.330 19287
5745 1 20 . 1 1 41 41 ASN N N 41 116.960 116.960 117.441 -0.481 19287
5746 1 20 . 1 1 41 41 ASN HA H 41 4.560 4.560 4.921 -0.361 19287
5747 1 20 . 1 1 41 41 ASN C C 41 173.670 173.670 176.020 -2.350 19287
5748 1 20 . 1 1 41 41 ASN CA C 41 51.850 51.850 52.466 -0.616 19287
5749 1 20 . 1 1 41 41 ASN CB C 41 40.230 40.230 41.391 -1.161 19287
5750 1 20 . 1 1 41 41 ASN H H 41 8.790 8.790 8.627 0.163 19287
5751 1 20 . 1 1 42 42 ALA N N 42 113.290 113.290 123.215 -9.925 19287
5752 1 20 . 1 1 42 42 ALA HA H 42 3.720 3.720 4.071 -0.351 19287
5753 1 20 . 1 1 42 42 ALA C C 42 177.220 177.220 177.969 -0.749 19287
5754 1 20 . 1 1 42 42 ALA CA C 42 52.810 52.810 54.592 -1.782 19287
5755 1 20 . 1 1 42 42 ALA CB C 42 17.980 17.980 18.576 -0.596 19287
5756 1 20 . 1 1 42 42 ALA H H 42 7.590 7.590 8.726 -1.136 19287
5757 1 20 . 1 1 43 43 ASN N N 43 117.710 117.710 115.423 2.287 19287
5758 1 20 . 1 1 43 43 ASN HA H 43 4.700 4.700 4.564 0.136 19287
5759 1 20 . 1 1 43 43 ASN C C 43 173.660 173.660 174.253 -0.593 19287
5760 1 20 . 1 1 43 43 ASN CA C 43 50.630 50.630 54.404 -3.774 19287
5761 1 20 . 1 1 43 43 ASN CB C 43 34.840 34.840 37.980 -3.140 19287
5762 1 20 . 1 1 43 43 ASN H H 43 7.900 7.900 8.100 -0.200 19287
5763 1 20 . 1 1 44 44 ARG N N 44 120.690 120.690 119.744 0.946 19287
5764 1 20 . 1 1 44 44 ARG HA H 44 4.692 4.692 4.518 0.174 19287
5765 1 20 . 1 1 44 44 ARG C C 44 173.530 173.530 174.260 -0.730 19287
5766 1 20 . 1 1 44 44 ARG CA C 44 56.660 56.660 55.718 0.942 19287
5767 1 20 . 1 1 44 44 ARG CB C 44 31.450 31.450 30.054 1.396 19287
5768 1 20 . 1 1 44 44 ARG H H 44 6.860 6.860 6.905 -0.045 19287
5769 1 20 . 1 1 45 45 PHE N N 45 123.690 123.690 122.750 0.940 19287
5770 1 20 . 1 1 45 45 PHE HA H 45 4.810 4.810 4.932 -0.122 19287
5771 1 20 . 1 1 45 45 PHE C C 45 175.420 175.420 175.625 -0.205 19287
5772 1 20 . 1 1 45 45 PHE CA C 45 55.670 55.670 56.010 -0.340 19287
5773 1 20 . 1 1 45 45 PHE CB C 45 43.790 43.790 42.054 1.736 19287
5774 1 20 . 1 1 45 45 PHE H H 45 9.340 9.340 8.642 0.698 19287
5775 1 20 . 1 1 46 46 ARG N N 46 120.920 120.920 118.117 2.803 19287
5776 1 20 . 1 1 46 46 ARG HA H 46 4.397 4.397 4.518 -0.121 19287
5777 1 20 . 1 1 46 46 ARG C C 46 176.560 176.560 175.909 0.651 19287
5778 1 20 . 1 1 46 46 ARG CA C 46 58.210 58.210 55.720 2.490 19287
5779 1 20 . 1 1 46 46 ARG CB C 46 30.900 30.900 30.786 0.114 19287
5780 1 20 . 1 1 46 46 ARG H H 46 9.080 9.080 8.662 0.418 19287
5781 1 20 . 1 1 47 47 THR N N 47 102.800 102.800 111.858 -9.058 19287
5782 1 20 . 1 1 47 47 THR HA H 47 4.660 4.660 3.812 0.848 19287
5783 1 20 . 1 1 47 47 THR C C 47 174.110 174.110 173.245 0.865 19287
5784 1 20 . 1 1 47 47 THR CA C 47 58.170 58.170 59.295 -1.125 19287
5785 1 20 . 1 1 47 47 THR CB C 47 72.380 72.380 71.148 1.232 19287
5786 1 20 . 1 1 47 47 THR H H 47 7.230 7.230 7.266 -0.036 19287
5787 1 20 . 1 1 48 48 ILE N N 48 123.200 123.200 123.413 -0.213 19287
5788 1 20 . 1 1 48 48 ILE HA H 48 2.901 2.901 3.746 -0.845 19287
5789 1 20 . 1 1 48 48 ILE C C 48 176.420 176.420 176.153 0.267 19287
5790 1 20 . 1 1 48 48 ILE CA C 48 64.000 64.000 63.590 0.410 19287
5791 1 20 . 1 1 48 48 ILE CB C 48 37.060 37.060 38.333 -1.273 19287
5792 1 20 . 1 1 48 48 ILE H H 48 8.110 8.110 7.882 0.228 19287
5793 1 20 . 1 1 49 49 ASP N N 49 119.560 119.560 121.156 -1.596 19287
5794 1 20 . 1 1 49 49 ASP HA H 49 4.130 4.130 4.235 -0.105 19287
5795 1 20 . 1 1 49 49 ASP C C 49 177.740 177.740 178.007 -0.267 19287
5796 1 20 . 1 1 49 49 ASP CA C 49 56.690 56.690 58.451 -1.761 19287
5797 1 20 . 1 1 49 49 ASP CB C 49 39.970 39.970 40.017 -0.047 19287
5798 1 20 . 1 1 49 49 ASP H H 49 7.700 7.700 7.567 0.133 19287
5799 1 20 . 1 1 50 50 GLU N N 50 117.720 117.720 119.533 -1.813 19287
5800 1 20 . 1 1 50 50 GLU HA H 50 3.710 3.710 4.135 -0.425 19287
5801 1 20 . 1 1 50 50 GLU C C 50 177.550 177.550 178.667 -1.117 19287
5802 1 20 . 1 1 50 50 GLU CA C 50 58.550 58.550 58.849 -0.299 19287
5803 1 20 . 1 1 50 50 GLU CB C 50 29.190 29.190 29.176 0.014 19287
5804 1 20 . 1 1 50 50 GLU H H 50 7.410 7.410 8.458 -1.048 19287
5805 1 20 . 1 1 51 51 CYS N N 51 120.260 120.260 118.562 1.698 19287
5806 1 20 . 1 1 51 51 CYS HA H 51 1.650 1.650 3.601 -1.951 19287
5807 1 20 . 1 1 51 51 CYS C C 51 175.070 175.070 176.521 -1.451 19287
5808 1 20 . 1 1 51 51 CYS CA C 51 59.120 59.120 61.248 -2.128 19287
5809 1 20 . 1 1 51 51 CYS CB C 51 43.000 43.000 25.894 17.106 19287
5810 1 20 . 1 1 51 51 CYS H H 51 6.760 6.760 7.843 -1.083 19287
5811 1 20 . 1 1 52 52 ASN N N 52 120.160 120.160 119.116 1.044 19287
5812 1 20 . 1 1 52 52 ASN HA H 52 4.090 4.090 4.482 -0.392 19287
5813 1 20 . 1 1 52 52 ASN C C 52 177.820 177.820 177.935 -0.115 19287
5814 1 20 . 1 1 52 52 ASN CA C 52 55.060 55.060 55.790 -0.730 19287
5815 1 20 . 1 1 52 52 ASN CB C 52 37.500 37.500 38.090 -0.590 19287
5816 1 20 . 1 1 52 52 ASN H H 52 8.650 8.650 8.523 0.127 19287
5817 1 20 . 1 1 53 53 ARG N N 53 117.000 117.000 119.363 -2.363 19287
5818 1 20 . 1 1 53 53 ARG HA H 53 3.770 3.770 4.177 -0.407 19287
5819 1 20 . 1 1 53 53 ARG C C 53 177.360 177.360 178.314 -0.954 19287
5820 1 20 . 1 1 53 53 ARG CA C 53 58.490 58.490 58.368 0.122 19287
5821 1 20 . 1 1 53 53 ARG CB C 53 30.180 30.180 29.400 0.780 19287
5822 1 20 . 1 1 53 53 ARG H H 53 7.900 7.900 8.174 -0.274 19287
5823 1 20 . 1 1 54 54 THR N N 54 112.080 112.080 112.797 -0.717 19287
5824 1 20 . 1 1 54 54 THR HA H 54 3.838 3.838 4.307 -0.469 19287
5825 1 20 . 1 1 54 54 THR C C 54 174.990 174.990 174.278 0.712 19287
5826 1 20 . 1 1 54 54 THR CA C 54 65.740 65.740 65.338 0.402 19287
5827 1 20 . 1 1 54 54 THR CB C 54 68.870 68.870 69.510 -0.640 19287
5828 1 20 . 1 1 54 54 THR H H 54 7.260 7.260 8.203 -0.943 19287
5829 1 20 . 1 1 55 55 CYS N N 55 112.540 112.540 116.515 -3.975 19287
5830 1 20 . 1 1 55 55 CYS HA H 55 4.400 4.400 4.446 -0.046 19287
5831 1 20 . 1 1 55 55 CYS C C 55 172.940 172.940 173.646 -0.706 19287
5832 1 20 . 1 1 55 55 CYS CA C 55 54.230 54.230 58.525 -4.295 19287
5833 1 20 . 1 1 55 55 CYS CB C 55 42.930 42.930 29.274 13.656 19287
5834 1 20 . 1 1 55 55 CYS H H 55 7.590 7.590 7.616 -0.026 19287
5835 1 20 . 1 1 56 56 VAL N N 56 119.720 119.720 123.320 -3.600 19287
5836 1 20 . 1 1 56 56 VAL HA H 56 3.631 3.631 4.125 -0.494 19287
5837 1 20 . 1 1 56 56 VAL C C 56 176.710 176.710 175.882 0.828 19287
5838 1 20 . 1 1 56 56 VAL CA C 56 64.540 64.540 62.363 2.177 19287
5839 1 20 . 1 1 56 56 VAL CB C 56 30.970 30.970 29.745 1.225 19287
5840 1 20 . 1 1 56 56 VAL H H 56 7.280 7.280 7.964 -0.684 19287
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 47 4.088 1.819 3.701 19287
2 1 1 "Average Difference" HA 54 0.347 0.145 0.319 19287
3 1 1 "Average Difference" C 51 1.021 0.308 0.983 19287
4 1 1 "Average Difference" CA 51 1.447 0.389 1.407 19287
5 1 1 "Average Difference" CB 48 4.956 -1.224 4.853 19287
6 1 1 "Average Difference" HN 47 0.536 0.095 0.533 19287
7 1 2 "Average Difference" N 47 4.038 1.781 3.663 19287
8 1 2 "Average Difference" HA 54 0.457 0.190 0.419 19287
9 1 2 "Average Difference" C 51 1.017 0.318 0.975 19287
10 1 2 "Average Difference" CA 51 1.481 0.388 1.443 19287
11 1 2 "Average Difference" CB 48 4.910 -1.226 4.805 19287
12 1 2 "Average Difference" HN 47 0.568 0.112 0.563 19287
13 1 3 "Average Difference" N 47 4.231 1.832 3.855 19287
14 1 3 "Average Difference" HA 54 0.468 0.201 0.426 19287
15 1 3 "Average Difference" C 51 0.950 0.271 0.920 19287
16 1 3 "Average Difference" CA 51 1.386 0.262 1.375 19287
17 1 3 "Average Difference" CB 48 4.936 -1.385 4.788 19287
18 1 3 "Average Difference" HN 47 0.623 0.051 0.628 19287
19 1 4 "Average Difference" N 47 4.073 1.764 3.711 19287
20 1 4 "Average Difference" HA 54 0.405 0.124 0.389 19287
21 1 4 "Average Difference" C 51 1.103 0.253 1.084 19287
22 1 4 "Average Difference" CA 51 1.406 0.286 1.390 19287
23 1 4 "Average Difference" CB 48 4.931 -1.258 4.819 19287
24 1 4 "Average Difference" HN 47 0.561 0.072 0.563 19287
25 1 5 "Average Difference" N 47 3.969 1.802 3.575 19287
26 1 5 "Average Difference" HA 54 0.459 0.203 0.415 19287
27 1 5 "Average Difference" C 51 1.177 0.256 1.160 19287
28 1 5 "Average Difference" CA 51 1.473 0.230 1.470 19287
29 1 5 "Average Difference" CB 48 4.875 -1.304 4.747 19287
30 1 5 "Average Difference" HN 47 0.607 0.072 0.609 19287
31 1 6 "Average Difference" N 47 4.045 1.575 3.767 19287
32 1 6 "Average Difference" HA 54 0.374 0.158 0.342 19287
33 1 6 "Average Difference" C 51 1.193 0.309 1.164 19287
34 1 6 "Average Difference" CA 51 1.455 0.318 1.434 19287
35 1 6 "Average Difference" CB 48 4.960 -1.317 4.833 19287
36 1 6 "Average Difference" HN 47 0.599 0.052 0.604 19287
37 1 7 "Average Difference" N 47 4.380 1.782 4.044 19287
38 1 7 "Average Difference" HA 54 0.461 0.193 0.422 19287
39 1 7 "Average Difference" C 51 0.925 0.264 0.896 19287
40 1 7 "Average Difference" CA 51 1.416 0.227 1.412 19287
41 1 7 "Average Difference" CB 48 4.916 -1.164 4.827 19287
42 1 7 "Average Difference" HN 47 0.595 0.070 0.597 19287
43 1 8 "Average Difference" N 47 3.916 1.903 3.460 19287
44 1 8 "Average Difference" HA 54 0.446 0.178 0.413 19287
45 1 8 "Average Difference" C 51 1.067 0.311 1.031 19287
46 1 8 "Average Difference" CA 51 1.464 0.391 1.425 19287
47 1 8 "Average Difference" CB 48 4.842 -1.242 4.730 19287
48 1 8 "Average Difference" HN 47 0.602 0.119 0.597 19287
49 1 9 "Average Difference" N 47 4.196 2.027 3.714 19287
50 1 9 "Average Difference" HA 54 0.396 0.172 0.361 19287
51 1 9 "Average Difference" C 51 1.115 0.291 1.087 19287
52 1 9 "Average Difference" CA 51 1.501 0.377 1.468 19287
53 1 9 "Average Difference" CB 48 4.999 -1.400 4.850 19287
54 1 9 "Average Difference" HN 47 0.569 0.078 0.570 19287
55 1 10 "Average Difference" N 47 4.215 2.061 3.716 19287
56 1 10 "Average Difference" HA 54 0.376 0.174 0.337 19287
57 1 10 "Average Difference" C 51 1.062 0.406 0.991 19287
58 1 10 "Average Difference" CA 51 1.499 0.403 1.458 19287
59 1 10 "Average Difference" CB 48 5.069 -1.368 4.933 19287
60 1 10 "Average Difference" HN 47 0.496 0.102 0.491 19287
61 1 11 "Average Difference" N 47 3.870 1.626 3.550 19287
62 1 11 "Average Difference" HA 54 0.458 0.202 0.415 19287
63 1 11 "Average Difference" C 51 0.980 0.259 0.954 19287
64 1 11 "Average Difference" CA 51 1.382 0.206 1.380 19287
65 1 11 "Average Difference" CB 48 4.919 -1.308 4.792 19287
66 1 11 "Average Difference" HN 47 0.600 0.040 0.606 19287
67 1 12 "Average Difference" N 47 4.379 2.051 3.911 19287
68 1 12 "Average Difference" HA 54 0.367 0.155 0.336 19287
69 1 12 "Average Difference" C 51 1.087 0.308 1.053 19287
70 1 12 "Average Difference" CA 51 1.438 0.255 1.430 19287
71 1 12 "Average Difference" CB 48 4.950 -1.268 4.836 19287
72 1 12 "Average Difference" HN 47 0.541 0.025 0.546 19287
73 1 13 "Average Difference" N 47 3.912 1.470 3.664 19287
74 1 13 "Average Difference" HA 54 0.420 0.190 0.378 19287
75 1 13 "Average Difference" C 51 1.168 0.290 1.143 19287
76 1 13 "Average Difference" CA 51 1.392 0.233 1.386 19287
77 1 13 "Average Difference" CB 48 4.928 -1.295 4.805 19287
78 1 13 "Average Difference" HN 47 0.605 0.057 0.609 19287
79 1 14 "Average Difference" N 47 4.173 1.997 3.703 19287
80 1 14 "Average Difference" HA 54 0.383 0.191 0.335 19287
81 1 14 "Average Difference" C 51 1.054 0.288 1.023 19287
82 1 14 "Average Difference" CA 51 1.341 0.271 1.326 19287
83 1 14 "Average Difference" CB 48 5.056 -1.336 4.928 19287
84 1 14 "Average Difference" HN 47 0.597 0.066 0.600 19287
85 1 15 "Average Difference" N 47 4.226 1.811 3.860 19287
86 1 15 "Average Difference" HA 54 0.442 0.132 0.426 19287
87 1 15 "Average Difference" C 51 0.923 0.361 0.858 19287
88 1 15 "Average Difference" CA 51 1.509 0.453 1.454 19287
89 1 15 "Average Difference" CB 48 5.019 -1.320 4.894 19287
90 1 15 "Average Difference" HN 47 0.584 0.093 0.583 19287
91 1 16 "Average Difference" N 47 4.130 1.721 3.794 19287
92 1 16 "Average Difference" HA 54 0.437 0.199 0.393 19287
93 1 16 "Average Difference" C 51 1.019 0.267 0.994 19287
94 1 16 "Average Difference" CA 51 1.367 0.330 1.340 19287
95 1 16 "Average Difference" CB 48 4.953 -1.359 4.813 19287
96 1 16 "Average Difference" HN 47 0.614 0.067 0.617 19287
97 1 17 "Average Difference" N 47 4.424 1.888 4.044 19287
98 1 17 "Average Difference" HA 54 0.367 0.152 0.337 19287
99 1 17 "Average Difference" C 51 1.034 0.274 1.007 19287
100 1 17 "Average Difference" CA 51 1.427 0.243 1.420 19287
101 1 17 "Average Difference" CB 48 4.994 -1.382 4.849 19287
102 1 17 "Average Difference" HN 47 0.584 0.035 0.589 19287
103 1 18 "Average Difference" N 47 3.691 1.750 3.285 19287
104 1 18 "Average Difference" HA 54 0.393 0.187 0.349 19287
105 1 18 "Average Difference" C 51 0.976 0.356 0.918 19287
106 1 18 "Average Difference" CA 51 1.496 0.356 1.467 19287
107 1 18 "Average Difference" CB 48 4.923 -1.316 4.794 19287
108 1 18 "Average Difference" HN 47 0.583 0.065 0.585 19287
109 1 19 "Average Difference" N 47 4.452 1.644 4.182 19287
110 1 19 "Average Difference" HA 54 0.378 0.142 0.354 19287
111 1 19 "Average Difference" C 51 1.035 0.294 1.002 19287
112 1 19 "Average Difference" CA 51 1.396 0.268 1.384 19287
113 1 19 "Average Difference" CB 48 4.854 -1.270 4.734 19287
114 1 19 "Average Difference" HN 47 0.571 0.077 0.571 19287
115 1 20 "Average Difference" N 47 4.059 1.735 3.709 19287
116 1 20 "Average Difference" HA 54 0.430 0.157 0.404 19287
117 1 20 "Average Difference" C 51 0.993 0.367 0.932 19287
118 1 20 "Average Difference" CA 51 1.480 0.359 1.450 19287
119 1 20 "Average Difference" CB 48 4.923 -1.305 4.797 19287
120 1 20 "Average Difference" HN 47 0.590 0.103 0.587 19287
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 19287
_Entity_delta_chem_shifts.ID 2
_Entity_delta_chem_shifts.Details
;
This saveframe contains the averaged SPARTA chemical shift over all the models used.
;
loop_
_Delta_CS.Atom_chem_shift_ID
_Delta_CS.Entity_delta_chem_shifts_ID
_Delta_CS.Assembly_atom_ID
_Delta_CS.Entity_assembly_ID
_Delta_CS.Entity_ID
_Delta_CS.Comp_index_ID
_Delta_CS.Seq_ID
_Delta_CS.Comp_ID
_Delta_CS.Atom_ID
_Delta_CS.Atom_type
_Delta_CS.Auth_seq_ID
_Delta_CS.Original_CS_value
_Delta_CS.Corrected_CS_value
_Delta_CS.Sparta_CS_value
_Delta_CS.Delta_CS_value
_Delta_CS.Entry_ID
1 1 . 1 1 2 2 PRO HA H 2 4.017 4.017 4.431 -0.414 19287
2 1 . 1 1 2 2 PRO C C 2 177.920 177.920 177.609 0.311 19287
3 1 . 1 1 2 2 PRO CA C 2 62.800 62.800 62.276 0.524 19287
4 1 . 1 1 2 2 PRO CB C 2 32.050 32.050 32.664 -0.615 19287
5 1 . 1 1 3 3 ARG N N 3 122.340 122.340 122.068 0.272 19287
6 1 . 1 1 3 3 ARG HA H 3 3.786 3.786 4.125 -0.339 19287
7 1 . 1 1 3 3 ARG C C 3 178.950 178.950 177.472 1.478 19287
8 1 . 1 1 3 3 ARG CA C 3 58.410 58.410 58.030 0.380 19287
9 1 . 1 1 3 3 ARG CB C 3 29.220 29.220 29.219 0.000 19287
10 1 . 1 1 3 3 ARG H H 3 8.550 8.550 8.778 -0.228 19287
11 1 . 1 1 4 4 PHE N N 4 113.010 113.010 116.771 -3.761 19287
12 1 . 1 1 4 4 PHE HA H 4 4.300 4.300 4.538 -0.238 19287
13 1 . 1 1 4 4 PHE C C 4 176.070 176.070 176.294 -0.224 19287
14 1 . 1 1 4 4 PHE CA C 4 58.220 58.220 58.228 -0.008 19287
15 1 . 1 1 4 4 PHE CB C 4 37.310 37.310 37.972 -0.662 19287
16 1 . 1 1 4 4 PHE H H 4 7.150 7.150 7.724 -0.574 19287
17 1 . 1 1 5 5 CYS N N 5 118.600 118.600 117.083 1.517 19287
18 1 . 1 1 5 5 CYS HA H 5 4.130 4.130 4.248 -0.118 19287
19 1 . 1 1 5 5 CYS C C 5 173.450 173.450 174.887 -1.437 19287
20 1 . 1 1 5 5 CYS CA C 5 57.960 57.960 59.770 -1.810 19287
21 1 . 1 1 5 5 CYS CB C 5 39.210 39.210 25.862 13.349 19287
22 1 . 1 1 5 5 CYS H H 5 7.090 7.090 7.261 -0.171 19287
23 1 . 1 1 6 6 GLU N N 6 110.710 110.710 118.407 -7.697 19287
24 1 . 1 1 6 6 GLU HA H 6 4.182 4.182 4.403 -0.221 19287
25 1 . 1 1 6 6 GLU C C 6 176.310 176.310 176.286 0.024 19287
26 1 . 1 1 6 6 GLU CA C 6 55.510 55.510 55.378 0.132 19287
27 1 . 1 1 6 6 GLU CB C 6 28.160 28.160 29.203 -1.043 19287
28 1 . 1 1 6 6 GLU H H 6 7.300 7.300 7.680 -0.380 19287
29 1 . 1 1 7 7 LEU N N 7 119.090 119.090 120.997 -1.907 19287
30 1 . 1 1 7 7 LEU HA H 7 4.160 4.160 4.331 -0.171 19287
31 1 . 1 1 7 7 LEU C C 7 176.630 176.630 176.018 0.612 19287
32 1 . 1 1 7 7 LEU CA C 7 54.510 54.510 54.239 0.271 19287
33 1 . 1 1 7 7 LEU CB C 7 42.330 42.330 42.697 -0.367 19287
34 1 . 1 1 7 7 LEU H H 7 7.210 7.210 7.218 -0.008 19287
35 1 . 1 1 8 8 ALA N N 8 124.490 124.490 121.868 2.622 19287
36 1 . 1 1 8 8 ALA HA H 8 4.250 4.250 4.721 -0.471 19287
37 1 . 1 1 8 8 ALA C C 8 174.710 174.710 175.512 -0.802 19287
38 1 . 1 1 8 8 ALA CA C 8 50.210 50.210 48.727 1.483 19287
39 1 . 1 1 8 8 ALA CB C 8 16.930 16.930 19.460 -2.530 19287
40 1 . 1 1 8 8 ALA H H 8 8.280 8.280 8.267 0.013 19287
41 1 . 1 1 9 9 PRO HA H 9 4.180 4.180 4.639 -0.459 19287
42 1 . 1 1 9 9 PRO C C 9 176.700 176.700 176.569 0.131 19287
43 1 . 1 1 9 9 PRO CA C 9 61.490 61.490 62.815 -1.325 19287
44 1 . 1 1 9 9 PRO CB C 9 30.360 30.360 31.773 -1.413 19287
45 1 . 1 1 10 10 SER N N 10 112.100 112.100 121.337 -9.237 19287
46 1 . 1 1 10 10 SER HA H 10 4.630 4.630 4.394 0.236 19287
47 1 . 1 1 10 10 SER C C 10 174.190 174.190 175.043 -0.853 19287
48 1 . 1 1 10 10 SER CA C 10 55.360 55.360 56.983 -1.623 19287
49 1 . 1 1 10 10 SER CB C 10 64.550 64.550 62.245 2.305 19287
50 1 . 1 1 10 10 SER H H 10 7.450 7.450 8.527 -1.077 19287
51 1 . 1 1 11 11 ALA N N 11 129.980 129.980 126.232 3.748 19287
52 1 . 1 1 11 11 ALA HA H 11 4.496 4.496 4.067 0.429 19287
53 1 . 1 1 11 11 ALA C C 11 178.510 178.510 178.398 0.112 19287
54 1 . 1 1 11 11 ALA CA C 11 54.810 54.810 53.741 1.069 19287
55 1 . 1 1 11 11 ALA CB C 11 19.910 19.910 18.866 1.044 19287
56 1 . 1 1 11 11 ALA H H 11 9.210 9.210 8.140 1.070 19287
57 1 . 1 1 12 12 GLY N N 12 104.410 104.410 104.652 -0.242 19287
58 1 . 1 1 12 12 GLY C C 12 174.850 174.850 175.654 -0.804 19287
59 1 . 1 1 12 12 GLY CA C 12 44.450 44.450 45.207 -0.757 19287
60 1 . 1 1 12 12 GLY H H 12 8.190 8.190 8.310 -0.120 19287
61 1 . 1 1 14 14 CYS HA H 14 4.250 4.250 4.636 -0.386 19287
62 1 . 1 1 14 14 CYS C C 14 172.410 172.410 173.496 -1.086 19287
63 1 . 1 1 14 14 CYS CA C 14 59.750 59.750 58.142 1.608 19287
64 1 . 1 1 14 14 CYS CB C 14 39.130 39.130 30.352 8.778 19287
65 1 . 1 1 15 15 PHE N N 15 116.000 116.000 124.227 -8.227 19287
66 1 . 1 1 15 15 PHE HA H 15 4.380 4.380 4.616 -0.236 19287
67 1 . 1 1 15 15 PHE C C 15 174.300 174.300 174.476 -0.176 19287
68 1 . 1 1 15 15 PHE CA C 15 56.830 56.830 57.824 -0.994 19287
69 1 . 1 1 15 15 PHE CB C 15 39.440 39.440 39.178 0.262 19287
70 1 . 1 1 15 15 PHE H H 15 7.960 7.960 8.681 -0.721 19287
71 1 . 1 1 16 16 ALA N N 16 125.630 125.630 130.486 -4.856 19287
72 1 . 1 1 16 16 ALA HA H 16 4.320 4.320 4.500 -0.180 19287
73 1 . 1 1 16 16 ALA C C 16 174.300 174.300 175.192 -0.892 19287
74 1 . 1 1 16 16 ALA CA C 16 50.130 50.130 51.641 -1.511 19287
75 1 . 1 1 16 16 ALA CB C 16 19.180 19.180 21.703 -2.523 19287
76 1 . 1 1 16 16 ALA H H 16 7.800 7.800 7.938 -0.138 19287
77 1 . 1 1 17 17 PHE N N 17 116.330 116.330 122.506 -6.176 19287
78 1 . 1 1 17 17 PHE HA H 17 4.390 4.390 4.817 -0.427 19287
79 1 . 1 1 17 17 PHE C C 17 175.310 175.310 174.000 1.310 19287
80 1 . 1 1 17 17 PHE CA C 17 57.160 57.160 55.704 1.456 19287
81 1 . 1 1 17 17 PHE CB C 17 39.380 39.380 40.750 -1.370 19287
82 1 . 1 1 17 17 PHE H H 17 7.330 7.330 8.376 -1.046 19287
83 1 . 1 1 18 18 VAL N N 18 122.890 122.890 124.729 -1.839 19287
84 1 . 1 1 18 18 VAL HA H 18 4.475 4.475 4.538 -0.063 19287
85 1 . 1 1 18 18 VAL C C 18 173.590 173.590 173.400 0.190 19287
86 1 . 1 1 18 18 VAL CA C 18 58.900 58.900 58.449 0.451 19287
87 1 . 1 1 18 18 VAL CB C 18 33.900 33.900 33.873 0.028 19287
88 1 . 1 1 18 18 VAL H H 18 8.680 8.680 8.525 0.155 19287
89 1 . 1 1 19 19 PRO HA H 19 4.275 4.275 4.601 -0.326 19287
90 1 . 1 1 19 19 PRO C C 19 176.940 176.940 176.419 0.521 19287
91 1 . 1 1 19 19 PRO CA C 19 64.060 64.060 62.567 1.493 19287
92 1 . 1 1 19 19 PRO CB C 19 31.710 31.710 31.505 0.205 19287
93 1 . 1 1 20 20 SER N N 20 120.230 120.230 118.523 1.707 19287
94 1 . 1 1 20 20 SER HA H 20 4.780 4.780 4.707 0.073 19287
95 1 . 1 1 20 20 SER C C 20 170.900 170.900 172.998 -2.098 19287
96 1 . 1 1 20 20 SER CA C 20 57.450 57.450 56.764 0.687 19287
97 1 . 1 1 20 20 SER CB C 20 67.910 67.910 66.250 1.660 19287
98 1 . 1 1 20 20 SER H H 20 8.390 8.390 7.972 0.418 19287
99 1 . 1 1 21 21 TYR N N 21 118.220 118.220 119.096 -0.876 19287
100 1 . 1 1 21 21 TYR HA H 21 5.600 5.600 5.075 0.525 19287
101 1 . 1 1 21 21 TYR C C 21 173.770 173.770 175.060 -1.290 19287
102 1 . 1 1 21 21 TYR CA C 21 57.740 57.740 58.126 -0.386 19287
103 1 . 1 1 21 21 TYR CB C 21 42.660 42.660 41.888 0.772 19287
104 1 . 1 1 21 21 TYR H H 21 9.020 9.020 8.640 0.380 19287
105 1 . 1 1 22 22 TYR N N 22 119.260 119.260 124.984 -5.723 19287
106 1 . 1 1 22 22 TYR HA H 22 5.110 5.110 4.766 0.344 19287
107 1 . 1 1 22 22 TYR C C 22 172.610 172.610 173.965 -1.355 19287
108 1 . 1 1 22 22 TYR CA C 22 55.380 55.380 56.146 -0.766 19287
109 1 . 1 1 22 22 TYR CB C 22 41.550 41.550 42.404 -0.854 19287
110 1 . 1 1 22 22 TYR H H 22 9.410 9.410 9.597 -0.187 19287
111 1 . 1 1 23 23 TYR N N 23 123.200 123.200 127.353 -4.153 19287
112 1 . 1 1 23 23 TYR HA H 23 4.382 4.382 4.919 -0.537 19287
113 1 . 1 1 23 23 TYR C C 23 173.250 173.250 174.236 -0.986 19287
114 1 . 1 1 23 23 TYR CA C 23 58.360 58.360 57.224 1.136 19287
115 1 . 1 1 23 23 TYR CB C 23 39.570 39.570 40.406 -0.836 19287
116 1 . 1 1 23 23 TYR H H 23 10.190 10.190 8.580 1.610 19287
117 1 . 1 1 24 24 ASN N N 24 126.280 126.280 127.312 -1.032 19287
118 1 . 1 1 24 24 ASN HA H 24 4.550 4.550 4.920 -0.370 19287
119 1 . 1 1 24 24 ASN C C 24 174.000 174.000 175.344 -1.344 19287
120 1 . 1 1 24 24 ASN CA C 24 51.360 51.360 51.757 -0.397 19287
121 1 . 1 1 24 24 ASN CB C 24 40.040 40.040 38.896 1.145 19287
122 1 . 1 1 24 24 ASN H H 24 7.890 7.890 8.630 -0.740 19287
123 1 . 1 1 25 25 GLN N N 25 122.760 122.760 123.149 -0.389 19287
124 1 . 1 1 25 25 GLN HA H 25 3.691 3.691 3.686 0.005 19287
125 1 . 1 1 25 25 GLN C C 25 175.670 175.670 176.872 -1.202 19287
126 1 . 1 1 25 25 GLN CA C 25 57.480 57.480 58.295 -0.815 19287
127 1 . 1 1 25 25 GLN CB C 25 28.120 28.120 27.665 0.455 19287
128 1 . 1 1 25 25 GLN H H 25 8.440 8.440 8.126 0.314 19287
129 1 . 1 1 26 26 TYR N N 26 119.190 119.190 119.460 -0.270 19287
130 1 . 1 1 26 26 TYR HA H 26 4.160 4.160 4.280 -0.120 19287
131 1 . 1 1 26 26 TYR C C 26 176.520 176.520 176.908 -0.388 19287
132 1 . 1 1 26 26 TYR CA C 26 60.170 60.170 59.870 0.300 19287
133 1 . 1 1 26 26 TYR CB C 26 36.880 36.880 37.813 -0.933 19287
134 1 . 1 1 26 26 TYR H H 26 7.810 7.810 7.713 0.097 19287
135 1 . 1 1 27 27 SER N N 27 109.600 109.600 111.999 -2.399 19287
136 1 . 1 1 27 27 SER HA H 27 4.330 4.330 4.554 -0.224 19287
137 1 . 1 1 27 27 SER C C 27 174.830 174.830 173.950 0.880 19287
138 1 . 1 1 27 27 SER CA C 27 57.490 57.490 57.454 0.036 19287
139 1 . 1 1 27 27 SER CB C 27 64.640 64.640 64.003 0.637 19287
140 1 . 1 1 27 27 SER H H 27 7.350 7.350 7.637 -0.287 19287
141 1 . 1 1 28 28 ASN N N 28 119.830 119.830 119.071 0.759 19287
142 1 . 1 1 28 28 ASN HA H 28 4.060 4.060 4.364 -0.304 19287
143 1 . 1 1 28 28 ASN C C 28 173.040 173.040 174.262 -1.222 19287
144 1 . 1 1 28 28 ASN CA C 28 53.830 53.830 54.639 -0.809 19287
145 1 . 1 1 28 28 ASN CB C 28 37.400 37.400 38.076 -0.676 19287
146 1 . 1 1 28 28 ASN H H 28 7.930 7.930 7.940 -0.010 19287
147 1 . 1 1 29 29 THR N N 29 103.070 103.070 111.281 -8.211 19287
148 1 . 1 1 29 29 THR HA H 29 4.441 4.441 4.698 -0.257 19287
149 1 . 1 1 29 29 THR C C 29 172.980 172.980 172.040 0.941 19287
150 1 . 1 1 29 29 THR CA C 29 58.920 58.920 61.439 -2.519 19287
151 1 . 1 1 29 29 THR CB C 29 73.260 73.260 71.174 2.086 19287
152 1 . 1 1 29 29 THR H H 29 6.990 6.990 7.667 -0.677 19287
153 1 . 1 1 30 30 CYS N N 30 118.340 118.340 119.472 -1.132 19287
154 1 . 1 1 30 30 CYS HA H 30 5.462 5.462 5.485 -0.023 19287
155 1 . 1 1 30 30 CYS C C 30 173.320 173.320 173.500 -0.180 19287
156 1 . 1 1 30 30 CYS CA C 30 57.750 57.750 57.514 0.236 19287
157 1 . 1 1 30 30 CYS CB C 30 50.680 50.680 31.521 19.159 19287
158 1 . 1 1 30 30 CYS H H 30 8.954 8.954 8.653 0.301 19287
159 1 . 1 1 31 31 HIS N N 31 118.930 118.930 120.690 -1.760 19287
160 1 . 1 1 31 31 HIS HA H 31 4.780 4.780 5.073 -0.293 19287
161 1 . 1 1 31 31 HIS C C 31 172.790 172.790 173.710 -0.920 19287
162 1 . 1 1 31 31 HIS CA C 31 53.530 53.530 55.478 -1.948 19287
163 1 . 1 1 31 31 HIS CB C 31 33.040 33.040 33.244 -0.204 19287
164 1 . 1 1 31 31 HIS H H 31 9.010 9.010 9.542 -0.532 19287
165 1 . 1 1 32 32 SER N N 32 117.600 117.600 120.219 -2.619 19287
166 1 . 1 1 32 32 SER HA H 32 4.700 4.700 4.283 0.417 19287
167 1 . 1 1 32 32 SER C C 32 174.930 174.930 173.750 1.180 19287
168 1 . 1 1 32 32 SER CA C 32 57.980 57.980 58.937 -0.957 19287
169 1 . 1 1 32 32 SER CB C 32 64.440 64.440 63.297 1.143 19287
170 1 . 1 1 32 32 SER H H 32 8.740 8.740 8.182 0.558 19287
171 1 . 1 1 33 33 PHE N N 33 120.690 120.690 120.212 0.478 19287
172 1 . 1 1 33 33 PHE HA H 33 4.790 4.790 5.012 -0.222 19287
173 1 . 1 1 33 33 PHE C C 33 171.810 171.810 173.578 -1.768 19287
174 1 . 1 1 33 33 PHE CA C 33 56.200 56.200 55.910 0.290 19287
175 1 . 1 1 33 33 PHE CB C 33 40.230 40.230 41.325 -1.095 19287
176 1 . 1 1 33 33 PHE H H 33 8.830 8.830 8.950 -0.120 19287
177 1 . 1 1 34 34 THR N N 34 116.650 116.650 112.012 4.638 19287
178 1 . 1 1 34 34 THR HA H 34 3.965 3.965 4.297 -0.332 19287
179 1 . 1 1 34 34 THR C C 34 172.600 172.600 172.521 0.079 19287
180 1 . 1 1 34 34 THR CA C 34 61.980 61.980 60.848 1.133 19287
181 1 . 1 1 34 34 THR CB C 34 68.530 68.530 69.565 -1.035 19287
182 1 . 1 1 34 34 THR H H 34 8.400 8.400 8.205 0.195 19287
183 1 . 1 1 35 35 TYR N N 35 127.790 127.790 125.840 1.950 19287
184 1 . 1 1 35 35 TYR HA H 35 4.500 4.500 4.693 -0.193 19287
185 1 . 1 1 35 35 TYR C C 35 174.200 174.200 173.980 0.220 19287
186 1 . 1 1 35 35 TYR CA C 35 55.130 55.130 56.653 -1.523 19287
187 1 . 1 1 35 35 TYR CB C 35 39.650 39.650 42.065 -2.415 19287
188 1 . 1 1 35 35 TYR H H 35 8.010 8.010 8.202 -0.192 19287
189 1 . 1 1 39 39 GLY N N 39 103.730 103.730 109.556 -5.826 19287
190 1 . 1 1 39 39 GLY C C 39 175.700 175.700 173.874 1.826 19287
191 1 . 1 1 39 39 GLY CA C 39 45.370 45.370 44.808 0.562 19287
192 1 . 1 1 39 39 GLY H H 39 8.500 8.500 8.083 0.417 19287
193 1 . 1 1 40 40 GLY N N 40 110.170 110.170 109.465 0.705 19287
194 1 . 1 1 40 40 GLY C C 40 173.140 173.140 173.233 -0.093 19287
195 1 . 1 1 40 40 GLY CA C 40 44.320 44.320 44.806 -0.486 19287
196 1 . 1 1 40 40 GLY H H 40 8.670 8.670 8.005 0.665 19287
197 1 . 1 1 41 41 ASN N N 41 116.960 116.960 118.071 -1.111 19287
198 1 . 1 1 41 41 ASN HA H 41 4.560 4.560 4.925 -0.365 19287
199 1 . 1 1 41 41 ASN C C 41 173.670 173.670 175.754 -2.084 19287
200 1 . 1 1 41 41 ASN CA C 41 51.850 51.850 52.188 -0.338 19287
201 1 . 1 1 41 41 ASN CB C 41 40.230 40.230 40.792 -0.562 19287
202 1 . 1 1 41 41 ASN H H 41 8.790 8.790 8.576 0.214 19287
203 1 . 1 1 42 42 ALA N N 42 113.290 113.290 122.544 -9.254 19287
204 1 . 1 1 42 42 ALA HA H 42 3.720 3.720 4.105 -0.385 19287
205 1 . 1 1 42 42 ALA C C 42 177.220 177.220 178.130 -0.910 19287
206 1 . 1 1 42 42 ALA CA C 42 52.810 52.810 54.592 -1.782 19287
207 1 . 1 1 42 42 ALA CB C 42 17.980 17.980 18.609 -0.629 19287
208 1 . 1 1 42 42 ALA H H 42 7.590 7.590 8.683 -1.092 19287
209 1 . 1 1 43 43 ASN N N 43 117.710 117.710 115.070 2.640 19287
210 1 . 1 1 43 43 ASN HA H 43 4.700 4.700 4.576 0.124 19287
211 1 . 1 1 43 43 ASN C C 43 173.660 173.660 174.923 -1.262 19287
212 1 . 1 1 43 43 ASN CA C 43 50.630 50.630 54.050 -3.420 19287
213 1 . 1 1 43 43 ASN CB C 43 34.840 34.840 38.045 -3.205 19287
214 1 . 1 1 43 43 ASN H H 43 7.900 7.900 8.105 -0.205 19287
215 1 . 1 1 44 44 ARG N N 44 120.690 120.690 120.436 0.254 19287
216 1 . 1 1 44 44 ARG HA H 44 4.692 4.692 4.348 0.344 19287
217 1 . 1 1 44 44 ARG C C 44 173.530 173.530 174.731 -1.201 19287
218 1 . 1 1 44 44 ARG CA C 44 56.660 56.660 56.524 0.136 19287
219 1 . 1 1 44 44 ARG CB C 44 31.450 31.450 29.859 1.591 19287
220 1 . 1 1 44 44 ARG H H 44 6.860 6.860 7.181 -0.321 19287
221 1 . 1 1 45 45 PHE N N 45 123.690 123.690 123.033 0.657 19287
222 1 . 1 1 45 45 PHE HA H 45 4.810 4.810 4.906 -0.096 19287
223 1 . 1 1 45 45 PHE C C 45 175.420 175.420 175.327 0.093 19287
224 1 . 1 1 45 45 PHE CA C 45 55.670 55.670 56.518 -0.848 19287
225 1 . 1 1 45 45 PHE CB C 45 43.790 43.790 42.729 1.061 19287
226 1 . 1 1 45 45 PHE H H 45 9.340 9.340 8.467 0.873 19287
227 1 . 1 1 46 46 ARG N N 46 120.920 120.920 118.140 2.780 19287
228 1 . 1 1 46 46 ARG HA H 46 4.397 4.397 4.584 -0.187 19287
229 1 . 1 1 46 46 ARG C C 46 176.560 176.560 175.792 0.768 19287
230 1 . 1 1 46 46 ARG CA C 46 58.210 58.210 55.888 2.322 19287
231 1 . 1 1 46 46 ARG CB C 46 30.900 30.900 30.711 0.189 19287
232 1 . 1 1 46 46 ARG H H 46 9.080 9.080 8.747 0.333 19287
233 1 . 1 1 47 47 THR N N 47 102.800 102.800 112.126 -9.326 19287
234 1 . 1 1 47 47 THR HA H 47 4.660 4.660 4.054 0.606 19287
235 1 . 1 1 47 47 THR C C 47 174.110 174.110 173.276 0.834 19287
236 1 . 1 1 47 47 THR CA C 47 58.170 58.170 59.961 -1.791 19287
237 1 . 1 1 47 47 THR CB C 47 72.380 72.380 70.742 1.638 19287
238 1 . 1 1 47 47 THR H H 47 7.230 7.230 7.389 -0.159 19287
239 1 . 1 1 48 48 ILE N N 48 123.200 123.200 124.402 -1.202 19287
240 1 . 1 1 48 48 ILE HA H 48 2.901 2.901 3.633 -0.732 19287
241 1 . 1 1 48 48 ILE C C 48 176.420 176.420 175.883 0.537 19287
242 1 . 1 1 48 48 ILE CA C 48 64.000 64.000 63.236 0.764 19287
243 1 . 1 1 48 48 ILE CB C 48 37.060 37.060 38.130 -1.070 19287
244 1 . 1 1 48 48 ILE H H 48 8.110 8.110 7.961 0.149 19287
245 1 . 1 1 49 49 ASP N N 49 119.560 119.560 119.710 -0.150 19287
246 1 . 1 1 49 49 ASP HA H 49 4.130 4.130 4.271 -0.141 19287
247 1 . 1 1 49 49 ASP C C 49 177.740 177.740 178.317 -0.577 19287
248 1 . 1 1 49 49 ASP CA C 49 56.690 56.690 57.739 -1.049 19287
249 1 . 1 1 49 49 ASP CB C 49 39.970 39.970 40.298 -0.328 19287
250 1 . 1 1 49 49 ASP H H 49 7.700 7.700 7.720 -0.020 19287
251 1 . 1 1 50 50 GLU N N 50 117.720 117.720 119.530 -1.810 19287
252 1 . 1 1 50 50 GLU HA H 50 3.710 3.710 4.217 -0.507 19287
253 1 . 1 1 50 50 GLU C C 50 177.550 177.550 178.423 -0.873 19287
254 1 . 1 1 50 50 GLU CA C 50 58.550 58.550 58.637 -0.087 19287
255 1 . 1 1 50 50 GLU CB C 50 29.190 29.190 29.714 -0.524 19287
256 1 . 1 1 50 50 GLU H H 50 7.410 7.410 7.696 -0.286 19287
257 1 . 1 1 51 51 CYS N N 51 120.260 120.260 118.963 1.297 19287
258 1 . 1 1 51 51 CYS HA H 51 1.650 1.650 3.250 -1.600 19287
259 1 . 1 1 51 51 CYS C C 51 175.070 175.070 176.351 -1.281 19287
260 1 . 1 1 51 51 CYS CA C 51 59.120 59.120 61.171 -2.051 19287
261 1 . 1 1 51 51 CYS CB C 51 43.000 43.000 26.040 16.960 19287
262 1 . 1 1 51 51 CYS H H 51 6.760 6.760 7.777 -1.017 19287
263 1 . 1 1 52 52 ASN N N 52 120.160 120.160 119.816 0.344 19287
264 1 . 1 1 52 52 ASN HA H 52 4.090 4.090 4.417 -0.327 19287
265 1 . 1 1 52 52 ASN C C 52 177.820 177.820 177.637 0.183 19287
266 1 . 1 1 52 52 ASN CA C 52 55.060 55.060 56.006 -0.946 19287
267 1 . 1 1 52 52 ASN CB C 52 37.500 37.500 38.074 -0.574 19287
268 1 . 1 1 52 52 ASN H H 52 8.650 8.650 8.555 0.095 19287
269 1 . 1 1 53 53 ARG N N 53 117.000 117.000 118.408 -1.408 19287
270 1 . 1 1 53 53 ARG HA H 53 3.770 3.770 4.057 -0.287 19287
271 1 . 1 1 53 53 ARG C C 53 177.360 177.360 177.751 -0.391 19287
272 1 . 1 1 53 53 ARG CA C 53 58.490 58.490 58.692 -0.202 19287
273 1 . 1 1 53 53 ARG CB C 53 30.180 30.180 29.397 0.783 19287
274 1 . 1 1 53 53 ARG H H 53 7.900 7.900 7.679 0.221 19287
275 1 . 1 1 54 54 THR N N 54 112.080 112.080 112.140 -0.060 19287
276 1 . 1 1 54 54 THR HA H 54 3.838 3.838 4.431 -0.593 19287
277 1 . 1 1 54 54 THR C C 54 174.990 174.990 174.462 0.528 19287
278 1 . 1 1 54 54 THR CA C 54 65.740 65.740 64.078 1.662 19287
279 1 . 1 1 54 54 THR CB C 54 68.870 68.870 70.106 -1.236 19287
280 1 . 1 1 54 54 THR H H 54 7.260 7.260 7.802 -0.542 19287
281 1 . 1 1 55 55 CYS N N 55 112.540 112.540 117.225 -4.685 19287
282 1 . 1 1 55 55 CYS HA H 55 4.400 4.400 4.439 -0.039 19287
283 1 . 1 1 55 55 CYS C C 55 172.940 172.940 174.091 -1.151 19287
284 1 . 1 1 55 55 CYS CA C 55 54.230 54.230 58.530 -4.300 19287
285 1 . 1 1 55 55 CYS CB C 55 42.930 42.930 29.195 13.735 19287
286 1 . 1 1 55 55 CYS H H 55 7.590 7.590 7.631 -0.041 19287
287 1 . 1 1 56 56 VAL N N 56 119.720 119.720 123.439 -3.719 19287
288 1 . 1 1 56 56 VAL HA H 56 3.631 3.631 4.092 -0.461 19287
289 1 . 1 1 56 56 VAL C C 56 176.710 176.710 176.046 0.664 19287
290 1 . 1 1 56 56 VAL CA C 56 64.540 64.540 63.150 1.390 19287
291 1 . 1 1 56 56 VAL CB C 56 30.970 30.970 30.746 0.224 19287
292 1 . 1 1 56 56 VAL H H 56 7.280 7.280 7.873 -0.593 19287
stop_
save_