data_25575
save_entry_information
_Entry.Sf_category entry_information
_Entry.NMR_STAR_version 3.0.9.13
_Entry.Entry_ID 25575
_Entry.PDB_ID 2N1U
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 25575
_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 24 24 SER HA H 24 4.330 4.330 4.288 0.042 25575
2 1 1 . 1 1 24 24 SER CA C 24 58.130 58.130 58.886 -0.756 25575
3 1 1 . 1 1 24 24 SER CB C 24 63.870 63.870 63.303 0.567 25575
4 1 1 . 1 1 25 25 TYR N N 25 122.160 122.160 119.813 2.347 25575
5 1 1 . 1 1 25 25 TYR HA H 25 4.530 4.530 4.485 0.045 25575
6 1 1 . 1 1 25 25 TYR CA C 25 58.420 58.420 58.248 0.172 25575
7 1 1 . 1 1 25 25 TYR CB C 25 38.570 38.570 38.967 -0.397 25575
8 1 1 . 1 1 25 25 TYR H H 25 8.310 8.310 7.510 0.800 25575
9 1 1 . 1 1 26 26 GLY N N 26 111.370 111.370 111.778 -0.408 25575
10 1 1 . 1 1 26 26 GLY CA C 26 45.330 45.330 45.054 0.276 25575
11 1 1 . 1 1 26 26 GLY H H 26 8.300 8.300 8.213 0.087 25575
12 1 1 . 1 1 27 27 GLN N N 27 118.910 118.910 125.402 -6.492 25575
13 1 1 . 1 1 27 27 GLN HA H 27 4.510 4.510 4.242 0.268 25575
14 1 1 . 1 1 27 27 GLN CA C 27 55.240 55.240 55.906 -0.666 25575
15 1 1 . 1 1 27 27 GLN CB C 27 29.800 29.800 27.741 2.059 25575
16 1 1 . 1 1 27 27 GLN H H 27 8.050 8.050 8.693 -0.643 25575
17 1 1 . 1 1 28 28 SER N N 28 119.460 119.460 115.613 3.847 25575
18 1 1 . 1 1 28 28 SER HA H 28 4.810 4.810 5.176 -0.366 25575
19 1 1 . 1 1 28 28 SER CA C 28 57.710 57.710 56.402 1.308 25575
20 1 1 . 1 1 28 28 SER CB C 28 65.530 65.530 65.724 -0.194 25575
21 1 1 . 1 1 28 28 SER H H 28 8.800 8.800 8.149 0.651 25575
22 1 1 . 1 1 29 29 CYS N N 29 122.160 122.160 118.758 3.402 25575
23 1 1 . 1 1 29 29 CYS HA H 29 4.130 4.130 4.589 -0.459 25575
24 1 1 . 1 1 29 29 CYS CA C 29 60.620 60.620 60.980 -0.360 25575
25 1 1 . 1 1 29 29 CYS CB C 29 32.770 32.770 29.149 3.621 25575
26 1 1 . 1 1 29 29 CYS H H 29 8.390 8.390 8.443 -0.053 25575
27 1 1 . 1 1 30 30 CYS N N 30 122.320 122.320 119.460 2.860 25575
28 1 1 . 1 1 30 30 CYS HA H 30 4.530 4.530 4.905 -0.375 25575
29 1 1 . 1 1 30 30 CYS CA C 30 58.810 58.810 57.141 1.669 25575
30 1 1 . 1 1 30 30 CYS CB C 30 28.910 28.910 27.372 1.538 25575
31 1 1 . 1 1 30 30 CYS H H 30 8.340 8.340 8.493 -0.153 25575
32 1 1 . 1 1 31 31 LEU N N 31 122.390 122.390 123.013 -0.623 25575
33 1 1 . 1 1 31 31 LEU HA H 31 4.640 4.640 5.162 -0.522 25575
34 1 1 . 1 1 31 31 LEU CA C 31 55.440 55.440 53.716 1.724 25575
35 1 1 . 1 1 31 31 LEU CB C 31 43.490 43.490 43.449 0.041 25575
36 1 1 . 1 1 31 31 LEU H H 31 8.460 8.460 7.178 1.282 25575
37 1 1 . 1 1 32 32 ILE N N 32 118.890 118.890 118.369 0.521 25575
38 1 1 . 1 1 32 32 ILE HA H 32 4.200 4.200 4.723 -0.523 25575
39 1 1 . 1 1 32 32 ILE CA C 32 60.440 60.440 60.277 0.163 25575
40 1 1 . 1 1 32 32 ILE CB C 32 39.890 39.890 41.433 -1.543 25575
41 1 1 . 1 1 32 32 ILE H H 32 8.680 8.680 8.302 0.378 25575
42 1 1 . 1 1 33 33 GLU N N 33 128.400 128.400 126.846 1.554 25575
43 1 1 . 1 1 33 33 GLU HA H 33 5.080 5.080 5.250 -0.170 25575
44 1 1 . 1 1 33 33 GLU CA C 33 54.120 54.120 54.593 -0.473 25575
45 1 1 . 1 1 33 33 GLU CB C 33 32.080 32.080 33.035 -0.955 25575
46 1 1 . 1 1 33 33 GLU H H 33 8.640 8.640 8.824 -0.184 25575
47 1 1 . 1 1 34 34 ASP N N 34 130.390 130.390 127.690 2.700 25575
48 1 1 . 1 1 34 34 ASP HA H 34 4.310 4.310 4.290 0.020 25575
49 1 1 . 1 1 34 34 ASP CA C 34 55.150 55.150 55.672 -0.522 25575
50 1 1 . 1 1 34 34 ASP CB C 34 40.050 40.050 40.642 -0.592 25575
51 1 1 . 1 1 34 34 ASP H H 34 9.540 9.540 8.855 0.685 25575
52 1 1 . 1 1 35 35 GLY N N 35 126.620 126.620 103.799 22.821 25575
53 1 1 . 1 1 35 35 GLY CA C 35 45.480 45.480 44.864 0.616 25575
54 1 1 . 1 1 35 35 GLY H H 35 8.370 8.370 8.254 0.116 25575
55 1 1 . 1 1 36 36 GLU N N 36 120.860 120.860 123.521 -2.661 25575
56 1 1 . 1 1 36 36 GLU HA H 36 4.670 4.670 4.204 0.466 25575
57 1 1 . 1 1 36 36 GLU CA C 36 54.350 54.350 55.623 -1.273 25575
58 1 1 . 1 1 36 36 GLU CB C 36 31.630 31.630 29.970 1.660 25575
59 1 1 . 1 1 36 36 GLU H H 36 7.820 7.820 8.016 -0.196 25575
60 1 1 . 1 1 37 37 ARG N N 37 129.790 129.790 127.882 1.908 25575
61 1 1 . 1 1 37 37 ARG HA H 37 4.200 4.200 4.295 -0.095 25575
62 1 1 . 1 1 37 37 ARG CA C 37 56.440 56.440 55.042 1.397 25575
63 1 1 . 1 1 37 37 ARG CB C 37 29.710 29.710 28.935 0.775 25575
64 1 1 . 1 1 37 37 ARG H H 37 8.930 8.930 8.437 0.493 25575
65 1 1 . 1 1 38 38 CYS N N 38 130.950 130.950 126.811 4.139 25575
66 1 1 . 1 1 38 38 CYS HA H 38 4.450 4.450 4.377 0.073 25575
67 1 1 . 1 1 38 38 CYS CA C 38 60.560 60.560 60.526 0.034 25575
68 1 1 . 1 1 38 38 CYS CB C 38 31.250 31.250 28.942 2.308 25575
69 1 1 . 1 1 38 38 CYS H H 38 9.050 9.050 8.231 0.819 25575
70 1 1 . 1 1 39 39 VAL N N 39 118.270 118.270 121.403 -3.133 25575
71 1 1 . 1 1 39 39 VAL HA H 39 4.710 4.710 4.301 0.409 25575
72 1 1 . 1 1 39 39 VAL CA C 39 60.340 60.340 61.037 -0.697 25575
73 1 1 . 1 1 39 39 VAL CB C 39 31.290 31.290 31.502 -0.212 25575
74 1 1 . 1 1 39 39 VAL H H 39 8.060 8.060 8.152 -0.092 25575
75 1 1 . 1 1 40 40 ARG N N 40 127.360 127.360 122.934 4.426 25575
76 1 1 . 1 1 40 40 ARG HA H 40 4.430 4.430 4.370 0.060 25575
77 1 1 . 1 1 40 40 ARG CA C 40 56.150 56.150 54.969 1.181 25575
78 1 1 . 1 1 40 40 ARG CB C 40 29.210 29.210 29.566 -0.356 25575
79 1 1 . 1 1 40 40 ARG H H 40 8.950 8.950 7.601 1.349 25575
80 1 1 . 1 1 41 41 PRO HA H 41 4.430 4.430 4.576 -0.146 25575
81 1 1 . 1 1 41 41 PRO CA C 41 62.690 62.690 62.761 -0.071 25575
82 1 1 . 1 1 41 41 PRO CB C 41 32.010 32.010 32.243 -0.233 25575
83 1 1 . 1 1 42 42 ALA N N 42 124.260 124.260 125.272 -1.012 25575
84 1 1 . 1 1 42 42 ALA HA H 42 3.620 3.620 4.703 -1.083 25575
85 1 1 . 1 1 42 42 ALA CA C 42 52.930 52.930 50.482 2.448 25575
86 1 1 . 1 1 42 42 ALA CB C 42 19.130 19.130 20.906 -1.776 25575
87 1 1 . 1 1 42 42 ALA H H 42 8.410 8.410 8.131 0.279 25575
88 1 1 . 1 1 43 43 GLY N N 43 112.690 112.690 110.123 2.567 25575
89 1 1 . 1 1 43 43 GLY CA C 43 44.240 44.240 44.590 -0.350 25575
90 1 1 . 1 1 43 43 GLY H H 43 8.090 8.090 8.244 -0.154 25575
91 1 1 . 1 1 44 44 ASN N N 44 116.980 116.980 118.320 -1.340 25575
92 1 1 . 1 1 44 44 ASN HA H 44 4.690 4.690 4.651 0.039 25575
93 1 1 . 1 1 44 44 ASN CA C 44 53.420 53.420 54.311 -0.891 25575
94 1 1 . 1 1 44 44 ASN CB C 44 39.370 39.370 38.401 0.969 25575
95 1 1 . 1 1 44 44 ASN H H 44 8.720 8.720 8.559 0.161 25575
96 1 1 . 1 1 45 45 ALA N N 45 124.240 124.240 121.595 2.645 25575
97 1 1 . 1 1 45 45 ALA HA H 45 4.640 4.640 4.441 0.199 25575
98 1 1 . 1 1 45 45 ALA CA C 45 52.240 52.240 52.752 -0.512 25575
99 1 1 . 1 1 45 45 ALA CB C 45 19.540 19.540 19.479 0.062 25575
100 1 1 . 1 1 45 45 ALA H H 45 8.770 8.770 8.207 0.563 25575
101 1 1 . 1 1 46 46 SER N N 46 111.670 111.670 116.912 -5.242 25575
102 1 1 . 1 1 46 46 SER HA H 46 5.300 5.300 4.874 0.426 25575
103 1 1 . 1 1 46 46 SER CA C 46 56.580 56.580 57.225 -0.645 25575
104 1 1 . 1 1 46 46 SER CB C 46 66.490 66.490 66.231 0.259 25575
105 1 1 . 1 1 46 46 SER H H 46 8.060 8.060 8.077 -0.017 25575
106 1 1 . 1 1 47 47 PHE HA H 47 4.520 4.520 4.622 -0.102 25575
107 1 1 . 1 1 47 47 PHE CA C 47 57.000 57.000 56.688 0.312 25575
108 1 1 . 1 1 47 47 PHE CB C 47 38.360 38.360 39.477 -1.117 25575
109 1 1 . 1 1 48 48 SER N N 48 116.970 116.970 119.149 -2.179 25575
110 1 1 . 1 1 48 48 SER HA H 48 4.440 4.440 4.510 -0.070 25575
111 1 1 . 1 1 48 48 SER CA C 48 56.950 56.950 57.423 -0.473 25575
112 1 1 . 1 1 48 48 SER CB C 48 65.810 65.810 64.988 0.822 25575
113 1 1 . 1 1 48 48 SER H H 48 7.100 7.100 8.006 -0.906 25575
114 1 1 . 1 1 49 49 LYS N N 49 120.650 120.650 121.762 -1.112 25575
115 1 1 . 1 1 49 49 LYS HA H 49 3.900 3.900 4.203 -0.303 25575
116 1 1 . 1 1 49 49 LYS CA C 49 59.570 59.570 58.476 1.094 25575
117 1 1 . 1 1 49 49 LYS CB C 49 31.790 31.790 31.659 0.131 25575
118 1 1 . 1 1 49 49 LYS H H 49 8.770 8.770 8.733 0.037 25575
119 1 1 . 1 1 50 50 ARG N N 50 118.240 118.240 119.231 -0.991 25575
120 1 1 . 1 1 50 50 ARG HA H 50 4.040 4.040 4.113 -0.073 25575
121 1 1 . 1 1 50 50 ARG CA C 50 59.070 59.070 58.293 0.777 25575
122 1 1 . 1 1 50 50 ARG CB C 50 30.080 30.080 30.664 -0.584 25575
123 1 1 . 1 1 50 50 ARG H H 50 8.040 8.040 7.256 0.784 25575
124 1 1 . 1 1 51 51 VAL N N 51 121.680 121.680 119.821 1.859 25575
125 1 1 . 1 1 51 51 VAL HA H 51 3.590 3.590 3.490 0.100 25575
126 1 1 . 1 1 51 51 VAL CA C 51 65.940 65.940 65.394 0.547 25575
127 1 1 . 1 1 51 51 VAL CB C 51 31.620 31.620 30.840 0.780 25575
128 1 1 . 1 1 51 51 VAL H H 51 7.350 7.350 7.539 -0.189 25575
129 1 1 . 1 1 52 52 GLN N N 52 119.680 119.680 118.451 1.229 25575
130 1 1 . 1 1 52 52 GLN HA H 52 3.570 3.570 3.760 -0.190 25575
131 1 1 . 1 1 52 52 GLN CA C 52 59.210 59.210 59.389 -0.179 25575
132 1 1 . 1 1 52 52 GLN CB C 52 28.620 28.620 28.067 0.553 25575
133 1 1 . 1 1 52 52 GLN H H 52 8.210 8.210 7.521 0.689 25575
134 1 1 . 1 1 53 53 LYS N N 53 118.080 118.080 118.380 -0.300 25575
135 1 1 . 1 1 53 53 LYS HA H 53 4.160 4.160 4.025 0.135 25575
136 1 1 . 1 1 53 53 LYS CA C 53 58.670 58.670 59.067 -0.397 25575
137 1 1 . 1 1 53 53 LYS CB C 53 32.120 32.120 31.732 0.388 25575
138 1 1 . 1 1 53 53 LYS H H 53 7.960 7.960 7.777 0.183 25575
139 1 1 . 1 1 54 54 SER N N 54 115.450 115.450 114.199 1.251 25575
140 1 1 . 1 1 54 54 SER HA H 54 4.370 4.370 4.221 0.149 25575
141 1 1 . 1 1 54 54 SER CA C 54 61.330 61.330 61.060 0.270 25575
142 1 1 . 1 1 54 54 SER CB C 54 63.690 63.690 63.005 0.685 25575
143 1 1 . 1 1 54 54 SER H H 54 7.800 7.800 7.722 0.078 25575
144 1 1 . 1 1 55 55 ILE N N 55 117.670 117.670 118.775 -1.105 25575
145 1 1 . 1 1 55 55 ILE HA H 55 4.060 4.060 3.996 0.064 25575
146 1 1 . 1 1 55 55 ILE CA C 55 63.330 63.330 63.639 -0.309 25575
147 1 1 . 1 1 55 55 ILE CB C 55 38.980 38.980 38.631 0.349 25575
148 1 1 . 1 1 55 55 ILE H H 55 7.840 7.840 7.464 0.376 25575
149 1 1 . 1 1 56 56 SER N N 56 115.650 115.650 117.300 -1.650 25575
150 1 1 . 1 1 56 56 SER HA H 56 4.490 4.490 4.145 0.345 25575
151 1 1 . 1 1 56 56 SER CA C 56 60.220 60.220 61.872 -1.652 25575
152 1 1 . 1 1 56 56 SER CB C 56 63.000 63.000 62.526 0.474 25575
153 1 1 . 1 1 56 56 SER H H 56 8.060 8.060 8.598 -0.538 25575
154 1 1 . 1 1 57 57 GLN N N 57 121.830 121.830 119.748 2.082 25575
155 1 1 . 1 1 57 57 GLN HA H 57 4.200 4.200 4.206 -0.006 25575
156 1 1 . 1 1 57 57 GLN CA C 57 58.310 58.310 57.616 0.694 25575
157 1 1 . 1 1 57 57 GLN CB C 57 28.850 28.850 28.892 -0.042 25575
158 1 1 . 1 1 57 57 GLN H H 57 8.620 8.620 7.762 0.858 25575
159 1 1 . 1 1 58 58 LYS N N 58 116.960 116.960 118.014 -1.054 25575
160 1 1 . 1 1 58 58 LYS HA H 58 4.290 4.290 4.357 -0.067 25575
161 1 1 . 1 1 58 58 LYS CA C 58 56.920 56.920 55.484 1.436 25575
162 1 1 . 1 1 58 58 LYS CB C 58 32.900 32.900 33.668 -0.768 25575
163 1 1 . 1 1 58 58 LYS H H 58 7.950 7.950 7.632 0.318 25575
164 1 1 . 1 1 59 59 LYS N N 59 116.960 116.960 118.007 -1.047 25575
165 1 1 . 1 1 59 59 LYS HA H 59 4.120 4.120 3.894 0.226 25575
166 1 1 . 1 1 59 59 LYS CA C 59 57.090 57.090 57.180 -0.090 25575
167 1 1 . 1 1 59 59 LYS CB C 59 30.080 30.080 29.829 0.251 25575
168 1 1 . 1 1 59 59 LYS H H 59 7.950 7.950 7.826 0.124 25575
169 1 1 . 1 1 60 60 LEU N N 60 117.540 117.540 118.664 -1.124 25575
170 1 1 . 1 1 60 60 LEU HA H 60 4.480 4.480 4.386 0.094 25575
171 1 1 . 1 1 60 60 LEU CA C 60 54.500 54.500 55.008 -0.508 25575
172 1 1 . 1 1 60 60 LEU CB C 60 42.840 42.840 42.685 0.155 25575
173 1 1 . 1 1 60 60 LEU H H 60 7.930 7.930 7.460 0.470 25575
174 1 1 . 1 1 61 61 LYS HA H 61 4.390 4.390 4.225 0.165 25575
175 1 1 . 1 1 61 61 LYS CA C 61 55.540 55.540 56.571 -1.031 25575
176 1 1 . 1 1 61 61 LYS CB C 61 30.050 30.050 31.182 -1.132 25575
177 1 1 . 1 1 62 62 LEU N N 62 120.000 120.000 123.096 -3.096 25575
178 1 1 . 1 1 62 62 LEU HA H 62 5.250 5.250 5.025 0.225 25575
179 1 1 . 1 1 62 62 LEU CA C 62 53.080 53.080 53.992 -0.912 25575
180 1 1 . 1 1 62 62 LEU CB C 62 45.760 45.760 42.189 3.571 25575
181 1 1 . 1 1 62 62 LEU H H 62 7.470 7.470 7.604 -0.134 25575
182 1 1 . 1 1 63 63 ASP N N 63 121.730 121.730 125.083 -3.353 25575
183 1 1 . 1 1 63 63 ASP HA H 63 4.860 4.860 4.781 0.079 25575
184 1 1 . 1 1 63 63 ASP CA C 63 51.890 51.890 52.765 -0.875 25575
185 1 1 . 1 1 63 63 ASP CB C 63 44.910 44.910 43.986 0.924 25575
186 1 1 . 1 1 63 63 ASP H H 63 8.620 8.620 8.620 0.000 25575
187 1 1 . 1 1 64 64 ILE N N 64 118.120 118.120 119.240 -1.120 25575
188 1 1 . 1 1 64 64 ILE HA H 64 4.210 4.210 4.448 -0.238 25575
189 1 1 . 1 1 64 64 ILE CA C 64 60.430 60.430 58.346 2.084 25575
190 1 1 . 1 1 64 64 ILE CB C 64 40.420 40.420 39.214 1.206 25575
191 1 1 . 1 1 64 64 ILE H H 64 8.650 8.650 8.154 0.496 25575
192 1 1 . 1 1 65 65 ASP N N 65 124.550 124.550 128.266 -3.716 25575
193 1 1 . 1 1 65 65 ASP HA H 65 4.570 4.570 4.495 0.075 25575
194 1 1 . 1 1 65 65 ASP CA C 65 53.310 53.310 54.107 -0.797 25575
195 1 1 . 1 1 65 65 ASP CB C 65 40.440 40.440 40.993 -0.554 25575
196 1 1 . 1 1 65 65 ASP H H 65 8.630 8.630 8.831 -0.201 25575
197 1 1 . 1 1 66 66 LYS N N 66 125.970 125.970 126.339 -0.369 25575
198 1 1 . 1 1 66 66 LYS HA H 66 4.040 4.040 4.239 -0.199 25575
199 1 1 . 1 1 66 66 LYS CA C 66 58.140 58.140 57.587 0.553 25575
200 1 1 . 1 1 66 66 LYS CB C 66 31.990 31.990 32.409 -0.419 25575
201 1 1 . 1 1 66 66 LYS H H 66 8.590 8.590 8.286 0.304 25575
202 1 1 . 1 1 67 67 SER N N 67 114.980 114.980 115.473 -0.493 25575
203 1 1 . 1 1 67 67 SER HA H 67 4.320 4.320 4.211 0.109 25575
204 1 1 . 1 1 67 67 SER CA C 67 60.330 60.330 60.636 -0.306 25575
205 1 1 . 1 1 67 67 SER CB C 67 63.710 63.710 63.402 0.308 25575
206 1 1 . 1 1 67 67 SER H H 67 8.760 8.760 8.559 0.201 25575
207 1 1 . 1 1 68 68 VAL HA H 68 4.250 4.250 3.885 0.365 25575
208 1 1 . 1 1 68 68 VAL CA C 68 62.150 62.150 62.109 0.041 25575
209 1 1 . 1 1 68 68 VAL CB C 68 31.900 31.900 31.669 0.230 25575
210 1 1 . 1 1 69 69 ARG CA C 69 56.960 56.960 57.001 -0.041 25575
211 1 1 . 1 1 70 70 HIS N N 70 116.270 116.270 114.874 1.396 25575
212 1 1 . 1 1 70 70 HIS HA H 70 4.760 4.760 4.770 -0.010 25575
213 1 1 . 1 1 70 70 HIS CA C 70 55.360 55.360 54.172 1.188 25575
214 1 1 . 1 1 70 70 HIS CB C 70 33.100 33.100 32.170 0.930 25575
215 1 1 . 1 1 70 70 HIS H H 70 7.390 7.390 7.780 -0.390 25575
216 1 1 . 1 1 71 71 LEU N N 71 120.200 120.200 120.488 -0.288 25575
217 1 1 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.639 0.421 25575
218 1 1 . 1 1 71 71 LEU CA C 71 54.070 54.070 53.936 0.134 25575
219 1 1 . 1 1 71 71 LEU CB C 71 42.710 42.710 41.470 1.240 25575
220 1 1 . 1 1 71 71 LEU H H 71 7.970 7.970 8.421 -0.451 25575
221 1 1 . 1 1 72 72 TYR HA H 72 5.030 5.030 4.833 0.197 25575
222 1 1 . 1 1 72 72 TYR CA C 72 59.990 59.990 58.117 1.873 25575
223 1 1 . 1 1 72 72 TYR CB C 72 39.440 39.440 40.334 -0.895 25575
224 1 1 . 1 1 73 73 ILE N N 73 112.940 112.940 114.725 -1.785 25575
225 1 1 . 1 1 73 73 ILE HA H 73 6.080 6.080 4.847 1.233 25575
226 1 1 . 1 1 73 73 ILE CA C 73 58.090 58.090 58.552 -0.462 25575
227 1 1 . 1 1 73 73 ILE CB C 73 41.820 41.820 42.492 -0.672 25575
228 1 1 . 1 1 73 73 ILE H H 73 8.450 8.450 8.444 0.006 25575
229 1 1 . 1 1 74 74 CYS N N 74 124.730 124.730 119.326 5.404 25575
230 1 1 . 1 1 74 74 CYS HA H 74 5.080 5.080 5.042 0.038 25575
231 1 1 . 1 1 74 74 CYS CA C 74 57.670 57.670 57.956 -0.286 25575
232 1 1 . 1 1 74 74 CYS CB C 74 33.330 33.330 29.388 3.942 25575
233 1 1 . 1 1 74 74 CYS H H 74 9.830 9.830 8.593 1.237 25575
234 1 1 . 1 1 75 75 ASP N N 75 120.990 120.990 123.593 -2.603 25575
235 1 1 . 1 1 75 75 ASP HA H 75 4.590 4.590 4.452 0.138 25575
236 1 1 . 1 1 75 75 ASP CA C 75 57.320 57.320 57.790 -0.470 25575
237 1 1 . 1 1 75 75 ASP CB C 75 39.670 39.670 40.984 -1.314 25575
238 1 1 . 1 1 75 75 ASP H H 75 9.090 9.090 9.163 -0.073 25575
239 1 1 . 1 1 76 76 PHE N N 76 122.470 122.470 119.542 2.928 25575
240 1 1 . 1 1 76 76 PHE HA H 76 4.230 4.230 4.171 0.059 25575
241 1 1 . 1 1 76 76 PHE CA C 76 62.030 62.030 61.878 0.152 25575
242 1 1 . 1 1 76 76 PHE CB C 76 38.190 38.190 39.201 -1.011 25575
243 1 1 . 1 1 76 76 PHE H H 76 8.330 8.330 8.322 0.008 25575
244 1 1 . 1 1 77 77 HIS N N 77 124.580 124.580 118.011 6.569 25575
245 1 1 . 1 1 77 77 HIS HA H 77 4.280 4.280 4.256 0.024 25575
246 1 1 . 1 1 77 77 HIS CA C 77 63.880 63.880 59.285 4.595 25575
247 1 1 . 1 1 77 77 HIS CB C 77 29.600 29.600 30.117 -0.517 25575
248 1 1 . 1 1 77 77 HIS H H 77 10.300 10.300 7.794 2.506 25575
249 1 1 . 1 1 78 78 LYS N N 78 122.930 122.930 120.268 2.662 25575
250 1 1 . 1 1 78 78 LYS HA H 78 3.860 3.860 3.934 -0.074 25575
251 1 1 . 1 1 78 78 LYS CA C 78 60.550 60.550 60.176 0.374 25575
252 1 1 . 1 1 78 78 LYS CB C 78 32.040 32.040 32.394 -0.354 25575
253 1 1 . 1 1 78 78 LYS H H 78 8.960 8.960 8.461 0.499 25575
254 1 1 . 1 1 79 79 ASN N N 79 116.670 116.670 117.767 -1.097 25575
255 1 1 . 1 1 79 79 ASN HA H 79 4.420 4.420 4.632 -0.212 25575
256 1 1 . 1 1 79 79 ASN CA C 79 56.030 56.030 55.903 0.127 25575
257 1 1 . 1 1 79 79 ASN CB C 79 38.100 38.100 38.235 -0.135 25575
258 1 1 . 1 1 79 79 ASN H H 79 8.230 8.230 7.894 0.336 25575
259 1 1 . 1 1 80 80 PHE N N 80 122.600 122.600 121.717 0.883 25575
260 1 1 . 1 1 80 80 PHE HA H 80 4.180 4.180 4.085 0.095 25575
261 1 1 . 1 1 80 80 PHE CA C 80 60.700 60.700 61.346 -0.646 25575
262 1 1 . 1 1 80 80 PHE CB C 80 39.840 39.840 38.977 0.863 25575
263 1 1 . 1 1 80 80 PHE H H 80 8.200 8.200 7.779 0.421 25575
264 1 1 . 1 1 81 81 ILE N N 81 118.240 118.240 114.849 3.391 25575
265 1 1 . 1 1 81 81 ILE HA H 81 3.320 3.320 3.533 -0.213 25575
266 1 1 . 1 1 81 81 ILE CA C 81 65.160 65.160 63.748 1.411 25575
267 1 1 . 1 1 81 81 ILE CB C 81 38.440 38.440 37.541 0.899 25575
268 1 1 . 1 1 81 81 ILE H H 81 8.520 8.520 7.709 0.811 25575
269 1 1 . 1 1 82 82 GLN N N 82 116.370 116.370 117.184 -0.814 25575
270 1 1 . 1 1 82 82 GLN HA H 82 4.100 4.100 4.096 0.004 25575
271 1 1 . 1 1 82 82 GLN CA C 82 57.710 57.710 57.932 -0.222 25575
272 1 1 . 1 1 82 82 GLN CB C 82 28.710 28.710 28.980 -0.270 25575
273 1 1 . 1 1 82 82 GLN H H 82 7.670 7.670 7.676 -0.006 25575
274 1 1 . 1 1 83 83 SER N N 83 114.440 114.440 117.299 -2.859 25575
275 1 1 . 1 1 83 83 SER HA H 83 4.300 4.300 4.162 0.138 25575
276 1 1 . 1 1 83 83 SER CA C 83 60.130 60.130 61.829 -1.699 25575
277 1 1 . 1 1 83 83 SER CB C 83 63.570 63.570 63.137 0.433 25575
278 1 1 . 1 1 83 83 SER H H 83 7.810 7.810 8.428 -0.618 25575
279 1 1 . 1 1 84 84 VAL N N 84 120.750 120.750 117.236 3.514 25575
280 1 1 . 1 1 84 84 VAL HA H 84 3.970 3.970 3.836 0.134 25575
281 1 1 . 1 1 84 84 VAL CA C 84 63.430 63.430 64.100 -0.670 25575
282 1 1 . 1 1 84 84 VAL CB C 84 31.960 31.960 31.346 0.614 25575
283 1 1 . 1 1 84 84 VAL H H 84 7.790 7.790 7.382 0.408 25575
284 1 1 . 1 1 85 85 ARG N N 85 122.090 122.090 118.780 3.310 25575
285 1 1 . 1 1 85 85 ARG HA H 85 4.240 4.240 4.372 -0.133 25575
286 1 1 . 1 1 85 85 ARG CA C 85 56.850 56.850 56.076 0.774 25575
287 1 1 . 1 1 85 85 ARG CB C 85 30.720 30.720 30.880 -0.160 25575
288 1 1 . 1 1 85 85 ARG H H 85 8.090 8.090 7.430 0.660 25575
289 1 1 . 1 1 86 86 ASN N N 86 118.510 118.510 117.512 0.998 25575
290 1 1 . 1 1 86 86 ASN HA H 86 4.690 4.690 4.758 -0.068 25575
291 1 1 . 1 1 86 86 ASN CA C 86 53.380 53.380 52.737 0.643 25575
292 1 1 . 1 1 86 86 ASN CB C 86 38.950 38.950 39.943 -0.993 25575
293 1 1 . 1 1 86 86 ASN H H 86 8.220 8.220 7.884 0.336 25575
294 1 1 . 1 1 87 87 LYS N N 87 121.600 121.600 119.505 2.095 25575
295 1 1 . 1 1 87 87 LYS HA H 87 4.310 4.310 4.457 -0.147 25575
296 1 1 . 1 1 87 87 LYS CA C 87 56.590 56.590 55.656 0.934 25575
297 1 1 . 1 1 87 87 LYS CB C 87 32.870 32.870 33.782 -0.913 25575
298 1 1 . 1 1 87 87 LYS H H 87 8.150 8.150 8.419 -0.269 25575
299 1 1 . 1 1 88 88 ARG N N 88 121.920 121.920 120.326 1.594 25575
300 1 1 . 1 1 88 88 ARG HA H 88 4.330 4.330 4.136 0.194 25575
301 1 1 . 1 1 88 88 ARG CA C 88 56.110 56.110 57.204 -1.094 25575
302 1 1 . 1 1 88 88 ARG CB C 88 30.870 30.870 30.588 0.282 25575
303 1 1 . 1 1 88 88 ARG H H 88 8.250 8.250 8.605 -0.355 25575
304 1 1 . 1 1 89 89 LYS N N 89 123.020 123.020 120.722 2.298 25575
305 1 1 . 1 1 89 89 LYS HA H 89 4.320 4.320 4.299 0.021 25575
306 1 1 . 1 1 89 89 LYS CA C 89 56.330 56.330 56.044 0.286 25575
307 1 1 . 1 1 89 89 LYS CB C 89 33.140 33.140 31.979 1.161 25575
308 1 1 . 1 1 89 89 LYS H H 89 8.320 8.320 7.818 0.502 25575
309 1 1 . 1 1 90 90 ARG N N 90 122.970 122.970 123.765 -0.795 25575
310 1 1 . 1 1 90 90 ARG HA H 90 4.360 4.360 4.169 0.191 25575
311 1 1 . 1 1 90 90 ARG CA C 90 56.100 56.100 56.876 -0.776 25575
312 1 1 . 1 1 90 90 ARG CB C 90 31.210 31.210 30.624 0.586 25575
313 1 1 . 1 1 90 90 ARG H H 90 8.360 8.360 8.420 -0.060 25575
314 1 1 . 1 1 91 91 LYS N N 91 123.680 123.680 120.392 3.288 25575
315 1 1 . 1 1 91 91 LYS HA H 91 4.380 4.380 4.579 -0.199 25575
316 1 1 . 1 1 91 91 LYS CA C 91 56.620 56.620 55.313 1.306 25575
317 1 1 . 1 1 91 91 LYS CB C 91 33.070 33.070 34.489 -1.419 25575
318 1 1 . 1 1 91 91 LYS H H 91 8.450 8.450 8.490 -0.040 25575
319 1 2 . 1 1 24 24 SER HA H 24 4.330 4.330 4.473 -0.143 25575
320 1 2 . 1 1 24 24 SER CA C 24 58.130 58.130 57.748 0.382 25575
321 1 2 . 1 1 24 24 SER CB C 24 63.870 63.870 64.561 -0.691 25575
322 1 2 . 1 1 25 25 TYR N N 25 122.160 122.160 120.243 1.917 25575
323 1 2 . 1 1 25 25 TYR HA H 25 4.530 4.530 4.677 -0.147 25575
324 1 2 . 1 1 25 25 TYR CA C 25 58.420 58.420 57.149 1.271 25575
325 1 2 . 1 1 25 25 TYR CB C 25 38.570 38.570 37.509 1.061 25575
326 1 2 . 1 1 25 25 TYR H H 25 8.310 8.310 8.482 -0.172 25575
327 1 2 . 1 1 26 26 GLY N N 26 111.370 111.370 108.991 2.379 25575
328 1 2 . 1 1 26 26 GLY CA C 26 45.330 45.330 45.013 0.317 25575
329 1 2 . 1 1 26 26 GLY H H 26 8.300 8.300 8.257 0.043 25575
330 1 2 . 1 1 27 27 GLN N N 27 118.910 118.910 120.165 -1.255 25575
331 1 2 . 1 1 27 27 GLN HA H 27 4.510 4.510 4.034 0.476 25575
332 1 2 . 1 1 27 27 GLN CA C 27 55.240 55.240 55.987 -0.747 25575
333 1 2 . 1 1 27 27 GLN CB C 27 29.800 29.800 27.961 1.839 25575
334 1 2 . 1 1 27 27 GLN H H 27 8.050 8.050 8.665 -0.615 25575
335 1 2 . 1 1 28 28 SER N N 28 119.460 119.460 116.337 3.123 25575
336 1 2 . 1 1 28 28 SER HA H 28 4.810 4.810 5.093 -0.283 25575
337 1 2 . 1 1 28 28 SER CA C 28 57.710 57.710 56.783 0.926 25575
338 1 2 . 1 1 28 28 SER CB C 28 65.530 65.530 66.131 -0.601 25575
339 1 2 . 1 1 28 28 SER H H 28 8.800 8.800 8.264 0.536 25575
340 1 2 . 1 1 29 29 CYS N N 29 122.160 122.160 119.543 2.617 25575
341 1 2 . 1 1 29 29 CYS HA H 29 4.130 4.130 4.350 -0.220 25575
342 1 2 . 1 1 29 29 CYS CA C 29 60.620 60.620 61.521 -0.901 25575
343 1 2 . 1 1 29 29 CYS CB C 29 32.770 32.770 28.504 4.266 25575
344 1 2 . 1 1 29 29 CYS H H 29 8.390 8.390 8.566 -0.176 25575
345 1 2 . 1 1 30 30 CYS N N 30 122.320 122.320 120.211 2.109 25575
346 1 2 . 1 1 30 30 CYS HA H 30 4.530 4.530 4.768 -0.237 25575
347 1 2 . 1 1 30 30 CYS CA C 30 58.810 58.810 58.231 0.579 25575
348 1 2 . 1 1 30 30 CYS CB C 30 28.910 28.910 27.875 1.035 25575
349 1 2 . 1 1 30 30 CYS H H 30 8.340 8.340 8.652 -0.312 25575
350 1 2 . 1 1 31 31 LEU N N 31 122.390 122.390 121.822 0.568 25575
351 1 2 . 1 1 31 31 LEU HA H 31 4.640 4.640 4.827 -0.187 25575
352 1 2 . 1 1 31 31 LEU CA C 31 55.440 55.440 54.659 0.781 25575
353 1 2 . 1 1 31 31 LEU CB C 31 43.490 43.490 43.023 0.467 25575
354 1 2 . 1 1 31 31 LEU H H 31 8.460 8.460 7.190 1.270 25575
355 1 2 . 1 1 32 32 ILE N N 32 118.890 118.890 118.153 0.737 25575
356 1 2 . 1 1 32 32 ILE HA H 32 4.200 4.200 4.780 -0.580 25575
357 1 2 . 1 1 32 32 ILE CA C 32 60.440 60.440 60.103 0.337 25575
358 1 2 . 1 1 32 32 ILE CB C 32 39.890 39.890 41.608 -1.718 25575
359 1 2 . 1 1 32 32 ILE H H 32 8.680 8.680 8.281 0.399 25575
360 1 2 . 1 1 33 33 GLU N N 33 128.400 128.400 126.291 2.109 25575
361 1 2 . 1 1 33 33 GLU HA H 33 5.080 5.080 5.298 -0.218 25575
362 1 2 . 1 1 33 33 GLU CA C 33 54.120 54.120 54.536 -0.416 25575
363 1 2 . 1 1 33 33 GLU CB C 33 32.080 32.080 33.517 -1.437 25575
364 1 2 . 1 1 33 33 GLU H H 33 8.640 8.640 8.973 -0.333 25575
365 1 2 . 1 1 34 34 ASP N N 34 130.390 130.390 126.749 3.641 25575
366 1 2 . 1 1 34 34 ASP HA H 34 4.310 4.310 4.308 0.002 25575
367 1 2 . 1 1 34 34 ASP CA C 34 55.150 55.150 56.070 -0.920 25575
368 1 2 . 1 1 34 34 ASP CB C 34 40.050 40.050 40.776 -0.726 25575
369 1 2 . 1 1 34 34 ASP H H 34 9.540 9.540 8.837 0.703 25575
370 1 2 . 1 1 35 35 GLY N N 35 126.620 126.620 103.394 23.226 25575
371 1 2 . 1 1 35 35 GLY CA C 35 45.480 45.480 44.882 0.598 25575
372 1 2 . 1 1 35 35 GLY H H 35 8.370 8.370 8.312 0.058 25575
373 1 2 . 1 1 36 36 GLU N N 36 120.860 120.860 122.132 -1.272 25575
374 1 2 . 1 1 36 36 GLU HA H 36 4.670 4.670 4.279 0.391 25575
375 1 2 . 1 1 36 36 GLU CA C 36 54.350 54.350 55.467 -1.117 25575
376 1 2 . 1 1 36 36 GLU CB C 36 31.630 31.630 30.428 1.202 25575
377 1 2 . 1 1 36 36 GLU H H 36 7.820 7.820 7.775 0.045 25575
378 1 2 . 1 1 37 37 ARG N N 37 129.790 129.790 127.435 2.355 25575
379 1 2 . 1 1 37 37 ARG HA H 37 4.200 4.200 4.305 -0.105 25575
380 1 2 . 1 1 37 37 ARG CA C 37 56.440 56.440 54.423 2.017 25575
381 1 2 . 1 1 37 37 ARG CB C 37 29.710 29.710 29.296 0.414 25575
382 1 2 . 1 1 37 37 ARG H H 37 8.930 8.930 8.501 0.429 25575
383 1 2 . 1 1 38 38 CYS N N 38 130.950 130.950 127.013 3.937 25575
384 1 2 . 1 1 38 38 CYS HA H 38 4.450 4.450 4.360 0.090 25575
385 1 2 . 1 1 38 38 CYS CA C 38 60.560 60.560 60.022 0.538 25575
386 1 2 . 1 1 38 38 CYS CB C 38 31.250 31.250 27.983 3.267 25575
387 1 2 . 1 1 38 38 CYS H H 38 9.050 9.050 8.437 0.613 25575
388 1 2 . 1 1 39 39 VAL N N 39 118.270 118.270 121.350 -3.080 25575
389 1 2 . 1 1 39 39 VAL HA H 39 4.710 4.710 4.500 0.210 25575
390 1 2 . 1 1 39 39 VAL CA C 39 60.340 60.340 61.052 -0.712 25575
391 1 2 . 1 1 39 39 VAL CB C 39 31.290 31.290 32.288 -0.998 25575
392 1 2 . 1 1 39 39 VAL H H 39 8.060 8.060 8.086 -0.026 25575
393 1 2 . 1 1 40 40 ARG N N 40 127.360 127.360 123.010 4.350 25575
394 1 2 . 1 1 40 40 ARG HA H 40 4.430 4.430 4.356 0.074 25575
395 1 2 . 1 1 40 40 ARG CA C 40 56.150 56.150 54.751 1.399 25575
396 1 2 . 1 1 40 40 ARG CB C 40 29.210 29.210 29.838 -0.628 25575
397 1 2 . 1 1 40 40 ARG H H 40 8.950 8.950 7.790 1.160 25575
398 1 2 . 1 1 41 41 PRO HA H 41 4.430 4.430 4.508 -0.078 25575
399 1 2 . 1 1 41 41 PRO CA C 41 62.690 62.690 62.901 -0.211 25575
400 1 2 . 1 1 41 41 PRO CB C 41 32.010 32.010 32.128 -0.118 25575
401 1 2 . 1 1 42 42 ALA N N 42 124.260 124.260 125.452 -1.192 25575
402 1 2 . 1 1 42 42 ALA HA H 42 3.620 3.620 4.773 -1.153 25575
403 1 2 . 1 1 42 42 ALA CA C 42 52.930 52.930 50.803 2.127 25575
404 1 2 . 1 1 42 42 ALA CB C 42 19.130 19.130 20.736 -1.606 25575
405 1 2 . 1 1 42 42 ALA H H 42 8.410 8.410 8.271 0.139 25575
406 1 2 . 1 1 43 43 GLY N N 43 112.690 112.690 108.865 3.825 25575
407 1 2 . 1 1 43 43 GLY CA C 43 44.240 44.240 45.327 -1.087 25575
408 1 2 . 1 1 43 43 GLY H H 43 8.090 8.090 8.446 -0.356 25575
409 1 2 . 1 1 44 44 ASN N N 44 116.980 116.980 119.550 -2.570 25575
410 1 2 . 1 1 44 44 ASN HA H 44 4.690 4.690 4.657 0.033 25575
411 1 2 . 1 1 44 44 ASN CA C 44 53.420 53.420 52.919 0.501 25575
412 1 2 . 1 1 44 44 ASN CB C 44 39.370 39.370 37.154 2.216 25575
413 1 2 . 1 1 44 44 ASN H H 44 8.720 8.720 8.627 0.093 25575
414 1 2 . 1 1 45 45 ALA N N 45 124.240 124.240 122.043 2.197 25575
415 1 2 . 1 1 45 45 ALA HA H 45 4.640 4.640 4.866 -0.226 25575
416 1 2 . 1 1 45 45 ALA CA C 45 52.240 52.240 51.279 0.961 25575
417 1 2 . 1 1 45 45 ALA CB C 45 19.540 19.540 21.214 -1.674 25575
418 1 2 . 1 1 45 45 ALA H H 45 8.770 8.770 7.952 0.818 25575
419 1 2 . 1 1 46 46 SER N N 46 111.670 111.670 118.617 -6.947 25575
420 1 2 . 1 1 46 46 SER HA H 46 5.300 5.300 4.840 0.460 25575
421 1 2 . 1 1 46 46 SER CA C 46 56.580 56.580 56.497 0.083 25575
422 1 2 . 1 1 46 46 SER CB C 46 66.490 66.490 65.830 0.660 25575
423 1 2 . 1 1 46 46 SER H H 46 8.060 8.060 8.502 -0.442 25575
424 1 2 . 1 1 47 47 PHE HA H 47 4.520 4.520 4.681 -0.161 25575
425 1 2 . 1 1 47 47 PHE CA C 47 57.000 57.000 56.412 0.588 25575
426 1 2 . 1 1 47 47 PHE CB C 47 38.360 38.360 39.055 -0.695 25575
427 1 2 . 1 1 48 48 SER N N 48 116.970 116.970 118.487 -1.517 25575
428 1 2 . 1 1 48 48 SER HA H 48 4.440 4.440 4.425 0.015 25575
429 1 2 . 1 1 48 48 SER CA C 48 56.950 56.950 57.859 -0.909 25575
430 1 2 . 1 1 48 48 SER CB C 48 65.810 65.810 64.210 1.600 25575
431 1 2 . 1 1 48 48 SER H H 48 7.100 7.100 7.940 -0.840 25575
432 1 2 . 1 1 49 49 LYS N N 49 120.650 120.650 126.056 -5.406 25575
433 1 2 . 1 1 49 49 LYS HA H 49 3.900 3.900 3.925 -0.025 25575
434 1 2 . 1 1 49 49 LYS CA C 49 59.570 59.570 59.631 -0.061 25575
435 1 2 . 1 1 49 49 LYS CB C 49 31.790 31.790 32.218 -0.428 25575
436 1 2 . 1 1 49 49 LYS H H 49 8.770 8.770 8.814 -0.044 25575
437 1 2 . 1 1 50 50 ARG N N 50 118.240 118.240 118.508 -0.268 25575
438 1 2 . 1 1 50 50 ARG HA H 50 4.040 4.040 4.037 0.003 25575
439 1 2 . 1 1 50 50 ARG CA C 50 59.070 59.070 58.424 0.646 25575
440 1 2 . 1 1 50 50 ARG CB C 50 30.080 30.080 29.732 0.348 25575
441 1 2 . 1 1 50 50 ARG H H 50 8.040 8.040 8.049 -0.009 25575
442 1 2 . 1 1 51 51 VAL N N 51 121.680 121.680 118.819 2.861 25575
443 1 2 . 1 1 51 51 VAL HA H 51 3.590 3.590 3.593 -0.003 25575
444 1 2 . 1 1 51 51 VAL CA C 51 65.940 65.940 65.211 0.729 25575
445 1 2 . 1 1 51 51 VAL CB C 51 31.620 31.620 31.464 0.156 25575
446 1 2 . 1 1 51 51 VAL H H 51 7.350 7.350 8.120 -0.770 25575
447 1 2 . 1 1 52 52 GLN N N 52 119.680 119.680 118.900 0.780 25575
448 1 2 . 1 1 52 52 GLN HA H 52 3.570 3.570 3.884 -0.314 25575
449 1 2 . 1 1 52 52 GLN CA C 52 59.210 59.210 58.875 0.335 25575
450 1 2 . 1 1 52 52 GLN CB C 52 28.620 28.620 28.122 0.498 25575
451 1 2 . 1 1 52 52 GLN H H 52 8.210 8.210 7.488 0.722 25575
452 1 2 . 1 1 53 53 LYS N N 53 118.080 118.080 119.304 -1.224 25575
453 1 2 . 1 1 53 53 LYS HA H 53 4.160 4.160 3.954 0.206 25575
454 1 2 . 1 1 53 53 LYS CA C 53 58.670 58.670 59.544 -0.875 25575
455 1 2 . 1 1 53 53 LYS CB C 53 32.120 32.120 31.811 0.309 25575
456 1 2 . 1 1 53 53 LYS H H 53 7.960 7.960 7.766 0.194 25575
457 1 2 . 1 1 54 54 SER N N 54 115.450 115.450 113.781 1.669 25575
458 1 2 . 1 1 54 54 SER HA H 54 4.370 4.370 4.200 0.170 25575
459 1 2 . 1 1 54 54 SER CA C 54 61.330 61.330 61.246 0.084 25575
460 1 2 . 1 1 54 54 SER CB C 54 63.690 63.690 62.847 0.842 25575
461 1 2 . 1 1 54 54 SER H H 54 7.800 7.800 7.820 -0.020 25575
462 1 2 . 1 1 55 55 ILE N N 55 117.670 117.670 118.567 -0.897 25575
463 1 2 . 1 1 55 55 ILE HA H 55 4.060 4.060 3.970 0.090 25575
464 1 2 . 1 1 55 55 ILE CA C 55 63.330 63.330 63.637 -0.307 25575
465 1 2 . 1 1 55 55 ILE CB C 55 38.980 38.980 38.639 0.341 25575
466 1 2 . 1 1 55 55 ILE H H 55 7.840 7.840 7.322 0.518 25575
467 1 2 . 1 1 56 56 SER N N 56 115.650 115.650 117.002 -1.352 25575
468 1 2 . 1 1 56 56 SER HA H 56 4.490 4.490 4.110 0.380 25575
469 1 2 . 1 1 56 56 SER CA C 56 60.220 60.220 61.726 -1.506 25575
470 1 2 . 1 1 56 56 SER CB C 56 63.000 63.000 63.243 -0.243 25575
471 1 2 . 1 1 56 56 SER H H 56 8.060 8.060 8.619 -0.559 25575
472 1 2 . 1 1 57 57 GLN N N 57 121.830 121.830 119.131 2.699 25575
473 1 2 . 1 1 57 57 GLN HA H 57 4.200 4.200 4.173 0.027 25575
474 1 2 . 1 1 57 57 GLN CA C 57 58.310 58.310 57.630 0.680 25575
475 1 2 . 1 1 57 57 GLN CB C 57 28.850 28.850 28.631 0.219 25575
476 1 2 . 1 1 57 57 GLN H H 57 8.620 8.620 7.977 0.643 25575
477 1 2 . 1 1 58 58 LYS N N 58 116.960 116.960 117.118 -0.158 25575
478 1 2 . 1 1 58 58 LYS HA H 58 4.290 4.290 4.423 -0.133 25575
479 1 2 . 1 1 58 58 LYS CA C 58 56.920 56.920 55.268 1.652 25575
480 1 2 . 1 1 58 58 LYS CB C 58 32.900 32.900 33.651 -0.751 25575
481 1 2 . 1 1 58 58 LYS H H 58 7.950 7.950 7.733 0.217 25575
482 1 2 . 1 1 59 59 LYS N N 59 116.960 116.960 119.585 -2.625 25575
483 1 2 . 1 1 59 59 LYS HA H 59 4.120 4.120 3.912 0.208 25575
484 1 2 . 1 1 59 59 LYS CA C 59 57.090 57.090 56.711 0.380 25575
485 1 2 . 1 1 59 59 LYS CB C 59 30.080 30.080 30.403 -0.323 25575
486 1 2 . 1 1 59 59 LYS H H 59 7.950 7.950 7.965 -0.015 25575
487 1 2 . 1 1 60 60 LEU N N 60 117.540 117.540 119.023 -1.483 25575
488 1 2 . 1 1 60 60 LEU HA H 60 4.480 4.480 4.303 0.177 25575
489 1 2 . 1 1 60 60 LEU CA C 60 54.500 54.500 55.126 -0.626 25575
490 1 2 . 1 1 60 60 LEU CB C 60 42.840 42.840 42.687 0.153 25575
491 1 2 . 1 1 60 60 LEU H H 60 7.930 7.930 7.386 0.544 25575
492 1 2 . 1 1 61 61 LYS HA H 61 4.390 4.390 4.212 0.178 25575
493 1 2 . 1 1 61 61 LYS CA C 61 55.540 55.540 56.588 -1.048 25575
494 1 2 . 1 1 61 61 LYS CB C 61 30.050 30.050 30.648 -0.598 25575
495 1 2 . 1 1 62 62 LEU N N 62 120.000 120.000 121.707 -1.707 25575
496 1 2 . 1 1 62 62 LEU HA H 62 5.250 5.250 5.197 0.052 25575
497 1 2 . 1 1 62 62 LEU CA C 62 53.080 53.080 53.854 -0.774 25575
498 1 2 . 1 1 62 62 LEU CB C 62 45.760 45.760 43.633 2.127 25575
499 1 2 . 1 1 62 62 LEU H H 62 7.470 7.470 7.821 -0.351 25575
500 1 2 . 1 1 63 63 ASP N N 63 121.730 121.730 124.278 -2.548 25575
501 1 2 . 1 1 63 63 ASP HA H 63 4.860 4.860 4.959 -0.099 25575
502 1 2 . 1 1 63 63 ASP CA C 63 51.890 51.890 52.599 -0.709 25575
503 1 2 . 1 1 63 63 ASP CB C 63 44.910 44.910 45.134 -0.224 25575
504 1 2 . 1 1 63 63 ASP H H 63 8.620 8.620 8.837 -0.217 25575
505 1 2 . 1 1 64 64 ILE N N 64 118.120 118.120 119.556 -1.436 25575
506 1 2 . 1 1 64 64 ILE HA H 64 4.210 4.210 4.463 -0.253 25575
507 1 2 . 1 1 64 64 ILE CA C 64 60.430 60.430 58.772 1.659 25575
508 1 2 . 1 1 64 64 ILE CB C 64 40.420 40.420 39.412 1.008 25575
509 1 2 . 1 1 64 64 ILE H H 64 8.650 8.650 8.278 0.372 25575
510 1 2 . 1 1 65 65 ASP N N 65 124.550 124.550 128.778 -4.228 25575
511 1 2 . 1 1 65 65 ASP HA H 65 4.570 4.570 4.474 0.096 25575
512 1 2 . 1 1 65 65 ASP CA C 65 53.310 53.310 54.267 -0.957 25575
513 1 2 . 1 1 65 65 ASP CB C 65 40.440 40.440 41.714 -1.274 25575
514 1 2 . 1 1 65 65 ASP H H 65 8.630 8.630 8.711 -0.081 25575
515 1 2 . 1 1 66 66 LYS N N 66 125.970 125.970 126.332 -0.362 25575
516 1 2 . 1 1 66 66 LYS HA H 66 4.040 4.040 4.273 -0.233 25575
517 1 2 . 1 1 66 66 LYS CA C 66 58.140 58.140 56.884 1.256 25575
518 1 2 . 1 1 66 66 LYS CB C 66 31.990 31.990 32.253 -0.263 25575
519 1 2 . 1 1 66 66 LYS H H 66 8.590 8.590 8.653 -0.063 25575
520 1 2 . 1 1 67 67 SER N N 67 114.980 114.980 115.021 -0.041 25575
521 1 2 . 1 1 67 67 SER HA H 67 4.320 4.320 4.230 0.090 25575
522 1 2 . 1 1 67 67 SER CA C 67 60.330 60.330 61.253 -0.923 25575
523 1 2 . 1 1 67 67 SER CB C 67 63.710 63.710 63.382 0.328 25575
524 1 2 . 1 1 67 67 SER H H 67 8.760 8.760 8.645 0.115 25575
525 1 2 . 1 1 68 68 VAL HA H 68 4.250 4.250 4.095 0.155 25575
526 1 2 . 1 1 68 68 VAL CA C 68 62.150 62.150 61.946 0.204 25575
527 1 2 . 1 1 68 68 VAL CB C 68 31.900 31.900 32.309 -0.409 25575
528 1 2 . 1 1 69 69 ARG CA C 69 56.960 56.960 57.694 -0.734 25575
529 1 2 . 1 1 70 70 HIS N N 70 116.270 116.270 116.353 -0.083 25575
530 1 2 . 1 1 70 70 HIS HA H 70 4.760 4.760 4.487 0.273 25575
531 1 2 . 1 1 70 70 HIS CA C 70 55.360 55.360 55.917 -0.557 25575
532 1 2 . 1 1 70 70 HIS CB C 70 33.100 33.100 30.445 2.655 25575
533 1 2 . 1 1 70 70 HIS H H 70 7.390 7.390 7.703 -0.313 25575
534 1 2 . 1 1 71 71 LEU N N 71 120.200 120.200 122.828 -2.628 25575
535 1 2 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.550 0.510 25575
536 1 2 . 1 1 71 71 LEU CA C 71 54.070 54.070 54.189 -0.119 25575
537 1 2 . 1 1 71 71 LEU CB C 71 42.710 42.710 40.408 2.302 25575
538 1 2 . 1 1 71 71 LEU H H 71 7.970 7.970 8.507 -0.537 25575
539 1 2 . 1 1 72 72 TYR HA H 72 5.030 5.030 4.880 0.150 25575
540 1 2 . 1 1 72 72 TYR CA C 72 59.990 59.990 57.446 2.544 25575
541 1 2 . 1 1 72 72 TYR CB C 72 39.440 39.440 41.653 -2.213 25575
542 1 2 . 1 1 73 73 ILE N N 73 112.940 112.940 113.564 -0.624 25575
543 1 2 . 1 1 73 73 ILE HA H 73 6.080 6.080 4.864 1.216 25575
544 1 2 . 1 1 73 73 ILE CA C 73 58.090 58.090 58.546 -0.456 25575
545 1 2 . 1 1 73 73 ILE CB C 73 41.820 41.820 42.579 -0.759 25575
546 1 2 . 1 1 73 73 ILE H H 73 8.450 8.450 8.386 0.064 25575
547 1 2 . 1 1 74 74 CYS N N 74 124.730 124.730 117.825 6.905 25575
548 1 2 . 1 1 74 74 CYS HA H 74 5.080 5.080 5.269 -0.189 25575
549 1 2 . 1 1 74 74 CYS CA C 74 57.670 57.670 56.855 0.815 25575
550 1 2 . 1 1 74 74 CYS CB C 74 33.330 33.330 30.738 2.592 25575
551 1 2 . 1 1 74 74 CYS H H 74 9.830 9.830 8.395 1.435 25575
552 1 2 . 1 1 75 75 ASP N N 75 120.990 120.990 122.187 -1.197 25575
553 1 2 . 1 1 75 75 ASP HA H 75 4.590 4.590 4.337 0.253 25575
554 1 2 . 1 1 75 75 ASP CA C 75 57.320 57.320 57.531 -0.211 25575
555 1 2 . 1 1 75 75 ASP CB C 75 39.670 39.670 40.140 -0.470 25575
556 1 2 . 1 1 75 75 ASP H H 75 9.090 9.090 8.913 0.177 25575
557 1 2 . 1 1 76 76 PHE N N 76 122.470 122.470 121.493 0.977 25575
558 1 2 . 1 1 76 76 PHE HA H 76 4.230 4.230 4.198 0.032 25575
559 1 2 . 1 1 76 76 PHE CA C 76 62.030 62.030 61.428 0.601 25575
560 1 2 . 1 1 76 76 PHE CB C 76 38.190 38.190 39.105 -0.915 25575
561 1 2 . 1 1 76 76 PHE H H 76 8.330 8.330 8.214 0.116 25575
562 1 2 . 1 1 77 77 HIS N N 77 124.580 124.580 117.977 6.603 25575
563 1 2 . 1 1 77 77 HIS HA H 77 4.280 4.280 4.283 -0.003 25575
564 1 2 . 1 1 77 77 HIS CA C 77 63.880 63.880 59.566 4.314 25575
565 1 2 . 1 1 77 77 HIS CB C 77 29.600 29.600 30.052 -0.452 25575
566 1 2 . 1 1 77 77 HIS H H 77 10.300 10.300 7.812 2.488 25575
567 1 2 . 1 1 78 78 LYS N N 78 122.930 122.930 120.586 2.344 25575
568 1 2 . 1 1 78 78 LYS HA H 78 3.860 3.860 3.937 -0.077 25575
569 1 2 . 1 1 78 78 LYS CA C 78 60.550 60.550 60.420 0.130 25575
570 1 2 . 1 1 78 78 LYS CB C 78 32.040 32.040 32.454 -0.414 25575
571 1 2 . 1 1 78 78 LYS H H 78 8.960 8.960 8.387 0.573 25575
572 1 2 . 1 1 79 79 ASN N N 79 116.670 116.670 117.977 -1.307 25575
573 1 2 . 1 1 79 79 ASN HA H 79 4.420 4.420 4.662 -0.242 25575
574 1 2 . 1 1 79 79 ASN CA C 79 56.030 56.030 55.901 0.129 25575
575 1 2 . 1 1 79 79 ASN CB C 79 38.100 38.100 38.404 -0.304 25575
576 1 2 . 1 1 79 79 ASN H H 79 8.230 8.230 7.961 0.269 25575
577 1 2 . 1 1 80 80 PHE N N 80 122.600 122.600 121.382 1.218 25575
578 1 2 . 1 1 80 80 PHE HA H 80 4.180 4.180 4.106 0.074 25575
579 1 2 . 1 1 80 80 PHE CA C 80 60.700 60.700 61.398 -0.698 25575
580 1 2 . 1 1 80 80 PHE CB C 80 39.840 39.840 39.063 0.777 25575
581 1 2 . 1 1 80 80 PHE H H 80 8.200 8.200 8.258 -0.058 25575
582 1 2 . 1 1 81 81 ILE N N 81 118.240 118.240 118.193 0.047 25575
583 1 2 . 1 1 81 81 ILE HA H 81 3.320 3.320 3.433 -0.113 25575
584 1 2 . 1 1 81 81 ILE CA C 81 65.160 65.160 65.066 0.094 25575
585 1 2 . 1 1 81 81 ILE CB C 81 38.440 38.440 37.604 0.836 25575
586 1 2 . 1 1 81 81 ILE H H 81 8.520 8.520 8.076 0.444 25575
587 1 2 . 1 1 82 82 GLN N N 82 116.370 116.370 118.892 -2.522 25575
588 1 2 . 1 1 82 82 GLN HA H 82 4.100 4.100 3.904 0.196 25575
589 1 2 . 1 1 82 82 GLN CA C 82 57.710 57.710 59.135 -1.425 25575
590 1 2 . 1 1 82 82 GLN CB C 82 28.710 28.710 28.566 0.144 25575
591 1 2 . 1 1 82 82 GLN H H 82 7.670 7.670 7.819 -0.149 25575
592 1 2 . 1 1 83 83 SER N N 83 114.440 114.440 115.965 -1.525 25575
593 1 2 . 1 1 83 83 SER HA H 83 4.300 4.300 4.111 0.189 25575
594 1 2 . 1 1 83 83 SER CA C 83 60.130 60.130 61.678 -1.548 25575
595 1 2 . 1 1 83 83 SER CB C 83 63.570 63.570 63.035 0.535 25575
596 1 2 . 1 1 83 83 SER H H 83 7.810 7.810 8.458 -0.648 25575
597 1 2 . 1 1 84 84 VAL N N 84 120.750 120.750 117.813 2.937 25575
598 1 2 . 1 1 84 84 VAL HA H 84 3.970 3.970 3.814 0.156 25575
599 1 2 . 1 1 84 84 VAL CA C 84 63.430 63.430 64.935 -1.505 25575
600 1 2 . 1 1 84 84 VAL CB C 84 31.960 31.960 30.883 1.077 25575
601 1 2 . 1 1 84 84 VAL H H 84 7.790 7.790 7.585 0.205 25575
602 1 2 . 1 1 85 85 ARG N N 85 122.090 122.090 120.214 1.876 25575
603 1 2 . 1 1 85 85 ARG HA H 85 4.240 4.240 4.071 0.169 25575
604 1 2 . 1 1 85 85 ARG CA C 85 56.850 56.850 58.538 -1.688 25575
605 1 2 . 1 1 85 85 ARG CB C 85 30.720 30.720 30.389 0.331 25575
606 1 2 . 1 1 85 85 ARG H H 85 8.090 8.090 7.443 0.647 25575
607 1 2 . 1 1 86 86 ASN N N 86 118.510 118.510 117.657 0.853 25575
608 1 2 . 1 1 86 86 ASN HA H 86 4.690 4.690 4.587 0.103 25575
609 1 2 . 1 1 86 86 ASN CA C 86 53.380 53.380 54.893 -1.513 25575
610 1 2 . 1 1 86 86 ASN CB C 86 38.950 38.950 38.891 0.059 25575
611 1 2 . 1 1 86 86 ASN H H 86 8.220 8.220 8.120 0.100 25575
612 1 2 . 1 1 87 87 LYS N N 87 121.600 121.600 118.087 3.513 25575
613 1 2 . 1 1 87 87 LYS HA H 87 4.310 4.310 3.826 0.484 25575
614 1 2 . 1 1 87 87 LYS CA C 87 56.590 56.590 56.744 -0.154 25575
615 1 2 . 1 1 87 87 LYS CB C 87 32.870 32.870 31.313 1.557 25575
616 1 2 . 1 1 87 87 LYS H H 87 8.150 8.150 7.628 0.522 25575
617 1 2 . 1 1 88 88 ARG N N 88 121.920 121.920 119.050 2.870 25575
618 1 2 . 1 1 88 88 ARG HA H 88 4.330 4.330 4.109 0.221 25575
619 1 2 . 1 1 88 88 ARG CA C 88 56.110 56.110 56.889 -0.779 25575
620 1 2 . 1 1 88 88 ARG CB C 88 30.870 30.870 30.370 0.500 25575
621 1 2 . 1 1 88 88 ARG H H 88 8.250 8.250 8.021 0.229 25575
622 1 2 . 1 1 89 89 LYS N N 89 123.020 123.020 124.353 -1.333 25575
623 1 2 . 1 1 89 89 LYS HA H 89 4.320 4.320 4.014 0.306 25575
624 1 2 . 1 1 89 89 LYS CA C 89 56.330 56.330 58.340 -2.010 25575
625 1 2 . 1 1 89 89 LYS CB C 89 33.140 33.140 32.742 0.398 25575
626 1 2 . 1 1 89 89 LYS H H 89 8.320 8.320 8.509 -0.189 25575
627 1 2 . 1 1 90 90 ARG N N 90 122.970 122.970 116.232 6.738 25575
628 1 2 . 1 1 90 90 ARG HA H 90 4.360 4.360 4.419 -0.059 25575
629 1 2 . 1 1 90 90 ARG CA C 90 56.100 56.100 55.048 1.052 25575
630 1 2 . 1 1 90 90 ARG CB C 90 31.210 31.210 31.432 -0.222 25575
631 1 2 . 1 1 90 90 ARG H H 90 8.360 8.360 7.470 0.890 25575
632 1 2 . 1 1 91 91 LYS N N 91 123.680 123.680 121.099 2.581 25575
633 1 2 . 1 1 91 91 LYS HA H 91 4.380 4.380 4.559 -0.179 25575
634 1 2 . 1 1 91 91 LYS CA C 91 56.620 56.620 57.373 -0.753 25575
635 1 2 . 1 1 91 91 LYS CB C 91 33.070 33.070 33.444 -0.374 25575
636 1 2 . 1 1 91 91 LYS H H 91 8.450 8.450 8.854 -0.404 25575
637 1 3 . 1 1 24 24 SER HA H 24 4.330 4.330 4.544 -0.214 25575
638 1 3 . 1 1 24 24 SER CA C 24 58.130 58.130 58.763 -0.632 25575
639 1 3 . 1 1 24 24 SER CB C 24 63.870 63.870 64.096 -0.226 25575
640 1 3 . 1 1 25 25 TYR N N 25 122.160 122.160 123.869 -1.709 25575
641 1 3 . 1 1 25 25 TYR HA H 25 4.530 4.530 4.522 0.008 25575
642 1 3 . 1 1 25 25 TYR CA C 25 58.420 58.420 58.239 0.181 25575
643 1 3 . 1 1 25 25 TYR CB C 25 38.570 38.570 38.647 -0.077 25575
644 1 3 . 1 1 25 25 TYR H H 25 8.310 8.310 9.168 -0.858 25575
645 1 3 . 1 1 26 26 GLY N N 26 111.370 111.370 106.890 4.480 25575
646 1 3 . 1 1 26 26 GLY CA C 26 45.330 45.330 45.097 0.233 25575
647 1 3 . 1 1 26 26 GLY H H 26 8.300 8.300 8.018 0.282 25575
648 1 3 . 1 1 27 27 GLN N N 27 118.910 118.910 119.170 -0.260 25575
649 1 3 . 1 1 27 27 GLN HA H 27 4.510 4.510 4.658 -0.148 25575
650 1 3 . 1 1 27 27 GLN CA C 27 55.240 55.240 54.041 1.199 25575
651 1 3 . 1 1 27 27 GLN CB C 27 29.800 29.800 30.901 -1.101 25575
652 1 3 . 1 1 27 27 GLN H H 27 8.050 8.050 8.065 -0.015 25575
653 1 3 . 1 1 28 28 SER N N 28 119.460 119.460 114.740 4.720 25575
654 1 3 . 1 1 28 28 SER HA H 28 4.810 4.810 4.975 -0.165 25575
655 1 3 . 1 1 28 28 SER CA C 28 57.710 57.710 57.112 0.598 25575
656 1 3 . 1 1 28 28 SER CB C 28 65.530 65.530 65.540 -0.009 25575
657 1 3 . 1 1 28 28 SER H H 28 8.800 8.800 8.246 0.554 25575
658 1 3 . 1 1 29 29 CYS N N 29 122.160 122.160 118.683 3.477 25575
659 1 3 . 1 1 29 29 CYS HA H 29 4.130 4.130 4.410 -0.280 25575
660 1 3 . 1 1 29 29 CYS CA C 29 60.620 60.620 61.712 -1.092 25575
661 1 3 . 1 1 29 29 CYS CB C 29 32.770 32.770 28.982 3.788 25575
662 1 3 . 1 1 29 29 CYS H H 29 8.390 8.390 8.454 -0.064 25575
663 1 3 . 1 1 30 30 CYS N N 30 122.320 122.320 119.281 3.039 25575
664 1 3 . 1 1 30 30 CYS HA H 30 4.530 4.530 4.732 -0.202 25575
665 1 3 . 1 1 30 30 CYS CA C 30 58.810 58.810 57.961 0.849 25575
666 1 3 . 1 1 30 30 CYS CB C 30 28.910 28.910 27.705 1.205 25575
667 1 3 . 1 1 30 30 CYS H H 30 8.340 8.340 8.550 -0.210 25575
668 1 3 . 1 1 31 31 LEU N N 31 122.390 122.390 121.422 0.968 25575
669 1 3 . 1 1 31 31 LEU HA H 31 4.640 4.640 4.852 -0.212 25575
670 1 3 . 1 1 31 31 LEU CA C 31 55.440 55.440 54.539 0.901 25575
671 1 3 . 1 1 31 31 LEU CB C 31 43.490 43.490 42.852 0.638 25575
672 1 3 . 1 1 31 31 LEU H H 31 8.460 8.460 7.157 1.303 25575
673 1 3 . 1 1 32 32 ILE N N 32 118.890 118.890 117.193 1.697 25575
674 1 3 . 1 1 32 32 ILE HA H 32 4.200 4.200 4.701 -0.501 25575
675 1 3 . 1 1 32 32 ILE CA C 32 60.440 60.440 60.080 0.360 25575
676 1 3 . 1 1 32 32 ILE CB C 32 39.890 39.890 41.940 -2.050 25575
677 1 3 . 1 1 32 32 ILE H H 32 8.680 8.680 8.458 0.222 25575
678 1 3 . 1 1 33 33 GLU N N 33 128.400 128.400 126.494 1.906 25575
679 1 3 . 1 1 33 33 GLU HA H 33 5.080 5.080 5.087 -0.007 25575
680 1 3 . 1 1 33 33 GLU CA C 33 54.120 54.120 55.096 -0.976 25575
681 1 3 . 1 1 33 33 GLU CB C 33 32.080 32.080 32.456 -0.376 25575
682 1 3 . 1 1 33 33 GLU H H 33 8.640 8.640 8.448 0.192 25575
683 1 3 . 1 1 34 34 ASP N N 34 130.390 130.390 127.005 3.385 25575
684 1 3 . 1 1 34 34 ASP HA H 34 4.310 4.310 4.296 0.014 25575
685 1 3 . 1 1 34 34 ASP CA C 34 55.150 55.150 55.934 -0.784 25575
686 1 3 . 1 1 34 34 ASP CB C 34 40.050 40.050 40.651 -0.601 25575
687 1 3 . 1 1 34 34 ASP H H 34 9.540 9.540 8.802 0.738 25575
688 1 3 . 1 1 35 35 GLY N N 35 126.620 126.620 104.209 22.411 25575
689 1 3 . 1 1 35 35 GLY CA C 35 45.480 45.480 44.924 0.556 25575
690 1 3 . 1 1 35 35 GLY H H 35 8.370 8.370 8.157 0.213 25575
691 1 3 . 1 1 36 36 GLU N N 36 120.860 120.860 123.747 -2.887 25575
692 1 3 . 1 1 36 36 GLU HA H 36 4.670 4.670 4.176 0.494 25575
693 1 3 . 1 1 36 36 GLU CA C 36 54.350 54.350 55.553 -1.203 25575
694 1 3 . 1 1 36 36 GLU CB C 36 31.630 31.630 29.621 2.009 25575
695 1 3 . 1 1 36 36 GLU H H 36 7.820 7.820 7.911 -0.091 25575
696 1 3 . 1 1 37 37 ARG N N 37 129.790 129.790 127.363 2.427 25575
697 1 3 . 1 1 37 37 ARG HA H 37 4.200 4.200 4.320 -0.120 25575
698 1 3 . 1 1 37 37 ARG CA C 37 56.440 56.440 55.026 1.414 25575
699 1 3 . 1 1 37 37 ARG CB C 37 29.710 29.710 28.379 1.331 25575
700 1 3 . 1 1 37 37 ARG H H 37 8.930 8.930 8.156 0.774 25575
701 1 3 . 1 1 38 38 CYS N N 38 130.950 130.950 125.179 5.771 25575
702 1 3 . 1 1 38 38 CYS HA H 38 4.450 4.450 4.251 0.199 25575
703 1 3 . 1 1 38 38 CYS CA C 38 60.560 60.560 60.333 0.227 25575
704 1 3 . 1 1 38 38 CYS CB C 38 31.250 31.250 28.267 2.983 25575
705 1 3 . 1 1 38 38 CYS H H 38 9.050 9.050 8.408 0.642 25575
706 1 3 . 1 1 39 39 VAL N N 39 118.270 118.270 121.195 -2.925 25575
707 1 3 . 1 1 39 39 VAL HA H 39 4.710 4.710 4.422 0.288 25575
708 1 3 . 1 1 39 39 VAL CA C 39 60.340 60.340 60.855 -0.515 25575
709 1 3 . 1 1 39 39 VAL CB C 39 31.290 31.290 31.971 -0.680 25575
710 1 3 . 1 1 39 39 VAL H H 39 8.060 8.060 8.378 -0.318 25575
711 1 3 . 1 1 40 40 ARG N N 40 127.360 127.360 122.809 4.551 25575
712 1 3 . 1 1 40 40 ARG HA H 40 4.430 4.430 4.404 0.026 25575
713 1 3 . 1 1 40 40 ARG CA C 40 56.150 56.150 54.327 1.823 25575
714 1 3 . 1 1 40 40 ARG CB C 40 29.210 29.210 29.546 -0.336 25575
715 1 3 . 1 1 40 40 ARG H H 40 8.950 8.950 7.691 1.259 25575
716 1 3 . 1 1 41 41 PRO HA H 41 4.430 4.430 4.557 -0.127 25575
717 1 3 . 1 1 41 41 PRO CA C 41 62.690 62.690 62.559 0.131 25575
718 1 3 . 1 1 41 41 PRO CB C 41 32.010 32.010 32.164 -0.155 25575
719 1 3 . 1 1 42 42 ALA N N 42 124.260 124.260 127.346 -3.086 25575
720 1 3 . 1 1 42 42 ALA HA H 42 3.620 3.620 4.453 -0.833 25575
721 1 3 . 1 1 42 42 ALA CA C 42 52.930 52.930 52.048 0.882 25575
722 1 3 . 1 1 42 42 ALA CB C 42 19.130 19.130 19.898 -0.768 25575
723 1 3 . 1 1 42 42 ALA H H 42 8.410 8.410 7.678 0.732 25575
724 1 3 . 1 1 43 43 GLY N N 43 112.690 112.690 110.201 2.489 25575
725 1 3 . 1 1 43 43 GLY CA C 43 44.240 44.240 43.762 0.478 25575
726 1 3 . 1 1 43 43 GLY H H 43 8.090 8.090 7.990 0.100 25575
727 1 3 . 1 1 44 44 ASN N N 44 116.980 116.980 120.641 -3.661 25575
728 1 3 . 1 1 44 44 ASN HA H 44 4.690 4.690 4.712 -0.022 25575
729 1 3 . 1 1 44 44 ASN CA C 44 53.420 53.420 53.127 0.293 25575
730 1 3 . 1 1 44 44 ASN CB C 44 39.370 39.370 36.650 2.720 25575
731 1 3 . 1 1 44 44 ASN H H 44 8.720 8.720 8.655 0.065 25575
732 1 3 . 1 1 45 45 ALA N N 45 124.240 124.240 122.998 1.242 25575
733 1 3 . 1 1 45 45 ALA HA H 45 4.640 4.640 4.774 -0.134 25575
734 1 3 . 1 1 45 45 ALA CA C 45 52.240 52.240 51.654 0.586 25575
735 1 3 . 1 1 45 45 ALA CB C 45 19.540 19.540 21.728 -2.188 25575
736 1 3 . 1 1 45 45 ALA H H 45 8.770 8.770 8.050 0.720 25575
737 1 3 . 1 1 46 46 SER N N 46 111.670 111.670 117.143 -5.473 25575
738 1 3 . 1 1 46 46 SER HA H 46 5.300 5.300 4.769 0.531 25575
739 1 3 . 1 1 46 46 SER CA C 46 56.580 56.580 56.836 -0.256 25575
740 1 3 . 1 1 46 46 SER CB C 46 66.490 66.490 65.629 0.861 25575
741 1 3 . 1 1 46 46 SER H H 46 8.060 8.060 8.324 -0.264 25575
742 1 3 . 1 1 47 47 PHE HA H 47 4.520 4.520 4.519 0.001 25575
743 1 3 . 1 1 47 47 PHE CA C 47 57.000 57.000 56.964 0.036 25575
744 1 3 . 1 1 47 47 PHE CB C 47 38.360 38.360 38.435 -0.075 25575
745 1 3 . 1 1 48 48 SER N N 48 116.970 116.970 119.124 -2.154 25575
746 1 3 . 1 1 48 48 SER HA H 48 4.440 4.440 4.375 0.065 25575
747 1 3 . 1 1 48 48 SER CA C 48 56.950 56.950 58.335 -1.385 25575
748 1 3 . 1 1 48 48 SER CB C 48 65.810 65.810 63.901 1.909 25575
749 1 3 . 1 1 48 48 SER H H 48 7.100 7.100 7.707 -0.607 25575
750 1 3 . 1 1 49 49 LYS N N 49 120.650 120.650 126.588 -5.938 25575
751 1 3 . 1 1 49 49 LYS HA H 49 3.900 3.900 3.917 -0.017 25575
752 1 3 . 1 1 49 49 LYS CA C 49 59.570 59.570 59.553 0.017 25575
753 1 3 . 1 1 49 49 LYS CB C 49 31.790 31.790 32.474 -0.684 25575
754 1 3 . 1 1 49 49 LYS H H 49 8.770 8.770 8.844 -0.074 25575
755 1 3 . 1 1 50 50 ARG N N 50 118.240 118.240 118.113 0.127 25575
756 1 3 . 1 1 50 50 ARG HA H 50 4.040 4.040 4.045 -0.005 25575
757 1 3 . 1 1 50 50 ARG CA C 50 59.070 59.070 58.517 0.553 25575
758 1 3 . 1 1 50 50 ARG CB C 50 30.080 30.080 29.893 0.187 25575
759 1 3 . 1 1 50 50 ARG H H 50 8.040 8.040 7.994 0.046 25575
760 1 3 . 1 1 51 51 VAL N N 51 121.680 121.680 118.627 3.053 25575
761 1 3 . 1 1 51 51 VAL HA H 51 3.590 3.590 3.539 0.051 25575
762 1 3 . 1 1 51 51 VAL CA C 51 65.940 65.940 65.625 0.315 25575
763 1 3 . 1 1 51 51 VAL CB C 51 31.620 31.620 31.107 0.513 25575
764 1 3 . 1 1 51 51 VAL H H 51 7.350 7.350 8.167 -0.817 25575
765 1 3 . 1 1 52 52 GLN N N 52 119.680 119.680 117.848 1.832 25575
766 1 3 . 1 1 52 52 GLN HA H 52 3.570 3.570 3.944 -0.374 25575
767 1 3 . 1 1 52 52 GLN CA C 52 59.210 59.210 59.125 0.085 25575
768 1 3 . 1 1 52 52 GLN CB C 52 28.620 28.620 28.059 0.561 25575
769 1 3 . 1 1 52 52 GLN H H 52 8.210 8.210 7.935 0.275 25575
770 1 3 . 1 1 53 53 LYS N N 53 118.080 118.080 119.808 -1.728 25575
771 1 3 . 1 1 53 53 LYS HA H 53 4.160 4.160 3.932 0.228 25575
772 1 3 . 1 1 53 53 LYS CA C 53 58.670 58.670 59.878 -1.208 25575
773 1 3 . 1 1 53 53 LYS CB C 53 32.120 32.120 31.926 0.194 25575
774 1 3 . 1 1 53 53 LYS H H 53 7.960 7.960 7.681 0.279 25575
775 1 3 . 1 1 54 54 SER N N 54 115.450 115.450 114.563 0.887 25575
776 1 3 . 1 1 54 54 SER HA H 54 4.370 4.370 4.158 0.212 25575
777 1 3 . 1 1 54 54 SER CA C 54 61.330 61.330 61.253 0.077 25575
778 1 3 . 1 1 54 54 SER CB C 54 63.690 63.690 62.820 0.870 25575
779 1 3 . 1 1 54 54 SER H H 54 7.800 7.800 7.713 0.087 25575
780 1 3 . 1 1 55 55 ILE N N 55 117.670 117.670 119.087 -1.417 25575
781 1 3 . 1 1 55 55 ILE HA H 55 4.060 4.060 3.812 0.248 25575
782 1 3 . 1 1 55 55 ILE CA C 55 63.330 63.330 64.567 -1.237 25575
783 1 3 . 1 1 55 55 ILE CB C 55 38.980 38.980 38.223 0.757 25575
784 1 3 . 1 1 55 55 ILE H H 55 7.840 7.840 7.358 0.482 25575
785 1 3 . 1 1 56 56 SER N N 56 115.650 115.650 116.416 -0.766 25575
786 1 3 . 1 1 56 56 SER HA H 56 4.490 4.490 4.110 0.380 25575
787 1 3 . 1 1 56 56 SER CA C 56 60.220 60.220 61.742 -1.522 25575
788 1 3 . 1 1 56 56 SER CB C 56 63.000 63.000 62.937 0.063 25575
789 1 3 . 1 1 56 56 SER H H 56 8.060 8.060 8.266 -0.206 25575
790 1 3 . 1 1 57 57 GLN N N 57 121.830 121.830 119.792 2.038 25575
791 1 3 . 1 1 57 57 GLN HA H 57 4.200 4.200 4.165 0.035 25575
792 1 3 . 1 1 57 57 GLN CA C 57 58.310 58.310 57.825 0.485 25575
793 1 3 . 1 1 57 57 GLN CB C 57 28.850 28.850 28.302 0.548 25575
794 1 3 . 1 1 57 57 GLN H H 57 8.620 8.620 8.533 0.087 25575
795 1 3 . 1 1 58 58 LYS N N 58 116.960 116.960 120.121 -3.161 25575
796 1 3 . 1 1 58 58 LYS HA H 58 4.290 4.290 4.469 -0.179 25575
797 1 3 . 1 1 58 58 LYS CA C 58 56.920 56.920 54.716 2.204 25575
798 1 3 . 1 1 58 58 LYS CB C 58 32.900 32.900 33.895 -0.995 25575
799 1 3 . 1 1 58 58 LYS H H 58 7.950 7.950 7.955 -0.005 25575
800 1 3 . 1 1 59 59 LYS N N 59 116.960 116.960 120.905 -3.945 25575
801 1 3 . 1 1 59 59 LYS HA H 59 4.120 4.120 3.928 0.192 25575
802 1 3 . 1 1 59 59 LYS CA C 59 57.090 57.090 57.017 0.072 25575
803 1 3 . 1 1 59 59 LYS CB C 59 30.080 30.080 30.986 -0.906 25575
804 1 3 . 1 1 59 59 LYS H H 59 7.950 7.950 7.695 0.255 25575
805 1 3 . 1 1 60 60 LEU N N 60 117.540 117.540 121.650 -4.110 25575
806 1 3 . 1 1 60 60 LEU HA H 60 4.480 4.480 4.491 -0.011 25575
807 1 3 . 1 1 60 60 LEU CA C 60 54.500 54.500 54.791 -0.291 25575
808 1 3 . 1 1 60 60 LEU CB C 60 42.840 42.840 43.082 -0.242 25575
809 1 3 . 1 1 60 60 LEU H H 60 7.930 7.930 8.299 -0.369 25575
810 1 3 . 1 1 61 61 LYS HA H 61 4.390 4.390 4.487 -0.097 25575
811 1 3 . 1 1 61 61 LYS CA C 61 55.540 55.540 55.542 -0.002 25575
812 1 3 . 1 1 61 61 LYS CB C 61 30.050 30.050 32.959 -2.909 25575
813 1 3 . 1 1 62 62 LEU N N 62 120.000 120.000 121.091 -1.091 25575
814 1 3 . 1 1 62 62 LEU HA H 62 5.250 5.250 4.901 0.349 25575
815 1 3 . 1 1 62 62 LEU CA C 62 53.080 53.080 54.772 -1.692 25575
816 1 3 . 1 1 62 62 LEU CB C 62 45.760 45.760 42.266 3.494 25575
817 1 3 . 1 1 62 62 LEU H H 62 7.470 7.470 7.877 -0.407 25575
818 1 3 . 1 1 63 63 ASP N N 63 121.730 121.730 125.230 -3.500 25575
819 1 3 . 1 1 63 63 ASP HA H 63 4.860 4.860 4.836 0.024 25575
820 1 3 . 1 1 63 63 ASP CA C 63 51.890 51.890 52.005 -0.115 25575
821 1 3 . 1 1 63 63 ASP CB C 63 44.910 44.910 44.979 -0.069 25575
822 1 3 . 1 1 63 63 ASP H H 63 8.620 8.620 8.787 -0.167 25575
823 1 3 . 1 1 64 64 ILE N N 64 118.120 118.120 119.339 -1.219 25575
824 1 3 . 1 1 64 64 ILE HA H 64 4.210 4.210 4.372 -0.162 25575
825 1 3 . 1 1 64 64 ILE CA C 64 60.430 60.430 58.530 1.900 25575
826 1 3 . 1 1 64 64 ILE CB C 64 40.420 40.420 39.980 0.440 25575
827 1 3 . 1 1 64 64 ILE H H 64 8.650 8.650 8.221 0.429 25575
828 1 3 . 1 1 65 65 ASP N N 65 124.550 124.550 128.304 -3.754 25575
829 1 3 . 1 1 65 65 ASP HA H 65 4.570 4.570 4.509 0.061 25575
830 1 3 . 1 1 65 65 ASP CA C 65 53.310 53.310 53.817 -0.507 25575
831 1 3 . 1 1 65 65 ASP CB C 65 40.440 40.440 40.639 -0.199 25575
832 1 3 . 1 1 65 65 ASP H H 65 8.630 8.630 8.620 0.010 25575
833 1 3 . 1 1 66 66 LYS N N 66 125.970 125.970 125.379 0.591 25575
834 1 3 . 1 1 66 66 LYS HA H 66 4.040 4.040 4.168 -0.128 25575
835 1 3 . 1 1 66 66 LYS CA C 66 58.140 58.140 57.631 0.509 25575
836 1 3 . 1 1 66 66 LYS CB C 66 31.990 31.990 32.458 -0.468 25575
837 1 3 . 1 1 66 66 LYS H H 66 8.590 8.590 8.275 0.315 25575
838 1 3 . 1 1 67 67 SER N N 67 114.980 114.980 115.627 -0.647 25575
839 1 3 . 1 1 67 67 SER HA H 67 4.320 4.320 4.225 0.095 25575
840 1 3 . 1 1 67 67 SER CA C 67 60.330 60.330 61.132 -0.802 25575
841 1 3 . 1 1 67 67 SER CB C 67 63.710 63.710 63.250 0.460 25575
842 1 3 . 1 1 67 67 SER H H 67 8.760 8.760 8.451 0.309 25575
843 1 3 . 1 1 68 68 VAL HA H 68 4.250 4.250 4.034 0.216 25575
844 1 3 . 1 1 68 68 VAL CA C 68 62.150 62.150 62.539 -0.389 25575
845 1 3 . 1 1 68 68 VAL CB C 68 31.900 31.900 31.977 -0.077 25575
846 1 3 . 1 1 69 69 ARG CA C 69 56.960 56.960 57.779 -0.819 25575
847 1 3 . 1 1 70 70 HIS N N 70 116.270 116.270 117.567 -1.297 25575
848 1 3 . 1 1 70 70 HIS HA H 70 4.760 4.760 4.568 0.192 25575
849 1 3 . 1 1 70 70 HIS CA C 70 55.360 55.360 54.716 0.644 25575
850 1 3 . 1 1 70 70 HIS CB C 70 33.100 33.100 30.596 2.504 25575
851 1 3 . 1 1 70 70 HIS H H 70 7.390 7.390 8.252 -0.862 25575
852 1 3 . 1 1 71 71 LEU N N 71 120.200 120.200 123.642 -3.442 25575
853 1 3 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.482 0.578 25575
854 1 3 . 1 1 71 71 LEU CA C 71 54.070 54.070 54.254 -0.184 25575
855 1 3 . 1 1 71 71 LEU CB C 71 42.710 42.710 40.295 2.415 25575
856 1 3 . 1 1 71 71 LEU H H 71 7.970 7.970 8.486 -0.516 25575
857 1 3 . 1 1 72 72 TYR HA H 72 5.030 5.030 4.902 0.128 25575
858 1 3 . 1 1 72 72 TYR CA C 72 59.990 59.990 57.285 2.705 25575
859 1 3 . 1 1 72 72 TYR CB C 72 39.440 39.440 41.992 -2.551 25575
860 1 3 . 1 1 73 73 ILE N N 73 112.940 112.940 113.921 -0.981 25575
861 1 3 . 1 1 73 73 ILE HA H 73 6.080 6.080 4.820 1.260 25575
862 1 3 . 1 1 73 73 ILE CA C 73 58.090 58.090 58.636 -0.546 25575
863 1 3 . 1 1 73 73 ILE CB C 73 41.820 41.820 42.441 -0.621 25575
864 1 3 . 1 1 73 73 ILE H H 73 8.450 8.450 8.124 0.326 25575
865 1 3 . 1 1 74 74 CYS N N 74 124.730 124.730 119.116 5.614 25575
866 1 3 . 1 1 74 74 CYS HA H 74 5.080 5.080 5.002 0.078 25575
867 1 3 . 1 1 74 74 CYS CA C 74 57.670 57.670 57.901 -0.231 25575
868 1 3 . 1 1 74 74 CYS CB C 74 33.330 33.330 29.509 3.821 25575
869 1 3 . 1 1 74 74 CYS H H 74 9.830 9.830 8.614 1.216 25575
870 1 3 . 1 1 75 75 ASP N N 75 120.990 120.990 123.218 -2.228 25575
871 1 3 . 1 1 75 75 ASP HA H 75 4.590 4.590 4.418 0.172 25575
872 1 3 . 1 1 75 75 ASP CA C 75 57.320 57.320 57.761 -0.441 25575
873 1 3 . 1 1 75 75 ASP CB C 75 39.670 39.670 40.737 -1.067 25575
874 1 3 . 1 1 75 75 ASP H H 75 9.090 9.090 9.113 -0.023 25575
875 1 3 . 1 1 76 76 PHE N N 76 122.470 122.470 119.546 2.924 25575
876 1 3 . 1 1 76 76 PHE HA H 76 4.230 4.230 4.191 0.039 25575
877 1 3 . 1 1 76 76 PHE CA C 76 62.030 62.030 62.048 -0.018 25575
878 1 3 . 1 1 76 76 PHE CB C 76 38.190 38.190 39.200 -1.010 25575
879 1 3 . 1 1 76 76 PHE H H 76 8.330 8.330 8.244 0.086 25575
880 1 3 . 1 1 77 77 HIS N N 77 124.580 124.580 118.225 6.355 25575
881 1 3 . 1 1 77 77 HIS HA H 77 4.280 4.280 4.380 -0.100 25575
882 1 3 . 1 1 77 77 HIS CA C 77 63.880 63.880 59.588 4.292 25575
883 1 3 . 1 1 77 77 HIS CB C 77 29.600 29.600 30.126 -0.526 25575
884 1 3 . 1 1 77 77 HIS H H 77 10.300 10.300 7.894 2.406 25575
885 1 3 . 1 1 78 78 LYS N N 78 122.930 122.930 120.017 2.913 25575
886 1 3 . 1 1 78 78 LYS HA H 78 3.860 3.860 3.951 -0.091 25575
887 1 3 . 1 1 78 78 LYS CA C 78 60.550 60.550 60.073 0.477 25575
888 1 3 . 1 1 78 78 LYS CB C 78 32.040 32.040 32.525 -0.485 25575
889 1 3 . 1 1 78 78 LYS H H 78 8.960 8.960 8.703 0.257 25575
890 1 3 . 1 1 79 79 ASN N N 79 116.670 116.670 117.298 -0.628 25575
891 1 3 . 1 1 79 79 ASN HA H 79 4.420 4.420 4.530 -0.110 25575
892 1 3 . 1 1 79 79 ASN CA C 79 56.030 56.030 55.971 0.059 25575
893 1 3 . 1 1 79 79 ASN CB C 79 38.100 38.100 38.475 -0.375 25575
894 1 3 . 1 1 79 79 ASN H H 79 8.230 8.230 7.856 0.374 25575
895 1 3 . 1 1 80 80 PHE N N 80 122.600 122.600 122.275 0.325 25575
896 1 3 . 1 1 80 80 PHE HA H 80 4.180 4.180 4.183 -0.003 25575
897 1 3 . 1 1 80 80 PHE CA C 80 60.700 60.700 61.384 -0.684 25575
898 1 3 . 1 1 80 80 PHE CB C 80 39.840 39.840 39.165 0.675 25575
899 1 3 . 1 1 80 80 PHE H H 80 8.200 8.200 8.057 0.143 25575
900 1 3 . 1 1 81 81 ILE N N 81 118.240 118.240 118.627 -0.387 25575
901 1 3 . 1 1 81 81 ILE HA H 81 3.320 3.320 3.427 -0.107 25575
902 1 3 . 1 1 81 81 ILE CA C 81 65.160 65.160 65.408 -0.248 25575
903 1 3 . 1 1 81 81 ILE CB C 81 38.440 38.440 37.685 0.755 25575
904 1 3 . 1 1 81 81 ILE H H 81 8.520 8.520 8.303 0.217 25575
905 1 3 . 1 1 82 82 GLN N N 82 116.370 116.370 118.984 -2.614 25575
906 1 3 . 1 1 82 82 GLN HA H 82 4.100 4.100 3.991 0.109 25575
907 1 3 . 1 1 82 82 GLN CA C 82 57.710 57.710 58.944 -1.234 25575
908 1 3 . 1 1 82 82 GLN CB C 82 28.710 28.710 28.131 0.579 25575
909 1 3 . 1 1 82 82 GLN H H 82 7.670 7.670 7.808 -0.138 25575
910 1 3 . 1 1 83 83 SER N N 83 114.440 114.440 116.263 -1.823 25575
911 1 3 . 1 1 83 83 SER HA H 83 4.300 4.300 4.130 0.170 25575
912 1 3 . 1 1 83 83 SER CA C 83 60.130 60.130 62.593 -2.463 25575
913 1 3 . 1 1 83 83 SER CB C 83 63.570 63.570 62.969 0.601 25575
914 1 3 . 1 1 83 83 SER H H 83 7.810 7.810 8.537 -0.727 25575
915 1 3 . 1 1 84 84 VAL N N 84 120.750 120.750 118.260 2.490 25575
916 1 3 . 1 1 84 84 VAL HA H 84 3.970 3.970 3.827 0.143 25575
917 1 3 . 1 1 84 84 VAL CA C 84 63.430 63.430 65.010 -1.580 25575
918 1 3 . 1 1 84 84 VAL CB C 84 31.960 31.960 31.302 0.658 25575
919 1 3 . 1 1 84 84 VAL H H 84 7.790 7.790 7.772 0.018 25575
920 1 3 . 1 1 85 85 ARG N N 85 122.090 122.090 119.283 2.807 25575
921 1 3 . 1 1 85 85 ARG HA H 85 4.240 4.240 4.012 0.228 25575
922 1 3 . 1 1 85 85 ARG CA C 85 56.850 56.850 58.453 -1.603 25575
923 1 3 . 1 1 85 85 ARG CB C 85 30.720 30.720 30.010 0.710 25575
924 1 3 . 1 1 85 85 ARG H H 85 8.090 8.090 8.121 -0.031 25575
925 1 3 . 1 1 86 86 ASN N N 86 118.510 118.510 116.732 1.778 25575
926 1 3 . 1 1 86 86 ASN HA H 86 4.690 4.690 4.652 0.038 25575
927 1 3 . 1 1 86 86 ASN CA C 86 53.380 53.380 54.761 -1.381 25575
928 1 3 . 1 1 86 86 ASN CB C 86 38.950 38.950 38.900 0.050 25575
929 1 3 . 1 1 86 86 ASN H H 86 8.220 8.220 8.054 0.166 25575
930 1 3 . 1 1 87 87 LYS N N 87 121.600 121.600 122.559 -0.959 25575
931 1 3 . 1 1 87 87 LYS HA H 87 4.310 4.310 4.257 0.053 25575
932 1 3 . 1 1 87 87 LYS CA C 87 56.590 56.590 54.907 1.683 25575
933 1 3 . 1 1 87 87 LYS CB C 87 32.870 32.870 31.706 1.164 25575
934 1 3 . 1 1 87 87 LYS H H 87 8.150 8.150 7.798 0.352 25575
935 1 3 . 1 1 88 88 ARG N N 88 121.920 121.920 125.917 -3.997 25575
936 1 3 . 1 1 88 88 ARG HA H 88 4.330 4.330 4.044 0.286 25575
937 1 3 . 1 1 88 88 ARG CA C 88 56.110 56.110 57.307 -1.197 25575
938 1 3 . 1 1 88 88 ARG CB C 88 30.870 30.870 28.372 2.498 25575
939 1 3 . 1 1 88 88 ARG H H 88 8.250 8.250 8.139 0.111 25575
940 1 3 . 1 1 89 89 LYS N N 89 123.020 123.020 123.710 -0.690 25575
941 1 3 . 1 1 89 89 LYS HA H 89 4.320 4.320 4.520 -0.200 25575
942 1 3 . 1 1 89 89 LYS CA C 89 56.330 56.330 55.284 1.046 25575
943 1 3 . 1 1 89 89 LYS CB C 89 33.140 33.140 33.728 -0.588 25575
944 1 3 . 1 1 89 89 LYS H H 89 8.320 8.320 8.120 0.200 25575
945 1 3 . 1 1 90 90 ARG N N 90 122.970 122.970 123.057 -0.087 25575
946 1 3 . 1 1 90 90 ARG HA H 90 4.360 4.360 4.360 0.000 25575
947 1 3 . 1 1 90 90 ARG CA C 90 56.100 56.100 55.761 0.339 25575
948 1 3 . 1 1 90 90 ARG CB C 90 31.210 31.210 30.971 0.239 25575
949 1 3 . 1 1 90 90 ARG H H 90 8.360 8.360 8.510 -0.150 25575
950 1 3 . 1 1 91 91 LYS N N 91 123.680 123.680 120.163 3.517 25575
951 1 3 . 1 1 91 91 LYS HA H 91 4.380 4.380 4.609 -0.229 25575
952 1 3 . 1 1 91 91 LYS CA C 91 56.620 56.620 56.390 0.230 25575
953 1 3 . 1 1 91 91 LYS CB C 91 33.070 33.070 33.269 -0.199 25575
954 1 3 . 1 1 91 91 LYS H H 91 8.450 8.450 8.482 -0.032 25575
955 1 4 . 1 1 24 24 SER HA H 24 4.330 4.330 5.049 -0.719 25575
956 1 4 . 1 1 24 24 SER CA C 24 58.130 58.130 57.787 0.343 25575
957 1 4 . 1 1 24 24 SER CB C 24 63.870 63.870 65.576 -1.706 25575
958 1 4 . 1 1 25 25 TYR N N 25 122.160 122.160 123.397 -1.237 25575
959 1 4 . 1 1 25 25 TYR HA H 25 4.530 4.530 4.710 -0.180 25575
960 1 4 . 1 1 25 25 TYR CA C 25 58.420 58.420 59.070 -0.650 25575
961 1 4 . 1 1 25 25 TYR CB C 25 38.570 38.570 40.173 -1.603 25575
962 1 4 . 1 1 25 25 TYR H H 25 8.310 8.310 8.427 -0.117 25575
963 1 4 . 1 1 26 26 GLY N N 26 111.370 111.370 111.267 0.103 25575
964 1 4 . 1 1 26 26 GLY CA C 26 45.330 45.330 44.895 0.435 25575
965 1 4 . 1 1 26 26 GLY H H 26 8.300 8.300 8.226 0.074 25575
966 1 4 . 1 1 27 27 GLN N N 27 118.910 118.910 123.370 -4.460 25575
967 1 4 . 1 1 27 27 GLN HA H 27 4.510 4.510 4.321 0.189 25575
968 1 4 . 1 1 27 27 GLN CA C 27 55.240 55.240 54.979 0.261 25575
969 1 4 . 1 1 27 27 GLN CB C 27 29.800 29.800 27.767 2.033 25575
970 1 4 . 1 1 27 27 GLN H H 27 8.050 8.050 8.679 -0.629 25575
971 1 4 . 1 1 28 28 SER N N 28 119.460 119.460 113.382 6.078 25575
972 1 4 . 1 1 28 28 SER HA H 28 4.810 4.810 5.160 -0.350 25575
973 1 4 . 1 1 28 28 SER CA C 28 57.710 57.710 56.255 1.455 25575
974 1 4 . 1 1 28 28 SER CB C 28 65.530 65.530 65.771 -0.241 25575
975 1 4 . 1 1 28 28 SER H H 28 8.800 8.800 7.708 1.092 25575
976 1 4 . 1 1 29 29 CYS N N 29 122.160 122.160 118.873 3.287 25575
977 1 4 . 1 1 29 29 CYS HA H 29 4.130 4.130 4.393 -0.263 25575
978 1 4 . 1 1 29 29 CYS CA C 29 60.620 60.620 60.968 -0.348 25575
979 1 4 . 1 1 29 29 CYS CB C 29 32.770 32.770 29.108 3.662 25575
980 1 4 . 1 1 29 29 CYS H H 29 8.390 8.390 8.529 -0.139 25575
981 1 4 . 1 1 30 30 CYS N N 30 122.320 122.320 120.705 1.615 25575
982 1 4 . 1 1 30 30 CYS HA H 30 4.530 4.530 4.756 -0.226 25575
983 1 4 . 1 1 30 30 CYS CA C 30 58.810 58.810 58.180 0.630 25575
984 1 4 . 1 1 30 30 CYS CB C 30 28.910 28.910 27.860 1.050 25575
985 1 4 . 1 1 30 30 CYS H H 30 8.340 8.340 8.626 -0.286 25575
986 1 4 . 1 1 31 31 LEU N N 31 122.390 122.390 121.734 0.656 25575
987 1 4 . 1 1 31 31 LEU HA H 31 4.640 4.640 4.697 -0.057 25575
988 1 4 . 1 1 31 31 LEU CA C 31 55.440 55.440 54.895 0.545 25575
989 1 4 . 1 1 31 31 LEU CB C 31 43.490 43.490 42.822 0.668 25575
990 1 4 . 1 1 31 31 LEU H H 31 8.460 8.460 7.156 1.304 25575
991 1 4 . 1 1 32 32 ILE N N 32 118.890 118.890 118.845 0.045 25575
992 1 4 . 1 1 32 32 ILE HA H 32 4.200 4.200 4.737 -0.537 25575
993 1 4 . 1 1 32 32 ILE CA C 32 60.440 60.440 60.159 0.281 25575
994 1 4 . 1 1 32 32 ILE CB C 32 39.890 39.890 41.410 -1.520 25575
995 1 4 . 1 1 32 32 ILE H H 32 8.680 8.680 8.460 0.220 25575
996 1 4 . 1 1 33 33 GLU N N 33 128.400 128.400 126.736 1.664 25575
997 1 4 . 1 1 33 33 GLU HA H 33 5.080 5.080 5.021 0.059 25575
998 1 4 . 1 1 33 33 GLU CA C 33 54.120 54.120 54.910 -0.790 25575
999 1 4 . 1 1 33 33 GLU CB C 33 32.080 32.080 32.607 -0.527 25575
1000 1 4 . 1 1 33 33 GLU H H 33 8.640 8.640 8.501 0.139 25575
1001 1 4 . 1 1 34 34 ASP N N 34 130.390 130.390 127.858 2.532 25575
1002 1 4 . 1 1 34 34 ASP HA H 34 4.310 4.310 4.233 0.077 25575
1003 1 4 . 1 1 34 34 ASP CA C 34 55.150 55.150 57.415 -2.265 25575
1004 1 4 . 1 1 34 34 ASP CB C 34 40.050 40.050 40.575 -0.525 25575
1005 1 4 . 1 1 34 34 ASP H H 34 9.540 9.540 8.670 0.870 25575
1006 1 4 . 1 1 35 35 GLY N N 35 126.620 126.620 103.475 23.145 25575
1007 1 4 . 1 1 35 35 GLY CA C 35 45.480 45.480 45.101 0.379 25575
1008 1 4 . 1 1 35 35 GLY H H 35 8.370 8.370 7.851 0.519 25575
1009 1 4 . 1 1 36 36 GLU N N 36 120.860 120.860 123.517 -2.657 25575
1010 1 4 . 1 1 36 36 GLU HA H 36 4.670 4.670 4.191 0.479 25575
1011 1 4 . 1 1 36 36 GLU CA C 36 54.350 54.350 56.110 -1.760 25575
1012 1 4 . 1 1 36 36 GLU CB C 36 31.630 31.630 29.706 1.924 25575
1013 1 4 . 1 1 36 36 GLU H H 36 7.820 7.820 7.939 -0.119 25575
1014 1 4 . 1 1 37 37 ARG N N 37 129.790 129.790 126.910 2.880 25575
1015 1 4 . 1 1 37 37 ARG HA H 37 4.200 4.200 4.252 -0.052 25575
1016 1 4 . 1 1 37 37 ARG CA C 37 56.440 56.440 55.497 0.943 25575
1017 1 4 . 1 1 37 37 ARG CB C 37 29.710 29.710 29.181 0.529 25575
1018 1 4 . 1 1 37 37 ARG H H 37 8.930 8.930 8.518 0.412 25575
1019 1 4 . 1 1 38 38 CYS N N 38 130.950 130.950 127.094 3.856 25575
1020 1 4 . 1 1 38 38 CYS HA H 38 4.450 4.450 4.362 0.088 25575
1021 1 4 . 1 1 38 38 CYS CA C 38 60.560 60.560 60.236 0.324 25575
1022 1 4 . 1 1 38 38 CYS CB C 38 31.250 31.250 28.115 3.135 25575
1023 1 4 . 1 1 38 38 CYS H H 38 9.050 9.050 8.295 0.755 25575
1024 1 4 . 1 1 39 39 VAL N N 39 118.270 118.270 120.929 -2.659 25575
1025 1 4 . 1 1 39 39 VAL HA H 39 4.710 4.710 4.386 0.324 25575
1026 1 4 . 1 1 39 39 VAL CA C 39 60.340 60.340 60.666 -0.326 25575
1027 1 4 . 1 1 39 39 VAL CB C 39 31.290 31.290 31.822 -0.532 25575
1028 1 4 . 1 1 39 39 VAL H H 39 8.060 8.060 8.084 -0.024 25575
1029 1 4 . 1 1 40 40 ARG N N 40 127.360 127.360 122.915 4.445 25575
1030 1 4 . 1 1 40 40 ARG HA H 40 4.430 4.430 4.278 0.152 25575
1031 1 4 . 1 1 40 40 ARG CA C 40 56.150 56.150 55.379 0.771 25575
1032 1 4 . 1 1 40 40 ARG CB C 40 29.210 29.210 29.468 -0.258 25575
1033 1 4 . 1 1 40 40 ARG H H 40 8.950 8.950 7.728 1.222 25575
1034 1 4 . 1 1 41 41 PRO HA H 41 4.430 4.430 4.463 -0.033 25575
1035 1 4 . 1 1 41 41 PRO CA C 41 62.690 62.690 62.906 -0.215 25575
1036 1 4 . 1 1 41 41 PRO CB C 41 32.010 32.010 32.087 -0.077 25575
1037 1 4 . 1 1 42 42 ALA N N 42 124.260 124.260 125.626 -1.366 25575
1038 1 4 . 1 1 42 42 ALA HA H 42 3.620 3.620 4.375 -0.755 25575
1039 1 4 . 1 1 42 42 ALA CA C 42 52.930 52.930 51.320 1.610 25575
1040 1 4 . 1 1 42 42 ALA CB C 42 19.130 19.130 20.229 -1.099 25575
1041 1 4 . 1 1 42 42 ALA H H 42 8.410 8.410 8.237 0.173 25575
1042 1 4 . 1 1 43 43 GLY N N 43 112.690 112.690 106.846 5.844 25575
1043 1 4 . 1 1 43 43 GLY CA C 43 44.240 44.240 45.087 -0.847 25575
1044 1 4 . 1 1 43 43 GLY H H 43 8.090 8.090 7.971 0.119 25575
1045 1 4 . 1 1 44 44 ASN N N 44 116.980 116.980 121.327 -4.347 25575
1046 1 4 . 1 1 44 44 ASN HA H 44 4.690 4.690 4.692 -0.002 25575
1047 1 4 . 1 1 44 44 ASN CA C 44 53.420 53.420 53.688 -0.268 25575
1048 1 4 . 1 1 44 44 ASN CB C 44 39.370 39.370 37.723 1.647 25575
1049 1 4 . 1 1 44 44 ASN H H 44 8.720 8.720 8.653 0.067 25575
1050 1 4 . 1 1 45 45 ALA N N 45 124.240 124.240 122.748 1.492 25575
1051 1 4 . 1 1 45 45 ALA HA H 45 4.640 4.640 4.750 -0.110 25575
1052 1 4 . 1 1 45 45 ALA CA C 45 52.240 52.240 51.120 1.120 25575
1053 1 4 . 1 1 45 45 ALA CB C 45 19.540 19.540 21.554 -2.014 25575
1054 1 4 . 1 1 45 45 ALA H H 45 8.770 8.770 7.908 0.862 25575
1055 1 4 . 1 1 46 46 SER N N 46 111.670 111.670 117.586 -5.916 25575
1056 1 4 . 1 1 46 46 SER HA H 46 5.300 5.300 4.790 0.510 25575
1057 1 4 . 1 1 46 46 SER CA C 46 56.580 56.580 56.979 -0.399 25575
1058 1 4 . 1 1 46 46 SER CB C 46 66.490 66.490 65.830 0.660 25575
1059 1 4 . 1 1 46 46 SER H H 46 8.060 8.060 8.368 -0.308 25575
1060 1 4 . 1 1 47 47 PHE HA H 47 4.520 4.520 4.484 0.036 25575
1061 1 4 . 1 1 47 47 PHE CA C 47 57.000 57.000 57.046 -0.046 25575
1062 1 4 . 1 1 47 47 PHE CB C 47 38.360 38.360 37.679 0.681 25575
1063 1 4 . 1 1 48 48 SER N N 48 116.970 116.970 117.842 -0.872 25575
1064 1 4 . 1 1 48 48 SER HA H 48 4.440 4.440 4.232 0.208 25575
1065 1 4 . 1 1 48 48 SER CA C 48 56.950 56.950 59.229 -2.279 25575
1066 1 4 . 1 1 48 48 SER CB C 48 65.810 65.810 64.064 1.746 25575
1067 1 4 . 1 1 48 48 SER H H 48 7.100 7.100 7.720 -0.620 25575
1068 1 4 . 1 1 49 49 LYS N N 49 120.650 120.650 125.037 -4.387 25575
1069 1 4 . 1 1 49 49 LYS HA H 49 3.900 3.900 3.825 0.075 25575
1070 1 4 . 1 1 49 49 LYS CA C 49 59.570 59.570 59.601 -0.031 25575
1071 1 4 . 1 1 49 49 LYS CB C 49 31.790 31.790 32.022 -0.232 25575
1072 1 4 . 1 1 49 49 LYS H H 49 8.770 8.770 8.704 0.066 25575
1073 1 4 . 1 1 50 50 ARG N N 50 118.240 118.240 117.633 0.607 25575
1074 1 4 . 1 1 50 50 ARG HA H 50 4.040 4.040 4.008 0.032 25575
1075 1 4 . 1 1 50 50 ARG CA C 50 59.070 59.070 58.562 0.508 25575
1076 1 4 . 1 1 50 50 ARG CB C 50 30.080 30.080 29.411 0.669 25575
1077 1 4 . 1 1 50 50 ARG H H 50 8.040 8.040 8.216 -0.176 25575
1078 1 4 . 1 1 51 51 VAL N N 51 121.680 121.680 120.081 1.599 25575
1079 1 4 . 1 1 51 51 VAL HA H 51 3.590 3.590 3.568 0.022 25575
1080 1 4 . 1 1 51 51 VAL CA C 51 65.940 65.940 65.402 0.538 25575
1081 1 4 . 1 1 51 51 VAL CB C 51 31.620 31.620 31.600 0.020 25575
1082 1 4 . 1 1 51 51 VAL H H 51 7.350 7.350 8.009 -0.659 25575
1083 1 4 . 1 1 52 52 GLN N N 52 119.680 119.680 118.660 1.020 25575
1084 1 4 . 1 1 52 52 GLN HA H 52 3.570 3.570 3.687 -0.117 25575
1085 1 4 . 1 1 52 52 GLN CA C 52 59.210 59.210 59.261 -0.051 25575
1086 1 4 . 1 1 52 52 GLN CB C 52 28.620 28.620 28.116 0.504 25575
1087 1 4 . 1 1 52 52 GLN H H 52 8.210 8.210 7.555 0.655 25575
1088 1 4 . 1 1 53 53 LYS N N 53 118.080 118.080 119.495 -1.415 25575
1089 1 4 . 1 1 53 53 LYS HA H 53 4.160 4.160 3.949 0.211 25575
1090 1 4 . 1 1 53 53 LYS CA C 53 58.670 58.670 59.453 -0.783 25575
1091 1 4 . 1 1 53 53 LYS CB C 53 32.120 32.120 32.087 0.033 25575
1092 1 4 . 1 1 53 53 LYS H H 53 7.960 7.960 7.637 0.323 25575
1093 1 4 . 1 1 54 54 SER N N 54 115.450 115.450 115.169 0.281 25575
1094 1 4 . 1 1 54 54 SER HA H 54 4.370 4.370 4.181 0.189 25575
1095 1 4 . 1 1 54 54 SER CA C 54 61.330 61.330 61.255 0.075 25575
1096 1 4 . 1 1 54 54 SER CB C 54 63.690 63.690 62.884 0.806 25575
1097 1 4 . 1 1 54 54 SER H H 54 7.800 7.800 7.572 0.228 25575
1098 1 4 . 1 1 55 55 ILE N N 55 117.670 117.670 121.529 -3.859 25575
1099 1 4 . 1 1 55 55 ILE HA H 55 4.060 4.060 3.666 0.394 25575
1100 1 4 . 1 1 55 55 ILE CA C 55 63.330 63.330 65.114 -1.784 25575
1101 1 4 . 1 1 55 55 ILE CB C 55 38.980 38.980 38.066 0.914 25575
1102 1 4 . 1 1 55 55 ILE H H 55 7.840 7.840 7.411 0.429 25575
1103 1 4 . 1 1 56 56 SER N N 56 115.650 115.650 115.332 0.318 25575
1104 1 4 . 1 1 56 56 SER HA H 56 4.490 4.490 4.066 0.424 25575
1105 1 4 . 1 1 56 56 SER CA C 56 60.220 60.220 61.842 -1.621 25575
1106 1 4 . 1 1 56 56 SER CB C 56 63.000 63.000 63.159 -0.159 25575
1107 1 4 . 1 1 56 56 SER H H 56 8.060 8.060 8.475 -0.415 25575
1108 1 4 . 1 1 57 57 GLN N N 57 121.830 121.830 120.014 1.816 25575
1109 1 4 . 1 1 57 57 GLN HA H 57 4.200 4.200 4.091 0.109 25575
1110 1 4 . 1 1 57 57 GLN CA C 57 58.310 58.310 58.141 0.169 25575
1111 1 4 . 1 1 57 57 GLN CB C 57 28.850 28.850 28.776 0.074 25575
1112 1 4 . 1 1 57 57 GLN H H 57 8.620 8.620 7.982 0.638 25575
1113 1 4 . 1 1 58 58 LYS N N 58 116.960 116.960 117.181 -0.221 25575
1114 1 4 . 1 1 58 58 LYS HA H 58 4.290 4.290 4.248 0.042 25575
1115 1 4 . 1 1 58 58 LYS CA C 58 56.920 56.920 55.211 1.709 25575
1116 1 4 . 1 1 58 58 LYS CB C 58 32.900 32.900 32.773 0.127 25575
1117 1 4 . 1 1 58 58 LYS H H 58 7.950 7.950 7.416 0.534 25575
1118 1 4 . 1 1 59 59 LYS N N 59 116.960 116.960 119.835 -2.875 25575
1119 1 4 . 1 1 59 59 LYS HA H 59 4.120 4.120 3.961 0.159 25575
1120 1 4 . 1 1 59 59 LYS CA C 59 57.090 57.090 57.027 0.063 25575
1121 1 4 . 1 1 59 59 LYS CB C 59 30.080 30.080 30.221 -0.141 25575
1122 1 4 . 1 1 59 59 LYS H H 59 7.950 7.950 7.806 0.144 25575
1123 1 4 . 1 1 60 60 LEU N N 60 117.540 117.540 119.034 -1.494 25575
1124 1 4 . 1 1 60 60 LEU HA H 60 4.480 4.480 4.261 0.219 25575
1125 1 4 . 1 1 60 60 LEU CA C 60 54.500 54.500 55.748 -1.248 25575
1126 1 4 . 1 1 60 60 LEU CB C 60 42.840 42.840 42.485 0.355 25575
1127 1 4 . 1 1 60 60 LEU H H 60 7.930 7.930 7.457 0.473 25575
1128 1 4 . 1 1 61 61 LYS HA H 61 4.390 4.390 4.529 -0.139 25575
1129 1 4 . 1 1 61 61 LYS CA C 61 55.540 55.540 55.579 -0.039 25575
1130 1 4 . 1 1 61 61 LYS CB C 61 30.050 30.050 33.112 -3.062 25575
1131 1 4 . 1 1 62 62 LEU N N 62 120.000 120.000 122.983 -2.983 25575
1132 1 4 . 1 1 62 62 LEU HA H 62 5.250 5.250 5.217 0.033 25575
1133 1 4 . 1 1 62 62 LEU CA C 62 53.080 53.080 54.158 -1.079 25575
1134 1 4 . 1 1 62 62 LEU CB C 62 45.760 45.760 43.732 2.028 25575
1135 1 4 . 1 1 62 62 LEU H H 62 7.470 7.470 8.074 -0.604 25575
1136 1 4 . 1 1 63 63 ASP N N 63 121.730 121.730 126.900 -5.170 25575
1137 1 4 . 1 1 63 63 ASP HA H 63 4.860 4.860 4.991 -0.131 25575
1138 1 4 . 1 1 63 63 ASP CA C 63 51.890 51.890 52.860 -0.970 25575
1139 1 4 . 1 1 63 63 ASP CB C 63 44.910 44.910 44.256 0.654 25575
1140 1 4 . 1 1 63 63 ASP H H 63 8.620 8.620 8.783 -0.163 25575
1141 1 4 . 1 1 64 64 ILE N N 64 118.120 118.120 119.551 -1.431 25575
1142 1 4 . 1 1 64 64 ILE HA H 64 4.210 4.210 4.401 -0.191 25575
1143 1 4 . 1 1 64 64 ILE CA C 64 60.430 60.430 58.627 1.803 25575
1144 1 4 . 1 1 64 64 ILE CB C 64 40.420 40.420 39.008 1.412 25575
1145 1 4 . 1 1 64 64 ILE H H 64 8.650 8.650 8.271 0.379 25575
1146 1 4 . 1 1 65 65 ASP N N 65 124.550 124.550 128.474 -3.924 25575
1147 1 4 . 1 1 65 65 ASP HA H 65 4.570 4.570 4.497 0.073 25575
1148 1 4 . 1 1 65 65 ASP CA C 65 53.310 53.310 54.133 -0.823 25575
1149 1 4 . 1 1 65 65 ASP CB C 65 40.440 40.440 41.394 -0.954 25575
1150 1 4 . 1 1 65 65 ASP H H 65 8.630 8.630 8.609 0.021 25575
1151 1 4 . 1 1 66 66 LYS N N 66 125.970 125.970 126.319 -0.349 25575
1152 1 4 . 1 1 66 66 LYS HA H 66 4.040 4.040 4.140 -0.100 25575
1153 1 4 . 1 1 66 66 LYS CA C 66 58.140 58.140 57.564 0.576 25575
1154 1 4 . 1 1 66 66 LYS CB C 66 31.990 31.990 32.163 -0.172 25575
1155 1 4 . 1 1 66 66 LYS H H 66 8.590 8.590 8.608 -0.018 25575
1156 1 4 . 1 1 67 67 SER N N 67 114.980 114.980 116.237 -1.257 25575
1157 1 4 . 1 1 67 67 SER HA H 67 4.320 4.320 4.225 0.095 25575
1158 1 4 . 1 1 67 67 SER CA C 67 60.330 60.330 61.101 -0.771 25575
1159 1 4 . 1 1 67 67 SER CB C 67 63.710 63.710 63.236 0.474 25575
1160 1 4 . 1 1 67 67 SER H H 67 8.760 8.760 8.646 0.114 25575
1161 1 4 . 1 1 68 68 VAL HA H 68 4.250 4.250 3.953 0.297 25575
1162 1 4 . 1 1 68 68 VAL CA C 68 62.150 62.150 62.194 -0.044 25575
1163 1 4 . 1 1 68 68 VAL CB C 68 31.900 31.900 31.898 0.002 25575
1164 1 4 . 1 1 69 69 ARG CA C 69 56.960 56.960 57.096 -0.136 25575
1165 1 4 . 1 1 70 70 HIS N N 70 116.270 116.270 114.727 1.543 25575
1166 1 4 . 1 1 70 70 HIS HA H 70 4.760 4.760 4.809 -0.049 25575
1167 1 4 . 1 1 70 70 HIS CA C 70 55.360 55.360 53.528 1.832 25575
1168 1 4 . 1 1 70 70 HIS CB C 70 33.100 33.100 31.659 1.441 25575
1169 1 4 . 1 1 70 70 HIS H H 70 7.390 7.390 8.124 -0.734 25575
1170 1 4 . 1 1 71 71 LEU N N 71 120.200 120.200 121.786 -1.586 25575
1171 1 4 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.545 0.515 25575
1172 1 4 . 1 1 71 71 LEU CA C 71 54.070 54.070 54.455 -0.385 25575
1173 1 4 . 1 1 71 71 LEU CB C 71 42.710 42.710 40.561 2.149 25575
1174 1 4 . 1 1 71 71 LEU H H 71 7.970 7.970 8.491 -0.521 25575
1175 1 4 . 1 1 72 72 TYR HA H 72 5.030 5.030 4.763 0.267 25575
1176 1 4 . 1 1 72 72 TYR CA C 72 59.990 59.990 57.335 2.655 25575
1177 1 4 . 1 1 72 72 TYR CB C 72 39.440 39.440 41.494 -2.054 25575
1178 1 4 . 1 1 73 73 ILE N N 73 112.940 112.940 114.201 -1.261 25575
1179 1 4 . 1 1 73 73 ILE HA H 73 6.080 6.080 4.814 1.266 25575
1180 1 4 . 1 1 73 73 ILE CA C 73 58.090 58.090 58.502 -0.412 25575
1181 1 4 . 1 1 73 73 ILE CB C 73 41.820 41.820 42.474 -0.654 25575
1182 1 4 . 1 1 73 73 ILE H H 73 8.450 8.450 8.059 0.391 25575
1183 1 4 . 1 1 74 74 CYS N N 74 124.730 124.730 119.467 5.263 25575
1184 1 4 . 1 1 74 74 CYS HA H 74 5.080 5.080 4.984 0.096 25575
1185 1 4 . 1 1 74 74 CYS CA C 74 57.670 57.670 57.915 -0.245 25575
1186 1 4 . 1 1 74 74 CYS CB C 74 33.330 33.330 29.343 3.987 25575
1187 1 4 . 1 1 74 74 CYS H H 74 9.830 9.830 8.581 1.249 25575
1188 1 4 . 1 1 75 75 ASP N N 75 120.990 120.990 123.618 -2.628 25575
1189 1 4 . 1 1 75 75 ASP HA H 75 4.590 4.590 4.418 0.172 25575
1190 1 4 . 1 1 75 75 ASP CA C 75 57.320 57.320 58.291 -0.971 25575
1191 1 4 . 1 1 75 75 ASP CB C 75 39.670 39.670 40.735 -1.065 25575
1192 1 4 . 1 1 75 75 ASP H H 75 9.090 9.090 9.261 -0.171 25575
1193 1 4 . 1 1 76 76 PHE N N 76 122.470 122.470 119.638 2.832 25575
1194 1 4 . 1 1 76 76 PHE HA H 76 4.230 4.230 4.219 0.011 25575
1195 1 4 . 1 1 76 76 PHE CA C 76 62.030 62.030 62.087 -0.057 25575
1196 1 4 . 1 1 76 76 PHE CB C 76 38.190 38.190 39.272 -1.082 25575
1197 1 4 . 1 1 76 76 PHE H H 76 8.330 8.330 8.149 0.181 25575
1198 1 4 . 1 1 77 77 HIS N N 77 124.580 124.580 118.415 6.165 25575
1199 1 4 . 1 1 77 77 HIS HA H 77 4.280 4.280 4.358 -0.078 25575
1200 1 4 . 1 1 77 77 HIS CA C 77 63.880 63.880 59.895 3.985 25575
1201 1 4 . 1 1 77 77 HIS CB C 77 29.600 29.600 30.085 -0.485 25575
1202 1 4 . 1 1 77 77 HIS H H 77 10.300 10.300 7.860 2.440 25575
1203 1 4 . 1 1 78 78 LYS N N 78 122.930 122.930 119.320 3.610 25575
1204 1 4 . 1 1 78 78 LYS HA H 78 3.860 3.860 3.998 -0.138 25575
1205 1 4 . 1 1 78 78 LYS CA C 78 60.550 60.550 59.764 0.786 25575
1206 1 4 . 1 1 78 78 LYS CB C 78 32.040 32.040 32.408 -0.368 25575
1207 1 4 . 1 1 78 78 LYS H H 78 8.960 8.960 8.564 0.396 25575
1208 1 4 . 1 1 79 79 ASN N N 79 116.670 116.670 117.212 -0.542 25575
1209 1 4 . 1 1 79 79 ASN HA H 79 4.420 4.420 4.489 -0.069 25575
1210 1 4 . 1 1 79 79 ASN CA C 79 56.030 56.030 55.890 0.140 25575
1211 1 4 . 1 1 79 79 ASN CB C 79 38.100 38.100 38.506 -0.406 25575
1212 1 4 . 1 1 79 79 ASN H H 79 8.230 8.230 7.626 0.604 25575
1213 1 4 . 1 1 80 80 PHE N N 80 122.600 122.600 121.890 0.710 25575
1214 1 4 . 1 1 80 80 PHE HA H 80 4.180 4.180 4.192 -0.012 25575
1215 1 4 . 1 1 80 80 PHE CA C 80 60.700 60.700 61.407 -0.708 25575
1216 1 4 . 1 1 80 80 PHE CB C 80 39.840 39.840 39.200 0.640 25575
1217 1 4 . 1 1 80 80 PHE H H 80 8.200 8.200 7.744 0.456 25575
1218 1 4 . 1 1 81 81 ILE N N 81 118.240 118.240 115.860 2.380 25575
1219 1 4 . 1 1 81 81 ILE HA H 81 3.320 3.320 3.636 -0.316 25575
1220 1 4 . 1 1 81 81 ILE CA C 81 65.160 65.160 63.512 1.648 25575
1221 1 4 . 1 1 81 81 ILE CB C 81 38.440 38.440 37.347 1.093 25575
1222 1 4 . 1 1 81 81 ILE H H 81 8.520 8.520 7.995 0.525 25575
1223 1 4 . 1 1 82 82 GLN N N 82 116.370 116.370 118.470 -2.100 25575
1224 1 4 . 1 1 82 82 GLN HA H 82 4.100 4.100 4.369 -0.269 25575
1225 1 4 . 1 1 82 82 GLN CA C 82 57.710 57.710 56.395 1.315 25575
1226 1 4 . 1 1 82 82 GLN CB C 82 28.710 28.710 29.111 -0.402 25575
1227 1 4 . 1 1 82 82 GLN H H 82 7.670 7.670 7.906 -0.236 25575
1228 1 4 . 1 1 83 83 SER N N 83 114.440 114.440 116.475 -2.035 25575
1229 1 4 . 1 1 83 83 SER HA H 83 4.300 4.300 4.200 0.100 25575
1230 1 4 . 1 1 83 83 SER CA C 83 60.130 60.130 61.565 -1.435 25575
1231 1 4 . 1 1 83 83 SER CB C 83 63.570 63.570 63.136 0.434 25575
1232 1 4 . 1 1 83 83 SER H H 83 7.810 7.810 8.372 -0.562 25575
1233 1 4 . 1 1 84 84 VAL N N 84 120.750 120.750 117.956 2.794 25575
1234 1 4 . 1 1 84 84 VAL HA H 84 3.970 3.970 3.760 0.210 25575
1235 1 4 . 1 1 84 84 VAL CA C 84 63.430 63.430 65.434 -2.004 25575
1236 1 4 . 1 1 84 84 VAL CB C 84 31.960 31.960 30.640 1.321 25575
1237 1 4 . 1 1 84 84 VAL H H 84 7.790 7.790 7.372 0.418 25575
1238 1 4 . 1 1 85 85 ARG N N 85 122.090 122.090 119.670 2.420 25575
1239 1 4 . 1 1 85 85 ARG HA H 85 4.240 4.240 3.991 0.249 25575
1240 1 4 . 1 1 85 85 ARG CA C 85 56.850 56.850 58.595 -1.745 25575
1241 1 4 . 1 1 85 85 ARG CB C 85 30.720 30.720 29.498 1.222 25575
1242 1 4 . 1 1 85 85 ARG H H 85 8.090 8.090 7.558 0.532 25575
1243 1 4 . 1 1 86 86 ASN N N 86 118.510 118.510 115.749 2.761 25575
1244 1 4 . 1 1 86 86 ASN HA H 86 4.690 4.690 4.683 0.007 25575
1245 1 4 . 1 1 86 86 ASN CA C 86 53.380 53.380 54.498 -1.118 25575
1246 1 4 . 1 1 86 86 ASN CB C 86 38.950 38.950 39.176 -0.226 25575
1247 1 4 . 1 1 86 86 ASN H H 86 8.220 8.220 7.670 0.550 25575
1248 1 4 . 1 1 87 87 LYS N N 87 121.600 121.600 120.636 0.964 25575
1249 1 4 . 1 1 87 87 LYS HA H 87 4.310 4.310 4.542 -0.232 25575
1250 1 4 . 1 1 87 87 LYS CA C 87 56.590 56.590 55.603 0.987 25575
1251 1 4 . 1 1 87 87 LYS CB C 87 32.870 32.870 31.674 1.196 25575
1252 1 4 . 1 1 87 87 LYS H H 87 8.150 8.150 7.335 0.815 25575
1253 1 4 . 1 1 88 88 ARG N N 88 121.920 121.920 121.451 0.469 25575
1254 1 4 . 1 1 88 88 ARG HA H 88 4.330 4.330 4.521 -0.191 25575
1255 1 4 . 1 1 88 88 ARG CA C 88 56.110 56.110 55.187 0.923 25575
1256 1 4 . 1 1 88 88 ARG CB C 88 30.870 30.870 32.028 -1.158 25575
1257 1 4 . 1 1 88 88 ARG H H 88 8.250 8.250 7.862 0.388 25575
1258 1 4 . 1 1 89 89 LYS N N 89 123.020 123.020 120.259 2.761 25575
1259 1 4 . 1 1 89 89 LYS HA H 89 4.320 4.320 4.071 0.249 25575
1260 1 4 . 1 1 89 89 LYS CA C 89 56.330 56.330 57.887 -1.557 25575
1261 1 4 . 1 1 89 89 LYS CB C 89 33.140 33.140 32.575 0.565 25575
1262 1 4 . 1 1 89 89 LYS H H 89 8.320 8.320 8.508 -0.188 25575
1263 1 4 . 1 1 90 90 ARG N N 90 122.970 122.970 117.990 4.980 25575
1264 1 4 . 1 1 90 90 ARG HA H 90 4.360 4.360 4.402 -0.042 25575
1265 1 4 . 1 1 90 90 ARG CA C 90 56.100 56.100 55.263 0.837 25575
1266 1 4 . 1 1 90 90 ARG CB C 90 31.210 31.210 32.372 -1.162 25575
1267 1 4 . 1 1 90 90 ARG H H 90 8.360 8.360 7.592 0.768 25575
1268 1 4 . 1 1 91 91 LYS N N 91 123.680 123.680 124.142 -0.462 25575
1269 1 4 . 1 1 91 91 LYS HA H 91 4.380 4.380 4.252 0.128 25575
1270 1 4 . 1 1 91 91 LYS CA C 91 56.620 56.620 56.702 -0.082 25575
1271 1 4 . 1 1 91 91 LYS CB C 91 33.070 33.070 32.221 0.849 25575
1272 1 4 . 1 1 91 91 LYS H H 91 8.450 8.450 8.591 -0.141 25575
1273 1 5 . 1 1 24 24 SER HA H 24 4.330 4.330 4.177 0.153 25575
1274 1 5 . 1 1 24 24 SER CA C 24 58.130 58.130 58.308 -0.178 25575
1275 1 5 . 1 1 24 24 SER CB C 24 63.870 63.870 62.894 0.976 25575
1276 1 5 . 1 1 25 25 TYR N N 25 122.160 122.160 122.020 0.140 25575
1277 1 5 . 1 1 25 25 TYR HA H 25 4.530 4.530 4.218 0.312 25575
1278 1 5 . 1 1 25 25 TYR CA C 25 58.420 58.420 58.339 0.081 25575
1279 1 5 . 1 1 25 25 TYR CB C 25 38.570 38.570 37.025 1.545 25575
1280 1 5 . 1 1 25 25 TYR H H 25 8.310 8.310 8.376 -0.066 25575
1281 1 5 . 1 1 26 26 GLY N N 26 111.370 111.370 106.344 5.026 25575
1282 1 5 . 1 1 26 26 GLY CA C 26 45.330 45.330 44.467 0.863 25575
1283 1 5 . 1 1 26 26 GLY H H 26 8.300 8.300 7.420 0.880 25575
1284 1 5 . 1 1 27 27 GLN N N 27 118.910 118.910 123.606 -4.696 25575
1285 1 5 . 1 1 27 27 GLN HA H 27 4.510 4.510 4.278 0.232 25575
1286 1 5 . 1 1 27 27 GLN CA C 27 55.240 55.240 55.450 -0.210 25575
1287 1 5 . 1 1 27 27 GLN CB C 27 29.800 29.800 27.696 2.104 25575
1288 1 5 . 1 1 27 27 GLN H H 27 8.050 8.050 8.555 -0.505 25575
1289 1 5 . 1 1 28 28 SER N N 28 119.460 119.460 114.503 4.957 25575
1290 1 5 . 1 1 28 28 SER HA H 28 4.810 4.810 5.176 -0.366 25575
1291 1 5 . 1 1 28 28 SER CA C 28 57.710 57.710 56.392 1.318 25575
1292 1 5 . 1 1 28 28 SER CB C 28 65.530 65.530 65.960 -0.430 25575
1293 1 5 . 1 1 28 28 SER H H 28 8.800 8.800 7.947 0.853 25575
1294 1 5 . 1 1 29 29 CYS N N 29 122.160 122.160 119.240 2.920 25575
1295 1 5 . 1 1 29 29 CYS HA H 29 4.130 4.130 4.468 -0.338 25575
1296 1 5 . 1 1 29 29 CYS CA C 29 60.620 60.620 62.039 -1.419 25575
1297 1 5 . 1 1 29 29 CYS CB C 29 32.770 32.770 28.557 4.213 25575
1298 1 5 . 1 1 29 29 CYS H H 29 8.390 8.390 8.421 -0.031 25575
1299 1 5 . 1 1 30 30 CYS N N 30 122.320 122.320 120.398 1.922 25575
1300 1 5 . 1 1 30 30 CYS HA H 30 4.530 4.530 4.788 -0.258 25575
1301 1 5 . 1 1 30 30 CYS CA C 30 58.810 58.810 58.154 0.657 25575
1302 1 5 . 1 1 30 30 CYS CB C 30 28.910 28.910 27.791 1.119 25575
1303 1 5 . 1 1 30 30 CYS H H 30 8.340 8.340 8.756 -0.416 25575
1304 1 5 . 1 1 31 31 LEU N N 31 122.390 122.390 121.416 0.974 25575
1305 1 5 . 1 1 31 31 LEU HA H 31 4.640 4.640 4.963 -0.323 25575
1306 1 5 . 1 1 31 31 LEU CA C 31 55.440 55.440 54.481 0.959 25575
1307 1 5 . 1 1 31 31 LEU CB C 31 43.490 43.490 43.110 0.380 25575
1308 1 5 . 1 1 31 31 LEU H H 31 8.460 8.460 7.307 1.153 25575
1309 1 5 . 1 1 32 32 ILE N N 32 118.890 118.890 117.623 1.267 25575
1310 1 5 . 1 1 32 32 ILE HA H 32 4.200 4.200 4.729 -0.529 25575
1311 1 5 . 1 1 32 32 ILE CA C 32 60.440 60.440 60.210 0.230 25575
1312 1 5 . 1 1 32 32 ILE CB C 32 39.890 39.890 41.606 -1.716 25575
1313 1 5 . 1 1 32 32 ILE H H 32 8.680 8.680 8.162 0.518 25575
1314 1 5 . 1 1 33 33 GLU N N 33 128.400 128.400 127.091 1.309 25575
1315 1 5 . 1 1 33 33 GLU HA H 33 5.080 5.080 5.184 -0.104 25575
1316 1 5 . 1 1 33 33 GLU CA C 33 54.120 54.120 54.816 -0.695 25575
1317 1 5 . 1 1 33 33 GLU CB C 33 32.080 32.080 32.760 -0.680 25575
1318 1 5 . 1 1 33 33 GLU H H 33 8.640 8.640 8.756 -0.116 25575
1319 1 5 . 1 1 34 34 ASP N N 34 130.390 130.390 127.988 2.402 25575
1320 1 5 . 1 1 34 34 ASP HA H 34 4.310 4.310 4.284 0.026 25575
1321 1 5 . 1 1 34 34 ASP CA C 34 55.150 55.150 55.684 -0.534 25575
1322 1 5 . 1 1 34 34 ASP CB C 34 40.050 40.050 40.467 -0.417 25575
1323 1 5 . 1 1 34 34 ASP H H 34 9.540 9.540 8.826 0.714 25575
1324 1 5 . 1 1 35 35 GLY N N 35 126.620 126.620 103.985 22.635 25575
1325 1 5 . 1 1 35 35 GLY CA C 35 45.480 45.480 44.876 0.604 25575
1326 1 5 . 1 1 35 35 GLY H H 35 8.370 8.370 8.250 0.120 25575
1327 1 5 . 1 1 36 36 GLU N N 36 120.860 120.860 123.769 -2.909 25575
1328 1 5 . 1 1 36 36 GLU HA H 36 4.670 4.670 4.164 0.506 25575
1329 1 5 . 1 1 36 36 GLU CA C 36 54.350 54.350 55.807 -1.457 25575
1330 1 5 . 1 1 36 36 GLU CB C 36 31.630 31.630 29.737 1.893 25575
1331 1 5 . 1 1 36 36 GLU H H 36 7.820 7.820 8.083 -0.263 25575
1332 1 5 . 1 1 37 37 ARG N N 37 129.790 129.790 127.494 2.296 25575
1333 1 5 . 1 1 37 37 ARG HA H 37 4.200 4.200 4.320 -0.120 25575
1334 1 5 . 1 1 37 37 ARG CA C 37 56.440 56.440 55.032 1.408 25575
1335 1 5 . 1 1 37 37 ARG CB C 37 29.710 29.710 28.739 0.970 25575
1336 1 5 . 1 1 37 37 ARG H H 37 8.930 8.930 8.209 0.721 25575
1337 1 5 . 1 1 38 38 CYS N N 38 130.950 130.950 125.925 5.025 25575
1338 1 5 . 1 1 38 38 CYS HA H 38 4.450 4.450 4.268 0.182 25575
1339 1 5 . 1 1 38 38 CYS CA C 38 60.560 60.560 60.509 0.051 25575
1340 1 5 . 1 1 38 38 CYS CB C 38 31.250 31.250 28.530 2.720 25575
1341 1 5 . 1 1 38 38 CYS H H 38 9.050 9.050 8.272 0.778 25575
1342 1 5 . 1 1 39 39 VAL N N 39 118.270 118.270 120.762 -2.492 25575
1343 1 5 . 1 1 39 39 VAL HA H 39 4.710 4.710 4.497 0.213 25575
1344 1 5 . 1 1 39 39 VAL CA C 39 60.340 60.340 60.812 -0.472 25575
1345 1 5 . 1 1 39 39 VAL CB C 39 31.290 31.290 32.171 -0.881 25575
1346 1 5 . 1 1 39 39 VAL H H 39 8.060 8.060 8.502 -0.442 25575
1347 1 5 . 1 1 40 40 ARG N N 40 127.360 127.360 122.957 4.403 25575
1348 1 5 . 1 1 40 40 ARG HA H 40 4.430 4.430 4.340 0.090 25575
1349 1 5 . 1 1 40 40 ARG CA C 40 56.150 56.150 54.842 1.308 25575
1350 1 5 . 1 1 40 40 ARG CB C 40 29.210 29.210 29.346 -0.136 25575
1351 1 5 . 1 1 40 40 ARG H H 40 8.950 8.950 7.635 1.315 25575
1352 1 5 . 1 1 41 41 PRO HA H 41 4.430 4.430 4.518 -0.088 25575
1353 1 5 . 1 1 41 41 PRO CA C 41 62.690 62.690 62.854 -0.164 25575
1354 1 5 . 1 1 41 41 PRO CB C 41 32.010 32.010 32.094 -0.084 25575
1355 1 5 . 1 1 42 42 ALA N N 42 124.260 124.260 126.127 -1.867 25575
1356 1 5 . 1 1 42 42 ALA HA H 42 3.620 3.620 4.619 -0.999 25575
1357 1 5 . 1 1 42 42 ALA CA C 42 52.930 52.930 51.002 1.928 25575
1358 1 5 . 1 1 42 42 ALA CB C 42 19.130 19.130 20.679 -1.549 25575
1359 1 5 . 1 1 42 42 ALA H H 42 8.410 8.410 8.477 -0.067 25575
1360 1 5 . 1 1 43 43 GLY N N 43 112.690 112.690 108.670 4.020 25575
1361 1 5 . 1 1 43 43 GLY CA C 43 44.240 44.240 45.201 -0.961 25575
1362 1 5 . 1 1 43 43 GLY H H 43 8.090 8.090 8.078 0.012 25575
1363 1 5 . 1 1 44 44 ASN N N 44 116.980 116.980 120.357 -3.377 25575
1364 1 5 . 1 1 44 44 ASN HA H 44 4.690 4.690 4.654 0.036 25575
1365 1 5 . 1 1 44 44 ASN CA C 44 53.420 53.420 53.370 0.050 25575
1366 1 5 . 1 1 44 44 ASN CB C 44 39.370 39.370 37.747 1.623 25575
1367 1 5 . 1 1 44 44 ASN H H 44 8.720 8.720 8.761 -0.041 25575
1368 1 5 . 1 1 45 45 ALA N N 45 124.240 124.240 123.222 1.018 25575
1369 1 5 . 1 1 45 45 ALA HA H 45 4.640 4.640 4.701 -0.061 25575
1370 1 5 . 1 1 45 45 ALA CA C 45 52.240 52.240 51.057 1.183 25575
1371 1 5 . 1 1 45 45 ALA CB C 45 19.540 19.540 20.849 -1.309 25575
1372 1 5 . 1 1 45 45 ALA H H 45 8.770 8.770 7.851 0.919 25575
1373 1 5 . 1 1 46 46 SER N N 46 111.670 111.670 119.066 -7.396 25575
1374 1 5 . 1 1 46 46 SER HA H 46 5.300 5.300 4.735 0.565 25575
1375 1 5 . 1 1 46 46 SER CA C 46 56.580 56.580 56.916 -0.336 25575
1376 1 5 . 1 1 46 46 SER CB C 46 66.490 66.490 65.669 0.821 25575
1377 1 5 . 1 1 46 46 SER H H 46 8.060 8.060 8.588 -0.528 25575
1378 1 5 . 1 1 47 47 PHE HA H 47 4.520 4.520 4.367 0.153 25575
1379 1 5 . 1 1 47 47 PHE CA C 47 57.000 57.000 57.578 -0.578 25575
1380 1 5 . 1 1 47 47 PHE CB C 47 38.360 38.360 37.878 0.482 25575
1381 1 5 . 1 1 48 48 SER N N 48 116.970 116.970 118.646 -1.676 25575
1382 1 5 . 1 1 48 48 SER HA H 48 4.440 4.440 4.412 0.028 25575
1383 1 5 . 1 1 48 48 SER CA C 48 56.950 56.950 57.834 -0.884 25575
1384 1 5 . 1 1 48 48 SER CB C 48 65.810 65.810 64.469 1.341 25575
1385 1 5 . 1 1 48 48 SER H H 48 7.100 7.100 7.889 -0.789 25575
1386 1 5 . 1 1 49 49 LYS N N 49 120.650 120.650 125.666 -5.016 25575
1387 1 5 . 1 1 49 49 LYS HA H 49 3.900 3.900 3.827 0.073 25575
1388 1 5 . 1 1 49 49 LYS CA C 49 59.570 59.570 59.496 0.074 25575
1389 1 5 . 1 1 49 49 LYS CB C 49 31.790 31.790 32.197 -0.407 25575
1390 1 5 . 1 1 49 49 LYS H H 49 8.770 8.770 9.007 -0.237 25575
1391 1 5 . 1 1 50 50 ARG N N 50 118.240 118.240 116.665 1.575 25575
1392 1 5 . 1 1 50 50 ARG HA H 50 4.040 4.040 4.020 0.020 25575
1393 1 5 . 1 1 50 50 ARG CA C 50 59.070 59.070 58.507 0.563 25575
1394 1 5 . 1 1 50 50 ARG CB C 50 30.080 30.080 29.350 0.730 25575
1395 1 5 . 1 1 50 50 ARG H H 50 8.040 8.040 8.133 -0.093 25575
1396 1 5 . 1 1 51 51 VAL N N 51 121.680 121.680 119.443 2.237 25575
1397 1 5 . 1 1 51 51 VAL HA H 51 3.590 3.590 3.539 0.051 25575
1398 1 5 . 1 1 51 51 VAL CA C 51 65.940 65.940 65.444 0.496 25575
1399 1 5 . 1 1 51 51 VAL CB C 51 31.620 31.620 31.182 0.438 25575
1400 1 5 . 1 1 51 51 VAL H H 51 7.350 7.350 8.071 -0.721 25575
1401 1 5 . 1 1 52 52 GLN N N 52 119.680 119.680 117.908 1.772 25575
1402 1 5 . 1 1 52 52 GLN HA H 52 3.570 3.570 3.885 -0.315 25575
1403 1 5 . 1 1 52 52 GLN CA C 52 59.210 59.210 59.041 0.169 25575
1404 1 5 . 1 1 52 52 GLN CB C 52 28.620 28.620 28.101 0.520 25575
1405 1 5 . 1 1 52 52 GLN H H 52 8.210 8.210 7.608 0.602 25575
1406 1 5 . 1 1 53 53 LYS N N 53 118.080 118.080 119.496 -1.416 25575
1407 1 5 . 1 1 53 53 LYS HA H 53 4.160 4.160 3.948 0.212 25575
1408 1 5 . 1 1 53 53 LYS CA C 53 58.670 58.670 59.599 -0.929 25575
1409 1 5 . 1 1 53 53 LYS CB C 53 32.120 32.120 31.967 0.153 25575
1410 1 5 . 1 1 53 53 LYS H H 53 7.960 7.960 7.625 0.335 25575
1411 1 5 . 1 1 54 54 SER N N 54 115.450 115.450 113.893 1.557 25575
1412 1 5 . 1 1 54 54 SER HA H 54 4.370 4.370 4.263 0.107 25575
1413 1 5 . 1 1 54 54 SER CA C 54 61.330 61.330 60.943 0.387 25575
1414 1 5 . 1 1 54 54 SER CB C 54 63.690 63.690 62.738 0.952 25575
1415 1 5 . 1 1 54 54 SER H H 54 7.800 7.800 7.619 0.181 25575
1416 1 5 . 1 1 55 55 ILE N N 55 117.670 117.670 120.922 -3.252 25575
1417 1 5 . 1 1 55 55 ILE HA H 55 4.060 4.060 3.792 0.268 25575
1418 1 5 . 1 1 55 55 ILE CA C 55 63.330 63.330 64.688 -1.358 25575
1419 1 5 . 1 1 55 55 ILE CB C 55 38.980 38.980 38.189 0.791 25575
1420 1 5 . 1 1 55 55 ILE H H 55 7.840 7.840 7.434 0.406 25575
1421 1 5 . 1 1 56 56 SER N N 56 115.650 115.650 115.848 -0.198 25575
1422 1 5 . 1 1 56 56 SER HA H 56 4.490 4.490 4.225 0.265 25575
1423 1 5 . 1 1 56 56 SER CA C 56 60.220 60.220 61.334 -1.114 25575
1424 1 5 . 1 1 56 56 SER CB C 56 63.000 63.000 63.087 -0.086 25575
1425 1 5 . 1 1 56 56 SER H H 56 8.060 8.060 8.467 -0.407 25575
1426 1 5 . 1 1 57 57 GLN N N 57 121.830 121.830 119.728 2.102 25575
1427 1 5 . 1 1 57 57 GLN HA H 57 4.200 4.200 4.142 0.058 25575
1428 1 5 . 1 1 57 57 GLN CA C 57 58.310 58.310 58.097 0.213 25575
1429 1 5 . 1 1 57 57 GLN CB C 57 28.850 28.850 28.951 -0.101 25575
1430 1 5 . 1 1 57 57 GLN H H 57 8.620 8.620 7.981 0.639 25575
1431 1 5 . 1 1 58 58 LYS N N 58 116.960 116.960 116.497 0.463 25575
1432 1 5 . 1 1 58 58 LYS HA H 58 4.290 4.290 4.310 -0.020 25575
1433 1 5 . 1 1 58 58 LYS CA C 58 56.920 56.920 55.615 1.305 25575
1434 1 5 . 1 1 58 58 LYS CB C 58 32.900 32.900 33.225 -0.325 25575
1435 1 5 . 1 1 58 58 LYS H H 58 7.950 7.950 7.458 0.492 25575
1436 1 5 . 1 1 59 59 LYS N N 59 116.960 116.960 118.745 -1.785 25575
1437 1 5 . 1 1 59 59 LYS HA H 59 4.120 4.120 3.934 0.186 25575
1438 1 5 . 1 1 59 59 LYS CA C 59 57.090 57.090 56.893 0.197 25575
1439 1 5 . 1 1 59 59 LYS CB C 59 30.080 30.080 29.505 0.575 25575
1440 1 5 . 1 1 59 59 LYS H H 59 7.950 7.950 8.017 -0.067 25575
1441 1 5 . 1 1 60 60 LEU N N 60 117.540 117.540 121.080 -3.540 25575
1442 1 5 . 1 1 60 60 LEU HA H 60 4.480 4.480 4.280 0.200 25575
1443 1 5 . 1 1 60 60 LEU CA C 60 54.500 54.500 54.670 -0.170 25575
1444 1 5 . 1 1 60 60 LEU CB C 60 42.840 42.840 43.026 -0.186 25575
1445 1 5 . 1 1 60 60 LEU H H 60 7.930 7.930 7.689 0.241 25575
1446 1 5 . 1 1 61 61 LYS HA H 61 4.390 4.390 4.392 -0.002 25575
1447 1 5 . 1 1 61 61 LYS CA C 61 55.540 55.540 56.077 -0.537 25575
1448 1 5 . 1 1 61 61 LYS CB C 61 30.050 30.050 32.189 -2.139 25575
1449 1 5 . 1 1 62 62 LEU N N 62 120.000 120.000 121.981 -1.981 25575
1450 1 5 . 1 1 62 62 LEU HA H 62 5.250 5.250 5.241 0.009 25575
1451 1 5 . 1 1 62 62 LEU CA C 62 53.080 53.080 53.784 -0.704 25575
1452 1 5 . 1 1 62 62 LEU CB C 62 45.760 45.760 43.312 2.448 25575
1453 1 5 . 1 1 62 62 LEU H H 62 7.470 7.470 7.750 -0.280 25575
1454 1 5 . 1 1 63 63 ASP N N 63 121.730 121.730 123.798 -2.068 25575
1455 1 5 . 1 1 63 63 ASP HA H 63 4.860 4.860 4.873 -0.013 25575
1456 1 5 . 1 1 63 63 ASP CA C 63 51.890 51.890 52.375 -0.485 25575
1457 1 5 . 1 1 63 63 ASP CB C 63 44.910 44.910 44.948 -0.038 25575
1458 1 5 . 1 1 63 63 ASP H H 63 8.620 8.620 8.781 -0.161 25575
1459 1 5 . 1 1 64 64 ILE N N 64 118.120 118.120 119.877 -1.757 25575
1460 1 5 . 1 1 64 64 ILE HA H 64 4.210 4.210 4.310 -0.100 25575
1461 1 5 . 1 1 64 64 ILE CA C 64 60.430 60.430 58.327 2.103 25575
1462 1 5 . 1 1 64 64 ILE CB C 64 40.420 40.420 38.475 1.945 25575
1463 1 5 . 1 1 64 64 ILE H H 64 8.650 8.650 8.309 0.341 25575
1464 1 5 . 1 1 65 65 ASP N N 65 124.550 124.550 128.978 -4.428 25575
1465 1 5 . 1 1 65 65 ASP HA H 65 4.570 4.570 4.466 0.104 25575
1466 1 5 . 1 1 65 65 ASP CA C 65 53.310 53.310 54.436 -1.126 25575
1467 1 5 . 1 1 65 65 ASP CB C 65 40.440 40.440 42.554 -2.114 25575
1468 1 5 . 1 1 65 65 ASP H H 65 8.630 8.630 8.556 0.074 25575
1469 1 5 . 1 1 66 66 LYS N N 66 125.970 125.970 125.421 0.549 25575
1470 1 5 . 1 1 66 66 LYS HA H 66 4.040 4.040 4.451 -0.411 25575
1471 1 5 . 1 1 66 66 LYS CA C 66 58.140 58.140 55.774 2.366 25575
1472 1 5 . 1 1 66 66 LYS CB C 66 31.990 31.990 32.731 -0.741 25575
1473 1 5 . 1 1 66 66 LYS H H 66 8.590 8.590 8.415 0.175 25575
1474 1 5 . 1 1 67 67 SER N N 67 114.980 114.980 116.636 -1.656 25575
1475 1 5 . 1 1 67 67 SER HA H 67 4.320 4.320 4.182 0.138 25575
1476 1 5 . 1 1 67 67 SER CA C 67 60.330 60.330 61.362 -1.032 25575
1477 1 5 . 1 1 67 67 SER CB C 67 63.710 63.710 63.127 0.583 25575
1478 1 5 . 1 1 67 67 SER H H 67 8.760 8.760 8.887 -0.127 25575
1479 1 5 . 1 1 68 68 VAL HA H 68 4.250 4.250 3.622 0.628 25575
1480 1 5 . 1 1 68 68 VAL CA C 68 62.150 62.150 63.348 -1.198 25575
1481 1 5 . 1 1 68 68 VAL CB C 68 31.900 31.900 31.653 0.247 25575
1482 1 5 . 1 1 69 69 ARG CA C 69 56.960 56.960 57.284 -0.324 25575
1483 1 5 . 1 1 70 70 HIS N N 70 116.270 116.270 113.419 2.851 25575
1484 1 5 . 1 1 70 70 HIS HA H 70 4.760 4.760 4.735 0.025 25575
1485 1 5 . 1 1 70 70 HIS CA C 70 55.360 55.360 54.157 1.202 25575
1486 1 5 . 1 1 70 70 HIS CB C 70 33.100 33.100 31.119 1.981 25575
1487 1 5 . 1 1 70 70 HIS H H 70 7.390 7.390 8.049 -0.659 25575
1488 1 5 . 1 1 71 71 LEU N N 71 120.200 120.200 122.027 -1.827 25575
1489 1 5 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.595 0.465 25575
1490 1 5 . 1 1 71 71 LEU CA C 71 54.070 54.070 54.118 -0.048 25575
1491 1 5 . 1 1 71 71 LEU CB C 71 42.710 42.710 41.094 1.616 25575
1492 1 5 . 1 1 71 71 LEU H H 71 7.970 7.970 8.456 -0.486 25575
1493 1 5 . 1 1 72 72 TYR HA H 72 5.030 5.030 4.923 0.106 25575
1494 1 5 . 1 1 72 72 TYR CA C 72 59.990 59.990 57.613 2.377 25575
1495 1 5 . 1 1 72 72 TYR CB C 72 39.440 39.440 41.621 -2.181 25575
1496 1 5 . 1 1 73 73 ILE N N 73 112.940 112.940 113.929 -0.989 25575
1497 1 5 . 1 1 73 73 ILE HA H 73 6.080 6.080 4.907 1.173 25575
1498 1 5 . 1 1 73 73 ILE CA C 73 58.090 58.090 58.511 -0.421 25575
1499 1 5 . 1 1 73 73 ILE CB C 73 41.820 41.820 42.659 -0.839 25575
1500 1 5 . 1 1 73 73 ILE H H 73 8.450 8.450 8.667 -0.217 25575
1501 1 5 . 1 1 74 74 CYS N N 74 124.730 124.730 118.567 6.163 25575
1502 1 5 . 1 1 74 74 CYS HA H 74 5.080 5.080 5.110 -0.030 25575
1503 1 5 . 1 1 74 74 CYS CA C 74 57.670 57.670 57.595 0.075 25575
1504 1 5 . 1 1 74 74 CYS CB C 74 33.330 33.330 29.537 3.793 25575
1505 1 5 . 1 1 74 74 CYS H H 74 9.830 9.830 8.591 1.239 25575
1506 1 5 . 1 1 75 75 ASP N N 75 120.990 120.990 123.508 -2.518 25575
1507 1 5 . 1 1 75 75 ASP HA H 75 4.590 4.590 4.435 0.155 25575
1508 1 5 . 1 1 75 75 ASP CA C 75 57.320 57.320 57.921 -0.601 25575
1509 1 5 . 1 1 75 75 ASP CB C 75 39.670 39.670 41.045 -1.375 25575
1510 1 5 . 1 1 75 75 ASP H H 75 9.090 9.090 9.010 0.080 25575
1511 1 5 . 1 1 76 76 PHE N N 76 122.470 122.470 119.146 3.324 25575
1512 1 5 . 1 1 76 76 PHE HA H 76 4.230 4.230 4.144 0.086 25575
1513 1 5 . 1 1 76 76 PHE CA C 76 62.030 62.030 61.996 0.034 25575
1514 1 5 . 1 1 76 76 PHE CB C 76 38.190 38.190 39.131 -0.941 25575
1515 1 5 . 1 1 76 76 PHE H H 76 8.330 8.330 8.439 -0.109 25575
1516 1 5 . 1 1 77 77 HIS N N 77 124.580 124.580 117.816 6.764 25575
1517 1 5 . 1 1 77 77 HIS HA H 77 4.280 4.280 4.451 -0.171 25575
1518 1 5 . 1 1 77 77 HIS CA C 77 63.880 63.880 58.852 5.028 25575
1519 1 5 . 1 1 77 77 HIS CB C 77 29.600 29.600 30.171 -0.571 25575
1520 1 5 . 1 1 77 77 HIS H H 77 10.300 10.300 7.831 2.469 25575
1521 1 5 . 1 1 78 78 LYS N N 78 122.930 122.930 120.586 2.344 25575
1522 1 5 . 1 1 78 78 LYS HA H 78 3.860 3.860 3.957 -0.097 25575
1523 1 5 . 1 1 78 78 LYS CA C 78 60.550 60.550 59.876 0.674 25575
1524 1 5 . 1 1 78 78 LYS CB C 78 32.040 32.040 32.405 -0.365 25575
1525 1 5 . 1 1 78 78 LYS H H 78 8.960 8.960 8.480 0.480 25575
1526 1 5 . 1 1 79 79 ASN N N 79 116.670 116.670 118.107 -1.437 25575
1527 1 5 . 1 1 79 79 ASN HA H 79 4.420 4.420 4.493 -0.073 25575
1528 1 5 . 1 1 79 79 ASN CA C 79 56.030 56.030 56.160 -0.130 25575
1529 1 5 . 1 1 79 79 ASN CB C 79 38.100 38.100 38.199 -0.099 25575
1530 1 5 . 1 1 79 79 ASN H H 79 8.230 8.230 8.006 0.224 25575
1531 1 5 . 1 1 80 80 PHE N N 80 122.600 122.600 121.579 1.021 25575
1532 1 5 . 1 1 80 80 PHE HA H 80 4.180 4.180 4.234 -0.054 25575
1533 1 5 . 1 1 80 80 PHE CA C 80 60.700 60.700 61.432 -0.732 25575
1534 1 5 . 1 1 80 80 PHE CB C 80 39.840 39.840 39.156 0.684 25575
1535 1 5 . 1 1 80 80 PHE H H 80 8.200 8.200 7.937 0.263 25575
1536 1 5 . 1 1 81 81 ILE N N 81 118.240 118.240 117.751 0.489 25575
1537 1 5 . 1 1 81 81 ILE HA H 81 3.320 3.320 3.445 -0.125 25575
1538 1 5 . 1 1 81 81 ILE CA C 81 65.160 65.160 64.703 0.457 25575
1539 1 5 . 1 1 81 81 ILE CB C 81 38.440 38.440 37.655 0.785 25575
1540 1 5 . 1 1 81 81 ILE H H 81 8.520 8.520 8.156 0.364 25575
1541 1 5 . 1 1 82 82 GLN N N 82 116.370 116.370 118.479 -2.109 25575
1542 1 5 . 1 1 82 82 GLN HA H 82 4.100 4.100 3.990 0.110 25575
1543 1 5 . 1 1 82 82 GLN CA C 82 57.710 57.710 58.558 -0.848 25575
1544 1 5 . 1 1 82 82 GLN CB C 82 28.710 28.710 28.773 -0.064 25575
1545 1 5 . 1 1 82 82 GLN H H 82 7.670 7.670 7.724 -0.054 25575
1546 1 5 . 1 1 83 83 SER N N 83 114.440 114.440 115.166 -0.726 25575
1547 1 5 . 1 1 83 83 SER HA H 83 4.300 4.300 4.264 0.036 25575
1548 1 5 . 1 1 83 83 SER CA C 83 60.130 60.130 61.382 -1.252 25575
1549 1 5 . 1 1 83 83 SER CB C 83 63.570 63.570 63.464 0.106 25575
1550 1 5 . 1 1 83 83 SER H H 83 7.810 7.810 8.273 -0.463 25575
1551 1 5 . 1 1 84 84 VAL N N 84 120.750 120.750 117.353 3.397 25575
1552 1 5 . 1 1 84 84 VAL HA H 84 3.970 3.970 3.803 0.167 25575
1553 1 5 . 1 1 84 84 VAL CA C 84 63.430 63.430 64.729 -1.299 25575
1554 1 5 . 1 1 84 84 VAL CB C 84 31.960 31.960 31.143 0.817 25575
1555 1 5 . 1 1 84 84 VAL H H 84 7.790 7.790 7.688 0.102 25575
1556 1 5 . 1 1 85 85 ARG N N 85 122.090 122.090 119.582 2.508 25575
1557 1 5 . 1 1 85 85 ARG HA H 85 4.240 4.240 4.116 0.124 25575
1558 1 5 . 1 1 85 85 ARG CA C 85 56.850 56.850 57.247 -0.397 25575
1559 1 5 . 1 1 85 85 ARG CB C 85 30.720 30.720 30.456 0.264 25575
1560 1 5 . 1 1 85 85 ARG H H 85 8.090 8.090 7.571 0.519 25575
1561 1 5 . 1 1 86 86 ASN N N 86 118.510 118.510 118.799 -0.289 25575
1562 1 5 . 1 1 86 86 ASN HA H 86 4.690 4.690 4.822 -0.132 25575
1563 1 5 . 1 1 86 86 ASN CA C 86 53.380 53.380 52.491 0.889 25575
1564 1 5 . 1 1 86 86 ASN CB C 86 38.950 38.950 38.914 0.036 25575
1565 1 5 . 1 1 86 86 ASN H H 86 8.220 8.220 7.556 0.664 25575
1566 1 5 . 1 1 87 87 LYS N N 87 121.600 121.600 122.492 -0.892 25575
1567 1 5 . 1 1 87 87 LYS HA H 87 4.310 4.310 4.289 0.021 25575
1568 1 5 . 1 1 87 87 LYS CA C 87 56.590 56.590 56.076 0.514 25575
1569 1 5 . 1 1 87 87 LYS CB C 87 32.870 32.870 30.089 2.781 25575
1570 1 5 . 1 1 87 87 LYS H H 87 8.150 8.150 8.902 -0.752 25575
1571 1 5 . 1 1 88 88 ARG N N 88 121.920 121.920 122.643 -0.723 25575
1572 1 5 . 1 1 88 88 ARG HA H 88 4.330 4.330 4.126 0.204 25575
1573 1 5 . 1 1 88 88 ARG CA C 88 56.110 56.110 56.522 -0.412 25575
1574 1 5 . 1 1 88 88 ARG CB C 88 30.870 30.870 28.320 2.550 25575
1575 1 5 . 1 1 88 88 ARG H H 88 8.250 8.250 8.199 0.051 25575
1576 1 5 . 1 1 89 89 LYS N N 89 123.020 123.020 119.705 3.315 25575
1577 1 5 . 1 1 89 89 LYS HA H 89 4.320 4.320 4.011 0.309 25575
1578 1 5 . 1 1 89 89 LYS CA C 89 56.330 56.330 58.090 -1.760 25575
1579 1 5 . 1 1 89 89 LYS CB C 89 33.140 33.140 32.313 0.827 25575
1580 1 5 . 1 1 89 89 LYS H H 89 8.320 8.320 8.221 0.099 25575
1581 1 5 . 1 1 90 90 ARG N N 90 122.970 122.970 120.412 2.558 25575
1582 1 5 . 1 1 90 90 ARG HA H 90 4.360 4.360 4.329 0.031 25575
1583 1 5 . 1 1 90 90 ARG CA C 90 56.100 56.100 55.683 0.417 25575
1584 1 5 . 1 1 90 90 ARG CB C 90 31.210 31.210 29.097 2.113 25575
1585 1 5 . 1 1 90 90 ARG H H 90 8.360 8.360 8.111 0.249 25575
1586 1 5 . 1 1 91 91 LYS N N 91 123.680 123.680 123.337 0.343 25575
1587 1 5 . 1 1 91 91 LYS HA H 91 4.380 4.380 4.256 0.124 25575
1588 1 5 . 1 1 91 91 LYS CA C 91 56.620 56.620 56.601 0.019 25575
1589 1 5 . 1 1 91 91 LYS CB C 91 33.070 33.070 33.146 -0.076 25575
1590 1 5 . 1 1 91 91 LYS H H 91 8.450 8.450 7.942 0.508 25575
1591 1 6 . 1 1 24 24 SER HA H 24 4.330 4.330 4.313 0.017 25575
1592 1 6 . 1 1 24 24 SER CA C 24 58.130 58.130 58.636 -0.506 25575
1593 1 6 . 1 1 24 24 SER CB C 24 63.870 63.870 63.292 0.578 25575
1594 1 6 . 1 1 25 25 TYR N N 25 122.160 122.160 122.906 -0.746 25575
1595 1 6 . 1 1 25 25 TYR HA H 25 4.530 4.530 4.426 0.104 25575
1596 1 6 . 1 1 25 25 TYR CA C 25 58.420 58.420 58.755 -0.335 25575
1597 1 6 . 1 1 25 25 TYR CB C 25 38.570 38.570 38.486 0.084 25575
1598 1 6 . 1 1 25 25 TYR H H 25 8.310 8.310 7.802 0.508 25575
1599 1 6 . 1 1 26 26 GLY N N 26 111.370 111.370 110.899 0.471 25575
1600 1 6 . 1 1 26 26 GLY CA C 26 45.330 45.330 44.882 0.449 25575
1601 1 6 . 1 1 26 26 GLY H H 26 8.300 8.300 8.535 -0.235 25575
1602 1 6 . 1 1 27 27 GLN N N 27 118.910 118.910 124.270 -5.360 25575
1603 1 6 . 1 1 27 27 GLN HA H 27 4.510 4.510 4.310 0.200 25575
1604 1 6 . 1 1 27 27 GLN CA C 27 55.240 55.240 56.207 -0.967 25575
1605 1 6 . 1 1 27 27 GLN CB C 27 29.800 29.800 28.080 1.720 25575
1606 1 6 . 1 1 27 27 GLN H H 27 8.050 8.050 8.518 -0.468 25575
1607 1 6 . 1 1 28 28 SER N N 28 119.460 119.460 116.060 3.400 25575
1608 1 6 . 1 1 28 28 SER HA H 28 4.810 4.810 5.108 -0.298 25575
1609 1 6 . 1 1 28 28 SER CA C 28 57.710 57.710 56.502 1.208 25575
1610 1 6 . 1 1 28 28 SER CB C 28 65.530 65.530 65.509 0.021 25575
1611 1 6 . 1 1 28 28 SER H H 28 8.800 8.800 7.976 0.824 25575
1612 1 6 . 1 1 29 29 CYS N N 29 122.160 122.160 119.311 2.849 25575
1613 1 6 . 1 1 29 29 CYS HA H 29 4.130 4.130 4.443 -0.313 25575
1614 1 6 . 1 1 29 29 CYS CA C 29 60.620 60.620 61.614 -0.994 25575
1615 1 6 . 1 1 29 29 CYS CB C 29 32.770 32.770 29.025 3.745 25575
1616 1 6 . 1 1 29 29 CYS H H 29 8.390 8.390 8.564 -0.174 25575
1617 1 6 . 1 1 30 30 CYS N N 30 122.320 122.320 119.796 2.524 25575
1618 1 6 . 1 1 30 30 CYS HA H 30 4.530 4.530 4.764 -0.234 25575
1619 1 6 . 1 1 30 30 CYS CA C 30 58.810 58.810 58.059 0.750 25575
1620 1 6 . 1 1 30 30 CYS CB C 30 28.910 28.910 27.720 1.190 25575
1621 1 6 . 1 1 30 30 CYS H H 30 8.340 8.340 8.512 -0.172 25575
1622 1 6 . 1 1 31 31 LEU N N 31 122.390 122.390 122.845 -0.455 25575
1623 1 6 . 1 1 31 31 LEU HA H 31 4.640 4.640 4.773 -0.133 25575
1624 1 6 . 1 1 31 31 LEU CA C 31 55.440 55.440 54.763 0.677 25575
1625 1 6 . 1 1 31 31 LEU CB C 31 43.490 43.490 42.823 0.667 25575
1626 1 6 . 1 1 31 31 LEU H H 31 8.460 8.460 7.224 1.236 25575
1627 1 6 . 1 1 32 32 ILE N N 32 118.890 118.890 117.803 1.087 25575
1628 1 6 . 1 1 32 32 ILE HA H 32 4.200 4.200 4.802 -0.602 25575
1629 1 6 . 1 1 32 32 ILE CA C 32 60.440 60.440 60.148 0.292 25575
1630 1 6 . 1 1 32 32 ILE CB C 32 39.890 39.890 42.217 -2.327 25575
1631 1 6 . 1 1 32 32 ILE H H 32 8.680 8.680 7.967 0.713 25575
1632 1 6 . 1 1 33 33 GLU N N 33 128.400 128.400 126.146 2.254 25575
1633 1 6 . 1 1 33 33 GLU HA H 33 5.080 5.080 5.113 -0.033 25575
1634 1 6 . 1 1 33 33 GLU CA C 33 54.120 54.120 54.787 -0.667 25575
1635 1 6 . 1 1 33 33 GLU CB C 33 32.080 32.080 33.181 -1.101 25575
1636 1 6 . 1 1 33 33 GLU H H 33 8.640 8.640 8.566 0.074 25575
1637 1 6 . 1 1 34 34 ASP N N 34 130.390 130.390 126.930 3.460 25575
1638 1 6 . 1 1 34 34 ASP HA H 34 4.310 4.310 4.302 0.008 25575
1639 1 6 . 1 1 34 34 ASP CA C 34 55.150 55.150 56.141 -0.991 25575
1640 1 6 . 1 1 34 34 ASP CB C 34 40.050 40.050 40.705 -0.655 25575
1641 1 6 . 1 1 34 34 ASP H H 34 9.540 9.540 9.140 0.400 25575
1642 1 6 . 1 1 35 35 GLY N N 35 126.620 126.620 104.201 22.419 25575
1643 1 6 . 1 1 35 35 GLY CA C 35 45.480 45.480 44.785 0.695 25575
1644 1 6 . 1 1 35 35 GLY H H 35 8.370 8.370 8.253 0.117 25575
1645 1 6 . 1 1 36 36 GLU N N 36 120.860 120.860 122.305 -1.445 25575
1646 1 6 . 1 1 36 36 GLU HA H 36 4.670 4.670 4.302 0.368 25575
1647 1 6 . 1 1 36 36 GLU CA C 36 54.350 54.350 55.675 -1.325 25575
1648 1 6 . 1 1 36 36 GLU CB C 36 31.630 31.630 30.392 1.238 25575
1649 1 6 . 1 1 36 36 GLU H H 36 7.820 7.820 7.935 -0.115 25575
1650 1 6 . 1 1 37 37 ARG N N 37 129.790 129.790 127.658 2.132 25575
1651 1 6 . 1 1 37 37 ARG HA H 37 4.200 4.200 4.493 -0.293 25575
1652 1 6 . 1 1 37 37 ARG CA C 37 56.440 56.440 54.417 2.023 25575
1653 1 6 . 1 1 37 37 ARG CB C 37 29.710 29.710 29.145 0.565 25575
1654 1 6 . 1 1 37 37 ARG H H 37 8.930 8.930 8.550 0.380 25575
1655 1 6 . 1 1 38 38 CYS N N 38 130.950 130.950 126.080 4.870 25575
1656 1 6 . 1 1 38 38 CYS HA H 38 4.450 4.450 4.383 0.067 25575
1657 1 6 . 1 1 38 38 CYS CA C 38 60.560 60.560 60.418 0.142 25575
1658 1 6 . 1 1 38 38 CYS CB C 38 31.250 31.250 27.534 3.716 25575
1659 1 6 . 1 1 38 38 CYS H H 38 9.050 9.050 8.628 0.422 25575
1660 1 6 . 1 1 39 39 VAL N N 39 118.270 118.270 120.427 -2.157 25575
1661 1 6 . 1 1 39 39 VAL HA H 39 4.710 4.710 4.534 0.176 25575
1662 1 6 . 1 1 39 39 VAL CA C 39 60.340 60.340 60.538 -0.198 25575
1663 1 6 . 1 1 39 39 VAL CB C 39 31.290 31.290 32.306 -1.016 25575
1664 1 6 . 1 1 39 39 VAL H H 39 8.060 8.060 8.043 0.017 25575
1665 1 6 . 1 1 40 40 ARG N N 40 127.360 127.360 122.965 4.395 25575
1666 1 6 . 1 1 40 40 ARG HA H 40 4.430 4.430 4.361 0.069 25575
1667 1 6 . 1 1 40 40 ARG CA C 40 56.150 56.150 54.712 1.438 25575
1668 1 6 . 1 1 40 40 ARG CB C 40 29.210 29.210 29.476 -0.266 25575
1669 1 6 . 1 1 40 40 ARG H H 40 8.950 8.950 7.923 1.027 25575
1670 1 6 . 1 1 41 41 PRO HA H 41 4.430 4.430 4.530 -0.100 25575
1671 1 6 . 1 1 41 41 PRO CA C 41 62.690 62.690 62.855 -0.165 25575
1672 1 6 . 1 1 41 41 PRO CB C 41 32.010 32.010 32.166 -0.157 25575
1673 1 6 . 1 1 42 42 ALA N N 42 124.260 124.260 125.367 -1.107 25575
1674 1 6 . 1 1 42 42 ALA HA H 42 3.620 3.620 4.681 -1.061 25575
1675 1 6 . 1 1 42 42 ALA CA C 42 52.930 52.930 50.681 2.248 25575
1676 1 6 . 1 1 42 42 ALA CB C 42 19.130 19.130 20.202 -1.072 25575
1677 1 6 . 1 1 42 42 ALA H H 42 8.410 8.410 8.192 0.218 25575
1678 1 6 . 1 1 43 43 GLY N N 43 112.690 112.690 110.906 1.784 25575
1679 1 6 . 1 1 43 43 GLY CA C 43 44.240 44.240 44.352 -0.112 25575
1680 1 6 . 1 1 43 43 GLY H H 43 8.090 8.090 8.814 -0.724 25575
1681 1 6 . 1 1 44 44 ASN N N 44 116.980 116.980 120.890 -3.910 25575
1682 1 6 . 1 1 44 44 ASN HA H 44 4.690 4.690 4.652 0.038 25575
1683 1 6 . 1 1 44 44 ASN CA C 44 53.420 53.420 53.586 -0.166 25575
1684 1 6 . 1 1 44 44 ASN CB C 44 39.370 39.370 37.468 1.902 25575
1685 1 6 . 1 1 44 44 ASN H H 44 8.720 8.720 8.591 0.129 25575
1686 1 6 . 1 1 45 45 ALA N N 45 124.240 124.240 122.715 1.525 25575
1687 1 6 . 1 1 45 45 ALA HA H 45 4.640 4.640 4.805 -0.165 25575
1688 1 6 . 1 1 45 45 ALA CA C 45 52.240 52.240 51.319 0.921 25575
1689 1 6 . 1 1 45 45 ALA CB C 45 19.540 19.540 21.704 -2.164 25575
1690 1 6 . 1 1 45 45 ALA H H 45 8.770 8.770 8.179 0.591 25575
1691 1 6 . 1 1 46 46 SER N N 46 111.670 111.670 117.440 -5.770 25575
1692 1 6 . 1 1 46 46 SER HA H 46 5.300 5.300 4.757 0.543 25575
1693 1 6 . 1 1 46 46 SER CA C 46 56.580 56.580 56.678 -0.098 25575
1694 1 6 . 1 1 46 46 SER CB C 46 66.490 66.490 65.865 0.625 25575
1695 1 6 . 1 1 46 46 SER H H 46 8.060 8.060 8.390 -0.330 25575
1696 1 6 . 1 1 47 47 PHE HA H 47 4.520 4.520 4.629 -0.109 25575
1697 1 6 . 1 1 47 47 PHE CA C 47 57.000 57.000 56.105 0.895 25575
1698 1 6 . 1 1 47 47 PHE CB C 47 38.360 38.360 37.914 0.446 25575
1699 1 6 . 1 1 48 48 SER N N 48 116.970 116.970 118.526 -1.556 25575
1700 1 6 . 1 1 48 48 SER HA H 48 4.440 4.440 4.254 0.186 25575
1701 1 6 . 1 1 48 48 SER CA C 48 56.950 56.950 58.845 -1.895 25575
1702 1 6 . 1 1 48 48 SER CB C 48 65.810 65.810 64.259 1.551 25575
1703 1 6 . 1 1 48 48 SER H H 48 7.100 7.100 7.465 -0.365 25575
1704 1 6 . 1 1 49 49 LYS N N 49 120.650 120.650 125.194 -4.544 25575
1705 1 6 . 1 1 49 49 LYS HA H 49 3.900 3.900 3.764 0.136 25575
1706 1 6 . 1 1 49 49 LYS CA C 49 59.570 59.570 59.318 0.252 25575
1707 1 6 . 1 1 49 49 LYS CB C 49 31.790 31.790 32.037 -0.247 25575
1708 1 6 . 1 1 49 49 LYS H H 49 8.770 8.770 8.607 0.163 25575
1709 1 6 . 1 1 50 50 ARG N N 50 118.240 118.240 119.177 -0.937 25575
1710 1 6 . 1 1 50 50 ARG HA H 50 4.040 4.040 4.034 0.006 25575
1711 1 6 . 1 1 50 50 ARG CA C 50 59.070 59.070 58.661 0.409 25575
1712 1 6 . 1 1 50 50 ARG CB C 50 30.080 30.080 29.912 0.168 25575
1713 1 6 . 1 1 50 50 ARG H H 50 8.040 8.040 8.042 -0.002 25575
1714 1 6 . 1 1 51 51 VAL N N 51 121.680 121.680 118.838 2.842 25575
1715 1 6 . 1 1 51 51 VAL HA H 51 3.590 3.590 3.628 -0.038 25575
1716 1 6 . 1 1 51 51 VAL CA C 51 65.940 65.940 65.765 0.175 25575
1717 1 6 . 1 1 51 51 VAL CB C 51 31.620 31.620 30.886 0.734 25575
1718 1 6 . 1 1 51 51 VAL H H 51 7.350 7.350 8.052 -0.702 25575
1719 1 6 . 1 1 52 52 GLN N N 52 119.680 119.680 118.087 1.593 25575
1720 1 6 . 1 1 52 52 GLN HA H 52 3.570 3.570 3.987 -0.417 25575
1721 1 6 . 1 1 52 52 GLN CA C 52 59.210 59.210 59.095 0.115 25575
1722 1 6 . 1 1 52 52 GLN CB C 52 28.620 28.620 27.949 0.671 25575
1723 1 6 . 1 1 52 52 GLN H H 52 8.210 8.210 7.732 0.478 25575
1724 1 6 . 1 1 53 53 LYS N N 53 118.080 118.080 120.365 -2.285 25575
1725 1 6 . 1 1 53 53 LYS HA H 53 4.160 4.160 4.019 0.141 25575
1726 1 6 . 1 1 53 53 LYS CA C 53 58.670 58.670 58.759 -0.089 25575
1727 1 6 . 1 1 53 53 LYS CB C 53 32.120 32.120 31.857 0.263 25575
1728 1 6 . 1 1 53 53 LYS H H 53 7.960 7.960 7.622 0.338 25575
1729 1 6 . 1 1 54 54 SER N N 54 115.450 115.450 115.015 0.435 25575
1730 1 6 . 1 1 54 54 SER HA H 54 4.370 4.370 4.210 0.160 25575
1731 1 6 . 1 1 54 54 SER CA C 54 61.330 61.330 61.399 -0.069 25575
1732 1 6 . 1 1 54 54 SER CB C 54 63.690 63.690 62.759 0.931 25575
1733 1 6 . 1 1 54 54 SER H H 54 7.800 7.800 7.539 0.261 25575
1734 1 6 . 1 1 55 55 ILE N N 55 117.670 117.670 121.698 -4.028 25575
1735 1 6 . 1 1 55 55 ILE HA H 55 4.060 4.060 3.853 0.207 25575
1736 1 6 . 1 1 55 55 ILE CA C 55 63.330 63.330 64.698 -1.369 25575
1737 1 6 . 1 1 55 55 ILE CB C 55 38.980 38.980 38.113 0.867 25575
1738 1 6 . 1 1 55 55 ILE H H 55 7.840 7.840 7.804 0.036 25575
1739 1 6 . 1 1 56 56 SER N N 56 115.650 115.650 117.208 -1.558 25575
1740 1 6 . 1 1 56 56 SER HA H 56 4.490 4.490 4.097 0.393 25575
1741 1 6 . 1 1 56 56 SER CA C 56 60.220 60.220 62.312 -2.092 25575
1742 1 6 . 1 1 56 56 SER CB C 56 63.000 63.000 62.958 0.042 25575
1743 1 6 . 1 1 56 56 SER H H 56 8.060 8.060 8.488 -0.428 25575
1744 1 6 . 1 1 57 57 GLN N N 57 121.830 121.830 118.782 3.048 25575
1745 1 6 . 1 1 57 57 GLN HA H 57 4.200 4.200 4.192 0.008 25575
1746 1 6 . 1 1 57 57 GLN CA C 57 58.310 58.310 57.965 0.345 25575
1747 1 6 . 1 1 57 57 GLN CB C 57 28.850 28.850 28.266 0.584 25575
1748 1 6 . 1 1 57 57 GLN H H 57 8.620 8.620 8.359 0.261 25575
1749 1 6 . 1 1 58 58 LYS N N 58 116.960 116.960 119.966 -3.006 25575
1750 1 6 . 1 1 58 58 LYS HA H 58 4.290 4.290 4.325 -0.035 25575
1751 1 6 . 1 1 58 58 LYS CA C 58 56.920 56.920 55.043 1.877 25575
1752 1 6 . 1 1 58 58 LYS CB C 58 32.900 32.900 33.063 -0.163 25575
1753 1 6 . 1 1 58 58 LYS H H 58 7.950 7.950 7.821 0.129 25575
1754 1 6 . 1 1 59 59 LYS N N 59 116.960 116.960 117.590 -0.630 25575
1755 1 6 . 1 1 59 59 LYS HA H 59 4.120 4.120 3.934 0.186 25575
1756 1 6 . 1 1 59 59 LYS CA C 59 57.090 57.090 57.013 0.077 25575
1757 1 6 . 1 1 59 59 LYS CB C 59 30.080 30.080 29.482 0.598 25575
1758 1 6 . 1 1 59 59 LYS H H 59 7.950 7.950 7.680 0.270 25575
1759 1 6 . 1 1 60 60 LEU N N 60 117.540 117.540 118.970 -1.430 25575
1760 1 6 . 1 1 60 60 LEU HA H 60 4.480 4.480 4.312 0.168 25575
1761 1 6 . 1 1 60 60 LEU CA C 60 54.500 54.500 55.638 -1.138 25575
1762 1 6 . 1 1 60 60 LEU CB C 60 42.840 42.840 42.319 0.521 25575
1763 1 6 . 1 1 60 60 LEU H H 60 7.930 7.930 7.505 0.425 25575
1764 1 6 . 1 1 61 61 LYS HA H 61 4.390 4.390 4.319 0.071 25575
1765 1 6 . 1 1 61 61 LYS CA C 61 55.540 55.540 55.934 -0.393 25575
1766 1 6 . 1 1 61 61 LYS CB C 61 30.050 30.050 30.777 -0.727 25575
1767 1 6 . 1 1 62 62 LEU N N 62 120.000 120.000 121.147 -1.147 25575
1768 1 6 . 1 1 62 62 LEU HA H 62 5.250 5.250 4.923 0.327 25575
1769 1 6 . 1 1 62 62 LEU CA C 62 53.080 53.080 54.350 -1.270 25575
1770 1 6 . 1 1 62 62 LEU CB C 62 45.760 45.760 42.626 3.134 25575
1771 1 6 . 1 1 62 62 LEU H H 62 7.470 7.470 7.450 0.020 25575
1772 1 6 . 1 1 63 63 ASP N N 63 121.730 121.730 124.661 -2.931 25575
1773 1 6 . 1 1 63 63 ASP HA H 63 4.860 4.860 4.818 0.042 25575
1774 1 6 . 1 1 63 63 ASP CA C 63 51.890 51.890 52.401 -0.511 25575
1775 1 6 . 1 1 63 63 ASP CB C 63 44.910 44.910 44.698 0.212 25575
1776 1 6 . 1 1 63 63 ASP H H 63 8.620 8.620 8.831 -0.211 25575
1777 1 6 . 1 1 64 64 ILE N N 64 118.120 118.120 120.466 -2.346 25575
1778 1 6 . 1 1 64 64 ILE HA H 64 4.210 4.210 4.210 0.000 25575
1779 1 6 . 1 1 64 64 ILE CA C 64 60.430 60.430 58.526 1.904 25575
1780 1 6 . 1 1 64 64 ILE CB C 64 40.420 40.420 38.415 2.005 25575
1781 1 6 . 1 1 64 64 ILE H H 64 8.650 8.650 8.222 0.428 25575
1782 1 6 . 1 1 65 65 ASP N N 65 124.550 124.550 127.808 -3.258 25575
1783 1 6 . 1 1 65 65 ASP HA H 65 4.570 4.570 4.516 0.054 25575
1784 1 6 . 1 1 65 65 ASP CA C 65 53.310 53.310 54.282 -0.972 25575
1785 1 6 . 1 1 65 65 ASP CB C 65 40.440 40.440 43.031 -2.591 25575
1786 1 6 . 1 1 65 65 ASP H H 65 8.630 8.630 8.080 0.550 25575
1787 1 6 . 1 1 66 66 LYS N N 66 125.970 125.970 123.693 2.277 25575
1788 1 6 . 1 1 66 66 LYS HA H 66 4.040 4.040 4.394 -0.354 25575
1789 1 6 . 1 1 66 66 LYS CA C 66 58.140 58.140 56.850 1.290 25575
1790 1 6 . 1 1 66 66 LYS CB C 66 31.990 31.990 32.709 -0.719 25575
1791 1 6 . 1 1 66 66 LYS H H 66 8.590 8.590 8.582 0.008 25575
1792 1 6 . 1 1 67 67 SER N N 67 114.980 114.980 117.143 -2.163 25575
1793 1 6 . 1 1 67 67 SER HA H 67 4.320 4.320 4.243 0.077 25575
1794 1 6 . 1 1 67 67 SER CA C 67 60.330 60.330 61.073 -0.743 25575
1795 1 6 . 1 1 67 67 SER CB C 67 63.710 63.710 62.983 0.727 25575
1796 1 6 . 1 1 67 67 SER H H 67 8.760 8.760 8.638 0.122 25575
1797 1 6 . 1 1 68 68 VAL HA H 68 4.250 4.250 4.211 0.039 25575
1798 1 6 . 1 1 68 68 VAL CA C 68 62.150 62.150 62.121 0.029 25575
1799 1 6 . 1 1 68 68 VAL CB C 68 31.900 31.900 32.480 -0.580 25575
1800 1 6 . 1 1 69 69 ARG CA C 69 56.960 56.960 57.892 -0.932 25575
1801 1 6 . 1 1 70 70 HIS N N 70 116.270 116.270 117.222 -0.952 25575
1802 1 6 . 1 1 70 70 HIS HA H 70 4.760 4.760 4.659 0.101 25575
1803 1 6 . 1 1 70 70 HIS CA C 70 55.360 55.360 54.826 0.534 25575
1804 1 6 . 1 1 70 70 HIS CB C 70 33.100 33.100 30.802 2.298 25575
1805 1 6 . 1 1 70 70 HIS H H 70 7.390 7.390 8.021 -0.631 25575
1806 1 6 . 1 1 71 71 LEU N N 71 120.200 120.200 123.073 -2.873 25575
1807 1 6 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.584 0.476 25575
1808 1 6 . 1 1 71 71 LEU CA C 71 54.070 54.070 54.294 -0.224 25575
1809 1 6 . 1 1 71 71 LEU CB C 71 42.710 42.710 40.453 2.257 25575
1810 1 6 . 1 1 71 71 LEU H H 71 7.970 7.970 8.562 -0.592 25575
1811 1 6 . 1 1 72 72 TYR HA H 72 5.030 5.030 4.948 0.082 25575
1812 1 6 . 1 1 72 72 TYR CA C 72 59.990 59.990 57.292 2.698 25575
1813 1 6 . 1 1 72 72 TYR CB C 72 39.440 39.440 42.060 -2.620 25575
1814 1 6 . 1 1 73 73 ILE N N 73 112.940 112.940 114.538 -1.598 25575
1815 1 6 . 1 1 73 73 ILE HA H 73 6.080 6.080 4.836 1.244 25575
1816 1 6 . 1 1 73 73 ILE CA C 73 58.090 58.090 58.622 -0.532 25575
1817 1 6 . 1 1 73 73 ILE CB C 73 41.820 41.820 42.240 -0.420 25575
1818 1 6 . 1 1 73 73 ILE H H 73 8.450 8.450 8.372 0.078 25575
1819 1 6 . 1 1 74 74 CYS N N 74 124.730 124.730 120.863 3.867 25575
1820 1 6 . 1 1 74 74 CYS HA H 74 5.080 5.080 5.050 0.030 25575
1821 1 6 . 1 1 74 74 CYS CA C 74 57.670 57.670 57.310 0.360 25575
1822 1 6 . 1 1 74 74 CYS CB C 74 33.330 33.330 30.614 2.716 25575
1823 1 6 . 1 1 74 74 CYS H H 74 9.830 9.830 8.629 1.201 25575
1824 1 6 . 1 1 75 75 ASP N N 75 120.990 120.990 122.849 -1.859 25575
1825 1 6 . 1 1 75 75 ASP HA H 75 4.590 4.590 4.316 0.274 25575
1826 1 6 . 1 1 75 75 ASP CA C 75 57.320 57.320 57.547 -0.227 25575
1827 1 6 . 1 1 75 75 ASP CB C 75 39.670 39.670 40.183 -0.513 25575
1828 1 6 . 1 1 75 75 ASP H H 75 9.090 9.090 8.760 0.330 25575
1829 1 6 . 1 1 76 76 PHE N N 76 122.470 122.470 121.682 0.788 25575
1830 1 6 . 1 1 76 76 PHE HA H 76 4.230 4.230 4.195 0.035 25575
1831 1 6 . 1 1 76 76 PHE CA C 76 62.030 62.030 61.584 0.445 25575
1832 1 6 . 1 1 76 76 PHE CB C 76 38.190 38.190 39.171 -0.981 25575
1833 1 6 . 1 1 76 76 PHE H H 76 8.330 8.330 8.146 0.184 25575
1834 1 6 . 1 1 77 77 HIS N N 77 124.580 124.580 118.507 6.073 25575
1835 1 6 . 1 1 77 77 HIS HA H 77 4.280 4.280 4.221 0.059 25575
1836 1 6 . 1 1 77 77 HIS CA C 77 63.880 63.880 59.757 4.123 25575
1837 1 6 . 1 1 77 77 HIS CB C 77 29.600 29.600 29.968 -0.368 25575
1838 1 6 . 1 1 77 77 HIS H H 77 10.300 10.300 7.758 2.542 25575
1839 1 6 . 1 1 78 78 LYS N N 78 122.930 122.930 119.745 3.185 25575
1840 1 6 . 1 1 78 78 LYS HA H 78 3.860 3.860 3.938 -0.078 25575
1841 1 6 . 1 1 78 78 LYS CA C 78 60.550 60.550 60.183 0.367 25575
1842 1 6 . 1 1 78 78 LYS CB C 78 32.040 32.040 32.344 -0.304 25575
1843 1 6 . 1 1 78 78 LYS H H 78 8.960 8.960 8.598 0.362 25575
1844 1 6 . 1 1 79 79 ASN N N 79 116.670 116.670 118.054 -1.384 25575
1845 1 6 . 1 1 79 79 ASN HA H 79 4.420 4.420 4.636 -0.216 25575
1846 1 6 . 1 1 79 79 ASN CA C 79 56.030 56.030 56.141 -0.111 25575
1847 1 6 . 1 1 79 79 ASN CB C 79 38.100 38.100 38.490 -0.390 25575
1848 1 6 . 1 1 79 79 ASN H H 79 8.230 8.230 7.854 0.376 25575
1849 1 6 . 1 1 80 80 PHE N N 80 122.600 122.600 121.991 0.609 25575
1850 1 6 . 1 1 80 80 PHE HA H 80 4.180 4.180 4.058 0.122 25575
1851 1 6 . 1 1 80 80 PHE CA C 80 60.700 60.700 61.446 -0.746 25575
1852 1 6 . 1 1 80 80 PHE CB C 80 39.840 39.840 38.911 0.929 25575
1853 1 6 . 1 1 80 80 PHE H H 80 8.200 8.200 8.338 -0.138 25575
1854 1 6 . 1 1 81 81 ILE N N 81 118.240 118.240 117.418 0.822 25575
1855 1 6 . 1 1 81 81 ILE HA H 81 3.320 3.320 3.399 -0.079 25575
1856 1 6 . 1 1 81 81 ILE CA C 81 65.160 65.160 65.438 -0.278 25575
1857 1 6 . 1 1 81 81 ILE CB C 81 38.440 38.440 37.554 0.886 25575
1858 1 6 . 1 1 81 81 ILE H H 81 8.520 8.520 7.859 0.661 25575
1859 1 6 . 1 1 82 82 GLN N N 82 116.370 116.370 118.779 -2.409 25575
1860 1 6 . 1 1 82 82 GLN HA H 82 4.100 4.100 3.948 0.152 25575
1861 1 6 . 1 1 82 82 GLN CA C 82 57.710 57.710 58.924 -1.214 25575
1862 1 6 . 1 1 82 82 GLN CB C 82 28.710 28.710 28.465 0.245 25575
1863 1 6 . 1 1 82 82 GLN H H 82 7.670 7.670 7.492 0.178 25575
1864 1 6 . 1 1 83 83 SER N N 83 114.440 114.440 115.975 -1.535 25575
1865 1 6 . 1 1 83 83 SER HA H 83 4.300 4.300 4.055 0.245 25575
1866 1 6 . 1 1 83 83 SER CA C 83 60.130 60.130 61.712 -1.582 25575
1867 1 6 . 1 1 83 83 SER CB C 83 63.570 63.570 62.981 0.589 25575
1868 1 6 . 1 1 83 83 SER H H 83 7.810 7.810 8.460 -0.650 25575
1869 1 6 . 1 1 84 84 VAL N N 84 120.750 120.750 120.159 0.591 25575
1870 1 6 . 1 1 84 84 VAL HA H 84 3.970 3.970 3.679 0.291 25575
1871 1 6 . 1 1 84 84 VAL CA C 84 63.430 63.430 65.941 -2.511 25575
1872 1 6 . 1 1 84 84 VAL CB C 84 31.960 31.960 30.521 1.439 25575
1873 1 6 . 1 1 84 84 VAL H H 84 7.790 7.790 7.377 0.413 25575
1874 1 6 . 1 1 85 85 ARG N N 85 122.090 122.090 120.189 1.901 25575
1875 1 6 . 1 1 85 85 ARG HA H 85 4.240 4.240 4.016 0.224 25575
1876 1 6 . 1 1 85 85 ARG CA C 85 56.850 56.850 58.720 -1.870 25575
1877 1 6 . 1 1 85 85 ARG CB C 85 30.720 30.720 29.906 0.814 25575
1878 1 6 . 1 1 85 85 ARG H H 85 8.090 8.090 7.427 0.663 25575
1879 1 6 . 1 1 86 86 ASN N N 86 118.510 118.510 117.205 1.305 25575
1880 1 6 . 1 1 86 86 ASN HA H 86 4.690 4.690 4.619 0.071 25575
1881 1 6 . 1 1 86 86 ASN CA C 86 53.380 53.380 54.732 -1.352 25575
1882 1 6 . 1 1 86 86 ASN CB C 86 38.950 38.950 38.465 0.485 25575
1883 1 6 . 1 1 86 86 ASN H H 86 8.220 8.220 8.050 0.170 25575
1884 1 6 . 1 1 87 87 LYS N N 87 121.600 121.600 118.974 2.626 25575
1885 1 6 . 1 1 87 87 LYS HA H 87 4.310 4.310 4.157 0.153 25575
1886 1 6 . 1 1 87 87 LYS CA C 87 56.590 56.590 56.547 0.043 25575
1887 1 6 . 1 1 87 87 LYS CB C 87 32.870 32.870 32.711 0.159 25575
1888 1 6 . 1 1 87 87 LYS H H 87 8.150 8.150 7.955 0.195 25575
1889 1 6 . 1 1 88 88 ARG N N 88 121.920 121.920 118.754 3.166 25575
1890 1 6 . 1 1 88 88 ARG HA H 88 4.330 4.330 3.896 0.434 25575
1891 1 6 . 1 1 88 88 ARG CA C 88 56.110 56.110 57.118 -1.008 25575
1892 1 6 . 1 1 88 88 ARG CB C 88 30.870 30.870 28.752 2.118 25575
1893 1 6 . 1 1 88 88 ARG H H 88 8.250 8.250 7.615 0.635 25575
1894 1 6 . 1 1 89 89 LYS N N 89 123.020 123.020 118.614 4.406 25575
1895 1 6 . 1 1 89 89 LYS HA H 89 4.320 4.320 4.167 0.153 25575
1896 1 6 . 1 1 89 89 LYS CA C 89 56.330 56.330 56.500 -0.170 25575
1897 1 6 . 1 1 89 89 LYS CB C 89 33.140 33.140 30.680 2.460 25575
1898 1 6 . 1 1 89 89 LYS H H 89 8.320 8.320 8.273 0.047 25575
1899 1 6 . 1 1 90 90 ARG N N 90 122.970 122.970 122.987 -0.017 25575
1900 1 6 . 1 1 90 90 ARG HA H 90 4.360 4.360 4.246 0.114 25575
1901 1 6 . 1 1 90 90 ARG CA C 90 56.100 56.100 56.012 0.088 25575
1902 1 6 . 1 1 90 90 ARG CB C 90 31.210 31.210 29.030 2.180 25575
1903 1 6 . 1 1 90 90 ARG H H 90 8.360 8.360 8.099 0.261 25575
1904 1 6 . 1 1 91 91 LYS N N 91 123.680 123.680 124.389 -0.709 25575
1905 1 6 . 1 1 91 91 LYS HA H 91 4.380 4.380 4.633 -0.253 25575
1906 1 6 . 1 1 91 91 LYS CA C 91 56.620 56.620 55.639 0.980 25575
1907 1 6 . 1 1 91 91 LYS CB C 91 33.070 33.070 34.298 -1.228 25575
1908 1 6 . 1 1 91 91 LYS H H 91 8.450 8.450 7.922 0.528 25575
1909 1 7 . 1 1 24 24 SER HA H 24 4.330 4.330 4.337 -0.007 25575
1910 1 7 . 1 1 24 24 SER CA C 24 58.130 58.130 58.787 -0.657 25575
1911 1 7 . 1 1 24 24 SER CB C 24 63.870 63.870 63.355 0.515 25575
1912 1 7 . 1 1 25 25 TYR N N 25 122.160 122.160 119.020 3.140 25575
1913 1 7 . 1 1 25 25 TYR HA H 25 4.530 4.530 4.463 0.067 25575
1914 1 7 . 1 1 25 25 TYR CA C 25 58.420 58.420 58.723 -0.303 25575
1915 1 7 . 1 1 25 25 TYR CB C 25 38.570 38.570 38.694 -0.124 25575
1916 1 7 . 1 1 25 25 TYR H H 25 8.310 8.310 7.593 0.717 25575
1917 1 7 . 1 1 26 26 GLY N N 26 111.370 111.370 111.869 -0.499 25575
1918 1 7 . 1 1 26 26 GLY CA C 26 45.330 45.330 45.545 -0.215 25575
1919 1 7 . 1 1 26 26 GLY H H 26 8.300 8.300 8.836 -0.536 25575
1920 1 7 . 1 1 27 27 GLN N N 27 118.910 118.910 120.423 -1.513 25575
1921 1 7 . 1 1 27 27 GLN HA H 27 4.510 4.510 4.781 -0.271 25575
1922 1 7 . 1 1 27 27 GLN CA C 27 55.240 55.240 54.449 0.791 25575
1923 1 7 . 1 1 27 27 GLN CB C 27 29.800 29.800 29.987 -0.187 25575
1924 1 7 . 1 1 27 27 GLN H H 27 8.050 8.050 8.142 -0.092 25575
1925 1 7 . 1 1 28 28 SER N N 28 119.460 119.460 115.096 4.364 25575
1926 1 7 . 1 1 28 28 SER HA H 28 4.810 4.810 4.958 -0.148 25575
1927 1 7 . 1 1 28 28 SER CA C 28 57.710 57.710 56.484 1.226 25575
1928 1 7 . 1 1 28 28 SER CB C 28 65.530 65.530 65.674 -0.144 25575
1929 1 7 . 1 1 28 28 SER H H 28 8.800 8.800 8.403 0.397 25575
1930 1 7 . 1 1 29 29 CYS N N 29 122.160 122.160 118.765 3.395 25575
1931 1 7 . 1 1 29 29 CYS HA H 29 4.130 4.130 4.533 -0.403 25575
1932 1 7 . 1 1 29 29 CYS CA C 29 60.620 60.620 61.749 -1.129 25575
1933 1 7 . 1 1 29 29 CYS CB C 29 32.770 32.770 29.073 3.697 25575
1934 1 7 . 1 1 29 29 CYS H H 29 8.390 8.390 8.481 -0.091 25575
1935 1 7 . 1 1 30 30 CYS N N 30 122.320 122.320 119.258 3.062 25575
1936 1 7 . 1 1 30 30 CYS HA H 30 4.530 4.530 4.888 -0.358 25575
1937 1 7 . 1 1 30 30 CYS CA C 30 58.810 58.810 56.925 1.885 25575
1938 1 7 . 1 1 30 30 CYS CB C 30 28.910 28.910 28.195 0.715 25575
1939 1 7 . 1 1 30 30 CYS H H 30 8.340 8.340 8.310 0.030 25575
1940 1 7 . 1 1 31 31 LEU N N 31 122.390 122.390 122.868 -0.478 25575
1941 1 7 . 1 1 31 31 LEU HA H 31 4.640 4.640 4.911 -0.271 25575
1942 1 7 . 1 1 31 31 LEU CA C 31 55.440 55.440 54.098 1.342 25575
1943 1 7 . 1 1 31 31 LEU CB C 31 43.490 43.490 43.120 0.370 25575
1944 1 7 . 1 1 31 31 LEU H H 31 8.460 8.460 7.113 1.347 25575
1945 1 7 . 1 1 32 32 ILE N N 32 118.890 118.890 118.690 0.200 25575
1946 1 7 . 1 1 32 32 ILE HA H 32 4.200 4.200 4.659 -0.459 25575
1947 1 7 . 1 1 32 32 ILE CA C 32 60.440 60.440 60.387 0.053 25575
1948 1 7 . 1 1 32 32 ILE CB C 32 39.890 39.890 40.769 -0.879 25575
1949 1 7 . 1 1 32 32 ILE H H 32 8.680 8.680 8.169 0.511 25575
1950 1 7 . 1 1 33 33 GLU N N 33 128.400 128.400 127.925 0.475 25575
1951 1 7 . 1 1 33 33 GLU HA H 33 5.080 5.080 5.143 -0.063 25575
1952 1 7 . 1 1 33 33 GLU CA C 33 54.120 54.120 54.768 -0.648 25575
1953 1 7 . 1 1 33 33 GLU CB C 33 32.080 32.080 32.360 -0.280 25575
1954 1 7 . 1 1 33 33 GLU H H 33 8.640 8.640 8.607 0.033 25575
1955 1 7 . 1 1 34 34 ASP N N 34 130.390 130.390 127.848 2.542 25575
1956 1 7 . 1 1 34 34 ASP HA H 34 4.310 4.310 4.278 0.032 25575
1957 1 7 . 1 1 34 34 ASP CA C 34 55.150 55.150 55.692 -0.542 25575
1958 1 7 . 1 1 34 34 ASP CB C 34 40.050 40.050 40.558 -0.508 25575
1959 1 7 . 1 1 34 34 ASP H H 34 9.540 9.540 8.855 0.685 25575
1960 1 7 . 1 1 35 35 GLY N N 35 126.620 126.620 103.692 22.928 25575
1961 1 7 . 1 1 35 35 GLY CA C 35 45.480 45.480 44.856 0.624 25575
1962 1 7 . 1 1 35 35 GLY H H 35 8.370 8.370 8.209 0.161 25575
1963 1 7 . 1 1 36 36 GLU N N 36 120.860 120.860 123.274 -2.414 25575
1964 1 7 . 1 1 36 36 GLU HA H 36 4.670 4.670 4.204 0.466 25575
1965 1 7 . 1 1 36 36 GLU CA C 36 54.350 54.350 55.404 -1.054 25575
1966 1 7 . 1 1 36 36 GLU CB C 36 31.630 31.630 29.839 1.791 25575
1967 1 7 . 1 1 36 36 GLU H H 36 7.820 7.820 8.013 -0.193 25575
1968 1 7 . 1 1 37 37 ARG N N 37 129.790 129.790 127.975 1.815 25575
1969 1 7 . 1 1 37 37 ARG HA H 37 4.200 4.200 4.298 -0.098 25575
1970 1 7 . 1 1 37 37 ARG CA C 37 56.440 56.440 55.103 1.337 25575
1971 1 7 . 1 1 37 37 ARG CB C 37 29.710 29.710 28.589 1.121 25575
1972 1 7 . 1 1 37 37 ARG H H 37 8.930 8.930 8.383 0.547 25575
1973 1 7 . 1 1 38 38 CYS N N 38 130.950 130.950 125.592 5.358 25575
1974 1 7 . 1 1 38 38 CYS HA H 38 4.450 4.450 4.291 0.159 25575
1975 1 7 . 1 1 38 38 CYS CA C 38 60.560 60.560 60.604 -0.044 25575
1976 1 7 . 1 1 38 38 CYS CB C 38 31.250 31.250 28.724 2.526 25575
1977 1 7 . 1 1 38 38 CYS H H 38 9.050 9.050 8.184 0.866 25575
1978 1 7 . 1 1 39 39 VAL N N 39 118.270 118.270 120.622 -2.352 25575
1979 1 7 . 1 1 39 39 VAL HA H 39 4.710 4.710 4.326 0.384 25575
1980 1 7 . 1 1 39 39 VAL CA C 39 60.340 60.340 60.504 -0.164 25575
1981 1 7 . 1 1 39 39 VAL CB C 39 31.290 31.290 31.599 -0.309 25575
1982 1 7 . 1 1 39 39 VAL H H 39 8.060 8.060 8.151 -0.091 25575
1983 1 7 . 1 1 40 40 ARG N N 40 127.360 127.360 123.158 4.202 25575
1984 1 7 . 1 1 40 40 ARG HA H 40 4.430 4.430 4.403 0.027 25575
1985 1 7 . 1 1 40 40 ARG CA C 40 56.150 56.150 55.001 1.149 25575
1986 1 7 . 1 1 40 40 ARG CB C 40 29.210 29.210 29.576 -0.366 25575
1987 1 7 . 1 1 40 40 ARG H H 40 8.950 8.950 7.684 1.266 25575
1988 1 7 . 1 1 41 41 PRO HA H 41 4.430 4.430 4.432 -0.002 25575
1989 1 7 . 1 1 41 41 PRO CA C 41 62.690 62.690 62.991 -0.301 25575
1990 1 7 . 1 1 41 41 PRO CB C 41 32.010 32.010 32.372 -0.362 25575
1991 1 7 . 1 1 42 42 ALA N N 42 124.260 124.260 123.800 0.460 25575
1992 1 7 . 1 1 42 42 ALA HA H 42 3.620 3.620 4.765 -1.145 25575
1993 1 7 . 1 1 42 42 ALA CA C 42 52.930 52.930 50.928 2.002 25575
1994 1 7 . 1 1 42 42 ALA CB C 42 19.130 19.130 20.771 -1.641 25575
1995 1 7 . 1 1 42 42 ALA H H 42 8.410 8.410 8.140 0.270 25575
1996 1 7 . 1 1 43 43 GLY N N 43 112.690 112.690 111.502 1.188 25575
1997 1 7 . 1 1 43 43 GLY CA C 43 44.240 44.240 45.089 -0.849 25575
1998 1 7 . 1 1 43 43 GLY H H 43 8.090 8.090 8.442 -0.352 25575
1999 1 7 . 1 1 44 44 ASN N N 44 116.980 116.980 121.373 -4.393 25575
2000 1 7 . 1 1 44 44 ASN HA H 44 4.690 4.690 4.341 0.349 25575
2001 1 7 . 1 1 44 44 ASN CA C 44 53.420 53.420 53.904 -0.484 25575
2002 1 7 . 1 1 44 44 ASN CB C 44 39.370 39.370 38.217 1.153 25575
2003 1 7 . 1 1 44 44 ASN H H 44 8.720 8.720 8.888 -0.168 25575
2004 1 7 . 1 1 45 45 ALA N N 45 124.240 124.240 118.896 5.344 25575
2005 1 7 . 1 1 45 45 ALA HA H 45 4.640 4.640 4.653 -0.013 25575
2006 1 7 . 1 1 45 45 ALA CA C 45 52.240 52.240 51.433 0.807 25575
2007 1 7 . 1 1 45 45 ALA CB C 45 19.540 19.540 22.536 -2.996 25575
2008 1 7 . 1 1 45 45 ALA H H 45 8.770 8.770 7.883 0.887 25575
2009 1 7 . 1 1 46 46 SER N N 46 111.670 111.670 115.721 -4.051 25575
2010 1 7 . 1 1 46 46 SER HA H 46 5.300 5.300 4.997 0.303 25575
2011 1 7 . 1 1 46 46 SER CA C 46 56.580 56.580 57.496 -0.916 25575
2012 1 7 . 1 1 46 46 SER CB C 46 66.490 66.490 65.323 1.167 25575
2013 1 7 . 1 1 46 46 SER H H 46 8.060 8.060 8.210 -0.150 25575
2014 1 7 . 1 1 47 47 PHE HA H 47 4.520 4.520 4.762 -0.242 25575
2015 1 7 . 1 1 47 47 PHE CA C 47 57.000 57.000 56.423 0.577 25575
2016 1 7 . 1 1 47 47 PHE CB C 47 38.360 38.360 39.120 -0.760 25575
2017 1 7 . 1 1 48 48 SER N N 48 116.970 116.970 118.522 -1.552 25575
2018 1 7 . 1 1 48 48 SER HA H 48 4.440 4.440 4.293 0.147 25575
2019 1 7 . 1 1 48 48 SER CA C 48 56.950 56.950 58.705 -1.755 25575
2020 1 7 . 1 1 48 48 SER CB C 48 65.810 65.810 64.288 1.522 25575
2021 1 7 . 1 1 48 48 SER H H 48 7.100 7.100 8.032 -0.932 25575
2022 1 7 . 1 1 49 49 LYS N N 49 120.650 120.650 123.645 -2.995 25575
2023 1 7 . 1 1 49 49 LYS HA H 49 3.900 3.900 3.975 -0.075 25575
2024 1 7 . 1 1 49 49 LYS CA C 49 59.570 59.570 59.728 -0.158 25575
2025 1 7 . 1 1 49 49 LYS CB C 49 31.790 31.790 32.289 -0.499 25575
2026 1 7 . 1 1 49 49 LYS H H 49 8.770 8.770 8.549 0.221 25575
2027 1 7 . 1 1 50 50 ARG N N 50 118.240 118.240 118.102 0.138 25575
2028 1 7 . 1 1 50 50 ARG HA H 50 4.040 4.040 4.088 -0.048 25575
2029 1 7 . 1 1 50 50 ARG CA C 50 59.070 59.070 58.306 0.764 25575
2030 1 7 . 1 1 50 50 ARG CB C 50 30.080 30.080 29.421 0.659 25575
2031 1 7 . 1 1 50 50 ARG H H 50 8.040 8.040 8.194 -0.154 25575
2032 1 7 . 1 1 51 51 VAL N N 51 121.680 121.680 118.289 3.391 25575
2033 1 7 . 1 1 51 51 VAL HA H 51 3.590 3.590 3.893 -0.303 25575
2034 1 7 . 1 1 51 51 VAL CA C 51 65.940 65.940 65.231 0.709 25575
2035 1 7 . 1 1 51 51 VAL CB C 51 31.620 31.620 32.090 -0.470 25575
2036 1 7 . 1 1 51 51 VAL H H 51 7.350 7.350 7.699 -0.349 25575
2037 1 7 . 1 1 52 52 GLN N N 52 119.680 119.680 120.377 -0.697 25575
2038 1 7 . 1 1 52 52 GLN HA H 52 3.570 3.570 3.625 -0.055 25575
2039 1 7 . 1 1 52 52 GLN CA C 52 59.210 59.210 59.303 -0.093 25575
2040 1 7 . 1 1 52 52 GLN CB C 52 28.620 28.620 28.171 0.449 25575
2041 1 7 . 1 1 52 52 GLN H H 52 8.210 8.210 7.738 0.472 25575
2042 1 7 . 1 1 53 53 LYS N N 53 118.080 118.080 118.045 0.035 25575
2043 1 7 . 1 1 53 53 LYS HA H 53 4.160 4.160 3.962 0.198 25575
2044 1 7 . 1 1 53 53 LYS CA C 53 58.670 58.670 59.087 -0.417 25575
2045 1 7 . 1 1 53 53 LYS CB C 53 32.120 32.120 31.507 0.613 25575
2046 1 7 . 1 1 53 53 LYS H H 53 7.960 7.960 7.681 0.279 25575
2047 1 7 . 1 1 54 54 SER N N 54 115.450 115.450 114.413 1.037 25575
2048 1 7 . 1 1 54 54 SER HA H 54 4.370 4.370 4.281 0.089 25575
2049 1 7 . 1 1 54 54 SER CA C 54 61.330 61.330 60.645 0.685 25575
2050 1 7 . 1 1 54 54 SER CB C 54 63.690 63.690 63.167 0.523 25575
2051 1 7 . 1 1 54 54 SER H H 54 7.800 7.800 7.659 0.141 25575
2052 1 7 . 1 1 55 55 ILE N N 55 117.670 117.670 120.363 -2.693 25575
2053 1 7 . 1 1 55 55 ILE HA H 55 4.060 4.060 4.004 0.056 25575
2054 1 7 . 1 1 55 55 ILE CA C 55 63.330 63.330 63.943 -0.613 25575
2055 1 7 . 1 1 55 55 ILE CB C 55 38.980 38.980 38.527 0.453 25575
2056 1 7 . 1 1 55 55 ILE H H 55 7.840 7.840 7.507 0.333 25575
2057 1 7 . 1 1 56 56 SER N N 56 115.650 115.650 116.498 -0.848 25575
2058 1 7 . 1 1 56 56 SER HA H 56 4.490 4.490 4.144 0.346 25575
2059 1 7 . 1 1 56 56 SER CA C 56 60.220 60.220 61.803 -1.583 25575
2060 1 7 . 1 1 56 56 SER CB C 56 63.000 63.000 62.831 0.169 25575
2061 1 7 . 1 1 56 56 SER H H 56 8.060 8.060 8.436 -0.376 25575
2062 1 7 . 1 1 57 57 GLN N N 57 121.830 121.830 120.195 1.635 25575
2063 1 7 . 1 1 57 57 GLN HA H 57 4.200 4.200 4.205 -0.005 25575
2064 1 7 . 1 1 57 57 GLN CA C 57 58.310 58.310 57.763 0.547 25575
2065 1 7 . 1 1 57 57 GLN CB C 57 28.850 28.850 28.889 -0.039 25575
2066 1 7 . 1 1 57 57 GLN H H 57 8.620 8.620 7.832 0.788 25575
2067 1 7 . 1 1 58 58 LYS N N 58 116.960 116.960 117.792 -0.832 25575
2068 1 7 . 1 1 58 58 LYS HA H 58 4.290 4.290 4.409 -0.119 25575
2069 1 7 . 1 1 58 58 LYS CA C 58 56.920 56.920 55.160 1.760 25575
2070 1 7 . 1 1 58 58 LYS CB C 58 32.900 32.900 33.038 -0.138 25575
2071 1 7 . 1 1 58 58 LYS H H 58 7.950 7.950 7.499 0.451 25575
2072 1 7 . 1 1 59 59 LYS N N 59 116.960 116.960 120.075 -3.115 25575
2073 1 7 . 1 1 59 59 LYS HA H 59 4.120 4.120 3.931 0.189 25575
2074 1 7 . 1 1 59 59 LYS CA C 59 57.090 57.090 57.188 -0.098 25575
2075 1 7 . 1 1 59 59 LYS CB C 59 30.080 30.080 30.449 -0.369 25575
2076 1 7 . 1 1 59 59 LYS H H 59 7.950 7.950 7.640 0.310 25575
2077 1 7 . 1 1 60 60 LEU N N 60 117.540 117.540 118.747 -1.207 25575
2078 1 7 . 1 1 60 60 LEU HA H 60 4.480 4.480 4.286 0.194 25575
2079 1 7 . 1 1 60 60 LEU CA C 60 54.500 54.500 55.383 -0.883 25575
2080 1 7 . 1 1 60 60 LEU CB C 60 42.840 42.840 42.840 0.000 25575
2081 1 7 . 1 1 60 60 LEU H H 60 7.930 7.930 7.500 0.430 25575
2082 1 7 . 1 1 61 61 LYS HA H 61 4.390 4.390 4.328 0.062 25575
2083 1 7 . 1 1 61 61 LYS CA C 61 55.540 55.540 55.966 -0.426 25575
2084 1 7 . 1 1 61 61 LYS CB C 61 30.050 30.050 31.273 -1.224 25575
2085 1 7 . 1 1 62 62 LEU N N 62 120.000 120.000 121.635 -1.635 25575
2086 1 7 . 1 1 62 62 LEU HA H 62 5.250 5.250 5.201 0.049 25575
2087 1 7 . 1 1 62 62 LEU CA C 62 53.080 53.080 53.849 -0.769 25575
2088 1 7 . 1 1 62 62 LEU CB C 62 45.760 45.760 44.066 1.694 25575
2089 1 7 . 1 1 62 62 LEU H H 62 7.470 7.470 7.537 -0.067 25575
2090 1 7 . 1 1 63 63 ASP N N 63 121.730 121.730 126.287 -4.557 25575
2091 1 7 . 1 1 63 63 ASP HA H 63 4.860 4.860 4.838 0.022 25575
2092 1 7 . 1 1 63 63 ASP CA C 63 51.890 51.890 52.365 -0.475 25575
2093 1 7 . 1 1 63 63 ASP CB C 63 44.910 44.910 44.352 0.558 25575
2094 1 7 . 1 1 63 63 ASP H H 63 8.620 8.620 9.112 -0.492 25575
2095 1 7 . 1 1 64 64 ILE N N 64 118.120 118.120 118.593 -0.473 25575
2096 1 7 . 1 1 64 64 ILE HA H 64 4.210 4.210 4.541 -0.331 25575
2097 1 7 . 1 1 64 64 ILE CA C 64 60.430 60.430 58.610 1.820 25575
2098 1 7 . 1 1 64 64 ILE CB C 64 40.420 40.420 40.892 -0.472 25575
2099 1 7 . 1 1 64 64 ILE H H 64 8.650 8.650 8.205 0.445 25575
2100 1 7 . 1 1 65 65 ASP N N 65 124.550 124.550 127.998 -3.448 25575
2101 1 7 . 1 1 65 65 ASP HA H 65 4.570 4.570 4.530 0.040 25575
2102 1 7 . 1 1 65 65 ASP CA C 65 53.310 53.310 53.798 -0.488 25575
2103 1 7 . 1 1 65 65 ASP CB C 65 40.440 40.440 40.198 0.242 25575
2104 1 7 . 1 1 65 65 ASP H H 65 8.630 8.630 8.990 -0.360 25575
2105 1 7 . 1 1 66 66 LYS N N 66 125.970 125.970 125.681 0.289 25575
2106 1 7 . 1 1 66 66 LYS HA H 66 4.040 4.040 4.061 -0.021 25575
2107 1 7 . 1 1 66 66 LYS CA C 66 58.140 58.140 58.580 -0.440 25575
2108 1 7 . 1 1 66 66 LYS CB C 66 31.990 31.990 32.467 -0.477 25575
2109 1 7 . 1 1 66 66 LYS H H 66 8.590 8.590 8.253 0.337 25575
2110 1 7 . 1 1 67 67 SER N N 67 114.980 114.980 114.756 0.224 25575
2111 1 7 . 1 1 67 67 SER HA H 67 4.320 4.320 4.299 0.021 25575
2112 1 7 . 1 1 67 67 SER CA C 67 60.330 60.330 61.144 -0.813 25575
2113 1 7 . 1 1 67 67 SER CB C 67 63.710 63.710 63.668 0.042 25575
2114 1 7 . 1 1 67 67 SER H H 67 8.760 8.760 8.057 0.703 25575
2115 1 7 . 1 1 68 68 VAL HA H 68 4.250 4.250 3.896 0.354 25575
2116 1 7 . 1 1 68 68 VAL CA C 68 62.150 62.150 62.697 -0.547 25575
2117 1 7 . 1 1 68 68 VAL CB C 68 31.900 31.900 32.017 -0.117 25575
2118 1 7 . 1 1 69 69 ARG CA C 69 56.960 56.960 57.490 -0.530 25575
2119 1 7 . 1 1 70 70 HIS N N 70 116.270 116.270 113.506 2.764 25575
2120 1 7 . 1 1 70 70 HIS HA H 70 4.760 4.760 4.599 0.161 25575
2121 1 7 . 1 1 70 70 HIS CA C 70 55.360 55.360 54.369 0.991 25575
2122 1 7 . 1 1 70 70 HIS CB C 70 33.100 33.100 30.776 2.324 25575
2123 1 7 . 1 1 70 70 HIS H H 70 7.390 7.390 8.010 -0.620 25575
2124 1 7 . 1 1 71 71 LEU N N 71 120.200 120.200 120.848 -0.648 25575
2125 1 7 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.649 0.411 25575
2126 1 7 . 1 1 71 71 LEU CA C 71 54.070 54.070 53.286 0.784 25575
2127 1 7 . 1 1 71 71 LEU CB C 71 42.710 42.710 41.257 1.453 25575
2128 1 7 . 1 1 71 71 LEU H H 71 7.970 7.970 8.375 -0.405 25575
2129 1 7 . 1 1 72 72 TYR HA H 72 5.030 5.030 4.486 0.544 25575
2130 1 7 . 1 1 72 72 TYR CA C 72 59.990 59.990 58.226 1.764 25575
2131 1 7 . 1 1 72 72 TYR CB C 72 39.440 39.440 39.766 -0.326 25575
2132 1 7 . 1 1 73 73 ILE N N 73 112.940 112.940 114.114 -1.174 25575
2133 1 7 . 1 1 73 73 ILE HA H 73 6.080 6.080 4.770 1.310 25575
2134 1 7 . 1 1 73 73 ILE CA C 73 58.090 58.090 58.330 -0.239 25575
2135 1 7 . 1 1 73 73 ILE CB C 73 41.820 41.820 42.393 -0.573 25575
2136 1 7 . 1 1 73 73 ILE H H 73 8.450 8.450 7.938 0.512 25575
2137 1 7 . 1 1 74 74 CYS N N 74 124.730 124.730 118.851 5.879 25575
2138 1 7 . 1 1 74 74 CYS HA H 74 5.080 5.080 5.240 -0.160 25575
2139 1 7 . 1 1 74 74 CYS CA C 74 57.670 57.670 56.858 0.812 25575
2140 1 7 . 1 1 74 74 CYS CB C 74 33.330 33.330 30.519 2.811 25575
2141 1 7 . 1 1 74 74 CYS H H 74 9.830 9.830 8.380 1.450 25575
2142 1 7 . 1 1 75 75 ASP N N 75 120.990 120.990 122.589 -1.599 25575
2143 1 7 . 1 1 75 75 ASP HA H 75 4.590 4.590 4.286 0.304 25575
2144 1 7 . 1 1 75 75 ASP CA C 75 57.320 57.320 57.538 -0.218 25575
2145 1 7 . 1 1 75 75 ASP CB C 75 39.670 39.670 40.462 -0.792 25575
2146 1 7 . 1 1 75 75 ASP H H 75 9.090 9.090 8.815 0.275 25575
2147 1 7 . 1 1 76 76 PHE N N 76 122.470 122.470 120.691 1.779 25575
2148 1 7 . 1 1 76 76 PHE HA H 76 4.230 4.230 4.155 0.075 25575
2149 1 7 . 1 1 76 76 PHE CA C 76 62.030 62.030 62.106 -0.076 25575
2150 1 7 . 1 1 76 76 PHE CB C 76 38.190 38.190 39.265 -1.075 25575
2151 1 7 . 1 1 76 76 PHE H H 76 8.330 8.330 8.144 0.186 25575
2152 1 7 . 1 1 77 77 HIS N N 77 124.580 124.580 117.781 6.799 25575
2153 1 7 . 1 1 77 77 HIS HA H 77 4.280 4.280 4.307 -0.027 25575
2154 1 7 . 1 1 77 77 HIS CA C 77 63.880 63.880 59.665 4.215 25575
2155 1 7 . 1 1 77 77 HIS CB C 77 29.600 29.600 30.020 -0.419 25575
2156 1 7 . 1 1 77 77 HIS H H 77 10.300 10.300 7.845 2.455 25575
2157 1 7 . 1 1 78 78 LYS N N 78 122.930 122.930 120.490 2.440 25575
2158 1 7 . 1 1 78 78 LYS HA H 78 3.860 3.860 3.934 -0.074 25575
2159 1 7 . 1 1 78 78 LYS CA C 78 60.550 60.550 60.346 0.204 25575
2160 1 7 . 1 1 78 78 LYS CB C 78 32.040 32.040 32.367 -0.327 25575
2161 1 7 . 1 1 78 78 LYS H H 78 8.960 8.960 8.552 0.408 25575
2162 1 7 . 1 1 79 79 ASN N N 79 116.670 116.670 118.152 -1.482 25575
2163 1 7 . 1 1 79 79 ASN HA H 79 4.420 4.420 4.461 -0.041 25575
2164 1 7 . 1 1 79 79 ASN CA C 79 56.030 56.030 56.299 -0.269 25575
2165 1 7 . 1 1 79 79 ASN CB C 79 38.100 38.100 38.295 -0.195 25575
2166 1 7 . 1 1 79 79 ASN H H 79 8.230 8.230 7.862 0.368 25575
2167 1 7 . 1 1 80 80 PHE N N 80 122.600 122.600 120.733 1.867 25575
2168 1 7 . 1 1 80 80 PHE HA H 80 4.180 4.180 4.172 0.008 25575
2169 1 7 . 1 1 80 80 PHE CA C 80 60.700 60.700 61.166 -0.466 25575
2170 1 7 . 1 1 80 80 PHE CB C 80 39.840 39.840 39.089 0.751 25575
2171 1 7 . 1 1 80 80 PHE H H 80 8.200 8.200 7.838 0.362 25575
2172 1 7 . 1 1 81 81 ILE N N 81 118.240 118.240 116.211 2.029 25575
2173 1 7 . 1 1 81 81 ILE HA H 81 3.320 3.320 3.654 -0.334 25575
2174 1 7 . 1 1 81 81 ILE CA C 81 65.160 65.160 63.975 1.185 25575
2175 1 7 . 1 1 81 81 ILE CB C 81 38.440 38.440 38.126 0.314 25575
2176 1 7 . 1 1 81 81 ILE H H 81 8.520 8.520 7.713 0.807 25575
2177 1 7 . 1 1 82 82 GLN N N 82 116.370 116.370 120.731 -4.361 25575
2178 1 7 . 1 1 82 82 GLN HA H 82 4.100 4.100 3.947 0.153 25575
2179 1 7 . 1 1 82 82 GLN CA C 82 57.710 57.710 59.302 -1.592 25575
2180 1 7 . 1 1 82 82 GLN CB C 82 28.710 28.710 28.669 0.040 25575
2181 1 7 . 1 1 82 82 GLN H H 82 7.670 7.670 8.676 -1.006 25575
2182 1 7 . 1 1 83 83 SER N N 83 114.440 114.440 115.867 -1.427 25575
2183 1 7 . 1 1 83 83 SER HA H 83 4.300 4.300 4.167 0.133 25575
2184 1 7 . 1 1 83 83 SER CA C 83 60.130 60.130 61.609 -1.479 25575
2185 1 7 . 1 1 83 83 SER CB C 83 63.570 63.570 62.573 0.997 25575
2186 1 7 . 1 1 83 83 SER H H 83 7.810 7.810 8.705 -0.895 25575
2187 1 7 . 1 1 84 84 VAL N N 84 120.750 120.750 121.623 -0.873 25575
2188 1 7 . 1 1 84 84 VAL HA H 84 3.970 3.970 3.853 0.117 25575
2189 1 7 . 1 1 84 84 VAL CA C 84 63.430 63.430 65.787 -2.357 25575
2190 1 7 . 1 1 84 84 VAL CB C 84 31.960 31.960 31.159 0.801 25575
2191 1 7 . 1 1 84 84 VAL H H 84 7.790 7.790 7.592 0.198 25575
2192 1 7 . 1 1 85 85 ARG N N 85 122.090 122.090 120.792 1.298 25575
2193 1 7 . 1 1 85 85 ARG HA H 85 4.240 4.240 3.967 0.273 25575
2194 1 7 . 1 1 85 85 ARG CA C 85 56.850 56.850 58.837 -1.987 25575
2195 1 7 . 1 1 85 85 ARG CB C 85 30.720 30.720 29.567 1.153 25575
2196 1 7 . 1 1 85 85 ARG H H 85 8.090 8.090 7.783 0.307 25575
2197 1 7 . 1 1 86 86 ASN N N 86 118.510 118.510 116.334 2.176 25575
2198 1 7 . 1 1 86 86 ASN HA H 86 4.690 4.690 4.540 0.150 25575
2199 1 7 . 1 1 86 86 ASN CA C 86 53.380 53.380 54.684 -1.304 25575
2200 1 7 . 1 1 86 86 ASN CB C 86 38.950 38.950 38.189 0.761 25575
2201 1 7 . 1 1 86 86 ASN H H 86 8.220 8.220 7.782 0.438 25575
2202 1 7 . 1 1 87 87 LYS N N 87 121.600 121.600 121.337 0.263 25575
2203 1 7 . 1 1 87 87 LYS HA H 87 4.310 4.310 4.370 -0.060 25575
2204 1 7 . 1 1 87 87 LYS CA C 87 56.590 56.590 54.862 1.728 25575
2205 1 7 . 1 1 87 87 LYS CB C 87 32.870 32.870 30.747 2.123 25575
2206 1 7 . 1 1 87 87 LYS H H 87 8.150 8.150 7.820 0.330 25575
2207 1 7 . 1 1 88 88 ARG N N 88 121.920 121.920 125.293 -3.373 25575
2208 1 7 . 1 1 88 88 ARG HA H 88 4.330 4.330 4.098 0.232 25575
2209 1 7 . 1 1 88 88 ARG CA C 88 56.110 56.110 56.252 -0.142 25575
2210 1 7 . 1 1 88 88 ARG CB C 88 30.870 30.870 28.982 1.888 25575
2211 1 7 . 1 1 88 88 ARG H H 88 8.250 8.250 8.152 0.098 25575
2212 1 7 . 1 1 89 89 LYS N N 89 123.020 123.020 123.475 -0.455 25575
2213 1 7 . 1 1 89 89 LYS HA H 89 4.320 4.320 4.161 0.159 25575
2214 1 7 . 1 1 89 89 LYS CA C 89 56.330 56.330 56.387 -0.057 25575
2215 1 7 . 1 1 89 89 LYS CB C 89 33.140 33.140 31.095 2.045 25575
2216 1 7 . 1 1 89 89 LYS H H 89 8.320 8.320 8.107 0.213 25575
2217 1 7 . 1 1 90 90 ARG N N 90 122.970 122.970 122.088 0.882 25575
2218 1 7 . 1 1 90 90 ARG HA H 90 4.360 4.360 4.489 -0.129 25575
2219 1 7 . 1 1 90 90 ARG CA C 90 56.100 56.100 54.949 1.151 25575
2220 1 7 . 1 1 90 90 ARG CB C 90 31.210 31.210 31.420 -0.210 25575
2221 1 7 . 1 1 90 90 ARG H H 90 8.360 8.360 7.883 0.477 25575
2222 1 7 . 1 1 91 91 LYS N N 91 123.680 123.680 122.215 1.465 25575
2223 1 7 . 1 1 91 91 LYS HA H 91 4.380 4.380 4.531 -0.151 25575
2224 1 7 . 1 1 91 91 LYS CA C 91 56.620 56.620 56.035 0.585 25575
2225 1 7 . 1 1 91 91 LYS CB C 91 33.070 33.070 32.611 0.459 25575
2226 1 7 . 1 1 91 91 LYS H H 91 8.450 8.450 8.327 0.123 25575
2227 1 8 . 1 1 24 24 SER HA H 24 4.330 4.330 4.225 0.105 25575
2228 1 8 . 1 1 24 24 SER CA C 24 58.130 58.130 59.177 -1.047 25575
2229 1 8 . 1 1 24 24 SER CB C 24 63.870 63.870 63.083 0.787 25575
2230 1 8 . 1 1 25 25 TYR N N 25 122.160 122.160 121.972 0.188 25575
2231 1 8 . 1 1 25 25 TYR HA H 25 4.530 4.530 4.516 0.014 25575
2232 1 8 . 1 1 25 25 TYR CA C 25 58.420 58.420 58.022 0.398 25575
2233 1 8 . 1 1 25 25 TYR CB C 25 38.570 38.570 38.744 -0.174 25575
2234 1 8 . 1 1 25 25 TYR H H 25 8.310 8.310 7.481 0.829 25575
2235 1 8 . 1 1 26 26 GLY N N 26 111.370 111.370 110.883 0.487 25575
2236 1 8 . 1 1 26 26 GLY CA C 26 45.330 45.330 45.331 -0.001 25575
2237 1 8 . 1 1 26 26 GLY H H 26 8.300 8.300 8.486 -0.186 25575
2238 1 8 . 1 1 27 27 GLN N N 27 118.910 118.910 121.028 -2.118 25575
2239 1 8 . 1 1 27 27 GLN HA H 27 4.510 4.510 4.628 -0.118 25575
2240 1 8 . 1 1 27 27 GLN CA C 27 55.240 55.240 54.766 0.474 25575
2241 1 8 . 1 1 27 27 GLN CB C 27 29.800 29.800 29.693 0.107 25575
2242 1 8 . 1 1 27 27 GLN H H 27 8.050 8.050 8.253 -0.203 25575
2243 1 8 . 1 1 28 28 SER N N 28 119.460 119.460 117.977 1.483 25575
2244 1 8 . 1 1 28 28 SER HA H 28 4.810 4.810 5.144 -0.334 25575
2245 1 8 . 1 1 28 28 SER CA C 28 57.710 57.710 57.296 0.414 25575
2246 1 8 . 1 1 28 28 SER CB C 28 65.530 65.530 66.192 -0.662 25575
2247 1 8 . 1 1 28 28 SER H H 28 8.800 8.800 8.596 0.204 25575
2248 1 8 . 1 1 29 29 CYS N N 29 122.160 122.160 120.309 1.851 25575
2249 1 8 . 1 1 29 29 CYS HA H 29 4.130 4.130 4.474 -0.344 25575
2250 1 8 . 1 1 29 29 CYS CA C 29 60.620 60.620 60.338 0.282 25575
2251 1 8 . 1 1 29 29 CYS CB C 29 32.770 32.770 27.706 5.064 25575
2252 1 8 . 1 1 29 29 CYS H H 29 8.390 8.390 8.574 -0.184 25575
2253 1 8 . 1 1 30 30 CYS N N 30 122.320 122.320 121.339 0.981 25575
2254 1 8 . 1 1 30 30 CYS HA H 30 4.530 4.530 4.898 -0.368 25575
2255 1 8 . 1 1 30 30 CYS CA C 30 58.810 58.810 56.641 2.169 25575
2256 1 8 . 1 1 30 30 CYS CB C 30 28.910 28.910 28.827 0.083 25575
2257 1 8 . 1 1 30 30 CYS H H 30 8.340 8.340 8.408 -0.068 25575
2258 1 8 . 1 1 31 31 LEU N N 31 122.390 122.390 122.465 -0.075 25575
2259 1 8 . 1 1 31 31 LEU HA H 31 4.640 4.640 4.881 -0.241 25575
2260 1 8 . 1 1 31 31 LEU CA C 31 55.440 55.440 54.590 0.850 25575
2261 1 8 . 1 1 31 31 LEU CB C 31 43.490 43.490 42.518 0.972 25575
2262 1 8 . 1 1 31 31 LEU H H 31 8.460 8.460 7.123 1.337 25575
2263 1 8 . 1 1 32 32 ILE N N 32 118.890 118.890 118.454 0.436 25575
2264 1 8 . 1 1 32 32 ILE HA H 32 4.200 4.200 4.790 -0.590 25575
2265 1 8 . 1 1 32 32 ILE CA C 32 60.440 60.440 60.056 0.384 25575
2266 1 8 . 1 1 32 32 ILE CB C 32 39.890 39.890 41.654 -1.764 25575
2267 1 8 . 1 1 32 32 ILE H H 32 8.680 8.680 8.353 0.327 25575
2268 1 8 . 1 1 33 33 GLU N N 33 128.400 128.400 126.262 2.138 25575
2269 1 8 . 1 1 33 33 GLU HA H 33 5.080 5.080 5.178 -0.098 25575
2270 1 8 . 1 1 33 33 GLU CA C 33 54.120 54.120 54.857 -0.737 25575
2271 1 8 . 1 1 33 33 GLU CB C 33 32.080 32.080 33.267 -1.187 25575
2272 1 8 . 1 1 33 33 GLU H H 33 8.640 8.640 8.720 -0.080 25575
2273 1 8 . 1 1 34 34 ASP N N 34 130.390 130.390 127.371 3.019 25575
2274 1 8 . 1 1 34 34 ASP HA H 34 4.310 4.310 4.271 0.039 25575
2275 1 8 . 1 1 34 34 ASP CA C 34 55.150 55.150 55.758 -0.608 25575
2276 1 8 . 1 1 34 34 ASP CB C 34 40.050 40.050 40.190 -0.140 25575
2277 1 8 . 1 1 34 34 ASP H H 34 9.540 9.540 9.057 0.483 25575
2278 1 8 . 1 1 35 35 GLY N N 35 126.620 126.620 104.566 22.054 25575
2279 1 8 . 1 1 35 35 GLY CA C 35 45.480 45.480 44.887 0.593 25575
2280 1 8 . 1 1 35 35 GLY H H 35 8.370 8.370 8.428 -0.058 25575
2281 1 8 . 1 1 36 36 GLU N N 36 120.860 120.860 123.271 -2.411 25575
2282 1 8 . 1 1 36 36 GLU HA H 36 4.670 4.670 4.181 0.489 25575
2283 1 8 . 1 1 36 36 GLU CA C 36 54.350 54.350 55.648 -1.298 25575
2284 1 8 . 1 1 36 36 GLU CB C 36 31.630 31.630 29.970 1.660 25575
2285 1 8 . 1 1 36 36 GLU H H 36 7.820 7.820 7.954 -0.134 25575
2286 1 8 . 1 1 37 37 ARG N N 37 129.790 129.790 127.897 1.893 25575
2287 1 8 . 1 1 37 37 ARG HA H 37 4.200 4.200 4.304 -0.104 25575
2288 1 8 . 1 1 37 37 ARG CA C 37 56.440 56.440 55.350 1.090 25575
2289 1 8 . 1 1 37 37 ARG CB C 37 29.710 29.710 29.058 0.652 25575
2290 1 8 . 1 1 37 37 ARG H H 37 8.930 8.930 8.377 0.553 25575
2291 1 8 . 1 1 38 38 CYS N N 38 130.950 130.950 126.616 4.334 25575
2292 1 8 . 1 1 38 38 CYS HA H 38 4.450 4.450 4.303 0.147 25575
2293 1 8 . 1 1 38 38 CYS CA C 38 60.560 60.560 60.183 0.377 25575
2294 1 8 . 1 1 38 38 CYS CB C 38 31.250 31.250 27.864 3.386 25575
2295 1 8 . 1 1 38 38 CYS H H 38 9.050 9.050 8.379 0.671 25575
2296 1 8 . 1 1 39 39 VAL N N 39 118.270 118.270 121.639 -3.369 25575
2297 1 8 . 1 1 39 39 VAL HA H 39 4.710 4.710 4.317 0.393 25575
2298 1 8 . 1 1 39 39 VAL CA C 39 60.340 60.340 61.213 -0.873 25575
2299 1 8 . 1 1 39 39 VAL CB C 39 31.290 31.290 31.244 0.047 25575
2300 1 8 . 1 1 39 39 VAL H H 39 8.060 8.060 8.014 0.046 25575
2301 1 8 . 1 1 40 40 ARG N N 40 127.360 127.360 122.640 4.720 25575
2302 1 8 . 1 1 40 40 ARG HA H 40 4.430 4.430 4.328 0.102 25575
2303 1 8 . 1 1 40 40 ARG CA C 40 56.150 56.150 54.878 1.272 25575
2304 1 8 . 1 1 40 40 ARG CB C 40 29.210 29.210 29.514 -0.304 25575
2305 1 8 . 1 1 40 40 ARG H H 40 8.950 8.950 7.658 1.292 25575
2306 1 8 . 1 1 41 41 PRO HA H 41 4.430 4.430 4.576 -0.146 25575
2307 1 8 . 1 1 41 41 PRO CA C 41 62.690 62.690 62.625 0.065 25575
2308 1 8 . 1 1 41 41 PRO CB C 41 32.010 32.010 32.105 -0.095 25575
2309 1 8 . 1 1 42 42 ALA N N 42 124.260 124.260 126.188 -1.928 25575
2310 1 8 . 1 1 42 42 ALA HA H 42 3.620 3.620 4.507 -0.887 25575
2311 1 8 . 1 1 42 42 ALA CA C 42 52.930 52.930 51.265 1.665 25575
2312 1 8 . 1 1 42 42 ALA CB C 42 19.130 19.130 20.380 -1.250 25575
2313 1 8 . 1 1 42 42 ALA H H 42 8.410 8.410 7.978 0.432 25575
2314 1 8 . 1 1 43 43 GLY N N 43 112.690 112.690 108.517 4.173 25575
2315 1 8 . 1 1 43 43 GLY CA C 43 44.240 44.240 45.383 -1.143 25575
2316 1 8 . 1 1 43 43 GLY H H 43 8.090 8.090 7.960 0.130 25575
2317 1 8 . 1 1 44 44 ASN N N 44 116.980 116.980 118.293 -1.313 25575
2318 1 8 . 1 1 44 44 ASN HA H 44 4.690 4.690 4.578 0.112 25575
2319 1 8 . 1 1 44 44 ASN CA C 44 53.420 53.420 54.434 -1.014 25575
2320 1 8 . 1 1 44 44 ASN CB C 44 39.370 39.370 38.315 1.055 25575
2321 1 8 . 1 1 44 44 ASN H H 44 8.720 8.720 8.600 0.120 25575
2322 1 8 . 1 1 45 45 ALA N N 45 124.240 124.240 122.065 2.175 25575
2323 1 8 . 1 1 45 45 ALA HA H 45 4.640 4.640 4.452 0.188 25575
2324 1 8 . 1 1 45 45 ALA CA C 45 52.240 52.240 52.269 -0.029 25575
2325 1 8 . 1 1 45 45 ALA CB C 45 19.540 19.540 19.468 0.072 25575
2326 1 8 . 1 1 45 45 ALA H H 45 8.770 8.770 8.377 0.393 25575
2327 1 8 . 1 1 46 46 SER N N 46 111.670 111.670 119.483 -7.813 25575
2328 1 8 . 1 1 46 46 SER HA H 46 5.300 5.300 4.807 0.493 25575
2329 1 8 . 1 1 46 46 SER CA C 46 56.580 56.580 56.445 0.135 25575
2330 1 8 . 1 1 46 46 SER CB C 46 66.490 66.490 65.895 0.595 25575
2331 1 8 . 1 1 46 46 SER H H 46 8.060 8.060 8.533 -0.473 25575
2332 1 8 . 1 1 47 47 PHE HA H 47 4.520 4.520 4.505 0.015 25575
2333 1 8 . 1 1 47 47 PHE CA C 47 57.000 57.000 56.132 0.868 25575
2334 1 8 . 1 1 47 47 PHE CB C 47 38.360 38.360 37.871 0.489 25575
2335 1 8 . 1 1 48 48 SER N N 48 116.970 116.970 117.712 -0.742 25575
2336 1 8 . 1 1 48 48 SER HA H 48 4.440 4.440 4.121 0.319 25575
2337 1 8 . 1 1 48 48 SER CA C 48 56.950 56.950 59.072 -2.123 25575
2338 1 8 . 1 1 48 48 SER CB C 48 65.810 65.810 63.724 2.086 25575
2339 1 8 . 1 1 48 48 SER H H 48 7.100 7.100 7.696 -0.596 25575
2340 1 8 . 1 1 49 49 LYS N N 49 120.650 120.650 124.618 -3.968 25575
2341 1 8 . 1 1 49 49 LYS HA H 49 3.900 3.900 3.840 0.060 25575
2342 1 8 . 1 1 49 49 LYS CA C 49 59.570 59.570 59.339 0.231 25575
2343 1 8 . 1 1 49 49 LYS CB C 49 31.790 31.790 32.312 -0.522 25575
2344 1 8 . 1 1 49 49 LYS H H 49 8.770 8.770 8.772 -0.002 25575
2345 1 8 . 1 1 50 50 ARG N N 50 118.240 118.240 117.844 0.396 25575
2346 1 8 . 1 1 50 50 ARG HA H 50 4.040 4.040 4.039 0.001 25575
2347 1 8 . 1 1 50 50 ARG CA C 50 59.070 59.070 58.816 0.254 25575
2348 1 8 . 1 1 50 50 ARG CB C 50 30.080 30.080 29.896 0.184 25575
2349 1 8 . 1 1 50 50 ARG H H 50 8.040 8.040 8.152 -0.112 25575
2350 1 8 . 1 1 51 51 VAL N N 51 121.680 121.680 118.929 2.751 25575
2351 1 8 . 1 1 51 51 VAL HA H 51 3.590 3.590 3.633 -0.043 25575
2352 1 8 . 1 1 51 51 VAL CA C 51 65.940 65.940 65.870 0.070 25575
2353 1 8 . 1 1 51 51 VAL CB C 51 31.620 31.620 31.284 0.336 25575
2354 1 8 . 1 1 51 51 VAL H H 51 7.350 7.350 7.861 -0.510 25575
2355 1 8 . 1 1 52 52 GLN N N 52 119.680 119.680 118.901 0.779 25575
2356 1 8 . 1 1 52 52 GLN HA H 52 3.570 3.570 3.788 -0.218 25575
2357 1 8 . 1 1 52 52 GLN CA C 52 59.210 59.210 58.658 0.552 25575
2358 1 8 . 1 1 52 52 GLN CB C 52 28.620 28.620 27.548 1.072 25575
2359 1 8 . 1 1 52 52 GLN H H 52 8.210 8.210 7.443 0.767 25575
2360 1 8 . 1 1 53 53 LYS N N 53 118.080 118.080 120.026 -1.946 25575
2361 1 8 . 1 1 53 53 LYS HA H 53 4.160 4.160 3.970 0.191 25575
2362 1 8 . 1 1 53 53 LYS CA C 53 58.670 58.670 59.157 -0.487 25575
2363 1 8 . 1 1 53 53 LYS CB C 53 32.120 32.120 31.899 0.221 25575
2364 1 8 . 1 1 53 53 LYS H H 53 7.960 7.960 7.541 0.419 25575
2365 1 8 . 1 1 54 54 SER N N 54 115.450 115.450 115.537 -0.087 25575
2366 1 8 . 1 1 54 54 SER HA H 54 4.370 4.370 4.119 0.251 25575
2367 1 8 . 1 1 54 54 SER CA C 54 61.330 61.330 61.237 0.093 25575
2368 1 8 . 1 1 54 54 SER CB C 54 63.690 63.690 62.935 0.755 25575
2369 1 8 . 1 1 54 54 SER H H 54 7.800 7.800 7.553 0.247 25575
2370 1 8 . 1 1 55 55 ILE N N 55 117.670 117.670 120.483 -2.813 25575
2371 1 8 . 1 1 55 55 ILE HA H 55 4.060 4.060 3.710 0.350 25575
2372 1 8 . 1 1 55 55 ILE CA C 55 63.330 63.330 64.612 -1.282 25575
2373 1 8 . 1 1 55 55 ILE CB C 55 38.980 38.980 38.074 0.906 25575
2374 1 8 . 1 1 55 55 ILE H H 55 7.840 7.840 7.354 0.486 25575
2375 1 8 . 1 1 56 56 SER N N 56 115.650 115.650 115.707 -0.057 25575
2376 1 8 . 1 1 56 56 SER HA H 56 4.490 4.490 4.117 0.373 25575
2377 1 8 . 1 1 56 56 SER CA C 56 60.220 60.220 61.699 -1.479 25575
2378 1 8 . 1 1 56 56 SER CB C 56 63.000 63.000 63.134 -0.134 25575
2379 1 8 . 1 1 56 56 SER H H 56 8.060 8.060 7.816 0.244 25575
2380 1 8 . 1 1 57 57 GLN N N 57 121.830 121.830 119.299 2.531 25575
2381 1 8 . 1 1 57 57 GLN HA H 57 4.200 4.200 4.184 0.016 25575
2382 1 8 . 1 1 57 57 GLN CA C 57 58.310 58.310 57.463 0.847 25575
2383 1 8 . 1 1 57 57 GLN CB C 57 28.850 28.850 28.661 0.189 25575
2384 1 8 . 1 1 57 57 GLN H H 57 8.620 8.620 7.794 0.826 25575
2385 1 8 . 1 1 58 58 LYS N N 58 116.960 116.960 116.942 0.018 25575
2386 1 8 . 1 1 58 58 LYS HA H 58 4.290 4.290 4.462 -0.172 25575
2387 1 8 . 1 1 58 58 LYS CA C 58 56.920 56.920 55.346 1.574 25575
2388 1 8 . 1 1 58 58 LYS CB C 58 32.900 32.900 33.663 -0.763 25575
2389 1 8 . 1 1 58 58 LYS H H 58 7.950 7.950 7.460 0.490 25575
2390 1 8 . 1 1 59 59 LYS N N 59 116.960 116.960 118.153 -1.193 25575
2391 1 8 . 1 1 59 59 LYS HA H 59 4.120 4.120 3.894 0.226 25575
2392 1 8 . 1 1 59 59 LYS CA C 59 57.090 57.090 57.066 0.023 25575
2393 1 8 . 1 1 59 59 LYS CB C 59 30.080 30.080 29.678 0.402 25575
2394 1 8 . 1 1 59 59 LYS H H 59 7.950 7.950 7.815 0.135 25575
2395 1 8 . 1 1 60 60 LEU N N 60 117.540 117.540 118.607 -1.067 25575
2396 1 8 . 1 1 60 60 LEU HA H 60 4.480 4.480 4.384 0.096 25575
2397 1 8 . 1 1 60 60 LEU CA C 60 54.500 54.500 54.983 -0.483 25575
2398 1 8 . 1 1 60 60 LEU CB C 60 42.840 42.840 42.557 0.283 25575
2399 1 8 . 1 1 60 60 LEU H H 60 7.930 7.930 7.436 0.494 25575
2400 1 8 . 1 1 61 61 LYS HA H 61 4.390 4.390 4.195 0.195 25575
2401 1 8 . 1 1 61 61 LYS CA C 61 55.540 55.540 56.596 -1.056 25575
2402 1 8 . 1 1 61 61 LYS CB C 61 30.050 30.050 30.931 -0.881 25575
2403 1 8 . 1 1 62 62 LEU N N 62 120.000 120.000 120.890 -0.890 25575
2404 1 8 . 1 1 62 62 LEU HA H 62 5.250 5.250 5.083 0.167 25575
2405 1 8 . 1 1 62 62 LEU CA C 62 53.080 53.080 53.893 -0.813 25575
2406 1 8 . 1 1 62 62 LEU CB C 62 45.760 45.760 42.596 3.164 25575
2407 1 8 . 1 1 62 62 LEU H H 62 7.470 7.470 7.621 -0.151 25575
2408 1 8 . 1 1 63 63 ASP N N 63 121.730 121.730 125.092 -3.362 25575
2409 1 8 . 1 1 63 63 ASP HA H 63 4.860 4.860 4.912 -0.052 25575
2410 1 8 . 1 1 63 63 ASP CA C 63 51.890 51.890 51.785 0.105 25575
2411 1 8 . 1 1 63 63 ASP CB C 63 44.910 44.910 44.771 0.139 25575
2412 1 8 . 1 1 63 63 ASP H H 63 8.620 8.620 8.949 -0.329 25575
2413 1 8 . 1 1 64 64 ILE N N 64 118.120 118.120 119.438 -1.318 25575
2414 1 8 . 1 1 64 64 ILE HA H 64 4.210 4.210 4.452 -0.242 25575
2415 1 8 . 1 1 64 64 ILE CA C 64 60.430 60.430 58.847 1.583 25575
2416 1 8 . 1 1 64 64 ILE CB C 64 40.420 40.420 40.422 -0.002 25575
2417 1 8 . 1 1 64 64 ILE H H 64 8.650 8.650 8.200 0.450 25575
2418 1 8 . 1 1 65 65 ASP N N 65 124.550 124.550 128.425 -3.875 25575
2419 1 8 . 1 1 65 65 ASP HA H 65 4.570 4.570 4.447 0.123 25575
2420 1 8 . 1 1 65 65 ASP CA C 65 53.310 53.310 54.502 -1.192 25575
2421 1 8 . 1 1 65 65 ASP CB C 65 40.440 40.440 41.186 -0.746 25575
2422 1 8 . 1 1 65 65 ASP H H 65 8.630 8.630 8.605 0.025 25575
2423 1 8 . 1 1 66 66 LYS N N 66 125.970 125.970 125.054 0.916 25575
2424 1 8 . 1 1 66 66 LYS HA H 66 4.040 4.040 4.124 -0.084 25575
2425 1 8 . 1 1 66 66 LYS CA C 66 58.140 58.140 57.995 0.145 25575
2426 1 8 . 1 1 66 66 LYS CB C 66 31.990 31.990 32.181 -0.191 25575
2427 1 8 . 1 1 66 66 LYS H H 66 8.590 8.590 8.433 0.157 25575
2428 1 8 . 1 1 67 67 SER N N 67 114.980 114.980 114.197 0.783 25575
2429 1 8 . 1 1 67 67 SER HA H 67 4.320 4.320 4.342 -0.022 25575
2430 1 8 . 1 1 67 67 SER CA C 67 60.330 60.330 60.880 -0.550 25575
2431 1 8 . 1 1 67 67 SER CB C 67 63.710 63.710 63.340 0.370 25575
2432 1 8 . 1 1 67 67 SER H H 67 8.760 8.760 8.190 0.570 25575
2433 1 8 . 1 1 68 68 VAL HA H 68 4.250 4.250 3.952 0.298 25575
2434 1 8 . 1 1 68 68 VAL CA C 68 62.150 62.150 62.154 -0.004 25575
2435 1 8 . 1 1 68 68 VAL CB C 68 31.900 31.900 32.050 -0.150 25575
2436 1 8 . 1 1 69 69 ARG CA C 69 56.960 56.960 57.555 -0.595 25575
2437 1 8 . 1 1 70 70 HIS N N 70 116.270 116.270 112.039 4.231 25575
2438 1 8 . 1 1 70 70 HIS HA H 70 4.760 4.760 4.895 -0.135 25575
2439 1 8 . 1 1 70 70 HIS CA C 70 55.360 55.360 53.172 2.188 25575
2440 1 8 . 1 1 70 70 HIS CB C 70 33.100 33.100 32.448 0.652 25575
2441 1 8 . 1 1 70 70 HIS H H 70 7.390 7.390 8.043 -0.652 25575
2442 1 8 . 1 1 71 71 LEU N N 71 120.200 120.200 122.545 -2.345 25575
2443 1 8 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.639 0.421 25575
2444 1 8 . 1 1 71 71 LEU CA C 71 54.070 54.070 54.267 -0.197 25575
2445 1 8 . 1 1 71 71 LEU CB C 71 42.710 42.710 40.696 2.014 25575
2446 1 8 . 1 1 71 71 LEU H H 71 7.970 7.970 8.701 -0.731 25575
2447 1 8 . 1 1 72 72 TYR HA H 72 5.030 5.030 4.976 0.054 25575
2448 1 8 . 1 1 72 72 TYR CA C 72 59.990 59.990 57.151 2.839 25575
2449 1 8 . 1 1 72 72 TYR CB C 72 39.440 39.440 41.823 -2.383 25575
2450 1 8 . 1 1 73 73 ILE N N 73 112.940 112.940 114.657 -1.717 25575
2451 1 8 . 1 1 73 73 ILE HA H 73 6.080 6.080 4.908 1.172 25575
2452 1 8 . 1 1 73 73 ILE CA C 73 58.090 58.090 58.390 -0.300 25575
2453 1 8 . 1 1 73 73 ILE CB C 73 41.820 41.820 42.628 -0.808 25575
2454 1 8 . 1 1 73 73 ILE H H 73 8.450 8.450 8.631 -0.181 25575
2455 1 8 . 1 1 74 74 CYS N N 74 124.730 124.730 118.411 6.319 25575
2456 1 8 . 1 1 74 74 CYS HA H 74 5.080 5.080 5.235 -0.155 25575
2457 1 8 . 1 1 74 74 CYS CA C 74 57.670 57.670 57.118 0.552 25575
2458 1 8 . 1 1 74 74 CYS CB C 74 33.330 33.330 30.567 2.763 25575
2459 1 8 . 1 1 74 74 CYS H H 74 9.830 9.830 8.470 1.360 25575
2460 1 8 . 1 1 75 75 ASP N N 75 120.990 120.990 122.752 -1.762 25575
2461 1 8 . 1 1 75 75 ASP HA H 75 4.590 4.590 4.340 0.250 25575
2462 1 8 . 1 1 75 75 ASP CA C 75 57.320 57.320 57.350 -0.030 25575
2463 1 8 . 1 1 75 75 ASP CB C 75 39.670 39.670 40.216 -0.546 25575
2464 1 8 . 1 1 75 75 ASP H H 75 9.090 9.090 9.016 0.074 25575
2465 1 8 . 1 1 76 76 PHE N N 76 122.470 122.470 121.631 0.839 25575
2466 1 8 . 1 1 76 76 PHE HA H 76 4.230 4.230 4.110 0.120 25575
2467 1 8 . 1 1 76 76 PHE CA C 76 62.030 62.030 62.075 -0.045 25575
2468 1 8 . 1 1 76 76 PHE CB C 76 38.190 38.190 39.142 -0.952 25575
2469 1 8 . 1 1 76 76 PHE H H 76 8.330 8.330 8.195 0.135 25575
2470 1 8 . 1 1 77 77 HIS N N 77 124.580 124.580 117.141 7.439 25575
2471 1 8 . 1 1 77 77 HIS HA H 77 4.280 4.280 4.349 -0.069 25575
2472 1 8 . 1 1 77 77 HIS CA C 77 63.880 63.880 59.180 4.700 25575
2473 1 8 . 1 1 77 77 HIS CB C 77 29.600 29.600 30.058 -0.458 25575
2474 1 8 . 1 1 77 77 HIS H H 77 10.300 10.300 7.867 2.433 25575
2475 1 8 . 1 1 78 78 LYS N N 78 122.930 122.930 120.264 2.666 25575
2476 1 8 . 1 1 78 78 LYS HA H 78 3.860 3.860 3.986 -0.126 25575
2477 1 8 . 1 1 78 78 LYS CA C 78 60.550 60.550 60.068 0.482 25575
2478 1 8 . 1 1 78 78 LYS CB C 78 32.040 32.040 32.377 -0.337 25575
2479 1 8 . 1 1 78 78 LYS H H 78 8.960 8.960 8.328 0.632 25575
2480 1 8 . 1 1 79 79 ASN N N 79 116.670 116.670 117.983 -1.313 25575
2481 1 8 . 1 1 79 79 ASN HA H 79 4.420 4.420 4.519 -0.099 25575
2482 1 8 . 1 1 79 79 ASN CA C 79 56.030 56.030 56.131 -0.101 25575
2483 1 8 . 1 1 79 79 ASN CB C 79 38.100 38.100 38.325 -0.225 25575
2484 1 8 . 1 1 79 79 ASN H H 79 8.230 8.230 7.999 0.231 25575
2485 1 8 . 1 1 80 80 PHE N N 80 122.600 122.600 121.569 1.031 25575
2486 1 8 . 1 1 80 80 PHE HA H 80 4.180 4.180 4.164 0.016 25575
2487 1 8 . 1 1 80 80 PHE CA C 80 60.700 60.700 61.565 -0.865 25575
2488 1 8 . 1 1 80 80 PHE CB C 80 39.840 39.840 39.214 0.626 25575
2489 1 8 . 1 1 80 80 PHE H H 80 8.200 8.200 7.996 0.204 25575
2490 1 8 . 1 1 81 81 ILE N N 81 118.240 118.240 115.868 2.372 25575
2491 1 8 . 1 1 81 81 ILE HA H 81 3.320 3.320 3.710 -0.390 25575
2492 1 8 . 1 1 81 81 ILE CA C 81 65.160 65.160 63.863 1.297 25575
2493 1 8 . 1 1 81 81 ILE CB C 81 38.440 38.440 37.682 0.758 25575
2494 1 8 . 1 1 81 81 ILE H H 81 8.520 8.520 7.894 0.626 25575
2495 1 8 . 1 1 82 82 GLN N N 82 116.370 116.370 118.461 -2.091 25575
2496 1 8 . 1 1 82 82 GLN HA H 82 4.100 4.100 4.138 -0.038 25575
2497 1 8 . 1 1 82 82 GLN CA C 82 57.710 57.710 58.498 -0.788 25575
2498 1 8 . 1 1 82 82 GLN CB C 82 28.710 28.710 29.283 -0.573 25575
2499 1 8 . 1 1 82 82 GLN H H 82 7.670 7.670 7.774 -0.104 25575
2500 1 8 . 1 1 83 83 SER N N 83 114.440 114.440 116.463 -2.023 25575
2501 1 8 . 1 1 83 83 SER HA H 83 4.300 4.300 4.248 0.052 25575
2502 1 8 . 1 1 83 83 SER CA C 83 60.130 60.130 61.598 -1.468 25575
2503 1 8 . 1 1 83 83 SER CB C 83 63.570 63.570 62.920 0.650 25575
2504 1 8 . 1 1 83 83 SER H H 83 7.810 7.810 8.520 -0.710 25575
2505 1 8 . 1 1 84 84 VAL N N 84 120.750 120.750 118.775 1.975 25575
2506 1 8 . 1 1 84 84 VAL HA H 84 3.970 3.970 3.797 0.173 25575
2507 1 8 . 1 1 84 84 VAL CA C 84 63.430 63.430 64.385 -0.955 25575
2508 1 8 . 1 1 84 84 VAL CB C 84 31.960 31.960 30.596 1.364 25575
2509 1 8 . 1 1 84 84 VAL H H 84 7.790 7.790 7.549 0.241 25575
2510 1 8 . 1 1 85 85 ARG N N 85 122.090 122.090 118.919 3.171 25575
2511 1 8 . 1 1 85 85 ARG HA H 85 4.240 4.240 4.454 -0.214 25575
2512 1 8 . 1 1 85 85 ARG CA C 85 56.850 56.850 56.073 0.777 25575
2513 1 8 . 1 1 85 85 ARG CB C 85 30.720 30.720 31.914 -1.194 25575
2514 1 8 . 1 1 85 85 ARG H H 85 8.090 8.090 7.582 0.508 25575
2515 1 8 . 1 1 86 86 ASN N N 86 118.510 118.510 120.296 -1.786 25575
2516 1 8 . 1 1 86 86 ASN HA H 86 4.690 4.690 4.717 -0.027 25575
2517 1 8 . 1 1 86 86 ASN CA C 86 53.380 53.380 53.393 -0.013 25575
2518 1 8 . 1 1 86 86 ASN CB C 86 38.950 38.950 39.336 -0.386 25575
2519 1 8 . 1 1 86 86 ASN H H 86 8.220 8.220 7.971 0.249 25575
2520 1 8 . 1 1 87 87 LYS N N 87 121.600 121.600 118.398 3.202 25575
2521 1 8 . 1 1 87 87 LYS HA H 87 4.310 4.310 4.488 -0.178 25575
2522 1 8 . 1 1 87 87 LYS CA C 87 56.590 56.590 55.994 0.596 25575
2523 1 8 . 1 1 87 87 LYS CB C 87 32.870 32.870 32.486 0.384 25575
2524 1 8 . 1 1 87 87 LYS H H 87 8.150 8.150 8.134 0.016 25575
2525 1 8 . 1 1 88 88 ARG N N 88 121.920 121.920 119.763 2.157 25575
2526 1 8 . 1 1 88 88 ARG HA H 88 4.330 4.330 4.584 -0.254 25575
2527 1 8 . 1 1 88 88 ARG CA C 88 56.110 56.110 56.494 -0.384 25575
2528 1 8 . 1 1 88 88 ARG CB C 88 30.870 30.870 30.994 -0.124 25575
2529 1 8 . 1 1 88 88 ARG H H 88 8.250 8.250 8.606 -0.356 25575
2530 1 8 . 1 1 89 89 LYS N N 89 123.020 123.020 119.859 3.161 25575
2531 1 8 . 1 1 89 89 LYS HA H 89 4.320 4.320 4.517 -0.197 25575
2532 1 8 . 1 1 89 89 LYS CA C 89 56.330 56.330 55.338 0.992 25575
2533 1 8 . 1 1 89 89 LYS CB C 89 33.140 33.140 34.771 -1.631 25575
2534 1 8 . 1 1 89 89 LYS H H 89 8.320 8.320 7.793 0.527 25575
2535 1 8 . 1 1 90 90 ARG N N 90 122.970 122.970 123.420 -0.450 25575
2536 1 8 . 1 1 90 90 ARG HA H 90 4.360 4.360 4.249 0.111 25575
2537 1 8 . 1 1 90 90 ARG CA C 90 56.100 56.100 56.066 0.034 25575
2538 1 8 . 1 1 90 90 ARG CB C 90 31.210 31.210 29.346 1.864 25575
2539 1 8 . 1 1 90 90 ARG H H 90 8.360 8.360 8.618 -0.258 25575
2540 1 8 . 1 1 91 91 LYS N N 91 123.680 123.680 124.490 -0.810 25575
2541 1 8 . 1 1 91 91 LYS HA H 91 4.380 4.380 4.220 0.160 25575
2542 1 8 . 1 1 91 91 LYS CA C 91 56.620 56.620 56.345 0.275 25575
2543 1 8 . 1 1 91 91 LYS CB C 91 33.070 33.070 32.686 0.384 25575
2544 1 8 . 1 1 91 91 LYS H H 91 8.450 8.450 7.841 0.609 25575
2545 1 9 . 1 1 24 24 SER HA H 24 4.330 4.330 4.409 -0.079 25575
2546 1 9 . 1 1 24 24 SER CA C 24 58.130 58.130 57.668 0.462 25575
2547 1 9 . 1 1 24 24 SER CB C 24 63.870 63.870 63.875 -0.005 25575
2548 1 9 . 1 1 25 25 TYR N N 25 122.160 122.160 120.141 2.019 25575
2549 1 9 . 1 1 25 25 TYR HA H 25 4.530 4.530 4.844 -0.314 25575
2550 1 9 . 1 1 25 25 TYR CA C 25 58.420 58.420 57.586 0.834 25575
2551 1 9 . 1 1 25 25 TYR CB C 25 38.570 38.570 39.470 -0.900 25575
2552 1 9 . 1 1 25 25 TYR H H 25 8.310 8.310 7.566 0.744 25575
2553 1 9 . 1 1 26 26 GLY N N 26 111.370 111.370 109.256 2.114 25575
2554 1 9 . 1 1 26 26 GLY CA C 26 45.330 45.330 45.738 -0.408 25575
2555 1 9 . 1 1 26 26 GLY H H 26 8.300 8.300 8.731 -0.431 25575
2556 1 9 . 1 1 27 27 GLN N N 27 118.910 118.910 121.306 -2.396 25575
2557 1 9 . 1 1 27 27 GLN HA H 27 4.510 4.510 4.457 0.053 25575
2558 1 9 . 1 1 27 27 GLN CA C 27 55.240 55.240 55.149 0.091 25575
2559 1 9 . 1 1 27 27 GLN CB C 27 29.800 29.800 29.117 0.682 25575
2560 1 9 . 1 1 27 27 GLN H H 27 8.050 8.050 8.089 -0.039 25575
2561 1 9 . 1 1 28 28 SER N N 28 119.460 119.460 116.066 3.394 25575
2562 1 9 . 1 1 28 28 SER HA H 28 4.810 4.810 5.026 -0.216 25575
2563 1 9 . 1 1 28 28 SER CA C 28 57.710 57.710 56.977 0.733 25575
2564 1 9 . 1 1 28 28 SER CB C 28 65.530 65.530 66.245 -0.715 25575
2565 1 9 . 1 1 28 28 SER H H 28 8.800 8.800 8.355 0.445 25575
2566 1 9 . 1 1 29 29 CYS N N 29 122.160 122.160 119.120 3.040 25575
2567 1 9 . 1 1 29 29 CYS HA H 29 4.130 4.130 4.494 -0.364 25575
2568 1 9 . 1 1 29 29 CYS CA C 29 60.620 60.620 61.071 -0.451 25575
2569 1 9 . 1 1 29 29 CYS CB C 29 32.770 32.770 28.180 4.590 25575
2570 1 9 . 1 1 29 29 CYS H H 29 8.390 8.390 8.643 -0.253 25575
2571 1 9 . 1 1 30 30 CYS N N 30 122.320 122.320 119.798 2.522 25575
2572 1 9 . 1 1 30 30 CYS HA H 30 4.530 4.530 4.907 -0.377 25575
2573 1 9 . 1 1 30 30 CYS CA C 30 58.810 58.810 56.684 2.126 25575
2574 1 9 . 1 1 30 30 CYS CB C 30 28.910 28.910 28.697 0.213 25575
2575 1 9 . 1 1 30 30 CYS H H 30 8.340 8.340 8.512 -0.172 25575
2576 1 9 . 1 1 31 31 LEU N N 31 122.390 122.390 122.707 -0.317 25575
2577 1 9 . 1 1 31 31 LEU HA H 31 4.640 4.640 4.842 -0.202 25575
2578 1 9 . 1 1 31 31 LEU CA C 31 55.440 55.440 54.636 0.804 25575
2579 1 9 . 1 1 31 31 LEU CB C 31 43.490 43.490 42.547 0.943 25575
2580 1 9 . 1 1 31 31 LEU H H 31 8.460 8.460 7.136 1.324 25575
2581 1 9 . 1 1 32 32 ILE N N 32 118.890 118.890 118.636 0.254 25575
2582 1 9 . 1 1 32 32 ILE HA H 32 4.200 4.200 4.744 -0.544 25575
2583 1 9 . 1 1 32 32 ILE CA C 32 60.440 60.440 60.070 0.370 25575
2584 1 9 . 1 1 32 32 ILE CB C 32 39.890 39.890 41.979 -2.089 25575
2585 1 9 . 1 1 32 32 ILE H H 32 8.680 8.680 7.991 0.689 25575
2586 1 9 . 1 1 33 33 GLU N N 33 128.400 128.400 126.475 1.925 25575
2587 1 9 . 1 1 33 33 GLU HA H 33 5.080 5.080 5.181 -0.101 25575
2588 1 9 . 1 1 33 33 GLU CA C 33 54.120 54.120 54.594 -0.474 25575
2589 1 9 . 1 1 33 33 GLU CB C 33 32.080 32.080 32.929 -0.849 25575
2590 1 9 . 1 1 33 33 GLU H H 33 8.640 8.640 8.608 0.032 25575
2591 1 9 . 1 1 34 34 ASP N N 34 130.390 130.390 127.731 2.659 25575
2592 1 9 . 1 1 34 34 ASP HA H 34 4.310 4.310 4.272 0.038 25575
2593 1 9 . 1 1 34 34 ASP CA C 34 55.150 55.150 55.748 -0.598 25575
2594 1 9 . 1 1 34 34 ASP CB C 34 40.050 40.050 40.550 -0.500 25575
2595 1 9 . 1 1 34 34 ASP H H 34 9.540 9.540 9.003 0.537 25575
2596 1 9 . 1 1 35 35 GLY N N 35 126.620 126.620 103.209 23.411 25575
2597 1 9 . 1 1 35 35 GLY CA C 35 45.480 45.480 44.805 0.675 25575
2598 1 9 . 1 1 35 35 GLY H H 35 8.370 8.370 8.076 0.294 25575
2599 1 9 . 1 1 36 36 GLU N N 36 120.860 120.860 122.354 -1.494 25575
2600 1 9 . 1 1 36 36 GLU HA H 36 4.670 4.670 4.273 0.397 25575
2601 1 9 . 1 1 36 36 GLU CA C 36 54.350 54.350 55.636 -1.286 25575
2602 1 9 . 1 1 36 36 GLU CB C 36 31.630 31.630 30.335 1.295 25575
2603 1 9 . 1 1 36 36 GLU H H 36 7.820 7.820 7.846 -0.026 25575
2604 1 9 . 1 1 37 37 ARG N N 37 129.790 129.790 127.564 2.226 25575
2605 1 9 . 1 1 37 37 ARG HA H 37 4.200 4.200 4.428 -0.228 25575
2606 1 9 . 1 1 37 37 ARG CA C 37 56.440 56.440 54.675 1.765 25575
2607 1 9 . 1 1 37 37 ARG CB C 37 29.710 29.710 29.310 0.400 25575
2608 1 9 . 1 1 37 37 ARG H H 37 8.930 8.930 8.530 0.400 25575
2609 1 9 . 1 1 38 38 CYS N N 38 130.950 130.950 126.289 4.661 25575
2610 1 9 . 1 1 38 38 CYS HA H 38 4.450 4.450 4.320 0.130 25575
2611 1 9 . 1 1 38 38 CYS CA C 38 60.560 60.560 60.215 0.345 25575
2612 1 9 . 1 1 38 38 CYS CB C 38 31.250 31.250 27.242 4.008 25575
2613 1 9 . 1 1 38 38 CYS H H 38 9.050 9.050 8.701 0.349 25575
2614 1 9 . 1 1 39 39 VAL N N 39 118.270 118.270 121.387 -3.117 25575
2615 1 9 . 1 1 39 39 VAL HA H 39 4.710 4.710 4.469 0.241 25575
2616 1 9 . 1 1 39 39 VAL CA C 39 60.340 60.340 60.424 -0.084 25575
2617 1 9 . 1 1 39 39 VAL CB C 39 31.290 31.290 31.885 -0.595 25575
2618 1 9 . 1 1 39 39 VAL H H 39 8.060 8.060 8.056 0.004 25575
2619 1 9 . 1 1 40 40 ARG N N 40 127.360 127.360 123.064 4.296 25575
2620 1 9 . 1 1 40 40 ARG HA H 40 4.430 4.430 4.335 0.095 25575
2621 1 9 . 1 1 40 40 ARG CA C 40 56.150 56.150 54.673 1.477 25575
2622 1 9 . 1 1 40 40 ARG CB C 40 29.210 29.210 29.676 -0.466 25575
2623 1 9 . 1 1 40 40 ARG H H 40 8.950 8.950 7.650 1.300 25575
2624 1 9 . 1 1 41 41 PRO HA H 41 4.430 4.430 4.515 -0.085 25575
2625 1 9 . 1 1 41 41 PRO CA C 41 62.690 62.690 62.828 -0.138 25575
2626 1 9 . 1 1 41 41 PRO CB C 41 32.010 32.010 32.055 -0.045 25575
2627 1 9 . 1 1 42 42 ALA N N 42 124.260 124.260 126.855 -2.595 25575
2628 1 9 . 1 1 42 42 ALA HA H 42 3.620 3.620 4.651 -1.031 25575
2629 1 9 . 1 1 42 42 ALA CA C 42 52.930 52.930 51.307 1.623 25575
2630 1 9 . 1 1 42 42 ALA CB C 42 19.130 19.130 21.053 -1.923 25575
2631 1 9 . 1 1 42 42 ALA H H 42 8.410 8.410 7.964 0.446 25575
2632 1 9 . 1 1 43 43 GLY N N 43 112.690 112.690 108.436 4.254 25575
2633 1 9 . 1 1 43 43 GLY CA C 43 44.240 44.240 44.879 -0.639 25575
2634 1 9 . 1 1 43 43 GLY H H 43 8.090 8.090 7.992 0.098 25575
2635 1 9 . 1 1 44 44 ASN N N 44 116.980 116.980 121.123 -4.143 25575
2636 1 9 . 1 1 44 44 ASN HA H 44 4.690 4.690 4.715 -0.025 25575
2637 1 9 . 1 1 44 44 ASN CA C 44 53.420 53.420 52.828 0.592 25575
2638 1 9 . 1 1 44 44 ASN CB C 44 39.370 39.370 37.723 1.647 25575
2639 1 9 . 1 1 44 44 ASN H H 44 8.720 8.720 8.618 0.102 25575
2640 1 9 . 1 1 45 45 ALA N N 45 124.240 124.240 122.267 1.973 25575
2641 1 9 . 1 1 45 45 ALA HA H 45 4.640 4.640 4.716 -0.076 25575
2642 1 9 . 1 1 45 45 ALA CA C 45 52.240 52.240 51.333 0.907 25575
2643 1 9 . 1 1 45 45 ALA CB C 45 19.540 19.540 20.949 -1.409 25575
2644 1 9 . 1 1 45 45 ALA H H 45 8.770 8.770 8.084 0.686 25575
2645 1 9 . 1 1 46 46 SER N N 46 111.670 111.670 117.826 -6.156 25575
2646 1 9 . 1 1 46 46 SER HA H 46 5.300 5.300 4.719 0.581 25575
2647 1 9 . 1 1 46 46 SER CA C 46 56.580 56.580 57.212 -0.632 25575
2648 1 9 . 1 1 46 46 SER CB C 46 66.490 66.490 65.780 0.710 25575
2649 1 9 . 1 1 46 46 SER H H 46 8.060 8.060 8.213 -0.153 25575
2650 1 9 . 1 1 47 47 PHE HA H 47 4.520 4.520 4.564 -0.044 25575
2651 1 9 . 1 1 47 47 PHE CA C 47 57.000 57.000 58.035 -1.035 25575
2652 1 9 . 1 1 47 47 PHE CB C 47 38.360 38.360 40.670 -2.310 25575
2653 1 9 . 1 1 48 48 SER N N 48 116.970 116.970 117.094 -0.124 25575
2654 1 9 . 1 1 48 48 SER HA H 48 4.440 4.440 4.548 -0.108 25575
2655 1 9 . 1 1 48 48 SER CA C 48 56.950 56.950 57.233 -0.283 25575
2656 1 9 . 1 1 48 48 SER CB C 48 65.810 65.810 65.669 0.141 25575
2657 1 9 . 1 1 48 48 SER H H 48 7.100 7.100 7.560 -0.460 25575
2658 1 9 . 1 1 49 49 LYS N N 49 120.650 120.650 124.906 -4.256 25575
2659 1 9 . 1 1 49 49 LYS HA H 49 3.900 3.900 4.145 -0.245 25575
2660 1 9 . 1 1 49 49 LYS CA C 49 59.570 59.570 59.238 0.332 25575
2661 1 9 . 1 1 49 49 LYS CB C 49 31.790 31.790 32.435 -0.645 25575
2662 1 9 . 1 1 49 49 LYS H H 49 8.770 8.770 8.782 -0.012 25575
2663 1 9 . 1 1 50 50 ARG N N 50 118.240 118.240 115.875 2.365 25575
2664 1 9 . 1 1 50 50 ARG HA H 50 4.040 4.040 4.105 -0.065 25575
2665 1 9 . 1 1 50 50 ARG CA C 50 59.070 59.070 58.365 0.705 25575
2666 1 9 . 1 1 50 50 ARG CB C 50 30.080 30.080 29.472 0.608 25575
2667 1 9 . 1 1 50 50 ARG H H 50 8.040 8.040 8.187 -0.147 25575
2668 1 9 . 1 1 51 51 VAL N N 51 121.680 121.680 119.621 2.059 25575
2669 1 9 . 1 1 51 51 VAL HA H 51 3.590 3.590 3.824 -0.234 25575
2670 1 9 . 1 1 51 51 VAL CA C 51 65.940 65.940 64.297 1.643 25575
2671 1 9 . 1 1 51 51 VAL CB C 51 31.620 31.620 31.425 0.195 25575
2672 1 9 . 1 1 51 51 VAL H H 51 7.350 7.350 7.627 -0.277 25575
2673 1 9 . 1 1 52 52 GLN N N 52 119.680 119.680 119.649 0.031 25575
2674 1 9 . 1 1 52 52 GLN HA H 52 3.570 3.570 3.778 -0.208 25575
2675 1 9 . 1 1 52 52 GLN CA C 52 59.210 59.210 59.456 -0.246 25575
2676 1 9 . 1 1 52 52 GLN CB C 52 28.620 28.620 28.163 0.457 25575
2677 1 9 . 1 1 52 52 GLN H H 52 8.210 8.210 7.681 0.529 25575
2678 1 9 . 1 1 53 53 LYS N N 53 118.080 118.080 118.424 -0.344 25575
2679 1 9 . 1 1 53 53 LYS HA H 53 4.160 4.160 4.028 0.132 25575
2680 1 9 . 1 1 53 53 LYS CA C 53 58.670 58.670 58.448 0.222 25575
2681 1 9 . 1 1 53 53 LYS CB C 53 32.120 32.120 31.599 0.521 25575
2682 1 9 . 1 1 53 53 LYS H H 53 7.960 7.960 7.633 0.327 25575
2683 1 9 . 1 1 54 54 SER N N 54 115.450 115.450 114.632 0.818 25575
2684 1 9 . 1 1 54 54 SER HA H 54 4.370 4.370 4.223 0.147 25575
2685 1 9 . 1 1 54 54 SER CA C 54 61.330 61.330 61.110 0.220 25575
2686 1 9 . 1 1 54 54 SER CB C 54 63.690 63.690 63.024 0.666 25575
2687 1 9 . 1 1 54 54 SER H H 54 7.800 7.800 7.704 0.096 25575
2688 1 9 . 1 1 55 55 ILE N N 55 117.670 117.670 120.058 -2.388 25575
2689 1 9 . 1 1 55 55 ILE HA H 55 4.060 4.060 3.835 0.225 25575
2690 1 9 . 1 1 55 55 ILE CA C 55 63.330 63.330 64.876 -1.546 25575
2691 1 9 . 1 1 55 55 ILE CB C 55 38.980 38.980 38.427 0.553 25575
2692 1 9 . 1 1 55 55 ILE H H 55 7.840 7.840 7.389 0.451 25575
2693 1 9 . 1 1 56 56 SER N N 56 115.650 115.650 115.156 0.494 25575
2694 1 9 . 1 1 56 56 SER HA H 56 4.490 4.490 4.172 0.318 25575
2695 1 9 . 1 1 56 56 SER CA C 56 60.220 60.220 61.678 -1.458 25575
2696 1 9 . 1 1 56 56 SER CB C 56 63.000 63.000 63.206 -0.206 25575
2697 1 9 . 1 1 56 56 SER H H 56 8.060 8.060 8.369 -0.309 25575
2698 1 9 . 1 1 57 57 GLN N N 57 121.830 121.830 120.149 1.681 25575
2699 1 9 . 1 1 57 57 GLN HA H 57 4.200 4.200 4.207 -0.007 25575
2700 1 9 . 1 1 57 57 GLN CA C 57 58.310 58.310 57.490 0.820 25575
2701 1 9 . 1 1 57 57 GLN CB C 57 28.850 28.850 28.642 0.208 25575
2702 1 9 . 1 1 57 57 GLN H H 57 8.620 8.620 7.766 0.854 25575
2703 1 9 . 1 1 58 58 LYS N N 58 116.960 116.960 116.812 0.148 25575
2704 1 9 . 1 1 58 58 LYS HA H 58 4.290 4.290 4.439 -0.149 25575
2705 1 9 . 1 1 58 58 LYS CA C 58 56.920 56.920 54.803 2.117 25575
2706 1 9 . 1 1 58 58 LYS CB C 58 32.900 32.900 32.927 -0.027 25575
2707 1 9 . 1 1 58 58 LYS H H 58 7.950 7.950 7.450 0.500 25575
2708 1 9 . 1 1 59 59 LYS N N 59 116.960 116.960 118.964 -2.004 25575
2709 1 9 . 1 1 59 59 LYS HA H 59 4.120 4.120 3.930 0.190 25575
2710 1 9 . 1 1 59 59 LYS CA C 59 57.090 57.090 56.730 0.360 25575
2711 1 9 . 1 1 59 59 LYS CB C 59 30.080 30.080 30.153 -0.073 25575
2712 1 9 . 1 1 59 59 LYS H H 59 7.950 7.950 7.716 0.234 25575
2713 1 9 . 1 1 60 60 LEU N N 60 117.540 117.540 118.825 -1.285 25575
2714 1 9 . 1 1 60 60 LEU HA H 60 4.480 4.480 4.298 0.182 25575
2715 1 9 . 1 1 60 60 LEU CA C 60 54.500 54.500 55.471 -0.971 25575
2716 1 9 . 1 1 60 60 LEU CB C 60 42.840 42.840 42.573 0.267 25575
2717 1 9 . 1 1 60 60 LEU H H 60 7.930 7.930 7.429 0.501 25575
2718 1 9 . 1 1 61 61 LYS HA H 61 4.390 4.390 4.181 0.209 25575
2719 1 9 . 1 1 61 61 LYS CA C 61 55.540 55.540 56.861 -1.321 25575
2720 1 9 . 1 1 61 61 LYS CB C 61 30.050 30.050 31.169 -1.119 25575
2721 1 9 . 1 1 62 62 LEU N N 62 120.000 120.000 122.070 -2.070 25575
2722 1 9 . 1 1 62 62 LEU HA H 62 5.250 5.250 5.094 0.156 25575
2723 1 9 . 1 1 62 62 LEU CA C 62 53.080 53.080 54.211 -1.131 25575
2724 1 9 . 1 1 62 62 LEU CB C 62 45.760 45.760 43.123 2.638 25575
2725 1 9 . 1 1 62 62 LEU H H 62 7.470 7.470 7.721 -0.251 25575
2726 1 9 . 1 1 63 63 ASP N N 63 121.730 121.730 126.181 -4.451 25575
2727 1 9 . 1 1 63 63 ASP HA H 63 4.860 4.860 4.871 -0.011 25575
2728 1 9 . 1 1 63 63 ASP CA C 63 51.890 51.890 52.292 -0.402 25575
2729 1 9 . 1 1 63 63 ASP CB C 63 44.910 44.910 44.611 0.299 25575
2730 1 9 . 1 1 63 63 ASP H H 63 8.620 8.620 8.772 -0.152 25575
2731 1 9 . 1 1 64 64 ILE N N 64 118.120 118.120 119.434 -1.314 25575
2732 1 9 . 1 1 64 64 ILE HA H 64 4.210 4.210 4.394 -0.184 25575
2733 1 9 . 1 1 64 64 ILE CA C 64 60.430 60.430 58.564 1.866 25575
2734 1 9 . 1 1 64 64 ILE CB C 64 40.420 40.420 39.753 0.667 25575
2735 1 9 . 1 1 64 64 ILE H H 64 8.650 8.650 8.250 0.400 25575
2736 1 9 . 1 1 65 65 ASP N N 65 124.550 124.550 129.303 -4.753 25575
2737 1 9 . 1 1 65 65 ASP HA H 65 4.570 4.570 4.422 0.148 25575
2738 1 9 . 1 1 65 65 ASP CA C 65 53.310 53.310 54.704 -1.394 25575
2739 1 9 . 1 1 65 65 ASP CB C 65 40.440 40.440 42.240 -1.800 25575
2740 1 9 . 1 1 65 65 ASP H H 65 8.630 8.630 8.546 0.084 25575
2741 1 9 . 1 1 66 66 LYS N N 66 125.970 125.970 125.373 0.597 25575
2742 1 9 . 1 1 66 66 LYS HA H 66 4.040 4.040 4.334 -0.294 25575
2743 1 9 . 1 1 66 66 LYS CA C 66 58.140 58.140 56.379 1.761 25575
2744 1 9 . 1 1 66 66 LYS CB C 66 31.990 31.990 32.782 -0.792 25575
2745 1 9 . 1 1 66 66 LYS H H 66 8.590 8.590 8.564 0.026 25575
2746 1 9 . 1 1 67 67 SER N N 67 114.980 114.980 116.369 -1.389 25575
2747 1 9 . 1 1 67 67 SER HA H 67 4.320 4.320 4.280 0.040 25575
2748 1 9 . 1 1 67 67 SER CA C 67 60.330 60.330 61.188 -0.857 25575
2749 1 9 . 1 1 67 67 SER CB C 67 63.710 63.710 63.266 0.444 25575
2750 1 9 . 1 1 67 67 SER H H 67 8.760 8.760 8.935 -0.175 25575
2751 1 9 . 1 1 68 68 VAL HA H 68 4.250 4.250 3.795 0.455 25575
2752 1 9 . 1 1 68 68 VAL CA C 68 62.150 62.150 63.361 -1.211 25575
2753 1 9 . 1 1 68 68 VAL CB C 68 31.900 31.900 31.758 0.142 25575
2754 1 9 . 1 1 69 69 ARG CA C 69 56.960 56.960 57.632 -0.672 25575
2755 1 9 . 1 1 70 70 HIS N N 70 116.270 116.270 112.672 3.598 25575
2756 1 9 . 1 1 70 70 HIS HA H 70 4.760 4.760 4.954 -0.194 25575
2757 1 9 . 1 1 70 70 HIS CA C 70 55.360 55.360 53.013 2.347 25575
2758 1 9 . 1 1 70 70 HIS CB C 70 33.100 33.100 32.505 0.595 25575
2759 1 9 . 1 1 70 70 HIS H H 70 7.390 7.390 7.941 -0.551 25575
2760 1 9 . 1 1 71 71 LEU N N 71 120.200 120.200 122.146 -1.946 25575
2761 1 9 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.569 0.491 25575
2762 1 9 . 1 1 71 71 LEU CA C 71 54.070 54.070 54.107 -0.037 25575
2763 1 9 . 1 1 71 71 LEU CB C 71 42.710 42.710 41.067 1.643 25575
2764 1 9 . 1 1 71 71 LEU H H 71 7.970 7.970 8.668 -0.698 25575
2765 1 9 . 1 1 72 72 TYR HA H 72 5.030 5.030 4.696 0.334 25575
2766 1 9 . 1 1 72 72 TYR CA C 72 59.990 59.990 57.520 2.470 25575
2767 1 9 . 1 1 72 72 TYR CB C 72 39.440 39.440 41.556 -2.116 25575
2768 1 9 . 1 1 73 73 ILE N N 73 112.940 112.940 114.336 -1.396 25575
2769 1 9 . 1 1 73 73 ILE HA H 73 6.080 6.080 4.888 1.192 25575
2770 1 9 . 1 1 73 73 ILE CA C 73 58.090 58.090 58.450 -0.360 25575
2771 1 9 . 1 1 73 73 ILE CB C 73 41.820 41.820 42.528 -0.708 25575
2772 1 9 . 1 1 73 73 ILE H H 73 8.450 8.450 8.053 0.397 25575
2773 1 9 . 1 1 74 74 CYS N N 74 124.730 124.730 118.864 5.866 25575
2774 1 9 . 1 1 74 74 CYS HA H 74 5.080 5.080 5.174 -0.094 25575
2775 1 9 . 1 1 74 74 CYS CA C 74 57.670 57.670 57.068 0.602 25575
2776 1 9 . 1 1 74 74 CYS CB C 74 33.330 33.330 30.595 2.735 25575
2777 1 9 . 1 1 74 74 CYS H H 74 9.830 9.830 8.416 1.414 25575
2778 1 9 . 1 1 75 75 ASP N N 75 120.990 120.990 122.490 -1.500 25575
2779 1 9 . 1 1 75 75 ASP HA H 75 4.590 4.590 4.333 0.257 25575
2780 1 9 . 1 1 75 75 ASP CA C 75 57.320 57.320 57.300 0.020 25575
2781 1 9 . 1 1 75 75 ASP CB C 75 39.670 39.670 39.996 -0.326 25575
2782 1 9 . 1 1 75 75 ASP H H 75 9.090 9.090 8.953 0.137 25575
2783 1 9 . 1 1 76 76 PHE N N 76 122.470 122.470 121.442 1.028 25575
2784 1 9 . 1 1 76 76 PHE HA H 76 4.230 4.230 4.173 0.057 25575
2785 1 9 . 1 1 76 76 PHE CA C 76 62.030 62.030 61.813 0.217 25575
2786 1 9 . 1 1 76 76 PHE CB C 76 38.190 38.190 39.148 -0.958 25575
2787 1 9 . 1 1 76 76 PHE H H 76 8.330 8.330 8.129 0.201 25575
2788 1 9 . 1 1 77 77 HIS N N 77 124.580 124.580 117.875 6.705 25575
2789 1 9 . 1 1 77 77 HIS HA H 77 4.280 4.280 4.354 -0.074 25575
2790 1 9 . 1 1 77 77 HIS CA C 77 63.880 63.880 59.709 4.171 25575
2791 1 9 . 1 1 77 77 HIS CB C 77 29.600 29.600 30.039 -0.439 25575
2792 1 9 . 1 1 77 77 HIS H H 77 10.300 10.300 7.829 2.471 25575
2793 1 9 . 1 1 78 78 LYS N N 78 122.930 122.930 120.010 2.920 25575
2794 1 9 . 1 1 78 78 LYS HA H 78 3.860 3.860 4.010 -0.150 25575
2795 1 9 . 1 1 78 78 LYS CA C 78 60.550 60.550 60.441 0.109 25575
2796 1 9 . 1 1 78 78 LYS CB C 78 32.040 32.040 32.462 -0.423 25575
2797 1 9 . 1 1 78 78 LYS H H 78 8.960 8.960 8.549 0.411 25575
2798 1 9 . 1 1 79 79 ASN N N 79 116.670 116.670 117.252 -0.582 25575
2799 1 9 . 1 1 79 79 ASN HA H 79 4.420 4.420 4.527 -0.107 25575
2800 1 9 . 1 1 79 79 ASN CA C 79 56.030 56.030 56.190 -0.160 25575
2801 1 9 . 1 1 79 79 ASN CB C 79 38.100 38.100 38.496 -0.396 25575
2802 1 9 . 1 1 79 79 ASN H H 79 8.230 8.230 7.882 0.348 25575
2803 1 9 . 1 1 80 80 PHE N N 80 122.600 122.600 121.535 1.065 25575
2804 1 9 . 1 1 80 80 PHE HA H 80 4.180 4.180 4.184 -0.004 25575
2805 1 9 . 1 1 80 80 PHE CA C 80 60.700 60.700 61.654 -0.954 25575
2806 1 9 . 1 1 80 80 PHE CB C 80 39.840 39.840 39.385 0.455 25575
2807 1 9 . 1 1 80 80 PHE H H 80 8.200 8.200 7.987 0.213 25575
2808 1 9 . 1 1 81 81 ILE N N 81 118.240 118.240 117.493 0.747 25575
2809 1 9 . 1 1 81 81 ILE HA H 81 3.320 3.320 3.523 -0.203 25575
2810 1 9 . 1 1 81 81 ILE CA C 81 65.160 65.160 64.448 0.712 25575
2811 1 9 . 1 1 81 81 ILE CB C 81 38.440 38.440 37.816 0.624 25575
2812 1 9 . 1 1 81 81 ILE H H 81 8.520 8.520 8.170 0.350 25575
2813 1 9 . 1 1 82 82 GLN N N 82 116.370 116.370 118.976 -2.606 25575
2814 1 9 . 1 1 82 82 GLN HA H 82 4.100 4.100 4.034 0.066 25575
2815 1 9 . 1 1 82 82 GLN CA C 82 57.710 57.710 58.481 -0.771 25575
2816 1 9 . 1 1 82 82 GLN CB C 82 28.710 28.710 28.226 0.484 25575
2817 1 9 . 1 1 82 82 GLN H H 82 7.670 7.670 8.161 -0.491 25575
2818 1 9 . 1 1 83 83 SER N N 83 114.440 114.440 115.843 -1.403 25575
2819 1 9 . 1 1 83 83 SER HA H 83 4.300 4.300 4.143 0.157 25575
2820 1 9 . 1 1 83 83 SER CA C 83 60.130 60.130 61.020 -0.890 25575
2821 1 9 . 1 1 83 83 SER CB C 83 63.570 63.570 62.761 0.809 25575
2822 1 9 . 1 1 83 83 SER H H 83 7.810 7.810 7.969 -0.159 25575
2823 1 9 . 1 1 84 84 VAL N N 84 120.750 120.750 119.493 1.257 25575
2824 1 9 . 1 1 84 84 VAL HA H 84 3.970 3.970 3.755 0.215 25575
2825 1 9 . 1 1 84 84 VAL CA C 84 63.430 63.430 64.583 -1.153 25575
2826 1 9 . 1 1 84 84 VAL CB C 84 31.960 31.960 30.522 1.438 25575
2827 1 9 . 1 1 84 84 VAL H H 84 7.790 7.790 7.450 0.340 25575
2828 1 9 . 1 1 85 85 ARG N N 85 122.090 122.090 117.526 4.564 25575
2829 1 9 . 1 1 85 85 ARG HA H 85 4.240 4.240 4.331 -0.091 25575
2830 1 9 . 1 1 85 85 ARG CA C 85 56.850 56.850 54.979 1.871 25575
2831 1 9 . 1 1 85 85 ARG CB C 85 30.720 30.720 30.457 0.262 25575
2832 1 9 . 1 1 85 85 ARG H H 85 8.090 8.090 7.502 0.588 25575
2833 1 9 . 1 1 86 86 ASN N N 86 118.510 118.510 115.175 3.335 25575
2834 1 9 . 1 1 86 86 ASN HA H 86 4.690 4.690 4.338 0.352 25575
2835 1 9 . 1 1 86 86 ASN CA C 86 53.380 53.380 55.309 -1.929 25575
2836 1 9 . 1 1 86 86 ASN CB C 86 38.950 38.950 37.548 1.402 25575
2837 1 9 . 1 1 86 86 ASN H H 86 8.220 8.220 8.347 -0.127 25575
2838 1 9 . 1 1 87 87 LYS N N 87 121.600 121.600 118.871 2.729 25575
2839 1 9 . 1 1 87 87 LYS HA H 87 4.310 4.310 4.571 -0.261 25575
2840 1 9 . 1 1 87 87 LYS CA C 87 56.590 56.590 55.554 1.036 25575
2841 1 9 . 1 1 87 87 LYS CB C 87 32.870 32.870 31.887 0.983 25575
2842 1 9 . 1 1 87 87 LYS H H 87 8.150 8.150 8.342 -0.192 25575
2843 1 9 . 1 1 88 88 ARG N N 88 121.920 121.920 119.494 2.426 25575
2844 1 9 . 1 1 88 88 ARG HA H 88 4.330 4.330 4.636 -0.306 25575
2845 1 9 . 1 1 88 88 ARG CA C 88 56.110 56.110 55.828 0.283 25575
2846 1 9 . 1 1 88 88 ARG CB C 88 30.870 30.870 31.670 -0.800 25575
2847 1 9 . 1 1 88 88 ARG H H 88 8.250 8.250 8.229 0.021 25575
2848 1 9 . 1 1 89 89 LYS N N 89 123.020 123.020 123.530 -0.510 25575
2849 1 9 . 1 1 89 89 LYS HA H 89 4.320 4.320 4.535 -0.215 25575
2850 1 9 . 1 1 89 89 LYS CA C 89 56.330 56.330 56.122 0.208 25575
2851 1 9 . 1 1 89 89 LYS CB C 89 33.140 33.140 33.563 -0.423 25575
2852 1 9 . 1 1 89 89 LYS H H 89 8.320 8.320 8.522 -0.202 25575
2853 1 9 . 1 1 90 90 ARG N N 90 122.970 122.970 122.749 0.221 25575
2854 1 9 . 1 1 90 90 ARG HA H 90 4.360 4.360 4.443 -0.083 25575
2855 1 9 . 1 1 90 90 ARG CA C 90 56.100 56.100 55.478 0.622 25575
2856 1 9 . 1 1 90 90 ARG CB C 90 31.210 31.210 31.435 -0.225 25575
2857 1 9 . 1 1 90 90 ARG H H 90 8.360 8.360 8.327 0.033 25575
2858 1 9 . 1 1 91 91 LYS N N 91 123.680 123.680 123.977 -0.297 25575
2859 1 9 . 1 1 91 91 LYS HA H 91 4.380 4.380 4.379 0.001 25575
2860 1 9 . 1 1 91 91 LYS CA C 91 56.620 56.620 56.689 -0.069 25575
2861 1 9 . 1 1 91 91 LYS CB C 91 33.070 33.070 32.931 0.140 25575
2862 1 9 . 1 1 91 91 LYS H H 91 8.450 8.450 8.508 -0.058 25575
2863 1 10 . 1 1 24 24 SER HA H 24 4.330 4.330 3.875 0.455 25575
2864 1 10 . 1 1 24 24 SER CA C 24 58.130 58.130 58.942 -0.812 25575
2865 1 10 . 1 1 24 24 SER CB C 24 63.870 63.870 62.786 1.084 25575
2866 1 10 . 1 1 25 25 TYR N N 25 122.160 122.160 120.709 1.451 25575
2867 1 10 . 1 1 25 25 TYR HA H 25 4.530 4.530 4.533 -0.003 25575
2868 1 10 . 1 1 25 25 TYR CA C 25 58.420 58.420 58.332 0.088 25575
2869 1 10 . 1 1 25 25 TYR CB C 25 38.570 38.570 38.750 -0.180 25575
2870 1 10 . 1 1 25 25 TYR H H 25 8.310 8.310 7.609 0.701 25575
2871 1 10 . 1 1 26 26 GLY N N 26 111.370 111.370 111.151 0.219 25575
2872 1 10 . 1 1 26 26 GLY CA C 26 45.330 45.330 45.855 -0.525 25575
2873 1 10 . 1 1 26 26 GLY H H 26 8.300 8.300 8.628 -0.328 25575
2874 1 10 . 1 1 27 27 GLN N N 27 118.910 118.910 121.855 -2.945 25575
2875 1 10 . 1 1 27 27 GLN HA H 27 4.510 4.510 4.524 -0.014 25575
2876 1 10 . 1 1 27 27 GLN CA C 27 55.240 55.240 54.997 0.243 25575
2877 1 10 . 1 1 27 27 GLN CB C 27 29.800 29.800 28.488 1.312 25575
2878 1 10 . 1 1 27 27 GLN H H 27 8.050 8.050 8.557 -0.507 25575
2879 1 10 . 1 1 28 28 SER N N 28 119.460 119.460 115.745 3.715 25575
2880 1 10 . 1 1 28 28 SER HA H 28 4.810 4.810 5.207 -0.397 25575
2881 1 10 . 1 1 28 28 SER CA C 28 57.710 57.710 56.716 0.994 25575
2882 1 10 . 1 1 28 28 SER CB C 28 65.530 65.530 65.682 -0.152 25575
2883 1 10 . 1 1 28 28 SER H H 28 8.800 8.800 7.937 0.863 25575
2884 1 10 . 1 1 29 29 CYS N N 29 122.160 122.160 118.736 3.424 25575
2885 1 10 . 1 1 29 29 CYS HA H 29 4.130 4.130 4.405 -0.275 25575
2886 1 10 . 1 1 29 29 CYS CA C 29 60.620 60.620 61.530 -0.910 25575
2887 1 10 . 1 1 29 29 CYS CB C 29 32.770 32.770 29.024 3.746 25575
2888 1 10 . 1 1 29 29 CYS H H 29 8.390 8.390 8.567 -0.177 25575
2889 1 10 . 1 1 30 30 CYS N N 30 122.320 122.320 119.623 2.697 25575
2890 1 10 . 1 1 30 30 CYS HA H 30 4.530 4.530 4.759 -0.229 25575
2891 1 10 . 1 1 30 30 CYS CA C 30 58.810 58.810 58.025 0.785 25575
2892 1 10 . 1 1 30 30 CYS CB C 30 28.910 28.910 27.760 1.150 25575
2893 1 10 . 1 1 30 30 CYS H H 30 8.340 8.340 8.437 -0.097 25575
2894 1 10 . 1 1 31 31 LEU N N 31 122.390 122.390 121.478 0.912 25575
2895 1 10 . 1 1 31 31 LEU HA H 31 4.640 4.640 4.826 -0.186 25575
2896 1 10 . 1 1 31 31 LEU CA C 31 55.440 55.440 54.923 0.517 25575
2897 1 10 . 1 1 31 31 LEU CB C 31 43.490 43.490 42.965 0.525 25575
2898 1 10 . 1 1 31 31 LEU H H 31 8.460 8.460 7.231 1.229 25575
2899 1 10 . 1 1 32 32 ILE N N 32 118.890 118.890 117.398 1.492 25575
2900 1 10 . 1 1 32 32 ILE HA H 32 4.200 4.200 4.689 -0.489 25575
2901 1 10 . 1 1 32 32 ILE CA C 32 60.440 60.440 60.114 0.326 25575
2902 1 10 . 1 1 32 32 ILE CB C 32 39.890 39.890 41.892 -2.002 25575
2903 1 10 . 1 1 32 32 ILE H H 32 8.680 8.680 8.028 0.652 25575
2904 1 10 . 1 1 33 33 GLU N N 33 128.400 128.400 126.228 2.172 25575
2905 1 10 . 1 1 33 33 GLU HA H 33 5.080 5.080 5.262 -0.182 25575
2906 1 10 . 1 1 33 33 GLU CA C 33 54.120 54.120 54.720 -0.600 25575
2907 1 10 . 1 1 33 33 GLU CB C 33 32.080 32.080 32.981 -0.901 25575
2908 1 10 . 1 1 33 33 GLU H H 33 8.640 8.640 8.731 -0.091 25575
2909 1 10 . 1 1 34 34 ASP N N 34 130.390 130.390 127.200 3.190 25575
2910 1 10 . 1 1 34 34 ASP HA H 34 4.310 4.310 4.371 -0.061 25575
2911 1 10 . 1 1 34 34 ASP CA C 34 55.150 55.150 55.741 -0.591 25575
2912 1 10 . 1 1 34 34 ASP CB C 34 40.050 40.050 40.699 -0.649 25575
2913 1 10 . 1 1 34 34 ASP H H 34 9.540 9.540 8.746 0.794 25575
2914 1 10 . 1 1 35 35 GLY N N 35 126.620 126.620 103.884 22.736 25575
2915 1 10 . 1 1 35 35 GLY CA C 35 45.480 45.480 44.781 0.699 25575
2916 1 10 . 1 1 35 35 GLY H H 35 8.370 8.370 8.466 -0.096 25575
2917 1 10 . 1 1 36 36 GLU N N 36 120.860 120.860 123.390 -2.530 25575
2918 1 10 . 1 1 36 36 GLU HA H 36 4.670 4.670 4.240 0.430 25575
2919 1 10 . 1 1 36 36 GLU CA C 36 54.350 54.350 55.527 -1.177 25575
2920 1 10 . 1 1 36 36 GLU CB C 36 31.630 31.630 29.966 1.664 25575
2921 1 10 . 1 1 36 36 GLU H H 36 7.820 7.820 8.101 -0.281 25575
2922 1 10 . 1 1 37 37 ARG N N 37 129.790 129.790 128.327 1.463 25575
2923 1 10 . 1 1 37 37 ARG HA H 37 4.200 4.200 4.321 -0.121 25575
2924 1 10 . 1 1 37 37 ARG CA C 37 56.440 56.440 55.345 1.095 25575
2925 1 10 . 1 1 37 37 ARG CB C 37 29.710 29.710 28.291 1.419 25575
2926 1 10 . 1 1 37 37 ARG H H 37 8.930 8.930 8.106 0.824 25575
2927 1 10 . 1 1 38 38 CYS N N 38 130.950 130.950 124.576 6.374 25575
2928 1 10 . 1 1 38 38 CYS HA H 38 4.450 4.450 4.369 0.081 25575
2929 1 10 . 1 1 38 38 CYS CA C 38 60.560 60.560 60.410 0.150 25575
2930 1 10 . 1 1 38 38 CYS CB C 38 31.250 31.250 27.996 3.254 25575
2931 1 10 . 1 1 38 38 CYS H H 38 9.050 9.050 8.182 0.868 25575
2932 1 10 . 1 1 39 39 VAL N N 39 118.270 118.270 121.137 -2.867 25575
2933 1 10 . 1 1 39 39 VAL HA H 39 4.710 4.710 4.519 0.191 25575
2934 1 10 . 1 1 39 39 VAL CA C 39 60.340 60.340 60.684 -0.344 25575
2935 1 10 . 1 1 39 39 VAL CB C 39 31.290 31.290 31.840 -0.549 25575
2936 1 10 . 1 1 39 39 VAL H H 39 8.060 8.060 8.483 -0.423 25575
2937 1 10 . 1 1 40 40 ARG N N 40 127.360 127.360 122.994 4.366 25575
2938 1 10 . 1 1 40 40 ARG HA H 40 4.430 4.430 4.308 0.122 25575
2939 1 10 . 1 1 40 40 ARG CA C 40 56.150 56.150 54.918 1.232 25575
2940 1 10 . 1 1 40 40 ARG CB C 40 29.210 29.210 29.848 -0.638 25575
2941 1 10 . 1 1 40 40 ARG H H 40 8.950 8.950 7.631 1.319 25575
2942 1 10 . 1 1 41 41 PRO HA H 41 4.430 4.430 4.460 -0.030 25575
2943 1 10 . 1 1 41 41 PRO CA C 41 62.690 62.690 62.595 0.095 25575
2944 1 10 . 1 1 41 41 PRO CB C 41 32.010 32.010 32.008 0.001 25575
2945 1 10 . 1 1 42 42 ALA N N 42 124.260 124.260 126.416 -2.156 25575
2946 1 10 . 1 1 42 42 ALA HA H 42 3.620 3.620 4.528 -0.908 25575
2947 1 10 . 1 1 42 42 ALA CA C 42 52.930 52.930 51.485 1.445 25575
2948 1 10 . 1 1 42 42 ALA CB C 42 19.130 19.130 19.788 -0.658 25575
2949 1 10 . 1 1 42 42 ALA H H 42 8.410 8.410 8.163 0.247 25575
2950 1 10 . 1 1 43 43 GLY N N 43 112.690 112.690 110.569 2.121 25575
2951 1 10 . 1 1 43 43 GLY CA C 43 44.240 44.240 44.483 -0.243 25575
2952 1 10 . 1 1 43 43 GLY H H 43 8.090 8.090 8.591 -0.501 25575
2953 1 10 . 1 1 44 44 ASN N N 44 116.980 116.980 121.727 -4.747 25575
2954 1 10 . 1 1 44 44 ASN HA H 44 4.690 4.690 4.688 0.002 25575
2955 1 10 . 1 1 44 44 ASN CA C 44 53.420 53.420 53.459 -0.039 25575
2956 1 10 . 1 1 44 44 ASN CB C 44 39.370 39.370 37.275 2.095 25575
2957 1 10 . 1 1 44 44 ASN H H 44 8.720 8.720 8.427 0.293 25575
2958 1 10 . 1 1 45 45 ALA N N 45 124.240 124.240 124.618 -0.378 25575
2959 1 10 . 1 1 45 45 ALA HA H 45 4.640 4.640 4.746 -0.106 25575
2960 1 10 . 1 1 45 45 ALA CA C 45 52.240 52.240 51.893 0.347 25575
2961 1 10 . 1 1 45 45 ALA CB C 45 19.540 19.540 22.022 -2.482 25575
2962 1 10 . 1 1 45 45 ALA H H 45 8.770 8.770 8.261 0.509 25575
2963 1 10 . 1 1 46 46 SER N N 46 111.670 111.670 117.172 -5.502 25575
2964 1 10 . 1 1 46 46 SER HA H 46 5.300 5.300 4.978 0.322 25575
2965 1 10 . 1 1 46 46 SER CA C 46 56.580 56.580 56.534 0.046 25575
2966 1 10 . 1 1 46 46 SER CB C 46 66.490 66.490 66.178 0.312 25575
2967 1 10 . 1 1 46 46 SER H H 46 8.060 8.060 8.119 -0.059 25575
2968 1 10 . 1 1 47 47 PHE HA H 47 4.520 4.520 4.441 0.079 25575
2969 1 10 . 1 1 47 47 PHE CA C 47 57.000 57.000 57.068 -0.068 25575
2970 1 10 . 1 1 47 47 PHE CB C 47 38.360 38.360 37.955 0.405 25575
2971 1 10 . 1 1 48 48 SER N N 48 116.970 116.970 117.888 -0.918 25575
2972 1 10 . 1 1 48 48 SER HA H 48 4.440 4.440 4.375 0.065 25575
2973 1 10 . 1 1 48 48 SER CA C 48 56.950 56.950 58.004 -1.054 25575
2974 1 10 . 1 1 48 48 SER CB C 48 65.810 65.810 64.236 1.574 25575
2975 1 10 . 1 1 48 48 SER H H 48 7.100 7.100 7.837 -0.737 25575
2976 1 10 . 1 1 49 49 LYS N N 49 120.650 120.650 125.514 -4.864 25575
2977 1 10 . 1 1 49 49 LYS HA H 49 3.900 3.900 3.993 -0.093 25575
2978 1 10 . 1 1 49 49 LYS CA C 49 59.570 59.570 59.293 0.277 25575
2979 1 10 . 1 1 49 49 LYS CB C 49 31.790 31.790 32.362 -0.572 25575
2980 1 10 . 1 1 49 49 LYS H H 49 8.770 8.770 8.922 -0.152 25575
2981 1 10 . 1 1 50 50 ARG N N 50 118.240 118.240 116.850 1.390 25575
2982 1 10 . 1 1 50 50 ARG HA H 50 4.040 4.040 4.049 -0.009 25575
2983 1 10 . 1 1 50 50 ARG CA C 50 59.070 59.070 58.396 0.674 25575
2984 1 10 . 1 1 50 50 ARG CB C 50 30.080 30.080 29.545 0.535 25575
2985 1 10 . 1 1 50 50 ARG H H 50 8.040 8.040 8.014 0.026 25575
2986 1 10 . 1 1 51 51 VAL N N 51 121.680 121.680 119.863 1.817 25575
2987 1 10 . 1 1 51 51 VAL HA H 51 3.590 3.590 3.615 -0.025 25575
2988 1 10 . 1 1 51 51 VAL CA C 51 65.940 65.940 64.868 1.072 25575
2989 1 10 . 1 1 51 51 VAL CB C 51 31.620 31.620 30.731 0.889 25575
2990 1 10 . 1 1 51 51 VAL H H 51 7.350 7.350 8.196 -0.846 25575
2991 1 10 . 1 1 52 52 GLN N N 52 119.680 119.680 118.208 1.472 25575
2992 1 10 . 1 1 52 52 GLN HA H 52 3.570 3.570 3.708 -0.138 25575
2993 1 10 . 1 1 52 52 GLN CA C 52 59.210 59.210 59.482 -0.272 25575
2994 1 10 . 1 1 52 52 GLN CB C 52 28.620 28.620 28.070 0.550 25575
2995 1 10 . 1 1 52 52 GLN H H 52 8.210 8.210 7.889 0.321 25575
2996 1 10 . 1 1 53 53 LYS N N 53 118.080 118.080 118.623 -0.543 25575
2997 1 10 . 1 1 53 53 LYS HA H 53 4.160 4.160 3.982 0.178 25575
2998 1 10 . 1 1 53 53 LYS CA C 53 58.670 58.670 59.860 -1.190 25575
2999 1 10 . 1 1 53 53 LYS CB C 53 32.120 32.120 31.909 0.211 25575
3000 1 10 . 1 1 53 53 LYS H H 53 7.960 7.960 7.787 0.173 25575
3001 1 10 . 1 1 54 54 SER N N 54 115.450 115.450 113.828 1.622 25575
3002 1 10 . 1 1 54 54 SER HA H 54 4.370 4.370 4.229 0.141 25575
3003 1 10 . 1 1 54 54 SER CA C 54 61.330 61.330 60.796 0.534 25575
3004 1 10 . 1 1 54 54 SER CB C 54 63.690 63.690 62.724 0.966 25575
3005 1 10 . 1 1 54 54 SER H H 54 7.800 7.800 7.597 0.203 25575
3006 1 10 . 1 1 55 55 ILE N N 55 117.670 117.670 119.670 -2.000 25575
3007 1 10 . 1 1 55 55 ILE HA H 55 4.060 4.060 3.948 0.112 25575
3008 1 10 . 1 1 55 55 ILE CA C 55 63.330 63.330 64.061 -0.731 25575
3009 1 10 . 1 1 55 55 ILE CB C 55 38.980 38.980 38.561 0.419 25575
3010 1 10 . 1 1 55 55 ILE H H 55 7.840 7.840 7.509 0.331 25575
3011 1 10 . 1 1 56 56 SER N N 56 115.650 115.650 116.334 -0.684 25575
3012 1 10 . 1 1 56 56 SER HA H 56 4.490 4.490 4.121 0.369 25575
3013 1 10 . 1 1 56 56 SER CA C 56 60.220 60.220 61.684 -1.464 25575
3014 1 10 . 1 1 56 56 SER CB C 56 63.000 63.000 63.263 -0.263 25575
3015 1 10 . 1 1 56 56 SER H H 56 8.060 8.060 8.506 -0.446 25575
3016 1 10 . 1 1 57 57 GLN N N 57 121.830 121.830 119.851 1.979 25575
3017 1 10 . 1 1 57 57 GLN HA H 57 4.200 4.200 4.147 0.053 25575
3018 1 10 . 1 1 57 57 GLN CA C 57 58.310 58.310 58.171 0.139 25575
3019 1 10 . 1 1 57 57 GLN CB C 57 28.850 28.850 28.687 0.163 25575
3020 1 10 . 1 1 57 57 GLN H H 57 8.620 8.620 7.924 0.696 25575
3021 1 10 . 1 1 58 58 LYS N N 58 116.960 116.960 116.558 0.402 25575
3022 1 10 . 1 1 58 58 LYS HA H 58 4.290 4.290 4.399 -0.109 25575
3023 1 10 . 1 1 58 58 LYS CA C 58 56.920 56.920 55.348 1.572 25575
3024 1 10 . 1 1 58 58 LYS CB C 58 32.900 32.900 33.179 -0.279 25575
3025 1 10 . 1 1 58 58 LYS H H 58 7.950 7.950 7.519 0.431 25575
3026 1 10 . 1 1 59 59 LYS N N 59 116.960 116.960 119.999 -3.039 25575
3027 1 10 . 1 1 59 59 LYS HA H 59 4.120 4.120 3.967 0.153 25575
3028 1 10 . 1 1 59 59 LYS CA C 59 57.090 57.090 56.913 0.177 25575
3029 1 10 . 1 1 59 59 LYS CB C 59 30.080 30.080 30.519 -0.439 25575
3030 1 10 . 1 1 59 59 LYS H H 59 7.950 7.950 7.751 0.199 25575
3031 1 10 . 1 1 60 60 LEU N N 60 117.540 117.540 118.408 -0.868 25575
3032 1 10 . 1 1 60 60 LEU HA H 60 4.480 4.480 4.350 0.130 25575
3033 1 10 . 1 1 60 60 LEU CA C 60 54.500 54.500 55.103 -0.603 25575
3034 1 10 . 1 1 60 60 LEU CB C 60 42.840 42.840 42.694 0.146 25575
3035 1 10 . 1 1 60 60 LEU H H 60 7.930 7.930 7.525 0.405 25575
3036 1 10 . 1 1 61 61 LYS HA H 61 4.390 4.390 4.302 0.088 25575
3037 1 10 . 1 1 61 61 LYS CA C 61 55.540 55.540 56.102 -0.562 25575
3038 1 10 . 1 1 61 61 LYS CB C 61 30.050 30.050 30.812 -0.762 25575
3039 1 10 . 1 1 62 62 LEU N N 62 120.000 120.000 122.701 -2.701 25575
3040 1 10 . 1 1 62 62 LEU HA H 62 5.250 5.250 5.003 0.247 25575
3041 1 10 . 1 1 62 62 LEU CA C 62 53.080 53.080 54.046 -0.966 25575
3042 1 10 . 1 1 62 62 LEU CB C 62 45.760 45.760 41.873 3.887 25575
3043 1 10 . 1 1 62 62 LEU H H 62 7.470 7.470 7.499 -0.029 25575
3044 1 10 . 1 1 63 63 ASP N N 63 121.730 121.730 123.805 -2.075 25575
3045 1 10 . 1 1 63 63 ASP HA H 63 4.860 4.860 4.844 0.016 25575
3046 1 10 . 1 1 63 63 ASP CA C 63 51.890 51.890 53.220 -1.330 25575
3047 1 10 . 1 1 63 63 ASP CB C 63 44.910 44.910 43.608 1.302 25575
3048 1 10 . 1 1 63 63 ASP H H 63 8.620 8.620 8.365 0.255 25575
3049 1 10 . 1 1 64 64 ILE N N 64 118.120 118.120 119.044 -0.924 25575
3050 1 10 . 1 1 64 64 ILE HA H 64 4.210 4.210 4.328 -0.118 25575
3051 1 10 . 1 1 64 64 ILE CA C 64 60.430 60.430 58.881 1.549 25575
3052 1 10 . 1 1 64 64 ILE CB C 64 40.420 40.420 39.154 1.266 25575
3053 1 10 . 1 1 64 64 ILE H H 64 8.650 8.650 8.166 0.484 25575
3054 1 10 . 1 1 65 65 ASP N N 65 124.550 124.550 128.116 -3.566 25575
3055 1 10 . 1 1 65 65 ASP HA H 65 4.570 4.570 4.544 0.026 25575
3056 1 10 . 1 1 65 65 ASP CA C 65 53.310 53.310 53.937 -0.627 25575
3057 1 10 . 1 1 65 65 ASP CB C 65 40.440 40.440 41.427 -0.987 25575
3058 1 10 . 1 1 65 65 ASP H H 65 8.630 8.630 8.726 -0.096 25575
3059 1 10 . 1 1 66 66 LYS N N 66 125.970 125.970 126.231 -0.261 25575
3060 1 10 . 1 1 66 66 LYS HA H 66 4.040 4.040 4.226 -0.186 25575
3061 1 10 . 1 1 66 66 LYS CA C 66 58.140 58.140 57.483 0.658 25575
3062 1 10 . 1 1 66 66 LYS CB C 66 31.990 31.990 32.189 -0.199 25575
3063 1 10 . 1 1 66 66 LYS H H 66 8.590 8.590 8.598 -0.008 25575
3064 1 10 . 1 1 67 67 SER N N 67 114.980 114.980 116.030 -1.050 25575
3065 1 10 . 1 1 67 67 SER HA H 67 4.320 4.320 4.216 0.104 25575
3066 1 10 . 1 1 67 67 SER CA C 67 60.330 60.330 61.067 -0.737 25575
3067 1 10 . 1 1 67 67 SER CB C 67 63.710 63.710 63.363 0.347 25575
3068 1 10 . 1 1 67 67 SER H H 67 8.760 8.760 8.826 -0.066 25575
3069 1 10 . 1 1 68 68 VAL HA H 68 4.250 4.250 4.071 0.179 25575
3070 1 10 . 1 1 68 68 VAL CA C 68 62.150 62.150 61.994 0.156 25575
3071 1 10 . 1 1 68 68 VAL CB C 68 31.900 31.900 31.774 0.126 25575
3072 1 10 . 1 1 69 69 ARG CA C 69 56.960 56.960 57.399 -0.439 25575
3073 1 10 . 1 1 70 70 HIS N N 70 116.270 116.270 113.237 3.033 25575
3074 1 10 . 1 1 70 70 HIS HA H 70 4.760 4.760 4.829 -0.069 25575
3075 1 10 . 1 1 70 70 HIS CA C 70 55.360 55.360 53.549 1.811 25575
3076 1 10 . 1 1 70 70 HIS CB C 70 33.100 33.100 31.549 1.551 25575
3077 1 10 . 1 1 70 70 HIS H H 70 7.390 7.390 8.099 -0.709 25575
3078 1 10 . 1 1 71 71 LEU N N 71 120.200 120.200 123.847 -3.647 25575
3079 1 10 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.544 0.516 25575
3080 1 10 . 1 1 71 71 LEU CA C 71 54.070 54.070 54.036 0.034 25575
3081 1 10 . 1 1 71 71 LEU CB C 71 42.710 42.710 39.979 2.731 25575
3082 1 10 . 1 1 71 71 LEU H H 71 7.970 7.970 8.683 -0.713 25575
3083 1 10 . 1 1 72 72 TYR HA H 72 5.030 5.030 4.848 0.182 25575
3084 1 10 . 1 1 72 72 TYR CA C 72 59.990 59.990 57.741 2.249 25575
3085 1 10 . 1 1 72 72 TYR CB C 72 39.440 39.440 40.502 -1.062 25575
3086 1 10 . 1 1 73 73 ILE N N 73 112.940 112.940 114.419 -1.479 25575
3087 1 10 . 1 1 73 73 ILE HA H 73 6.080 6.080 4.874 1.206 25575
3088 1 10 . 1 1 73 73 ILE CA C 73 58.090 58.090 58.460 -0.370 25575
3089 1 10 . 1 1 73 73 ILE CB C 73 41.820 41.820 42.427 -0.607 25575
3090 1 10 . 1 1 73 73 ILE H H 73 8.450 8.450 8.171 0.279 25575
3091 1 10 . 1 1 74 74 CYS N N 74 124.730 124.730 118.491 6.239 25575
3092 1 10 . 1 1 74 74 CYS HA H 74 5.080 5.080 5.165 -0.085 25575
3093 1 10 . 1 1 74 74 CYS CA C 74 57.670 57.670 57.103 0.567 25575
3094 1 10 . 1 1 74 74 CYS CB C 74 33.330 33.330 30.669 2.661 25575
3095 1 10 . 1 1 74 74 CYS H H 74 9.830 9.830 8.522 1.308 25575
3096 1 10 . 1 1 75 75 ASP N N 75 120.990 120.990 122.275 -1.285 25575
3097 1 10 . 1 1 75 75 ASP HA H 75 4.590 4.590 4.347 0.243 25575
3098 1 10 . 1 1 75 75 ASP CA C 75 57.320 57.320 57.348 -0.028 25575
3099 1 10 . 1 1 75 75 ASP CB C 75 39.670 39.670 40.229 -0.559 25575
3100 1 10 . 1 1 75 75 ASP H H 75 9.090 9.090 8.907 0.183 25575
3101 1 10 . 1 1 76 76 PHE N N 76 122.470 122.470 121.707 0.763 25575
3102 1 10 . 1 1 76 76 PHE HA H 76 4.230 4.230 4.206 0.024 25575
3103 1 10 . 1 1 76 76 PHE CA C 76 62.030 62.030 61.373 0.657 25575
3104 1 10 . 1 1 76 76 PHE CB C 76 38.190 38.190 39.115 -0.925 25575
3105 1 10 . 1 1 76 76 PHE H H 76 8.330 8.330 8.115 0.215 25575
3106 1 10 . 1 1 77 77 HIS N N 77 124.580 124.580 118.042 6.538 25575
3107 1 10 . 1 1 77 77 HIS HA H 77 4.280 4.280 4.237 0.043 25575
3108 1 10 . 1 1 77 77 HIS CA C 77 63.880 63.880 59.615 4.265 25575
3109 1 10 . 1 1 77 77 HIS CB C 77 29.600 29.600 30.065 -0.465 25575
3110 1 10 . 1 1 77 77 HIS H H 77 10.300 10.300 7.865 2.435 25575
3111 1 10 . 1 1 78 78 LYS N N 78 122.930 122.930 120.257 2.673 25575
3112 1 10 . 1 1 78 78 LYS HA H 78 3.860 3.860 3.956 -0.096 25575
3113 1 10 . 1 1 78 78 LYS CA C 78 60.550 60.550 59.811 0.739 25575
3114 1 10 . 1 1 78 78 LYS CB C 78 32.040 32.040 32.330 -0.290 25575
3115 1 10 . 1 1 78 78 LYS H H 78 8.960 8.960 8.391 0.569 25575
3116 1 10 . 1 1 79 79 ASN N N 79 116.670 116.670 118.111 -1.441 25575
3117 1 10 . 1 1 79 79 ASN HA H 79 4.420 4.420 4.506 -0.086 25575
3118 1 10 . 1 1 79 79 ASN CA C 79 56.030 56.030 56.193 -0.163 25575
3119 1 10 . 1 1 79 79 ASN CB C 79 38.100 38.100 38.638 -0.538 25575
3120 1 10 . 1 1 79 79 ASN H H 79 8.230 8.230 7.940 0.290 25575
3121 1 10 . 1 1 80 80 PHE N N 80 122.600 122.600 121.666 0.934 25575
3122 1 10 . 1 1 80 80 PHE HA H 80 4.180 4.180 4.072 0.108 25575
3123 1 10 . 1 1 80 80 PHE CA C 80 60.700 60.700 61.463 -0.763 25575
3124 1 10 . 1 1 80 80 PHE CB C 80 39.840 39.840 38.954 0.886 25575
3125 1 10 . 1 1 80 80 PHE H H 80 8.200 8.200 8.247 -0.047 25575
3126 1 10 . 1 1 81 81 ILE N N 81 118.240 118.240 118.183 0.057 25575
3127 1 10 . 1 1 81 81 ILE HA H 81 3.320 3.320 3.408 -0.088 25575
3128 1 10 . 1 1 81 81 ILE CA C 81 65.160 65.160 65.276 -0.116 25575
3129 1 10 . 1 1 81 81 ILE CB C 81 38.440 38.440 37.722 0.718 25575
3130 1 10 . 1 1 81 81 ILE H H 81 8.520 8.520 8.120 0.400 25575
3131 1 10 . 1 1 82 82 GLN N N 82 116.370 116.370 118.722 -2.352 25575
3132 1 10 . 1 1 82 82 GLN HA H 82 4.100 4.100 3.923 0.177 25575
3133 1 10 . 1 1 82 82 GLN CA C 82 57.710 57.710 58.520 -0.810 25575
3134 1 10 . 1 1 82 82 GLN CB C 82 28.710 28.710 27.936 0.774 25575
3135 1 10 . 1 1 82 82 GLN H H 82 7.670 7.670 7.841 -0.171 25575
3136 1 10 . 1 1 83 83 SER N N 83 114.440 114.440 115.434 -0.994 25575
3137 1 10 . 1 1 83 83 SER HA H 83 4.300 4.300 4.143 0.157 25575
3138 1 10 . 1 1 83 83 SER CA C 83 60.130 60.130 61.764 -1.633 25575
3139 1 10 . 1 1 83 83 SER CB C 83 63.570 63.570 63.016 0.555 25575
3140 1 10 . 1 1 83 83 SER H H 83 7.810 7.810 8.602 -0.792 25575
3141 1 10 . 1 1 84 84 VAL N N 84 120.750 120.750 117.331 3.419 25575
3142 1 10 . 1 1 84 84 VAL HA H 84 3.970 3.970 3.901 0.069 25575
3143 1 10 . 1 1 84 84 VAL CA C 84 63.430 63.430 64.786 -1.356 25575
3144 1 10 . 1 1 84 84 VAL CB C 84 31.960 31.960 30.751 1.209 25575
3145 1 10 . 1 1 84 84 VAL H H 84 7.790 7.790 7.270 0.520 25575
3146 1 10 . 1 1 85 85 ARG N N 85 122.090 122.090 119.922 2.168 25575
3147 1 10 . 1 1 85 85 ARG HA H 85 4.240 4.240 4.038 0.202 25575
3148 1 10 . 1 1 85 85 ARG CA C 85 56.850 56.850 58.567 -1.717 25575
3149 1 10 . 1 1 85 85 ARG CB C 85 30.720 30.720 30.202 0.518 25575
3150 1 10 . 1 1 85 85 ARG H H 85 8.090 8.090 8.193 -0.103 25575
3151 1 10 . 1 1 86 86 ASN N N 86 118.510 118.510 117.293 1.217 25575
3152 1 10 . 1 1 86 86 ASN HA H 86 4.690 4.690 4.666 0.024 25575
3153 1 10 . 1 1 86 86 ASN CA C 86 53.380 53.380 54.757 -1.377 25575
3154 1 10 . 1 1 86 86 ASN CB C 86 38.950 38.950 38.971 -0.021 25575
3155 1 10 . 1 1 86 86 ASN H H 86 8.220 8.220 8.007 0.213 25575
3156 1 10 . 1 1 87 87 LYS N N 87 121.600 121.600 121.422 0.178 25575
3157 1 10 . 1 1 87 87 LYS HA H 87 4.310 4.310 4.219 0.091 25575
3158 1 10 . 1 1 87 87 LYS CA C 87 56.590 56.590 55.956 0.634 25575
3159 1 10 . 1 1 87 87 LYS CB C 87 32.870 32.870 30.195 2.675 25575
3160 1 10 . 1 1 87 87 LYS H H 87 8.150 8.150 7.936 0.214 25575
3161 1 10 . 1 1 88 88 ARG N N 88 121.920 121.920 119.002 2.918 25575
3162 1 10 . 1 1 88 88 ARG HA H 88 4.330 4.330 4.505 -0.175 25575
3163 1 10 . 1 1 88 88 ARG CA C 88 56.110 56.110 54.891 1.220 25575
3164 1 10 . 1 1 88 88 ARG CB C 88 30.870 30.870 31.005 -0.135 25575
3165 1 10 . 1 1 88 88 ARG H H 88 8.250 8.250 7.925 0.325 25575
3166 1 10 . 1 1 89 89 LYS N N 89 123.020 123.020 122.458 0.562 25575
3167 1 10 . 1 1 89 89 LYS HA H 89 4.320 4.320 4.079 0.241 25575
3168 1 10 . 1 1 89 89 LYS CA C 89 56.330 56.330 56.594 -0.264 25575
3169 1 10 . 1 1 89 89 LYS CB C 89 33.140 33.140 32.378 0.762 25575
3170 1 10 . 1 1 89 89 LYS H H 89 8.320 8.320 8.533 -0.213 25575
3171 1 10 . 1 1 90 90 ARG N N 90 122.970 122.970 124.535 -1.565 25575
3172 1 10 . 1 1 90 90 ARG HA H 90 4.360 4.360 4.121 0.239 25575
3173 1 10 . 1 1 90 90 ARG CA C 90 56.100 56.100 57.573 -1.473 25575
3174 1 10 . 1 1 90 90 ARG CB C 90 31.210 31.210 30.668 0.542 25575
3175 1 10 . 1 1 90 90 ARG H H 90 8.360 8.360 8.544 -0.184 25575
3176 1 10 . 1 1 91 91 LYS N N 91 123.680 123.680 122.964 0.716 25575
3177 1 10 . 1 1 91 91 LYS HA H 91 4.380 4.380 4.437 -0.057 25575
3178 1 10 . 1 1 91 91 LYS CA C 91 56.620 56.620 56.826 -0.206 25575
3179 1 10 . 1 1 91 91 LYS CB C 91 33.070 33.070 33.608 -0.538 25575
3180 1 10 . 1 1 91 91 LYS H H 91 8.450 8.450 8.754 -0.304 25575
3181 1 11 . 1 1 24 24 SER HA H 24 4.330 4.330 4.235 0.095 25575
3182 1 11 . 1 1 24 24 SER CA C 24 58.130 58.130 60.129 -1.999 25575
3183 1 11 . 1 1 24 24 SER CB C 24 63.870 63.870 63.399 0.471 25575
3184 1 11 . 1 1 25 25 TYR N N 25 122.160 122.160 121.850 0.310 25575
3185 1 11 . 1 1 25 25 TYR HA H 25 4.530 4.530 4.611 -0.081 25575
3186 1 11 . 1 1 25 25 TYR CA C 25 58.420 58.420 58.072 0.348 25575
3187 1 11 . 1 1 25 25 TYR CB C 25 38.570 38.570 37.842 0.728 25575
3188 1 11 . 1 1 25 25 TYR H H 25 8.310 8.310 8.056 0.254 25575
3189 1 11 . 1 1 26 26 GLY N N 26 111.370 111.370 111.987 -0.617 25575
3190 1 11 . 1 1 26 26 GLY CA C 26 45.330 45.330 45.396 -0.066 25575
3191 1 11 . 1 1 26 26 GLY H H 26 8.300 8.300 7.998 0.302 25575
3192 1 11 . 1 1 27 27 GLN N N 27 118.910 118.910 124.004 -5.094 25575
3193 1 11 . 1 1 27 27 GLN HA H 27 4.510 4.510 4.289 0.221 25575
3194 1 11 . 1 1 27 27 GLN CA C 27 55.240 55.240 54.731 0.509 25575
3195 1 11 . 1 1 27 27 GLN CB C 27 29.800 29.800 27.816 1.984 25575
3196 1 11 . 1 1 27 27 GLN H H 27 8.050 8.050 8.079 -0.029 25575
3197 1 11 . 1 1 28 28 SER N N 28 119.460 119.460 116.245 3.215 25575
3198 1 11 . 1 1 28 28 SER HA H 28 4.810 4.810 5.060 -0.250 25575
3199 1 11 . 1 1 28 28 SER CA C 28 57.710 57.710 56.845 0.865 25575
3200 1 11 . 1 1 28 28 SER CB C 28 65.530 65.530 66.330 -0.800 25575
3201 1 11 . 1 1 28 28 SER H H 28 8.800 8.800 7.905 0.895 25575
3202 1 11 . 1 1 29 29 CYS N N 29 122.160 122.160 120.535 1.625 25575
3203 1 11 . 1 1 29 29 CYS HA H 29 4.130 4.130 4.510 -0.380 25575
3204 1 11 . 1 1 29 29 CYS CA C 29 60.620 60.620 61.111 -0.491 25575
3205 1 11 . 1 1 29 29 CYS CB C 29 32.770 32.770 28.937 3.833 25575
3206 1 11 . 1 1 29 29 CYS H H 29 8.390 8.390 8.529 -0.139 25575
3207 1 11 . 1 1 30 30 CYS N N 30 122.320 122.320 122.866 -0.546 25575
3208 1 11 . 1 1 30 30 CYS HA H 30 4.530 4.530 4.940 -0.410 25575
3209 1 11 . 1 1 30 30 CYS CA C 30 58.810 58.810 56.253 2.557 25575
3210 1 11 . 1 1 30 30 CYS CB C 30 28.910 28.910 27.488 1.421 25575
3211 1 11 . 1 1 30 30 CYS H H 30 8.340 8.340 8.648 -0.308 25575
3212 1 11 . 1 1 31 31 LEU N N 31 122.390 122.390 122.379 0.011 25575
3213 1 11 . 1 1 31 31 LEU HA H 31 4.640 4.640 5.171 -0.531 25575
3214 1 11 . 1 1 31 31 LEU CA C 31 55.440 55.440 53.792 1.648 25575
3215 1 11 . 1 1 31 31 LEU CB C 31 43.490 43.490 43.605 -0.115 25575
3216 1 11 . 1 1 31 31 LEU H H 31 8.460 8.460 7.186 1.274 25575
3217 1 11 . 1 1 32 32 ILE N N 32 118.890 118.890 118.328 0.562 25575
3218 1 11 . 1 1 32 32 ILE HA H 32 4.200 4.200 4.758 -0.558 25575
3219 1 11 . 1 1 32 32 ILE CA C 32 60.440 60.440 60.397 0.043 25575
3220 1 11 . 1 1 32 32 ILE CB C 32 39.890 39.890 41.736 -1.846 25575
3221 1 11 . 1 1 32 32 ILE H H 32 8.680 8.680 8.076 0.604 25575
3222 1 11 . 1 1 33 33 GLU N N 33 128.400 128.400 126.788 1.612 25575
3223 1 11 . 1 1 33 33 GLU HA H 33 5.080 5.080 5.235 -0.155 25575
3224 1 11 . 1 1 33 33 GLU CA C 33 54.120 54.120 54.524 -0.404 25575
3225 1 11 . 1 1 33 33 GLU CB C 33 32.080 32.080 33.063 -0.983 25575
3226 1 11 . 1 1 33 33 GLU H H 33 8.640 8.640 8.733 -0.093 25575
3227 1 11 . 1 1 34 34 ASP N N 34 130.390 130.390 127.506 2.884 25575
3228 1 11 . 1 1 34 34 ASP HA H 34 4.310 4.310 4.271 0.039 25575
3229 1 11 . 1 1 34 34 ASP CA C 34 55.150 55.150 55.944 -0.794 25575
3230 1 11 . 1 1 34 34 ASP CB C 34 40.050 40.050 40.442 -0.392 25575
3231 1 11 . 1 1 34 34 ASP H H 34 9.540 9.540 8.951 0.589 25575
3232 1 11 . 1 1 35 35 GLY N N 35 126.620 126.620 103.975 22.645 25575
3233 1 11 . 1 1 35 35 GLY CA C 35 45.480 45.480 44.790 0.690 25575
3234 1 11 . 1 1 35 35 GLY H H 35 8.370 8.370 8.175 0.195 25575
3235 1 11 . 1 1 36 36 GLU N N 36 120.860 120.860 122.247 -1.387 25575
3236 1 11 . 1 1 36 36 GLU HA H 36 4.670 4.670 4.264 0.406 25575
3237 1 11 . 1 1 36 36 GLU CA C 36 54.350 54.350 55.699 -1.349 25575
3238 1 11 . 1 1 36 36 GLU CB C 36 31.630 31.630 30.292 1.338 25575
3239 1 11 . 1 1 36 36 GLU H H 36 7.820 7.820 7.765 0.055 25575
3240 1 11 . 1 1 37 37 ARG N N 37 129.790 129.790 128.016 1.774 25575
3241 1 11 . 1 1 37 37 ARG HA H 37 4.200 4.200 4.393 -0.193 25575
3242 1 11 . 1 1 37 37 ARG CA C 37 56.440 56.440 54.807 1.633 25575
3243 1 11 . 1 1 37 37 ARG CB C 37 29.710 29.710 29.324 0.386 25575
3244 1 11 . 1 1 37 37 ARG H H 37 8.930 8.930 8.515 0.415 25575
3245 1 11 . 1 1 38 38 CYS N N 38 130.950 130.950 127.510 3.440 25575
3246 1 11 . 1 1 38 38 CYS HA H 38 4.450 4.450 4.326 0.124 25575
3247 1 11 . 1 1 38 38 CYS CA C 38 60.560 60.560 60.732 -0.172 25575
3248 1 11 . 1 1 38 38 CYS CB C 38 31.250 31.250 27.795 3.455 25575
3249 1 11 . 1 1 38 38 CYS H H 38 9.050 9.050 8.319 0.731 25575
3250 1 11 . 1 1 39 39 VAL N N 39 118.270 118.270 120.253 -1.983 25575
3251 1 11 . 1 1 39 39 VAL HA H 39 4.710 4.710 4.474 0.236 25575
3252 1 11 . 1 1 39 39 VAL CA C 39 60.340 60.340 60.498 -0.158 25575
3253 1 11 . 1 1 39 39 VAL CB C 39 31.290 31.290 32.177 -0.887 25575
3254 1 11 . 1 1 39 39 VAL H H 39 8.060 8.060 8.093 -0.033 25575
3255 1 11 . 1 1 40 40 ARG N N 40 127.360 127.360 122.896 4.464 25575
3256 1 11 . 1 1 40 40 ARG HA H 40 4.430 4.430 4.308 0.122 25575
3257 1 11 . 1 1 40 40 ARG CA C 40 56.150 56.150 55.393 0.757 25575
3258 1 11 . 1 1 40 40 ARG CB C 40 29.210 29.210 29.430 -0.220 25575
3259 1 11 . 1 1 40 40 ARG H H 40 8.950 8.950 7.930 1.020 25575
3260 1 11 . 1 1 41 41 PRO HA H 41 4.430 4.430 4.464 -0.034 25575
3261 1 11 . 1 1 41 41 PRO CA C 41 62.690 62.690 62.845 -0.155 25575
3262 1 11 . 1 1 41 41 PRO CB C 41 32.010 32.010 32.044 -0.034 25575
3263 1 11 . 1 1 42 42 ALA N N 42 124.260 124.260 127.309 -3.049 25575
3264 1 11 . 1 1 42 42 ALA HA H 42 3.620 3.620 4.497 -0.877 25575
3265 1 11 . 1 1 42 42 ALA CA C 42 52.930 52.930 51.792 1.138 25575
3266 1 11 . 1 1 42 42 ALA CB C 42 19.130 19.130 19.355 -0.226 25575
3267 1 11 . 1 1 42 42 ALA H H 42 8.410 8.410 8.237 0.173 25575
3268 1 11 . 1 1 43 43 GLY N N 43 112.690 112.690 111.047 1.643 25575
3269 1 11 . 1 1 43 43 GLY CA C 43 44.240 44.240 44.033 0.207 25575
3270 1 11 . 1 1 43 43 GLY H H 43 8.090 8.090 7.979 0.111 25575
3271 1 11 . 1 1 44 44 ASN N N 44 116.980 116.980 119.914 -2.934 25575
3272 1 11 . 1 1 44 44 ASN HA H 44 4.690 4.690 4.653 0.037 25575
3273 1 11 . 1 1 44 44 ASN CA C 44 53.420 53.420 53.456 -0.036 25575
3274 1 11 . 1 1 44 44 ASN CB C 44 39.370 39.370 36.672 2.698 25575
3275 1 11 . 1 1 44 44 ASN H H 44 8.720 8.720 8.666 0.054 25575
3276 1 11 . 1 1 45 45 ALA N N 45 124.240 124.240 123.548 0.692 25575
3277 1 11 . 1 1 45 45 ALA HA H 45 4.640 4.640 4.734 -0.094 25575
3278 1 11 . 1 1 45 45 ALA CA C 45 52.240 52.240 51.245 0.995 25575
3279 1 11 . 1 1 45 45 ALA CB C 45 19.540 19.540 21.763 -2.223 25575
3280 1 11 . 1 1 45 45 ALA H H 45 8.770 8.770 8.171 0.599 25575
3281 1 11 . 1 1 46 46 SER N N 46 111.670 111.670 117.690 -6.020 25575
3282 1 11 . 1 1 46 46 SER HA H 46 5.300 5.300 4.804 0.496 25575
3283 1 11 . 1 1 46 46 SER CA C 46 56.580 56.580 57.237 -0.657 25575
3284 1 11 . 1 1 46 46 SER CB C 46 66.490 66.490 65.724 0.766 25575
3285 1 11 . 1 1 46 46 SER H H 46 8.060 8.060 8.393 -0.333 25575
3286 1 11 . 1 1 47 47 PHE HA H 47 4.520 4.520 4.393 0.127 25575
3287 1 11 . 1 1 47 47 PHE CA C 47 57.000 57.000 57.538 -0.537 25575
3288 1 11 . 1 1 47 47 PHE CB C 47 38.360 38.360 38.126 0.234 25575
3289 1 11 . 1 1 48 48 SER N N 48 116.970 116.970 119.085 -2.115 25575
3290 1 11 . 1 1 48 48 SER HA H 48 4.440 4.440 4.385 0.055 25575
3291 1 11 . 1 1 48 48 SER CA C 48 56.950 56.950 57.889 -0.939 25575
3292 1 11 . 1 1 48 48 SER CB C 48 65.810 65.810 63.754 2.056 25575
3293 1 11 . 1 1 48 48 SER H H 48 7.100 7.100 7.752 -0.652 25575
3294 1 11 . 1 1 49 49 LYS N N 49 120.650 120.650 126.273 -5.623 25575
3295 1 11 . 1 1 49 49 LYS HA H 49 3.900 3.900 3.764 0.136 25575
3296 1 11 . 1 1 49 49 LYS CA C 49 59.570 59.570 59.544 0.026 25575
3297 1 11 . 1 1 49 49 LYS CB C 49 31.790 31.790 32.343 -0.553 25575
3298 1 11 . 1 1 49 49 LYS H H 49 8.770 8.770 8.954 -0.184 25575
3299 1 11 . 1 1 50 50 ARG N N 50 118.240 118.240 116.618 1.622 25575
3300 1 11 . 1 1 50 50 ARG HA H 50 4.040 4.040 3.997 0.043 25575
3301 1 11 . 1 1 50 50 ARG CA C 50 59.070 59.070 58.485 0.585 25575
3302 1 11 . 1 1 50 50 ARG CB C 50 30.080 30.080 29.345 0.735 25575
3303 1 11 . 1 1 50 50 ARG H H 50 8.040 8.040 8.103 -0.063 25575
3304 1 11 . 1 1 51 51 VAL N N 51 121.680 121.680 119.688 1.992 25575
3305 1 11 . 1 1 51 51 VAL HA H 51 3.590 3.590 3.512 0.078 25575
3306 1 11 . 1 1 51 51 VAL CA C 51 65.940 65.940 65.478 0.462 25575
3307 1 11 . 1 1 51 51 VAL CB C 51 31.620 31.620 31.121 0.499 25575
3308 1 11 . 1 1 51 51 VAL H H 51 7.350 7.350 8.152 -0.802 25575
3309 1 11 . 1 1 52 52 GLN N N 52 119.680 119.680 117.779 1.901 25575
3310 1 11 . 1 1 52 52 GLN HA H 52 3.570 3.570 3.808 -0.238 25575
3311 1 11 . 1 1 52 52 GLN CA C 52 59.210 59.210 59.024 0.186 25575
3312 1 11 . 1 1 52 52 GLN CB C 52 28.620 28.620 28.195 0.425 25575
3313 1 11 . 1 1 52 52 GLN H H 52 8.210 8.210 7.781 0.429 25575
3314 1 11 . 1 1 53 53 LYS N N 53 118.080 118.080 119.468 -1.388 25575
3315 1 11 . 1 1 53 53 LYS HA H 53 4.160 4.160 3.974 0.186 25575
3316 1 11 . 1 1 53 53 LYS CA C 53 58.670 58.670 59.013 -0.343 25575
3317 1 11 . 1 1 53 53 LYS CB C 53 32.120 32.120 31.768 0.352 25575
3318 1 11 . 1 1 53 53 LYS H H 53 7.960 7.960 7.643 0.317 25575
3319 1 11 . 1 1 54 54 SER N N 54 115.450 115.450 114.689 0.761 25575
3320 1 11 . 1 1 54 54 SER HA H 54 4.370 4.370 4.176 0.194 25575
3321 1 11 . 1 1 54 54 SER CA C 54 61.330 61.330 61.200 0.130 25575
3322 1 11 . 1 1 54 54 SER CB C 54 63.690 63.690 62.768 0.922 25575
3323 1 11 . 1 1 54 54 SER H H 54 7.800 7.800 7.553 0.247 25575
3324 1 11 . 1 1 55 55 ILE N N 55 117.670 117.670 121.592 -3.922 25575
3325 1 11 . 1 1 55 55 ILE HA H 55 4.060 4.060 3.621 0.439 25575
3326 1 11 . 1 1 55 55 ILE CA C 55 63.330 63.330 65.154 -1.825 25575
3327 1 11 . 1 1 55 55 ILE CB C 55 38.980 38.980 37.904 1.076 25575
3328 1 11 . 1 1 55 55 ILE H H 55 7.840 7.840 7.626 0.214 25575
3329 1 11 . 1 1 56 56 SER N N 56 115.650 115.650 115.376 0.274 25575
3330 1 11 . 1 1 56 56 SER HA H 56 4.490 4.490 4.048 0.442 25575
3331 1 11 . 1 1 56 56 SER CA C 56 60.220 60.220 61.387 -1.167 25575
3332 1 11 . 1 1 56 56 SER CB C 56 63.000 63.000 62.992 0.008 25575
3333 1 11 . 1 1 56 56 SER H H 56 8.060 8.060 8.301 -0.241 25575
3334 1 11 . 1 1 57 57 GLN N N 57 121.830 121.830 120.163 1.667 25575
3335 1 11 . 1 1 57 57 GLN HA H 57 4.200 4.200 4.153 0.047 25575
3336 1 11 . 1 1 57 57 GLN CA C 57 58.310 58.310 58.070 0.240 25575
3337 1 11 . 1 1 57 57 GLN CB C 57 28.850 28.850 28.862 -0.012 25575
3338 1 11 . 1 1 57 57 GLN H H 57 8.620 8.620 8.058 0.562 25575
3339 1 11 . 1 1 58 58 LYS N N 58 116.960 116.960 116.136 0.824 25575
3340 1 11 . 1 1 58 58 LYS HA H 58 4.290 4.290 4.410 -0.120 25575
3341 1 11 . 1 1 58 58 LYS CA C 58 56.920 56.920 55.519 1.401 25575
3342 1 11 . 1 1 58 58 LYS CB C 58 32.900 32.900 33.455 -0.555 25575
3343 1 11 . 1 1 58 58 LYS H H 58 7.950 7.950 7.358 0.592 25575
3344 1 11 . 1 1 59 59 LYS N N 59 116.960 116.960 117.214 -0.254 25575
3345 1 11 . 1 1 59 59 LYS HA H 59 4.120 4.120 3.944 0.176 25575
3346 1 11 . 1 1 59 59 LYS CA C 59 57.090 57.090 57.157 -0.067 25575
3347 1 11 . 1 1 59 59 LYS CB C 59 30.080 30.080 29.952 0.128 25575
3348 1 11 . 1 1 59 59 LYS H H 59 7.950 7.950 7.637 0.313 25575
3349 1 11 . 1 1 60 60 LEU N N 60 117.540 117.540 119.810 -2.270 25575
3350 1 11 . 1 1 60 60 LEU HA H 60 4.480 4.480 4.242 0.238 25575
3351 1 11 . 1 1 60 60 LEU CA C 60 54.500 54.500 55.489 -0.989 25575
3352 1 11 . 1 1 60 60 LEU CB C 60 42.840 42.840 42.127 0.714 25575
3353 1 11 . 1 1 60 60 LEU H H 60 7.930 7.930 7.623 0.307 25575
3354 1 11 . 1 1 61 61 LYS HA H 61 4.390 4.390 4.275 0.115 25575
3355 1 11 . 1 1 61 61 LYS CA C 61 55.540 55.540 56.051 -0.511 25575
3356 1 11 . 1 1 61 61 LYS CB C 61 30.050 30.050 30.950 -0.900 25575
3357 1 11 . 1 1 62 62 LEU N N 62 120.000 120.000 123.583 -3.583 25575
3358 1 11 . 1 1 62 62 LEU HA H 62 5.250 5.250 5.060 0.190 25575
3359 1 11 . 1 1 62 62 LEU CA C 62 53.080 53.080 53.839 -0.759 25575
3360 1 11 . 1 1 62 62 LEU CB C 62 45.760 45.760 42.229 3.531 25575
3361 1 11 . 1 1 62 62 LEU H H 62 7.470 7.470 7.693 -0.223 25575
3362 1 11 . 1 1 63 63 ASP N N 63 121.730 121.730 123.316 -1.586 25575
3363 1 11 . 1 1 63 63 ASP HA H 63 4.860 4.860 4.760 0.100 25575
3364 1 11 . 1 1 63 63 ASP CA C 63 51.890 51.890 53.038 -1.148 25575
3365 1 11 . 1 1 63 63 ASP CB C 63 44.910 44.910 43.941 0.970 25575
3366 1 11 . 1 1 63 63 ASP H H 63 8.620 8.620 8.540 0.080 25575
3367 1 11 . 1 1 64 64 ILE N N 64 118.120 118.120 118.453 -0.333 25575
3368 1 11 . 1 1 64 64 ILE HA H 64 4.210 4.210 4.433 -0.223 25575
3369 1 11 . 1 1 64 64 ILE CA C 64 60.430 60.430 58.592 1.838 25575
3370 1 11 . 1 1 64 64 ILE CB C 64 40.420 40.420 40.625 -0.205 25575
3371 1 11 . 1 1 64 64 ILE H H 64 8.650 8.650 8.072 0.578 25575
3372 1 11 . 1 1 65 65 ASP N N 65 124.550 124.550 128.406 -3.856 25575
3373 1 11 . 1 1 65 65 ASP HA H 65 4.570 4.570 4.439 0.131 25575
3374 1 11 . 1 1 65 65 ASP CA C 65 53.310 53.310 53.976 -0.666 25575
3375 1 11 . 1 1 65 65 ASP CB C 65 40.440 40.440 40.069 0.371 25575
3376 1 11 . 1 1 65 65 ASP H H 65 8.630 8.630 8.856 -0.226 25575
3377 1 11 . 1 1 66 66 LYS N N 66 125.970 125.970 123.629 2.341 25575
3378 1 11 . 1 1 66 66 LYS HA H 66 4.040 4.040 4.064 -0.024 25575
3379 1 11 . 1 1 66 66 LYS CA C 66 58.140 58.140 57.730 0.410 25575
3380 1 11 . 1 1 66 66 LYS CB C 66 31.990 31.990 31.898 0.091 25575
3381 1 11 . 1 1 66 66 LYS H H 66 8.590 8.590 8.131 0.459 25575
3382 1 11 . 1 1 67 67 SER N N 67 114.980 114.980 115.319 -0.339 25575
3383 1 11 . 1 1 67 67 SER HA H 67 4.320 4.320 4.228 0.092 25575
3384 1 11 . 1 1 67 67 SER CA C 67 60.330 60.330 61.499 -1.169 25575
3385 1 11 . 1 1 67 67 SER CB C 67 63.710 63.710 62.829 0.881 25575
3386 1 11 . 1 1 67 67 SER H H 67 8.760 8.760 8.087 0.673 25575
3387 1 11 . 1 1 68 68 VAL HA H 68 4.250 4.250 4.029 0.221 25575
3388 1 11 . 1 1 68 68 VAL CA C 68 62.150 62.150 61.947 0.203 25575
3389 1 11 . 1 1 68 68 VAL CB C 68 31.900 31.900 31.672 0.227 25575
3390 1 11 . 1 1 69 69 ARG CA C 69 56.960 56.960 57.450 -0.490 25575
3391 1 11 . 1 1 70 70 HIS N N 70 116.270 116.270 114.218 2.052 25575
3392 1 11 . 1 1 70 70 HIS HA H 70 4.760 4.760 4.717 0.043 25575
3393 1 11 . 1 1 70 70 HIS CA C 70 55.360 55.360 54.082 1.278 25575
3394 1 11 . 1 1 70 70 HIS CB C 70 33.100 33.100 31.451 1.649 25575
3395 1 11 . 1 1 70 70 HIS H H 70 7.390 7.390 8.039 -0.649 25575
3396 1 11 . 1 1 71 71 LEU N N 71 120.200 120.200 122.331 -2.131 25575
3397 1 11 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.562 0.498 25575
3398 1 11 . 1 1 71 71 LEU CA C 71 54.070 54.070 53.904 0.166 25575
3399 1 11 . 1 1 71 71 LEU CB C 71 42.710 42.710 41.469 1.241 25575
3400 1 11 . 1 1 71 71 LEU H H 71 7.970 7.970 8.380 -0.410 25575
3401 1 11 . 1 1 72 72 TYR HA H 72 5.030 5.030 5.022 0.008 25575
3402 1 11 . 1 1 72 72 TYR CA C 72 59.990 59.990 57.272 2.718 25575
3403 1 11 . 1 1 72 72 TYR CB C 72 39.440 39.440 41.346 -1.906 25575
3404 1 11 . 1 1 73 73 ILE N N 73 112.940 112.940 115.269 -2.329 25575
3405 1 11 . 1 1 73 73 ILE HA H 73 6.080 6.080 4.898 1.182 25575
3406 1 11 . 1 1 73 73 ILE CA C 73 58.090 58.090 58.357 -0.267 25575
3407 1 11 . 1 1 73 73 ILE CB C 73 41.820 41.820 42.552 -0.732 25575
3408 1 11 . 1 1 73 73 ILE H H 73 8.450 8.450 8.307 0.143 25575
3409 1 11 . 1 1 74 74 CYS N N 74 124.730 124.730 119.109 5.621 25575
3410 1 11 . 1 1 74 74 CYS HA H 74 5.080 5.080 5.017 0.063 25575
3411 1 11 . 1 1 74 74 CYS CA C 74 57.670 57.670 57.894 -0.224 25575
3412 1 11 . 1 1 74 74 CYS CB C 74 33.330 33.330 29.309 4.021 25575
3413 1 11 . 1 1 74 74 CYS H H 74 9.830 9.830 8.545 1.285 25575
3414 1 11 . 1 1 75 75 ASP N N 75 120.990 120.990 123.467 -2.477 25575
3415 1 11 . 1 1 75 75 ASP HA H 75 4.590 4.590 4.408 0.182 25575
3416 1 11 . 1 1 75 75 ASP CA C 75 57.320 57.320 58.449 -1.129 25575
3417 1 11 . 1 1 75 75 ASP CB C 75 39.670 39.670 40.817 -1.147 25575
3418 1 11 . 1 1 75 75 ASP H H 75 9.090 9.090 9.194 -0.104 25575
3419 1 11 . 1 1 76 76 PHE N N 76 122.470 122.470 119.310 3.160 25575
3420 1 11 . 1 1 76 76 PHE HA H 76 4.230 4.230 4.131 0.099 25575
3421 1 11 . 1 1 76 76 PHE CA C 76 62.030 62.030 62.047 -0.017 25575
3422 1 11 . 1 1 76 76 PHE CB C 76 38.190 38.190 39.065 -0.875 25575
3423 1 11 . 1 1 76 76 PHE H H 76 8.330 8.330 8.283 0.047 25575
3424 1 11 . 1 1 77 77 HIS N N 77 124.580 124.580 117.536 7.044 25575
3425 1 11 . 1 1 77 77 HIS HA H 77 4.280 4.280 4.485 -0.205 25575
3426 1 11 . 1 1 77 77 HIS CA C 77 63.880 63.880 59.053 4.827 25575
3427 1 11 . 1 1 77 77 HIS CB C 77 29.600 29.600 30.035 -0.435 25575
3428 1 11 . 1 1 77 77 HIS H H 77 10.300 10.300 7.805 2.495 25575
3429 1 11 . 1 1 78 78 LYS N N 78 122.930 122.930 120.050 2.880 25575
3430 1 11 . 1 1 78 78 LYS HA H 78 3.860 3.860 4.019 -0.159 25575
3431 1 11 . 1 1 78 78 LYS CA C 78 60.550 60.550 59.715 0.835 25575
3432 1 11 . 1 1 78 78 LYS CB C 78 32.040 32.040 32.524 -0.484 25575
3433 1 11 . 1 1 78 78 LYS H H 78 8.960 8.960 8.389 0.571 25575
3434 1 11 . 1 1 79 79 ASN N N 79 116.670 116.670 117.509 -0.839 25575
3435 1 11 . 1 1 79 79 ASN HA H 79 4.420 4.420 4.626 -0.206 25575
3436 1 11 . 1 1 79 79 ASN CA C 79 56.030 56.030 55.066 0.964 25575
3437 1 11 . 1 1 79 79 ASN CB C 79 38.100 38.100 38.252 -0.152 25575
3438 1 11 . 1 1 79 79 ASN H H 79 8.230 8.230 8.097 0.133 25575
3439 1 11 . 1 1 80 80 PHE N N 80 122.600 122.600 122.303 0.297 25575
3440 1 11 . 1 1 80 80 PHE HA H 80 4.180 4.180 4.232 -0.052 25575
3441 1 11 . 1 1 80 80 PHE CA C 80 60.700 60.700 61.392 -0.692 25575
3442 1 11 . 1 1 80 80 PHE CB C 80 39.840 39.840 39.149 0.691 25575
3443 1 11 . 1 1 80 80 PHE H H 80 8.200 8.200 8.321 -0.121 25575
3444 1 11 . 1 1 81 81 ILE N N 81 118.240 118.240 117.204 1.036 25575
3445 1 11 . 1 1 81 81 ILE HA H 81 3.320 3.320 3.555 -0.235 25575
3446 1 11 . 1 1 81 81 ILE CA C 81 65.160 65.160 64.933 0.227 25575
3447 1 11 . 1 1 81 81 ILE CB C 81 38.440 38.440 37.659 0.781 25575
3448 1 11 . 1 1 81 81 ILE H H 81 8.520 8.520 7.648 0.872 25575
3449 1 11 . 1 1 82 82 GLN N N 82 116.370 116.370 117.502 -1.132 25575
3450 1 11 . 1 1 82 82 GLN HA H 82 4.100 4.100 4.081 0.019 25575
3451 1 11 . 1 1 82 82 GLN CA C 82 57.710 57.710 58.330 -0.620 25575
3452 1 11 . 1 1 82 82 GLN CB C 82 28.710 28.710 28.328 0.381 25575
3453 1 11 . 1 1 82 82 GLN H H 82 7.670 7.670 7.630 0.040 25575
3454 1 11 . 1 1 83 83 SER N N 83 114.440 114.440 117.235 -2.795 25575
3455 1 11 . 1 1 83 83 SER HA H 83 4.300 4.300 4.360 -0.060 25575
3456 1 11 . 1 1 83 83 SER CA C 83 60.130 60.130 61.902 -1.772 25575
3457 1 11 . 1 1 83 83 SER CB C 83 63.570 63.570 63.148 0.422 25575
3458 1 11 . 1 1 83 83 SER H H 83 7.810 7.810 8.426 -0.616 25575
3459 1 11 . 1 1 84 84 VAL N N 84 120.750 120.750 119.854 0.896 25575
3460 1 11 . 1 1 84 84 VAL HA H 84 3.970 3.970 3.863 0.107 25575
3461 1 11 . 1 1 84 84 VAL CA C 84 63.430 63.430 64.761 -1.331 25575
3462 1 11 . 1 1 84 84 VAL CB C 84 31.960 31.960 31.167 0.793 25575
3463 1 11 . 1 1 84 84 VAL H H 84 7.790 7.790 7.662 0.128 25575
3464 1 11 . 1 1 85 85 ARG N N 85 122.090 122.090 119.336 2.754 25575
3465 1 11 . 1 1 85 85 ARG HA H 85 4.240 4.240 4.342 -0.102 25575
3466 1 11 . 1 1 85 85 ARG CA C 85 56.850 56.850 55.967 0.883 25575
3467 1 11 . 1 1 85 85 ARG CB C 85 30.720 30.720 31.064 -0.344 25575
3468 1 11 . 1 1 85 85 ARG H H 85 8.090 8.090 7.620 0.470 25575
3469 1 11 . 1 1 86 86 ASN N N 86 118.510 118.510 117.595 0.915 25575
3470 1 11 . 1 1 86 86 ASN HA H 86 4.690 4.690 4.844 -0.154 25575
3471 1 11 . 1 1 86 86 ASN CA C 86 53.380 53.380 53.009 0.371 25575
3472 1 11 . 1 1 86 86 ASN CB C 86 38.950 38.950 39.438 -0.488 25575
3473 1 11 . 1 1 86 86 ASN H H 86 8.220 8.220 7.666 0.554 25575
3474 1 11 . 1 1 87 87 LYS N N 87 121.600 121.600 117.753 3.847 25575
3475 1 11 . 1 1 87 87 LYS HA H 87 4.310 4.310 4.336 -0.026 25575
3476 1 11 . 1 1 87 87 LYS CA C 87 56.590 56.590 56.684 -0.094 25575
3477 1 11 . 1 1 87 87 LYS CB C 87 32.870 32.870 33.729 -0.859 25575
3478 1 11 . 1 1 87 87 LYS H H 87 8.150 8.150 8.293 -0.143 25575
3479 1 11 . 1 1 88 88 ARG N N 88 121.920 121.920 122.491 -0.571 25575
3480 1 11 . 1 1 88 88 ARG HA H 88 4.330 4.330 4.389 -0.059 25575
3481 1 11 . 1 1 88 88 ARG CA C 88 56.110 56.110 56.352 -0.242 25575
3482 1 11 . 1 1 88 88 ARG CB C 88 30.870 30.870 30.100 0.770 25575
3483 1 11 . 1 1 88 88 ARG H H 88 8.250 8.250 8.344 -0.094 25575
3484 1 11 . 1 1 89 89 LYS N N 89 123.020 123.020 123.420 -0.400 25575
3485 1 11 . 1 1 89 89 LYS HA H 89 4.320 4.320 4.503 -0.183 25575
3486 1 11 . 1 1 89 89 LYS CA C 89 56.330 56.330 55.746 0.584 25575
3487 1 11 . 1 1 89 89 LYS CB C 89 33.140 33.140 34.873 -1.733 25575
3488 1 11 . 1 1 89 89 LYS H H 89 8.320 8.320 8.471 -0.151 25575
3489 1 11 . 1 1 90 90 ARG N N 90 122.970 122.970 122.285 0.685 25575
3490 1 11 . 1 1 90 90 ARG HA H 90 4.360 4.360 4.511 -0.151 25575
3491 1 11 . 1 1 90 90 ARG CA C 90 56.100 56.100 56.189 -0.089 25575
3492 1 11 . 1 1 90 90 ARG CB C 90 31.210 31.210 31.431 -0.222 25575
3493 1 11 . 1 1 90 90 ARG H H 90 8.360 8.360 8.543 -0.183 25575
3494 1 11 . 1 1 91 91 LYS N N 91 123.680 123.680 120.139 3.541 25575
3495 1 11 . 1 1 91 91 LYS HA H 91 4.380 4.380 4.693 -0.313 25575
3496 1 11 . 1 1 91 91 LYS CA C 91 56.620 56.620 55.778 0.842 25575
3497 1 11 . 1 1 91 91 LYS CB C 91 33.070 33.070 34.817 -1.747 25575
3498 1 11 . 1 1 91 91 LYS H H 91 8.450 8.450 8.559 -0.109 25575
3499 1 12 . 1 1 24 24 SER HA H 24 4.330 4.330 4.625 -0.295 25575
3500 1 12 . 1 1 24 24 SER CA C 24 58.130 58.130 57.885 0.245 25575
3501 1 12 . 1 1 24 24 SER CB C 24 63.870 63.870 63.848 0.022 25575
3502 1 12 . 1 1 25 25 TYR N N 25 122.160 122.160 120.143 2.017 25575
3503 1 12 . 1 1 25 25 TYR HA H 25 4.530 4.530 4.774 -0.244 25575
3504 1 12 . 1 1 25 25 TYR CA C 25 58.420 58.420 57.192 1.228 25575
3505 1 12 . 1 1 25 25 TYR CB C 25 38.570 38.570 37.480 1.090 25575
3506 1 12 . 1 1 25 25 TYR H H 25 8.310 8.310 7.930 0.380 25575
3507 1 12 . 1 1 26 26 GLY N N 26 111.370 111.370 111.366 0.004 25575
3508 1 12 . 1 1 26 26 GLY CA C 26 45.330 45.330 45.402 -0.072 25575
3509 1 12 . 1 1 26 26 GLY H H 26 8.300 8.300 8.341 -0.041 25575
3510 1 12 . 1 1 27 27 GLN N N 27 118.910 118.910 119.791 -0.881 25575
3511 1 12 . 1 1 27 27 GLN HA H 27 4.510 4.510 3.620 0.890 25575
3512 1 12 . 1 1 27 27 GLN CA C 27 55.240 55.240 55.718 -0.478 25575
3513 1 12 . 1 1 27 27 GLN CB C 27 29.800 29.800 27.201 2.599 25575
3514 1 12 . 1 1 27 27 GLN H H 27 8.050 8.050 7.649 0.401 25575
3515 1 12 . 1 1 28 28 SER N N 28 119.460 119.460 112.942 6.518 25575
3516 1 12 . 1 1 28 28 SER HA H 28 4.810 4.810 4.937 -0.127 25575
3517 1 12 . 1 1 28 28 SER CA C 28 57.710 57.710 56.747 0.963 25575
3518 1 12 . 1 1 28 28 SER CB C 28 65.530 65.530 65.480 0.050 25575
3519 1 12 . 1 1 28 28 SER H H 28 8.800 8.800 8.017 0.783 25575
3520 1 12 . 1 1 29 29 CYS N N 29 122.160 122.160 118.537 3.623 25575
3521 1 12 . 1 1 29 29 CYS HA H 29 4.130 4.130 4.391 -0.261 25575
3522 1 12 . 1 1 29 29 CYS CA C 29 60.620 60.620 61.806 -1.186 25575
3523 1 12 . 1 1 29 29 CYS CB C 29 32.770 32.770 28.829 3.941 25575
3524 1 12 . 1 1 29 29 CYS H H 29 8.390 8.390 8.485 -0.095 25575
3525 1 12 . 1 1 30 30 CYS N N 30 122.320 122.320 118.706 3.614 25575
3526 1 12 . 1 1 30 30 CYS HA H 30 4.530 4.530 4.766 -0.236 25575
3527 1 12 . 1 1 30 30 CYS CA C 30 58.810 58.810 58.632 0.178 25575
3528 1 12 . 1 1 30 30 CYS CB C 30 28.910 28.910 27.867 1.043 25575
3529 1 12 . 1 1 30 30 CYS H H 30 8.340 8.340 8.762 -0.422 25575
3530 1 12 . 1 1 31 31 LEU N N 31 122.390 122.390 121.679 0.711 25575
3531 1 12 . 1 1 31 31 LEU HA H 31 4.640 4.640 4.643 -0.003 25575
3532 1 12 . 1 1 31 31 LEU CA C 31 55.440 55.440 55.370 0.070 25575
3533 1 12 . 1 1 31 31 LEU CB C 31 43.490 43.490 42.833 0.657 25575
3534 1 12 . 1 1 31 31 LEU H H 31 8.460 8.460 7.198 1.262 25575
3535 1 12 . 1 1 32 32 ILE N N 32 118.890 118.890 117.219 1.671 25575
3536 1 12 . 1 1 32 32 ILE HA H 32 4.200 4.200 4.888 -0.688 25575
3537 1 12 . 1 1 32 32 ILE CA C 32 60.440 60.440 59.787 0.653 25575
3538 1 12 . 1 1 32 32 ILE CB C 32 39.890 39.890 42.105 -2.215 25575
3539 1 12 . 1 1 32 32 ILE H H 32 8.680 8.680 7.996 0.684 25575
3540 1 12 . 1 1 33 33 GLU N N 33 128.400 128.400 125.529 2.871 25575
3541 1 12 . 1 1 33 33 GLU HA H 33 5.080 5.080 5.125 -0.045 25575
3542 1 12 . 1 1 33 33 GLU CA C 33 54.120 54.120 55.088 -0.968 25575
3543 1 12 . 1 1 33 33 GLU CB C 33 32.080 32.080 33.593 -1.513 25575
3544 1 12 . 1 1 33 33 GLU H H 33 8.640 8.640 8.794 -0.154 25575
3545 1 12 . 1 1 34 34 ASP N N 34 130.390 130.390 127.512 2.878 25575
3546 1 12 . 1 1 34 34 ASP HA H 34 4.310 4.310 4.273 0.037 25575
3547 1 12 . 1 1 34 34 ASP CA C 34 55.150 55.150 55.885 -0.735 25575
3548 1 12 . 1 1 34 34 ASP CB C 34 40.050 40.050 40.636 -0.586 25575
3549 1 12 . 1 1 34 34 ASP H H 34 9.540 9.540 9.012 0.528 25575
3550 1 12 . 1 1 35 35 GLY N N 35 126.620 126.620 103.502 23.118 25575
3551 1 12 . 1 1 35 35 GLY CA C 35 45.480 45.480 44.915 0.565 25575
3552 1 12 . 1 1 35 35 GLY H H 35 8.370 8.370 8.142 0.228 25575
3553 1 12 . 1 1 36 36 GLU N N 36 120.860 120.860 122.836 -1.976 25575
3554 1 12 . 1 1 36 36 GLU HA H 36 4.670 4.670 4.286 0.384 25575
3555 1 12 . 1 1 36 36 GLU CA C 36 54.350 54.350 56.043 -1.693 25575
3556 1 12 . 1 1 36 36 GLU CB C 36 31.630 31.630 30.359 1.271 25575
3557 1 12 . 1 1 36 36 GLU H H 36 7.820 7.820 7.959 -0.139 25575
3558 1 12 . 1 1 37 37 ARG N N 37 129.790 129.790 127.725 2.065 25575
3559 1 12 . 1 1 37 37 ARG HA H 37 4.200 4.200 4.306 -0.106 25575
3560 1 12 . 1 1 37 37 ARG CA C 37 56.440 56.440 54.655 1.785 25575
3561 1 12 . 1 1 37 37 ARG CB C 37 29.710 29.710 28.516 1.194 25575
3562 1 12 . 1 1 37 37 ARG H H 37 8.930 8.930 8.470 0.460 25575
3563 1 12 . 1 1 38 38 CYS N N 38 130.950 130.950 124.620 6.330 25575
3564 1 12 . 1 1 38 38 CYS HA H 38 4.450 4.450 4.296 0.154 25575
3565 1 12 . 1 1 38 38 CYS CA C 38 60.560 60.560 60.550 0.010 25575
3566 1 12 . 1 1 38 38 CYS CB C 38 31.250 31.250 26.701 4.549 25575
3567 1 12 . 1 1 38 38 CYS H H 38 9.050 9.050 8.104 0.946 25575
3568 1 12 . 1 1 39 39 VAL N N 39 118.270 118.270 123.255 -4.985 25575
3569 1 12 . 1 1 39 39 VAL HA H 39 4.710 4.710 4.358 0.352 25575
3570 1 12 . 1 1 39 39 VAL CA C 39 60.340 60.340 61.704 -1.364 25575
3571 1 12 . 1 1 39 39 VAL CB C 39 31.290 31.290 31.401 -0.111 25575
3572 1 12 . 1 1 39 39 VAL H H 39 8.060 8.060 7.877 0.183 25575
3573 1 12 . 1 1 40 40 ARG N N 40 127.360 127.360 122.285 5.075 25575
3574 1 12 . 1 1 40 40 ARG HA H 40 4.430 4.430 4.304 0.126 25575
3575 1 12 . 1 1 40 40 ARG CA C 40 56.150 56.150 54.801 1.349 25575
3576 1 12 . 1 1 40 40 ARG CB C 40 29.210 29.210 29.514 -0.304 25575
3577 1 12 . 1 1 40 40 ARG H H 40 8.950 8.950 7.715 1.235 25575
3578 1 12 . 1 1 41 41 PRO HA H 41 4.430 4.430 4.354 0.076 25575
3579 1 12 . 1 1 41 41 PRO CA C 41 62.690 62.690 62.971 -0.282 25575
3580 1 12 . 1 1 41 41 PRO CB C 41 32.010 32.010 32.057 -0.047 25575
3581 1 12 . 1 1 42 42 ALA N N 42 124.260 124.260 126.039 -1.779 25575
3582 1 12 . 1 1 42 42 ALA HA H 42 3.620 3.620 4.517 -0.897 25575
3583 1 12 . 1 1 42 42 ALA CA C 42 52.930 52.930 50.941 1.989 25575
3584 1 12 . 1 1 42 42 ALA CB C 42 19.130 19.130 20.559 -1.429 25575
3585 1 12 . 1 1 42 42 ALA H H 42 8.410 8.410 8.556 -0.146 25575
3586 1 12 . 1 1 43 43 GLY N N 43 112.690 112.690 106.673 6.017 25575
3587 1 12 . 1 1 43 43 GLY CA C 43 44.240 44.240 45.535 -1.295 25575
3588 1 12 . 1 1 43 43 GLY H H 43 8.090 8.090 7.891 0.199 25575
3589 1 12 . 1 1 44 44 ASN N N 44 116.980 116.980 118.446 -1.466 25575
3590 1 12 . 1 1 44 44 ASN HA H 44 4.690 4.690 4.643 0.047 25575
3591 1 12 . 1 1 44 44 ASN CA C 44 53.420 53.420 53.990 -0.571 25575
3592 1 12 . 1 1 44 44 ASN CB C 44 39.370 39.370 38.117 1.253 25575
3593 1 12 . 1 1 44 44 ASN H H 44 8.720 8.720 8.543 0.177 25575
3594 1 12 . 1 1 45 45 ALA N N 45 124.240 124.240 123.115 1.125 25575
3595 1 12 . 1 1 45 45 ALA HA H 45 4.640 4.640 4.631 0.009 25575
3596 1 12 . 1 1 45 45 ALA CA C 45 52.240 52.240 51.907 0.333 25575
3597 1 12 . 1 1 45 45 ALA CB C 45 19.540 19.540 19.997 -0.457 25575
3598 1 12 . 1 1 45 45 ALA H H 45 8.770 8.770 8.063 0.707 25575
3599 1 12 . 1 1 46 46 SER N N 46 111.670 111.670 117.288 -5.618 25575
3600 1 12 . 1 1 46 46 SER HA H 46 5.300 5.300 4.842 0.458 25575
3601 1 12 . 1 1 46 46 SER CA C 46 56.580 56.580 57.042 -0.462 25575
3602 1 12 . 1 1 46 46 SER CB C 46 66.490 66.490 66.082 0.408 25575
3603 1 12 . 1 1 46 46 SER H H 46 8.060 8.060 8.257 -0.197 25575
3604 1 12 . 1 1 47 47 PHE HA H 47 4.520 4.520 4.558 -0.038 25575
3605 1 12 . 1 1 47 47 PHE CA C 47 57.000 57.000 56.686 0.314 25575
3606 1 12 . 1 1 47 47 PHE CB C 47 38.360 38.360 37.964 0.396 25575
3607 1 12 . 1 1 48 48 SER N N 48 116.970 116.970 118.068 -1.098 25575
3608 1 12 . 1 1 48 48 SER HA H 48 4.440 4.440 4.268 0.172 25575
3609 1 12 . 1 1 48 48 SER CA C 48 56.950 56.950 59.160 -2.210 25575
3610 1 12 . 1 1 48 48 SER CB C 48 65.810 65.810 64.190 1.620 25575
3611 1 12 . 1 1 48 48 SER H H 48 7.100 7.100 7.490 -0.390 25575
3612 1 12 . 1 1 49 49 LYS N N 49 120.650 120.650 125.770 -5.120 25575
3613 1 12 . 1 1 49 49 LYS HA H 49 3.900 3.900 4.067 -0.167 25575
3614 1 12 . 1 1 49 49 LYS CA C 49 59.570 59.570 59.503 0.067 25575
3615 1 12 . 1 1 49 49 LYS CB C 49 31.790 31.790 31.973 -0.183 25575
3616 1 12 . 1 1 49 49 LYS H H 49 8.770 8.770 8.685 0.085 25575
3617 1 12 . 1 1 50 50 ARG N N 50 118.240 118.240 117.651 0.589 25575
3618 1 12 . 1 1 50 50 ARG HA H 50 4.040 4.040 4.038 0.002 25575
3619 1 12 . 1 1 50 50 ARG CA C 50 59.070 59.070 58.472 0.598 25575
3620 1 12 . 1 1 50 50 ARG CB C 50 30.080 30.080 29.364 0.716 25575
3621 1 12 . 1 1 50 50 ARG H H 50 8.040 8.040 8.146 -0.106 25575
3622 1 12 . 1 1 51 51 VAL N N 51 121.680 121.680 119.616 2.064 25575
3623 1 12 . 1 1 51 51 VAL HA H 51 3.590 3.590 3.502 0.088 25575
3624 1 12 . 1 1 51 51 VAL CA C 51 65.940 65.940 65.608 0.332 25575
3625 1 12 . 1 1 51 51 VAL CB C 51 31.620 31.620 31.137 0.483 25575
3626 1 12 . 1 1 51 51 VAL H H 51 7.350 7.350 8.226 -0.876 25575
3627 1 12 . 1 1 52 52 GLN N N 52 119.680 119.680 118.384 1.296 25575
3628 1 12 . 1 1 52 52 GLN HA H 52 3.570 3.570 3.804 -0.234 25575
3629 1 12 . 1 1 52 52 GLN CA C 52 59.210 59.210 59.060 0.150 25575
3630 1 12 . 1 1 52 52 GLN CB C 52 28.620 28.620 28.131 0.489 25575
3631 1 12 . 1 1 52 52 GLN H H 52 8.210 8.210 7.488 0.722 25575
3632 1 12 . 1 1 53 53 LYS N N 53 118.080 118.080 119.595 -1.515 25575
3633 1 12 . 1 1 53 53 LYS HA H 53 4.160 4.160 3.949 0.211 25575
3634 1 12 . 1 1 53 53 LYS CA C 53 58.670 58.670 59.360 -0.690 25575
3635 1 12 . 1 1 53 53 LYS CB C 53 32.120 32.120 31.529 0.591 25575
3636 1 12 . 1 1 53 53 LYS H H 53 7.960 7.960 7.704 0.256 25575
3637 1 12 . 1 1 54 54 SER N N 54 115.450 115.450 115.111 0.339 25575
3638 1 12 . 1 1 54 54 SER HA H 54 4.370 4.370 4.166 0.204 25575
3639 1 12 . 1 1 54 54 SER CA C 54 61.330 61.330 61.705 -0.375 25575
3640 1 12 . 1 1 54 54 SER CB C 54 63.690 63.690 63.024 0.666 25575
3641 1 12 . 1 1 54 54 SER H H 54 7.800 7.800 7.364 0.436 25575
3642 1 12 . 1 1 55 55 ILE N N 55 117.670 117.670 119.715 -2.045 25575
3643 1 12 . 1 1 55 55 ILE HA H 55 4.060 4.060 3.801 0.259 25575
3644 1 12 . 1 1 55 55 ILE CA C 55 63.330 63.330 64.454 -1.124 25575
3645 1 12 . 1 1 55 55 ILE CB C 55 38.980 38.980 38.230 0.750 25575
3646 1 12 . 1 1 55 55 ILE H H 55 7.840 7.840 7.672 0.168 25575
3647 1 12 . 1 1 56 56 SER N N 56 115.650 115.650 116.065 -0.415 25575
3648 1 12 . 1 1 56 56 SER HA H 56 4.490 4.490 4.144 0.346 25575
3649 1 12 . 1 1 56 56 SER CA C 56 60.220 60.220 61.674 -1.454 25575
3650 1 12 . 1 1 56 56 SER CB C 56 63.000 63.000 62.995 0.006 25575
3651 1 12 . 1 1 56 56 SER H H 56 8.060 8.060 8.350 -0.290 25575
3652 1 12 . 1 1 57 57 GLN N N 57 121.830 121.830 118.511 3.319 25575
3653 1 12 . 1 1 57 57 GLN HA H 57 4.200 4.200 4.281 -0.081 25575
3654 1 12 . 1 1 57 57 GLN CA C 57 58.310 58.310 56.885 1.425 25575
3655 1 12 . 1 1 57 57 GLN CB C 57 28.850 28.850 28.711 0.139 25575
3656 1 12 . 1 1 57 57 GLN H H 57 8.620 8.620 7.779 0.841 25575
3657 1 12 . 1 1 58 58 LYS N N 58 116.960 116.960 117.155 -0.195 25575
3658 1 12 . 1 1 58 58 LYS HA H 58 4.290 4.290 4.459 -0.169 25575
3659 1 12 . 1 1 58 58 LYS CA C 58 56.920 56.920 55.574 1.346 25575
3660 1 12 . 1 1 58 58 LYS CB C 58 32.900 32.900 34.004 -1.104 25575
3661 1 12 . 1 1 58 58 LYS H H 58 7.950 7.950 7.859 0.091 25575
3662 1 12 . 1 1 59 59 LYS N N 59 116.960 116.960 119.245 -2.285 25575
3663 1 12 . 1 1 59 59 LYS HA H 59 4.120 4.120 3.933 0.187 25575
3664 1 12 . 1 1 59 59 LYS CA C 59 57.090 57.090 56.670 0.420 25575
3665 1 12 . 1 1 59 59 LYS CB C 59 30.080 30.080 30.458 -0.378 25575
3666 1 12 . 1 1 59 59 LYS H H 59 7.950 7.950 7.958 -0.008 25575
3667 1 12 . 1 1 60 60 LEU N N 60 117.540 117.540 118.618 -1.078 25575
3668 1 12 . 1 1 60 60 LEU HA H 60 4.480 4.480 4.301 0.179 25575
3669 1 12 . 1 1 60 60 LEU CA C 60 54.500 54.500 55.231 -0.731 25575
3670 1 12 . 1 1 60 60 LEU CB C 60 42.840 42.840 42.348 0.492 25575
3671 1 12 . 1 1 60 60 LEU H H 60 7.930 7.930 7.487 0.443 25575
3672 1 12 . 1 1 61 61 LYS HA H 61 4.390 4.390 4.258 0.132 25575
3673 1 12 . 1 1 61 61 LYS CA C 61 55.540 55.540 56.250 -0.710 25575
3674 1 12 . 1 1 61 61 LYS CB C 61 30.050 30.050 30.431 -0.381 25575
3675 1 12 . 1 1 62 62 LEU N N 62 120.000 120.000 122.294 -2.294 25575
3676 1 12 . 1 1 62 62 LEU HA H 62 5.250 5.250 5.186 0.064 25575
3677 1 12 . 1 1 62 62 LEU CA C 62 53.080 53.080 54.014 -0.934 25575
3678 1 12 . 1 1 62 62 LEU CB C 62 45.760 45.760 42.903 2.857 25575
3679 1 12 . 1 1 62 62 LEU H H 62 7.470 7.470 7.685 -0.215 25575
3680 1 12 . 1 1 63 63 ASP N N 63 121.730 121.730 125.101 -3.371 25575
3681 1 12 . 1 1 63 63 ASP HA H 63 4.860 4.860 4.879 -0.019 25575
3682 1 12 . 1 1 63 63 ASP CA C 63 51.890 51.890 52.112 -0.222 25575
3683 1 12 . 1 1 63 63 ASP CB C 63 44.910 44.910 44.875 0.035 25575
3684 1 12 . 1 1 63 63 ASP H H 63 8.620 8.620 8.810 -0.190 25575
3685 1 12 . 1 1 64 64 ILE N N 64 118.120 118.120 118.894 -0.774 25575
3686 1 12 . 1 1 64 64 ILE HA H 64 4.210 4.210 4.413 -0.203 25575
3687 1 12 . 1 1 64 64 ILE CA C 64 60.430 60.430 58.159 2.271 25575
3688 1 12 . 1 1 64 64 ILE CB C 64 40.420 40.420 39.407 1.013 25575
3689 1 12 . 1 1 64 64 ILE H H 64 8.650 8.650 8.207 0.443 25575
3690 1 12 . 1 1 65 65 ASP N N 65 124.550 124.550 129.853 -5.303 25575
3691 1 12 . 1 1 65 65 ASP HA H 65 4.570 4.570 4.452 0.118 25575
3692 1 12 . 1 1 65 65 ASP CA C 65 53.310 53.310 54.569 -1.259 25575
3693 1 12 . 1 1 65 65 ASP CB C 65 40.440 40.440 41.636 -1.196 25575
3694 1 12 . 1 1 65 65 ASP H H 65 8.630 8.630 8.642 -0.012 25575
3695 1 12 . 1 1 66 66 LYS N N 66 125.970 125.970 125.697 0.273 25575
3696 1 12 . 1 1 66 66 LYS HA H 66 4.040 4.040 4.391 -0.351 25575
3697 1 12 . 1 1 66 66 LYS CA C 66 58.140 58.140 55.900 2.240 25575
3698 1 12 . 1 1 66 66 LYS CB C 66 31.990 31.990 32.470 -0.480 25575
3699 1 12 . 1 1 66 66 LYS H H 66 8.590 8.590 8.536 0.054 25575
3700 1 12 . 1 1 67 67 SER N N 67 114.980 114.980 116.143 -1.163 25575
3701 1 12 . 1 1 67 67 SER HA H 67 4.320 4.320 4.197 0.123 25575
3702 1 12 . 1 1 67 67 SER CA C 67 60.330 60.330 61.039 -0.709 25575
3703 1 12 . 1 1 67 67 SER CB C 67 63.710 63.710 63.283 0.427 25575
3704 1 12 . 1 1 67 67 SER H H 67 8.760 8.760 8.707 0.053 25575
3705 1 12 . 1 1 68 68 VAL HA H 68 4.250 4.250 3.936 0.314 25575
3706 1 12 . 1 1 68 68 VAL CA C 68 62.150 62.150 63.174 -1.024 25575
3707 1 12 . 1 1 68 68 VAL CB C 68 31.900 31.900 31.484 0.416 25575
3708 1 12 . 1 1 69 69 ARG CA C 69 56.960 56.960 58.089 -1.129 25575
3709 1 12 . 1 1 70 70 HIS N N 70 116.270 116.270 116.325 -0.055 25575
3710 1 12 . 1 1 70 70 HIS HA H 70 4.760 4.760 4.534 0.226 25575
3711 1 12 . 1 1 70 70 HIS CA C 70 55.360 55.360 54.715 0.645 25575
3712 1 12 . 1 1 70 70 HIS CB C 70 33.100 33.100 30.600 2.500 25575
3713 1 12 . 1 1 70 70 HIS H H 70 7.390 7.390 7.975 -0.585 25575
3714 1 12 . 1 1 71 71 LEU N N 71 120.200 120.200 118.422 1.778 25575
3715 1 12 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.708 0.352 25575
3716 1 12 . 1 1 71 71 LEU CA C 71 54.070 54.070 53.877 0.193 25575
3717 1 12 . 1 1 71 71 LEU CB C 71 42.710 42.710 41.325 1.385 25575
3718 1 12 . 1 1 71 71 LEU H H 71 7.970 7.970 8.318 -0.348 25575
3719 1 12 . 1 1 72 72 TYR HA H 72 5.030 5.030 4.717 0.313 25575
3720 1 12 . 1 1 72 72 TYR CA C 72 59.990 59.990 58.855 1.135 25575
3721 1 12 . 1 1 72 72 TYR CB C 72 39.440 39.440 40.007 -0.567 25575
3722 1 12 . 1 1 73 73 ILE N N 73 112.940 112.940 113.191 -0.251 25575
3723 1 12 . 1 1 73 73 ILE HA H 73 6.080 6.080 4.815 1.265 25575
3724 1 12 . 1 1 73 73 ILE CA C 73 58.090 58.090 58.594 -0.504 25575
3725 1 12 . 1 1 73 73 ILE CB C 73 41.820 41.820 42.510 -0.690 25575
3726 1 12 . 1 1 73 73 ILE H H 73 8.450 8.450 8.109 0.341 25575
3727 1 12 . 1 1 74 74 CYS N N 74 124.730 124.730 118.951 5.779 25575
3728 1 12 . 1 1 74 74 CYS HA H 74 5.080 5.080 5.126 -0.046 25575
3729 1 12 . 1 1 74 74 CYS CA C 74 57.670 57.670 57.431 0.238 25575
3730 1 12 . 1 1 74 74 CYS CB C 74 33.330 33.330 29.983 3.346 25575
3731 1 12 . 1 1 74 74 CYS H H 74 9.830 9.830 8.599 1.231 25575
3732 1 12 . 1 1 75 75 ASP N N 75 120.990 120.990 123.149 -2.159 25575
3733 1 12 . 1 1 75 75 ASP HA H 75 4.590 4.590 4.413 0.177 25575
3734 1 12 . 1 1 75 75 ASP CA C 75 57.320 57.320 57.901 -0.581 25575
3735 1 12 . 1 1 75 75 ASP CB C 75 39.670 39.670 41.089 -1.419 25575
3736 1 12 . 1 1 75 75 ASP H H 75 9.090 9.090 9.064 0.026 25575
3737 1 12 . 1 1 76 76 PHE N N 76 122.470 122.470 118.822 3.648 25575
3738 1 12 . 1 1 76 76 PHE HA H 76 4.230 4.230 4.150 0.080 25575
3739 1 12 . 1 1 76 76 PHE CA C 76 62.030 62.030 61.737 0.293 25575
3740 1 12 . 1 1 76 76 PHE CB C 76 38.190 38.190 39.100 -0.910 25575
3741 1 12 . 1 1 76 76 PHE H H 76 8.330 8.330 8.435 -0.105 25575
3742 1 12 . 1 1 77 77 HIS N N 77 124.580 124.580 117.643 6.937 25575
3743 1 12 . 1 1 77 77 HIS HA H 77 4.280 4.280 4.271 0.009 25575
3744 1 12 . 1 1 77 77 HIS CA C 77 63.880 63.880 59.231 4.649 25575
3745 1 12 . 1 1 77 77 HIS CB C 77 29.600 29.600 30.149 -0.549 25575
3746 1 12 . 1 1 77 77 HIS H H 77 10.300 10.300 7.748 2.552 25575
3747 1 12 . 1 1 78 78 LYS N N 78 122.930 122.930 120.287 2.643 25575
3748 1 12 . 1 1 78 78 LYS HA H 78 3.860 3.860 3.966 -0.106 25575
3749 1 12 . 1 1 78 78 LYS CA C 78 60.550 60.550 60.007 0.543 25575
3750 1 12 . 1 1 78 78 LYS CB C 78 32.040 32.040 32.393 -0.353 25575
3751 1 12 . 1 1 78 78 LYS H H 78 8.960 8.960 8.383 0.577 25575
3752 1 12 . 1 1 79 79 ASN N N 79 116.670 116.670 117.179 -0.509 25575
3753 1 12 . 1 1 79 79 ASN HA H 79 4.420 4.420 4.565 -0.145 25575
3754 1 12 . 1 1 79 79 ASN CA C 79 56.030 56.030 55.806 0.224 25575
3755 1 12 . 1 1 79 79 ASN CB C 79 38.100 38.100 38.829 -0.729 25575
3756 1 12 . 1 1 79 79 ASN H H 79 8.230 8.230 8.092 0.138 25575
3757 1 12 . 1 1 80 80 PHE N N 80 122.600 122.600 122.238 0.362 25575
3758 1 12 . 1 1 80 80 PHE HA H 80 4.180 4.180 4.090 0.090 25575
3759 1 12 . 1 1 80 80 PHE CA C 80 60.700 60.700 61.105 -0.404 25575
3760 1 12 . 1 1 80 80 PHE CB C 80 39.840 39.840 38.863 0.977 25575
3761 1 12 . 1 1 80 80 PHE H H 80 8.200 8.200 8.009 0.191 25575
3762 1 12 . 1 1 81 81 ILE N N 81 118.240 118.240 117.002 1.238 25575
3763 1 12 . 1 1 81 81 ILE HA H 81 3.320 3.320 3.507 -0.187 25575
3764 1 12 . 1 1 81 81 ILE CA C 81 65.160 65.160 64.306 0.854 25575
3765 1 12 . 1 1 81 81 ILE CB C 81 38.440 38.440 37.642 0.798 25575
3766 1 12 . 1 1 81 81 ILE H H 81 8.520 8.520 7.768 0.752 25575
3767 1 12 . 1 1 82 82 GLN N N 82 116.370 116.370 117.708 -1.338 25575
3768 1 12 . 1 1 82 82 GLN HA H 82 4.100 4.100 4.241 -0.141 25575
3769 1 12 . 1 1 82 82 GLN CA C 82 57.710 57.710 56.926 0.784 25575
3770 1 12 . 1 1 82 82 GLN CB C 82 28.710 28.710 28.620 0.090 25575
3771 1 12 . 1 1 82 82 GLN H H 82 7.670 7.670 7.894 -0.224 25575
3772 1 12 . 1 1 83 83 SER N N 83 114.440 114.440 117.634 -3.194 25575
3773 1 12 . 1 1 83 83 SER HA H 83 4.300 4.300 4.167 0.133 25575
3774 1 12 . 1 1 83 83 SER CA C 83 60.130 60.130 62.353 -2.223 25575
3775 1 12 . 1 1 83 83 SER CB C 83 63.570 63.570 63.346 0.224 25575
3776 1 12 . 1 1 83 83 SER H H 83 7.810 7.810 8.660 -0.850 25575
3777 1 12 . 1 1 84 84 VAL N N 84 120.750 120.750 115.958 4.792 25575
3778 1 12 . 1 1 84 84 VAL HA H 84 3.970 3.970 3.822 0.148 25575
3779 1 12 . 1 1 84 84 VAL CA C 84 63.430 63.430 63.813 -0.383 25575
3780 1 12 . 1 1 84 84 VAL CB C 84 31.960 31.960 31.518 0.442 25575
3781 1 12 . 1 1 84 84 VAL H H 84 7.790 7.790 7.568 0.222 25575
3782 1 12 . 1 1 85 85 ARG N N 85 122.090 122.090 119.232 2.858 25575
3783 1 12 . 1 1 85 85 ARG HA H 85 4.240 4.240 4.197 0.043 25575
3784 1 12 . 1 1 85 85 ARG CA C 85 56.850 56.850 56.667 0.183 25575
3785 1 12 . 1 1 85 85 ARG CB C 85 30.720 30.720 30.618 0.102 25575
3786 1 12 . 1 1 85 85 ARG H H 85 8.090 8.090 7.608 0.482 25575
3787 1 12 . 1 1 86 86 ASN N N 86 118.510 118.510 118.329 0.181 25575
3788 1 12 . 1 1 86 86 ASN HA H 86 4.690 4.690 4.598 0.092 25575
3789 1 12 . 1 1 86 86 ASN CA C 86 53.380 53.380 52.932 0.448 25575
3790 1 12 . 1 1 86 86 ASN CB C 86 38.950 38.950 39.262 -0.312 25575
3791 1 12 . 1 1 86 86 ASN H H 86 8.220 8.220 7.644 0.576 25575
3792 1 12 . 1 1 87 87 LYS N N 87 121.600 121.600 119.185 2.415 25575
3793 1 12 . 1 1 87 87 LYS HA H 87 4.310 4.310 4.489 -0.179 25575
3794 1 12 . 1 1 87 87 LYS CA C 87 56.590 56.590 55.788 0.802 25575
3795 1 12 . 1 1 87 87 LYS CB C 87 32.870 32.870 33.478 -0.608 25575
3796 1 12 . 1 1 87 87 LYS H H 87 8.150 8.150 8.205 -0.055 25575
3797 1 12 . 1 1 88 88 ARG N N 88 121.920 121.920 124.683 -2.763 25575
3798 1 12 . 1 1 88 88 ARG HA H 88 4.330 4.330 4.330 -0.000 25575
3799 1 12 . 1 1 88 88 ARG CA C 88 56.110 56.110 55.874 0.236 25575
3800 1 12 . 1 1 88 88 ARG CB C 88 30.870 30.870 28.660 2.210 25575
3801 1 12 . 1 1 88 88 ARG H H 88 8.250 8.250 8.803 -0.553 25575
3802 1 12 . 1 1 89 89 LYS N N 89 123.020 123.020 120.914 2.106 25575
3803 1 12 . 1 1 89 89 LYS HA H 89 4.320 4.320 4.550 -0.230 25575
3804 1 12 . 1 1 89 89 LYS CA C 89 56.330 56.330 55.822 0.509 25575
3805 1 12 . 1 1 89 89 LYS CB C 89 33.140 33.140 34.112 -0.972 25575
3806 1 12 . 1 1 89 89 LYS H H 89 8.320 8.320 7.970 0.350 25575
3807 1 12 . 1 1 90 90 ARG N N 90 122.970 122.970 120.157 2.813 25575
3808 1 12 . 1 1 90 90 ARG HA H 90 4.360 4.360 4.605 -0.245 25575
3809 1 12 . 1 1 90 90 ARG CA C 90 56.100 56.100 55.403 0.697 25575
3810 1 12 . 1 1 90 90 ARG CB C 90 31.210 31.210 31.561 -0.351 25575
3811 1 12 . 1 1 90 90 ARG H H 90 8.360 8.360 8.440 -0.080 25575
3812 1 12 . 1 1 91 91 LYS N N 91 123.680 123.680 120.966 2.714 25575
3813 1 12 . 1 1 91 91 LYS HA H 91 4.380 4.380 4.790 -0.410 25575
3814 1 12 . 1 1 91 91 LYS CA C 91 56.620 56.620 55.444 1.177 25575
3815 1 12 . 1 1 91 91 LYS CB C 91 33.070 33.070 33.904 -0.834 25575
3816 1 12 . 1 1 91 91 LYS H H 91 8.450 8.450 8.652 -0.202 25575
3817 1 13 . 1 1 24 24 SER HA H 24 4.330 4.330 4.892 -0.562 25575
3818 1 13 . 1 1 24 24 SER CA C 24 58.130 58.130 57.856 0.274 25575
3819 1 13 . 1 1 24 24 SER CB C 24 63.870 63.870 63.478 0.392 25575
3820 1 13 . 1 1 25 25 TYR N N 25 122.160 122.160 122.215 -0.055 25575
3821 1 13 . 1 1 25 25 TYR HA H 25 4.530 4.530 4.622 -0.092 25575
3822 1 13 . 1 1 25 25 TYR CA C 25 58.420 58.420 57.984 0.436 25575
3823 1 13 . 1 1 25 25 TYR CB C 25 38.570 38.570 37.659 0.911 25575
3824 1 13 . 1 1 25 25 TYR H H 25 8.310 8.310 8.244 0.066 25575
3825 1 13 . 1 1 26 26 GLY N N 26 111.370 111.370 114.724 -3.354 25575
3826 1 13 . 1 1 26 26 GLY CA C 26 45.330 45.330 45.992 -0.662 25575
3827 1 13 . 1 1 26 26 GLY H H 26 8.300 8.300 8.904 -0.604 25575
3828 1 13 . 1 1 27 27 GLN N N 27 118.910 118.910 124.609 -5.699 25575
3829 1 13 . 1 1 27 27 GLN HA H 27 4.510 4.510 4.280 0.230 25575
3830 1 13 . 1 1 27 27 GLN CA C 27 55.240 55.240 55.208 0.032 25575
3831 1 13 . 1 1 27 27 GLN CB C 27 29.800 29.800 27.887 1.913 25575
3832 1 13 . 1 1 27 27 GLN H H 27 8.050 8.050 8.140 -0.090 25575
3833 1 13 . 1 1 28 28 SER N N 28 119.460 119.460 114.336 5.124 25575
3834 1 13 . 1 1 28 28 SER HA H 28 4.810 4.810 5.288 -0.478 25575
3835 1 13 . 1 1 28 28 SER CA C 28 57.710 57.710 56.311 1.399 25575
3836 1 13 . 1 1 28 28 SER CB C 28 65.530 65.530 65.974 -0.444 25575
3837 1 13 . 1 1 28 28 SER H H 28 8.800 8.800 7.998 0.802 25575
3838 1 13 . 1 1 29 29 CYS N N 29 122.160 122.160 118.836 3.324 25575
3839 1 13 . 1 1 29 29 CYS HA H 29 4.130 4.130 4.412 -0.282 25575
3840 1 13 . 1 1 29 29 CYS CA C 29 60.620 60.620 61.660 -1.040 25575
3841 1 13 . 1 1 29 29 CYS CB C 29 32.770 32.770 29.085 3.685 25575
3842 1 13 . 1 1 29 29 CYS H H 29 8.390 8.390 8.620 -0.230 25575
3843 1 13 . 1 1 30 30 CYS N N 30 122.320 122.320 120.369 1.951 25575
3844 1 13 . 1 1 30 30 CYS HA H 30 4.530 4.530 4.749 -0.219 25575
3845 1 13 . 1 1 30 30 CYS CA C 30 58.810 58.810 58.474 0.336 25575
3846 1 13 . 1 1 30 30 CYS CB C 30 28.910 28.910 27.278 1.632 25575
3847 1 13 . 1 1 30 30 CYS H H 30 8.340 8.340 8.694 -0.354 25575
3848 1 13 . 1 1 31 31 LEU N N 31 122.390 122.390 121.459 0.931 25575
3849 1 13 . 1 1 31 31 LEU HA H 31 4.640 4.640 4.975 -0.335 25575
3850 1 13 . 1 1 31 31 LEU CA C 31 55.440 55.440 54.281 1.159 25575
3851 1 13 . 1 1 31 31 LEU CB C 31 43.490 43.490 43.025 0.465 25575
3852 1 13 . 1 1 31 31 LEU H H 31 8.460 8.460 7.202 1.258 25575
3853 1 13 . 1 1 32 32 ILE N N 32 118.890 118.890 118.003 0.887 25575
3854 1 13 . 1 1 32 32 ILE HA H 32 4.200 4.200 4.689 -0.489 25575
3855 1 13 . 1 1 32 32 ILE CA C 32 60.440 60.440 60.337 0.103 25575
3856 1 13 . 1 1 32 32 ILE CB C 32 39.890 39.890 41.615 -1.725 25575
3857 1 13 . 1 1 32 32 ILE H H 32 8.680 8.680 7.976 0.704 25575
3858 1 13 . 1 1 33 33 GLU N N 33 128.400 128.400 127.139 1.261 25575
3859 1 13 . 1 1 33 33 GLU HA H 33 5.080 5.080 5.179 -0.099 25575
3860 1 13 . 1 1 33 33 GLU CA C 33 54.120 54.120 54.657 -0.537 25575
3861 1 13 . 1 1 33 33 GLU CB C 33 32.080 32.080 32.869 -0.789 25575
3862 1 13 . 1 1 33 33 GLU H H 33 8.640 8.640 8.585 0.055 25575
3863 1 13 . 1 1 34 34 ASP N N 34 130.390 130.390 127.634 2.756 25575
3864 1 13 . 1 1 34 34 ASP HA H 34 4.310 4.310 4.266 0.044 25575
3865 1 13 . 1 1 34 34 ASP CA C 34 55.150 55.150 55.913 -0.763 25575
3866 1 13 . 1 1 34 34 ASP CB C 34 40.050 40.050 40.585 -0.535 25575
3867 1 13 . 1 1 34 34 ASP H H 34 9.540 9.540 8.853 0.687 25575
3868 1 13 . 1 1 35 35 GLY N N 35 126.620 126.620 104.501 22.119 25575
3869 1 13 . 1 1 35 35 GLY CA C 35 45.480 45.480 44.842 0.638 25575
3870 1 13 . 1 1 35 35 GLY H H 35 8.370 8.370 8.259 0.111 25575
3871 1 13 . 1 1 36 36 GLU N N 36 120.860 120.860 123.458 -2.598 25575
3872 1 13 . 1 1 36 36 GLU HA H 36 4.670 4.670 4.199 0.471 25575
3873 1 13 . 1 1 36 36 GLU CA C 36 54.350 54.350 55.675 -1.325 25575
3874 1 13 . 1 1 36 36 GLU CB C 36 31.630 31.630 30.230 1.400 25575
3875 1 13 . 1 1 36 36 GLU H H 36 7.820 7.820 8.027 -0.207 25575
3876 1 13 . 1 1 37 37 ARG N N 37 129.790 129.790 128.391 1.399 25575
3877 1 13 . 1 1 37 37 ARG HA H 37 4.200 4.200 4.353 -0.153 25575
3878 1 13 . 1 1 37 37 ARG CA C 37 56.440 56.440 55.631 0.809 25575
3879 1 13 . 1 1 37 37 ARG CB C 37 29.710 29.710 29.062 0.648 25575
3880 1 13 . 1 1 37 37 ARG H H 37 8.930 8.930 8.346 0.584 25575
3881 1 13 . 1 1 38 38 CYS N N 38 130.950 130.950 126.654 4.296 25575
3882 1 13 . 1 1 38 38 CYS HA H 38 4.450 4.450 4.310 0.140 25575
3883 1 13 . 1 1 38 38 CYS CA C 38 60.560 60.560 60.596 -0.036 25575
3884 1 13 . 1 1 38 38 CYS CB C 38 31.250 31.250 27.516 3.734 25575
3885 1 13 . 1 1 38 38 CYS H H 38 9.050 9.050 8.171 0.879 25575
3886 1 13 . 1 1 39 39 VAL N N 39 118.270 118.270 121.673 -3.403 25575
3887 1 13 . 1 1 39 39 VAL HA H 39 4.710 4.710 4.479 0.231 25575
3888 1 13 . 1 1 39 39 VAL CA C 39 60.340 60.340 60.282 0.058 25575
3889 1 13 . 1 1 39 39 VAL CB C 39 31.290 31.290 32.039 -0.749 25575
3890 1 13 . 1 1 39 39 VAL H H 39 8.060 8.060 8.130 -0.070 25575
3891 1 13 . 1 1 40 40 ARG N N 40 127.360 127.360 122.420 4.940 25575
3892 1 13 . 1 1 40 40 ARG HA H 40 4.430 4.430 4.295 0.135 25575
3893 1 13 . 1 1 40 40 ARG CA C 40 56.150 56.150 55.205 0.945 25575
3894 1 13 . 1 1 40 40 ARG CB C 40 29.210 29.210 29.362 -0.152 25575
3895 1 13 . 1 1 40 40 ARG H H 40 8.950 8.950 7.728 1.222 25575
3896 1 13 . 1 1 41 41 PRO HA H 41 4.430 4.430 4.545 -0.115 25575
3897 1 13 . 1 1 41 41 PRO CA C 41 62.690 62.690 62.880 -0.190 25575
3898 1 13 . 1 1 41 41 PRO CB C 41 32.010 32.010 32.196 -0.186 25575
3899 1 13 . 1 1 42 42 ALA N N 42 124.260 124.260 125.373 -1.113 25575
3900 1 13 . 1 1 42 42 ALA HA H 42 3.620 3.620 4.336 -0.716 25575
3901 1 13 . 1 1 42 42 ALA CA C 42 52.930 52.930 51.306 1.624 25575
3902 1 13 . 1 1 42 42 ALA CB C 42 19.130 19.130 20.115 -0.985 25575
3903 1 13 . 1 1 42 42 ALA H H 42 8.410 8.410 8.191 0.219 25575
3904 1 13 . 1 1 43 43 GLY N N 43 112.690 112.690 106.692 5.998 25575
3905 1 13 . 1 1 43 43 GLY CA C 43 44.240 44.240 45.015 -0.775 25575
3906 1 13 . 1 1 43 43 GLY H H 43 8.090 8.090 7.990 0.100 25575
3907 1 13 . 1 1 44 44 ASN N N 44 116.980 116.980 121.546 -4.566 25575
3908 1 13 . 1 1 44 44 ASN HA H 44 4.690 4.690 4.740 -0.050 25575
3909 1 13 . 1 1 44 44 ASN CA C 44 53.420 53.420 53.578 -0.158 25575
3910 1 13 . 1 1 44 44 ASN CB C 44 39.370 39.370 37.436 1.934 25575
3911 1 13 . 1 1 44 44 ASN H H 44 8.720 8.720 8.711 0.009 25575
3912 1 13 . 1 1 45 45 ALA N N 45 124.240 124.240 122.018 2.222 25575
3913 1 13 . 1 1 45 45 ALA HA H 45 4.640 4.640 4.830 -0.190 25575
3914 1 13 . 1 1 45 45 ALA CA C 45 52.240 52.240 51.581 0.659 25575
3915 1 13 . 1 1 45 45 ALA CB C 45 19.540 19.540 21.996 -2.456 25575
3916 1 13 . 1 1 45 45 ALA H H 45 8.770 8.770 8.037 0.733 25575
3917 1 13 . 1 1 46 46 SER N N 46 111.670 111.670 116.747 -5.077 25575
3918 1 13 . 1 1 46 46 SER HA H 46 5.300 5.300 4.964 0.336 25575
3919 1 13 . 1 1 46 46 SER CA C 46 56.580 56.580 56.802 -0.222 25575
3920 1 13 . 1 1 46 46 SER CB C 46 66.490 66.490 65.883 0.607 25575
3921 1 13 . 1 1 46 46 SER H H 46 8.060 8.060 8.231 -0.171 25575
3922 1 13 . 1 1 47 47 PHE HA H 47 4.520 4.520 4.446 0.074 25575
3923 1 13 . 1 1 47 47 PHE CA C 47 57.000 57.000 57.123 -0.123 25575
3924 1 13 . 1 1 47 47 PHE CB C 47 38.360 38.360 37.891 0.469 25575
3925 1 13 . 1 1 48 48 SER N N 48 116.970 116.970 116.992 -0.022 25575
3926 1 13 . 1 1 48 48 SER HA H 48 4.440 4.440 4.302 0.138 25575
3927 1 13 . 1 1 48 48 SER CA C 48 56.950 56.950 58.548 -1.598 25575
3928 1 13 . 1 1 48 48 SER CB C 48 65.810 65.810 64.266 1.544 25575
3929 1 13 . 1 1 48 48 SER H H 48 7.100 7.100 7.851 -0.751 25575
3930 1 13 . 1 1 49 49 LYS N N 49 120.650 120.650 122.455 -1.805 25575
3931 1 13 . 1 1 49 49 LYS HA H 49 3.900 3.900 3.911 -0.011 25575
3932 1 13 . 1 1 49 49 LYS CA C 49 59.570 59.570 59.580 -0.010 25575
3933 1 13 . 1 1 49 49 LYS CB C 49 31.790 31.790 32.182 -0.392 25575
3934 1 13 . 1 1 49 49 LYS H H 49 8.770 8.770 8.798 -0.028 25575
3935 1 13 . 1 1 50 50 ARG N N 50 118.240 118.240 117.813 0.427 25575
3936 1 13 . 1 1 50 50 ARG HA H 50 4.040 4.040 4.095 -0.055 25575
3937 1 13 . 1 1 50 50 ARG CA C 50 59.070 59.070 58.593 0.477 25575
3938 1 13 . 1 1 50 50 ARG CB C 50 30.080 30.080 29.470 0.610 25575
3939 1 13 . 1 1 50 50 ARG H H 50 8.040 8.040 7.872 0.168 25575
3940 1 13 . 1 1 51 51 VAL N N 51 121.680 121.680 120.664 1.016 25575
3941 1 13 . 1 1 51 51 VAL HA H 51 3.590 3.590 3.531 0.059 25575
3942 1 13 . 1 1 51 51 VAL CA C 51 65.940 65.940 65.656 0.284 25575
3943 1 13 . 1 1 51 51 VAL CB C 51 31.620 31.620 31.061 0.559 25575
3944 1 13 . 1 1 51 51 VAL H H 51 7.350 7.350 7.942 -0.592 25575
3945 1 13 . 1 1 52 52 GLN N N 52 119.680 119.680 119.108 0.572 25575
3946 1 13 . 1 1 52 52 GLN HA H 52 3.570 3.570 3.591 -0.021 25575
3947 1 13 . 1 1 52 52 GLN CA C 52 59.210 59.210 59.416 -0.206 25575
3948 1 13 . 1 1 52 52 GLN CB C 52 28.620 28.620 28.213 0.407 25575
3949 1 13 . 1 1 52 52 GLN H H 52 8.210 8.210 7.424 0.786 25575
3950 1 13 . 1 1 53 53 LYS N N 53 118.080 118.080 119.239 -1.159 25575
3951 1 13 . 1 1 53 53 LYS HA H 53 4.160 4.160 3.918 0.242 25575
3952 1 13 . 1 1 53 53 LYS CA C 53 58.670 58.670 59.704 -1.034 25575
3953 1 13 . 1 1 53 53 LYS CB C 53 32.120 32.120 31.954 0.166 25575
3954 1 13 . 1 1 53 53 LYS H H 53 7.960 7.960 7.570 0.390 25575
3955 1 13 . 1 1 54 54 SER N N 54 115.450 115.450 115.082 0.368 25575
3956 1 13 . 1 1 54 54 SER HA H 54 4.370 4.370 4.137 0.233 25575
3957 1 13 . 1 1 54 54 SER CA C 54 61.330 61.330 61.323 0.007 25575
3958 1 13 . 1 1 54 54 SER CB C 54 63.690 63.690 62.810 0.880 25575
3959 1 13 . 1 1 54 54 SER H H 54 7.800 7.800 7.519 0.281 25575
3960 1 13 . 1 1 55 55 ILE N N 55 117.670 117.670 121.377 -3.707 25575
3961 1 13 . 1 1 55 55 ILE HA H 55 4.060 4.060 3.650 0.410 25575
3962 1 13 . 1 1 55 55 ILE CA C 55 63.330 63.330 64.893 -1.563 25575
3963 1 13 . 1 1 55 55 ILE CB C 55 38.980 38.980 38.018 0.962 25575
3964 1 13 . 1 1 55 55 ILE H H 55 7.840 7.840 7.638 0.202 25575
3965 1 13 . 1 1 56 56 SER N N 56 115.650 115.650 115.209 0.441 25575
3966 1 13 . 1 1 56 56 SER HA H 56 4.490 4.490 4.060 0.430 25575
3967 1 13 . 1 1 56 56 SER CA C 56 60.220 60.220 61.779 -1.559 25575
3968 1 13 . 1 1 56 56 SER CB C 56 63.000 63.000 63.202 -0.202 25575
3969 1 13 . 1 1 56 56 SER H H 56 8.060 8.060 8.255 -0.195 25575
3970 1 13 . 1 1 57 57 GLN N N 57 121.830 121.830 119.982 1.848 25575
3971 1 13 . 1 1 57 57 GLN HA H 57 4.200 4.200 4.107 0.093 25575
3972 1 13 . 1 1 57 57 GLN CA C 57 58.310 58.310 58.291 0.019 25575
3973 1 13 . 1 1 57 57 GLN CB C 57 28.850 28.850 28.753 0.097 25575
3974 1 13 . 1 1 57 57 GLN H H 57 8.620 8.620 7.887 0.733 25575
3975 1 13 . 1 1 58 58 LYS N N 58 116.960 116.960 116.601 0.359 25575
3976 1 13 . 1 1 58 58 LYS HA H 58 4.290 4.290 4.265 0.025 25575
3977 1 13 . 1 1 58 58 LYS CA C 58 56.920 56.920 56.486 0.434 25575
3978 1 13 . 1 1 58 58 LYS CB C 58 32.900 32.900 32.806 0.094 25575
3979 1 13 . 1 1 58 58 LYS H H 58 7.950 7.950 7.473 0.477 25575
3980 1 13 . 1 1 59 59 LYS N N 59 116.960 116.960 116.554 0.406 25575
3981 1 13 . 1 1 59 59 LYS HA H 59 4.120 4.120 3.993 0.127 25575
3982 1 13 . 1 1 59 59 LYS CA C 59 57.090 57.090 57.117 -0.027 25575
3983 1 13 . 1 1 59 59 LYS CB C 59 30.080 30.080 29.517 0.563 25575
3984 1 13 . 1 1 59 59 LYS H H 59 7.950 7.950 7.787 0.163 25575
3985 1 13 . 1 1 60 60 LEU N N 60 117.540 117.540 119.062 -1.522 25575
3986 1 13 . 1 1 60 60 LEU HA H 60 4.480 4.480 4.354 0.126 25575
3987 1 13 . 1 1 60 60 LEU CA C 60 54.500 54.500 55.148 -0.648 25575
3988 1 13 . 1 1 60 60 LEU CB C 60 42.840 42.840 42.583 0.257 25575
3989 1 13 . 1 1 60 60 LEU H H 60 7.930 7.930 7.512 0.418 25575
3990 1 13 . 1 1 61 61 LYS HA H 61 4.390 4.390 4.308 0.082 25575
3991 1 13 . 1 1 61 61 LYS CA C 61 55.540 55.540 55.912 -0.372 25575
3992 1 13 . 1 1 61 61 LYS CB C 61 30.050 30.050 30.863 -0.813 25575
3993 1 13 . 1 1 62 62 LEU N N 62 120.000 120.000 122.523 -2.523 25575
3994 1 13 . 1 1 62 62 LEU HA H 62 5.250 5.250 4.987 0.263 25575
3995 1 13 . 1 1 62 62 LEU CA C 62 53.080 53.080 54.215 -1.135 25575
3996 1 13 . 1 1 62 62 LEU CB C 62 45.760 45.760 42.202 3.558 25575
3997 1 13 . 1 1 62 62 LEU H H 62 7.470 7.470 7.697 -0.227 25575
3998 1 13 . 1 1 63 63 ASP N N 63 121.730 121.730 124.635 -2.905 25575
3999 1 13 . 1 1 63 63 ASP HA H 63 4.860 4.860 4.795 0.065 25575
4000 1 13 . 1 1 63 63 ASP CA C 63 51.890 51.890 52.426 -0.536 25575
4001 1 13 . 1 1 63 63 ASP CB C 63 44.910 44.910 44.518 0.392 25575
4002 1 13 . 1 1 63 63 ASP H H 63 8.620 8.620 8.604 0.016 25575
4003 1 13 . 1 1 64 64 ILE N N 64 118.120 118.120 118.733 -0.613 25575
4004 1 13 . 1 1 64 64 ILE HA H 64 4.210 4.210 4.424 -0.214 25575
4005 1 13 . 1 1 64 64 ILE CA C 64 60.430 60.430 58.161 2.269 25575
4006 1 13 . 1 1 64 64 ILE CB C 64 40.420 40.420 40.059 0.361 25575
4007 1 13 . 1 1 64 64 ILE H H 64 8.650 8.650 8.155 0.495 25575
4008 1 13 . 1 1 65 65 ASP N N 65 124.550 124.550 127.894 -3.344 25575
4009 1 13 . 1 1 65 65 ASP HA H 65 4.570 4.570 4.564 0.006 25575
4010 1 13 . 1 1 65 65 ASP CA C 65 53.310 53.310 53.560 -0.250 25575
4011 1 13 . 1 1 65 65 ASP CB C 65 40.440 40.440 40.722 -0.282 25575
4012 1 13 . 1 1 65 65 ASP H H 65 8.630 8.630 8.766 -0.136 25575
4013 1 13 . 1 1 66 66 LYS N N 66 125.970 125.970 126.590 -0.620 25575
4014 1 13 . 1 1 66 66 LYS HA H 66 4.040 4.040 3.990 0.050 25575
4015 1 13 . 1 1 66 66 LYS CA C 66 58.140 58.140 58.592 -0.452 25575
4016 1 13 . 1 1 66 66 LYS CB C 66 31.990 31.990 32.310 -0.320 25575
4017 1 13 . 1 1 66 66 LYS H H 66 8.590 8.590 8.148 0.442 25575
4018 1 13 . 1 1 67 67 SER N N 67 114.980 114.980 115.941 -0.961 25575
4019 1 13 . 1 1 67 67 SER HA H 67 4.320 4.320 4.207 0.113 25575
4020 1 13 . 1 1 67 67 SER CA C 67 60.330 60.330 61.433 -1.103 25575
4021 1 13 . 1 1 67 67 SER CB C 67 63.710 63.710 63.087 0.623 25575
4022 1 13 . 1 1 67 67 SER H H 67 8.760 8.760 8.558 0.202 25575
4023 1 13 . 1 1 68 68 VAL HA H 68 4.250 4.250 3.910 0.340 25575
4024 1 13 . 1 1 68 68 VAL CA C 68 62.150 62.150 61.966 0.184 25575
4025 1 13 . 1 1 68 68 VAL CB C 68 31.900 31.900 31.316 0.584 25575
4026 1 13 . 1 1 69 69 ARG CA C 69 56.960 56.960 57.078 -0.118 25575
4027 1 13 . 1 1 70 70 HIS N N 70 116.270 116.270 113.808 2.462 25575
4028 1 13 . 1 1 70 70 HIS HA H 70 4.760 4.760 4.736 0.024 25575
4029 1 13 . 1 1 70 70 HIS CA C 70 55.360 55.360 53.926 1.434 25575
4030 1 13 . 1 1 70 70 HIS CB C 70 33.100 33.100 32.260 0.840 25575
4031 1 13 . 1 1 70 70 HIS H H 70 7.390 7.390 7.928 -0.538 25575
4032 1 13 . 1 1 71 71 LEU N N 71 120.200 120.200 120.612 -0.412 25575
4033 1 13 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.652 0.408 25575
4034 1 13 . 1 1 71 71 LEU CA C 71 54.070 54.070 54.069 0.001 25575
4035 1 13 . 1 1 71 71 LEU CB C 71 42.710 42.710 41.478 1.232 25575
4036 1 13 . 1 1 71 71 LEU H H 71 7.970 7.970 8.271 -0.301 25575
4037 1 13 . 1 1 72 72 TYR HA H 72 5.030 5.030 4.733 0.297 25575
4038 1 13 . 1 1 72 72 TYR CA C 72 59.990 59.990 58.546 1.444 25575
4039 1 13 . 1 1 72 72 TYR CB C 72 39.440 39.440 39.661 -0.221 25575
4040 1 13 . 1 1 73 73 ILE N N 73 112.940 112.940 113.620 -0.680 25575
4041 1 13 . 1 1 73 73 ILE HA H 73 6.080 6.080 4.791 1.289 25575
4042 1 13 . 1 1 73 73 ILE CA C 73 58.090 58.090 58.543 -0.453 25575
4043 1 13 . 1 1 73 73 ILE CB C 73 41.820 41.820 42.416 -0.596 25575
4044 1 13 . 1 1 73 73 ILE H H 73 8.450 8.450 7.982 0.468 25575
4045 1 13 . 1 1 74 74 CYS N N 74 124.730 124.730 119.661 5.069 25575
4046 1 13 . 1 1 74 74 CYS HA H 74 5.080 5.080 5.024 0.056 25575
4047 1 13 . 1 1 74 74 CYS CA C 74 57.670 57.670 57.882 -0.212 25575
4048 1 13 . 1 1 74 74 CYS CB C 74 33.330 33.330 29.578 3.752 25575
4049 1 13 . 1 1 74 74 CYS H H 74 9.830 9.830 8.573 1.257 25575
4050 1 13 . 1 1 75 75 ASP N N 75 120.990 120.990 123.375 -2.385 25575
4051 1 13 . 1 1 75 75 ASP HA H 75 4.590 4.590 4.403 0.187 25575
4052 1 13 . 1 1 75 75 ASP CA C 75 57.320 57.320 58.624 -1.304 25575
4053 1 13 . 1 1 75 75 ASP CB C 75 39.670 39.670 40.709 -1.039 25575
4054 1 13 . 1 1 75 75 ASP H H 75 9.090 9.090 9.238 -0.148 25575
4055 1 13 . 1 1 76 76 PHE N N 76 122.470 122.470 119.387 3.083 25575
4056 1 13 . 1 1 76 76 PHE HA H 76 4.230 4.230 4.166 0.064 25575
4057 1 13 . 1 1 76 76 PHE CA C 76 62.030 62.030 62.339 -0.309 25575
4058 1 13 . 1 1 76 76 PHE CB C 76 38.190 38.190 39.235 -1.045 25575
4059 1 13 . 1 1 76 76 PHE H H 76 8.330 8.330 8.307 0.023 25575
4060 1 13 . 1 1 77 77 HIS N N 77 124.580 124.580 118.115 6.465 25575
4061 1 13 . 1 1 77 77 HIS HA H 77 4.280 4.280 4.396 -0.116 25575
4062 1 13 . 1 1 77 77 HIS CA C 77 63.880 63.880 59.678 4.202 25575
4063 1 13 . 1 1 77 77 HIS CB C 77 29.600 29.600 30.158 -0.558 25575
4064 1 13 . 1 1 77 77 HIS H H 77 10.300 10.300 7.812 2.488 25575
4065 1 13 . 1 1 78 78 LYS N N 78 122.930 122.930 120.063 2.867 25575
4066 1 13 . 1 1 78 78 LYS HA H 78 3.860 3.860 3.954 -0.094 25575
4067 1 13 . 1 1 78 78 LYS CA C 78 60.550 60.550 59.785 0.765 25575
4068 1 13 . 1 1 78 78 LYS CB C 78 32.040 32.040 32.419 -0.379 25575
4069 1 13 . 1 1 78 78 LYS H H 78 8.960 8.960 8.558 0.402 25575
4070 1 13 . 1 1 79 79 ASN N N 79 116.670 116.670 117.807 -1.137 25575
4071 1 13 . 1 1 79 79 ASN HA H 79 4.420 4.420 4.494 -0.074 25575
4072 1 13 . 1 1 79 79 ASN CA C 79 56.030 56.030 55.812 0.218 25575
4073 1 13 . 1 1 79 79 ASN CB C 79 38.100 38.100 38.379 -0.279 25575
4074 1 13 . 1 1 79 79 ASN H H 79 8.230 8.230 7.887 0.343 25575
4075 1 13 . 1 1 80 80 PHE N N 80 122.600 122.600 122.030 0.570 25575
4076 1 13 . 1 1 80 80 PHE HA H 80 4.180 4.180 4.126 0.054 25575
4077 1 13 . 1 1 80 80 PHE CA C 80 60.700 60.700 61.497 -0.797 25575
4078 1 13 . 1 1 80 80 PHE CB C 80 39.840 39.840 39.026 0.814 25575
4079 1 13 . 1 1 80 80 PHE H H 80 8.200 8.200 8.139 0.061 25575
4080 1 13 . 1 1 81 81 ILE N N 81 118.240 118.240 117.663 0.577 25575
4081 1 13 . 1 1 81 81 ILE HA H 81 3.320 3.320 3.429 -0.109 25575
4082 1 13 . 1 1 81 81 ILE CA C 81 65.160 65.160 65.035 0.125 25575
4083 1 13 . 1 1 81 81 ILE CB C 81 38.440 38.440 37.579 0.861 25575
4084 1 13 . 1 1 81 81 ILE H H 81 8.520 8.520 8.135 0.385 25575
4085 1 13 . 1 1 82 82 GLN N N 82 116.370 116.370 118.943 -2.573 25575
4086 1 13 . 1 1 82 82 GLN HA H 82 4.100 4.100 4.091 0.009 25575
4087 1 13 . 1 1 82 82 GLN CA C 82 57.710 57.710 57.689 0.021 25575
4088 1 13 . 1 1 82 82 GLN CB C 82 28.710 28.710 28.002 0.708 25575
4089 1 13 . 1 1 82 82 GLN H H 82 7.670 7.670 7.850 -0.180 25575
4090 1 13 . 1 1 83 83 SER N N 83 114.440 114.440 117.190 -2.750 25575
4091 1 13 . 1 1 83 83 SER HA H 83 4.300 4.300 4.101 0.199 25575
4092 1 13 . 1 1 83 83 SER CA C 83 60.130 60.130 61.582 -1.452 25575
4093 1 13 . 1 1 83 83 SER CB C 83 63.570 63.570 63.097 0.473 25575
4094 1 13 . 1 1 83 83 SER H H 83 7.810 7.810 8.469 -0.659 25575
4095 1 13 . 1 1 84 84 VAL N N 84 120.750 120.750 117.559 3.191 25575
4096 1 13 . 1 1 84 84 VAL HA H 84 3.970 3.970 3.805 0.165 25575
4097 1 13 . 1 1 84 84 VAL CA C 84 63.430 63.430 63.861 -0.430 25575
4098 1 13 . 1 1 84 84 VAL CB C 84 31.960 31.960 31.000 0.960 25575
4099 1 13 . 1 1 84 84 VAL H H 84 7.790 7.790 7.835 -0.045 25575
4100 1 13 . 1 1 85 85 ARG N N 85 122.090 122.090 118.667 3.423 25575
4101 1 13 . 1 1 85 85 ARG HA H 85 4.240 4.240 4.129 0.111 25575
4102 1 13 . 1 1 85 85 ARG CA C 85 56.850 56.850 56.776 0.074 25575
4103 1 13 . 1 1 85 85 ARG CB C 85 30.720 30.720 30.433 0.287 25575
4104 1 13 . 1 1 85 85 ARG H H 85 8.090 8.090 7.629 0.461 25575
4105 1 13 . 1 1 86 86 ASN N N 86 118.510 118.510 117.550 0.960 25575
4106 1 13 . 1 1 86 86 ASN HA H 86 4.690 4.690 4.764 -0.074 25575
4107 1 13 . 1 1 86 86 ASN CA C 86 53.380 53.380 52.973 0.407 25575
4108 1 13 . 1 1 86 86 ASN CB C 86 38.950 38.950 39.042 -0.092 25575
4109 1 13 . 1 1 86 86 ASN H H 86 8.220 8.220 7.585 0.635 25575
4110 1 13 . 1 1 87 87 LYS N N 87 121.600 121.600 120.909 0.691 25575
4111 1 13 . 1 1 87 87 LYS HA H 87 4.310 4.310 4.243 0.067 25575
4112 1 13 . 1 1 87 87 LYS CA C 87 56.590 56.590 55.934 0.656 25575
4113 1 13 . 1 1 87 87 LYS CB C 87 32.870 32.870 30.129 2.741 25575
4114 1 13 . 1 1 87 87 LYS H H 87 8.150 8.150 8.641 -0.491 25575
4115 1 13 . 1 1 88 88 ARG N N 88 121.920 121.920 121.269 0.651 25575
4116 1 13 . 1 1 88 88 ARG HA H 88 4.330 4.330 4.238 0.092 25575
4117 1 13 . 1 1 88 88 ARG CA C 88 56.110 56.110 56.038 0.072 25575
4118 1 13 . 1 1 88 88 ARG CB C 88 30.870 30.870 31.137 -0.267 25575
4119 1 13 . 1 1 88 88 ARG H H 88 8.250 8.250 7.650 0.600 25575
4120 1 13 . 1 1 89 89 LYS N N 89 123.020 123.020 126.609 -3.589 25575
4121 1 13 . 1 1 89 89 LYS HA H 89 4.320 4.320 4.224 0.096 25575
4122 1 13 . 1 1 89 89 LYS CA C 89 56.330 56.330 57.079 -0.749 25575
4123 1 13 . 1 1 89 89 LYS CB C 89 33.140 33.140 31.919 1.221 25575
4124 1 13 . 1 1 89 89 LYS H H 89 8.320 8.320 8.656 -0.336 25575
4125 1 13 . 1 1 90 90 ARG N N 90 122.970 122.970 119.050 3.920 25575
4126 1 13 . 1 1 90 90 ARG HA H 90 4.360 4.360 4.529 -0.169 25575
4127 1 13 . 1 1 90 90 ARG CA C 90 56.100 56.100 55.563 0.536 25575
4128 1 13 . 1 1 90 90 ARG CB C 90 31.210 31.210 32.141 -0.931 25575
4129 1 13 . 1 1 90 90 ARG H H 90 8.360 8.360 7.717 0.643 25575
4130 1 13 . 1 1 91 91 LYS N N 91 123.680 123.680 120.737 2.943 25575
4131 1 13 . 1 1 91 91 LYS HA H 91 4.380 4.380 4.534 -0.154 25575
4132 1 13 . 1 1 91 91 LYS CA C 91 56.620 56.620 55.652 0.968 25575
4133 1 13 . 1 1 91 91 LYS CB C 91 33.070 33.070 33.519 -0.449 25575
4134 1 13 . 1 1 91 91 LYS H H 91 8.450 8.450 8.510 -0.060 25575
4135 1 14 . 1 1 24 24 SER HA H 24 4.330 4.330 4.607 -0.277 25575
4136 1 14 . 1 1 24 24 SER CA C 24 58.130 58.130 57.695 0.435 25575
4137 1 14 . 1 1 24 24 SER CB C 24 63.870 63.870 64.422 -0.552 25575
4138 1 14 . 1 1 25 25 TYR N N 25 122.160 122.160 124.865 -2.705 25575
4139 1 14 . 1 1 25 25 TYR HA H 25 4.530 4.530 4.254 0.276 25575
4140 1 14 . 1 1 25 25 TYR CA C 25 58.420 58.420 59.236 -0.816 25575
4141 1 14 . 1 1 25 25 TYR CB C 25 38.570 38.570 37.633 0.937 25575
4142 1 14 . 1 1 25 25 TYR H H 25 8.310 8.310 8.786 -0.476 25575
4143 1 14 . 1 1 26 26 GLY N N 26 111.370 111.370 106.140 5.230 25575
4144 1 14 . 1 1 26 26 GLY CA C 26 45.330 45.330 45.383 -0.053 25575
4145 1 14 . 1 1 26 26 GLY H H 26 8.300 8.300 8.362 -0.062 25575
4146 1 14 . 1 1 27 27 GLN N N 27 118.910 118.910 122.048 -3.138 25575
4147 1 14 . 1 1 27 27 GLN HA H 27 4.510 4.510 4.481 0.029 25575
4148 1 14 . 1 1 27 27 GLN CA C 27 55.240 55.240 54.758 0.482 25575
4149 1 14 . 1 1 27 27 GLN CB C 27 29.800 29.800 28.352 1.448 25575
4150 1 14 . 1 1 27 27 GLN H H 27 8.050 8.050 7.770 0.280 25575
4151 1 14 . 1 1 28 28 SER N N 28 119.460 119.460 115.759 3.701 25575
4152 1 14 . 1 1 28 28 SER HA H 28 4.810 4.810 5.190 -0.380 25575
4153 1 14 . 1 1 28 28 SER CA C 28 57.710 57.710 56.628 1.082 25575
4154 1 14 . 1 1 28 28 SER CB C 28 65.530 65.530 65.819 -0.288 25575
4155 1 14 . 1 1 28 28 SER H H 28 8.800 8.800 7.951 0.849 25575
4156 1 14 . 1 1 29 29 CYS N N 29 122.160 122.160 119.044 3.116 25575
4157 1 14 . 1 1 29 29 CYS HA H 29 4.130 4.130 4.451 -0.321 25575
4158 1 14 . 1 1 29 29 CYS CA C 29 60.620 60.620 61.235 -0.615 25575
4159 1 14 . 1 1 29 29 CYS CB C 29 32.770 32.770 28.862 3.908 25575
4160 1 14 . 1 1 29 29 CYS H H 29 8.390 8.390 8.658 -0.268 25575
4161 1 14 . 1 1 30 30 CYS N N 30 122.320 122.320 119.738 2.582 25575
4162 1 14 . 1 1 30 30 CYS HA H 30 4.530 4.530 4.766 -0.236 25575
4163 1 14 . 1 1 30 30 CYS CA C 30 58.810 58.810 58.230 0.580 25575
4164 1 14 . 1 1 30 30 CYS CB C 30 28.910 28.910 27.718 1.192 25575
4165 1 14 . 1 1 30 30 CYS H H 30 8.340 8.340 8.671 -0.331 25575
4166 1 14 . 1 1 31 31 LEU N N 31 122.390 122.390 121.685 0.705 25575
4167 1 14 . 1 1 31 31 LEU HA H 31 4.640 4.640 4.746 -0.106 25575
4168 1 14 . 1 1 31 31 LEU CA C 31 55.440 55.440 55.059 0.380 25575
4169 1 14 . 1 1 31 31 LEU CB C 31 43.490 43.490 42.792 0.698 25575
4170 1 14 . 1 1 31 31 LEU H H 31 8.460 8.460 7.193 1.267 25575
4171 1 14 . 1 1 32 32 ILE N N 32 118.890 118.890 117.065 1.825 25575
4172 1 14 . 1 1 32 32 ILE HA H 32 4.200 4.200 4.842 -0.642 25575
4173 1 14 . 1 1 32 32 ILE CA C 32 60.440 60.440 60.076 0.364 25575
4174 1 14 . 1 1 32 32 ILE CB C 32 39.890 39.890 42.264 -2.374 25575
4175 1 14 . 1 1 32 32 ILE H H 32 8.680 8.680 8.047 0.633 25575
4176 1 14 . 1 1 33 33 GLU N N 33 128.400 128.400 124.941 3.459 25575
4177 1 14 . 1 1 33 33 GLU HA H 33 5.080 5.080 5.163 -0.083 25575
4178 1 14 . 1 1 33 33 GLU CA C 33 54.120 54.120 54.836 -0.716 25575
4179 1 14 . 1 1 33 33 GLU CB C 33 32.080 32.080 33.269 -1.189 25575
4180 1 14 . 1 1 33 33 GLU H H 33 8.640 8.640 8.953 -0.313 25575
4181 1 14 . 1 1 34 34 ASP N N 34 130.390 130.390 127.072 3.318 25575
4182 1 14 . 1 1 34 34 ASP HA H 34 4.310 4.310 4.343 -0.033 25575
4183 1 14 . 1 1 34 34 ASP CA C 34 55.150 55.150 56.213 -1.063 25575
4184 1 14 . 1 1 34 34 ASP CB C 34 40.050 40.050 40.750 -0.700 25575
4185 1 14 . 1 1 34 34 ASP H H 34 9.540 9.540 8.676 0.864 25575
4186 1 14 . 1 1 35 35 GLY N N 35 126.620 126.620 104.812 21.808 25575
4187 1 14 . 1 1 35 35 GLY CA C 35 45.480 45.480 44.839 0.641 25575
4188 1 14 . 1 1 35 35 GLY H H 35 8.370 8.370 7.439 0.931 25575
4189 1 14 . 1 1 36 36 GLU N N 36 120.860 120.860 122.400 -1.540 25575
4190 1 14 . 1 1 36 36 GLU HA H 36 4.670 4.670 4.234 0.436 25575
4191 1 14 . 1 1 36 36 GLU CA C 36 54.350 54.350 55.908 -1.558 25575
4192 1 14 . 1 1 36 36 GLU CB C 36 31.630 31.630 30.266 1.364 25575
4193 1 14 . 1 1 36 36 GLU H H 36 7.820 7.820 7.825 -0.005 25575
4194 1 14 . 1 1 37 37 ARG N N 37 129.790 129.790 127.512 2.278 25575
4195 1 14 . 1 1 37 37 ARG HA H 37 4.200 4.200 4.305 -0.105 25575
4196 1 14 . 1 1 37 37 ARG CA C 37 56.440 56.440 54.860 1.580 25575
4197 1 14 . 1 1 37 37 ARG CB C 37 29.710 29.710 29.422 0.288 25575
4198 1 14 . 1 1 37 37 ARG H H 37 8.930 8.930 8.430 0.500 25575
4199 1 14 . 1 1 38 38 CYS N N 38 130.950 130.950 126.315 4.635 25575
4200 1 14 . 1 1 38 38 CYS HA H 38 4.450 4.450 4.392 0.058 25575
4201 1 14 . 1 1 38 38 CYS CA C 38 60.560 60.560 60.616 -0.056 25575
4202 1 14 . 1 1 38 38 CYS CB C 38 31.250 31.250 28.105 3.145 25575
4203 1 14 . 1 1 38 38 CYS H H 38 9.050 9.050 8.343 0.707 25575
4204 1 14 . 1 1 39 39 VAL N N 39 118.270 118.270 120.767 -2.497 25575
4205 1 14 . 1 1 39 39 VAL HA H 39 4.710 4.710 4.468 0.242 25575
4206 1 14 . 1 1 39 39 VAL CA C 39 60.340 60.340 60.678 -0.339 25575
4207 1 14 . 1 1 39 39 VAL CB C 39 31.290 31.290 32.193 -0.903 25575
4208 1 14 . 1 1 39 39 VAL H H 39 8.060 8.060 8.044 0.016 25575
4209 1 14 . 1 1 40 40 ARG N N 40 127.360 127.360 122.869 4.491 25575
4210 1 14 . 1 1 40 40 ARG HA H 40 4.430 4.430 4.310 0.120 25575
4211 1 14 . 1 1 40 40 ARG CA C 40 56.150 56.150 55.045 1.105 25575
4212 1 14 . 1 1 40 40 ARG CB C 40 29.210 29.210 29.456 -0.246 25575
4213 1 14 . 1 1 40 40 ARG H H 40 8.950 8.950 7.734 1.216 25575
4214 1 14 . 1 1 41 41 PRO HA H 41 4.430 4.430 4.542 -0.112 25575
4215 1 14 . 1 1 41 41 PRO CA C 41 62.690 62.690 62.804 -0.114 25575
4216 1 14 . 1 1 41 41 PRO CB C 41 32.010 32.010 32.050 -0.040 25575
4217 1 14 . 1 1 42 42 ALA N N 42 124.260 124.260 126.175 -1.915 25575
4218 1 14 . 1 1 42 42 ALA HA H 42 3.620 3.620 4.167 -0.547 25575
4219 1 14 . 1 1 42 42 ALA CA C 42 52.930 52.930 52.303 0.627 25575
4220 1 14 . 1 1 42 42 ALA CB C 42 19.130 19.130 19.620 -0.490 25575
4221 1 14 . 1 1 42 42 ALA H H 42 8.410 8.410 8.277 0.133 25575
4222 1 14 . 1 1 43 43 GLY N N 43 112.690 112.690 108.085 4.605 25575
4223 1 14 . 1 1 43 43 GLY CA C 43 44.240 44.240 44.178 0.062 25575
4224 1 14 . 1 1 43 43 GLY H H 43 8.090 8.090 8.295 -0.205 25575
4225 1 14 . 1 1 44 44 ASN N N 44 116.980 116.980 120.159 -3.179 25575
4226 1 14 . 1 1 44 44 ASN HA H 44 4.690 4.690 4.657 0.033 25575
4227 1 14 . 1 1 44 44 ASN CA C 44 53.420 53.420 53.641 -0.221 25575
4228 1 14 . 1 1 44 44 ASN CB C 44 39.370 39.370 36.610 2.760 25575
4229 1 14 . 1 1 44 44 ASN H H 44 8.720 8.720 8.800 -0.080 25575
4230 1 14 . 1 1 45 45 ALA N N 45 124.240 124.240 122.908 1.332 25575
4231 1 14 . 1 1 45 45 ALA HA H 45 4.640 4.640 4.753 -0.113 25575
4232 1 14 . 1 1 45 45 ALA CA C 45 52.240 52.240 51.441 0.799 25575
4233 1 14 . 1 1 45 45 ALA CB C 45 19.540 19.540 21.845 -2.305 25575
4234 1 14 . 1 1 45 45 ALA H H 45 8.770 8.770 8.138 0.632 25575
4235 1 14 . 1 1 46 46 SER N N 46 111.670 111.670 115.642 -3.972 25575
4236 1 14 . 1 1 46 46 SER HA H 46 5.300 5.300 4.923 0.377 25575
4237 1 14 . 1 1 46 46 SER CA C 46 56.580 56.580 57.265 -0.685 25575
4238 1 14 . 1 1 46 46 SER CB C 46 66.490 66.490 65.828 0.662 25575
4239 1 14 . 1 1 46 46 SER H H 46 8.060 8.060 8.295 -0.235 25575
4240 1 14 . 1 1 47 47 PHE HA H 47 4.520 4.520 4.648 -0.128 25575
4241 1 14 . 1 1 47 47 PHE CA C 47 57.000 57.000 56.577 0.423 25575
4242 1 14 . 1 1 47 47 PHE CB C 47 38.360 38.360 38.494 -0.134 25575
4243 1 14 . 1 1 48 48 SER N N 48 116.970 116.970 116.629 0.341 25575
4244 1 14 . 1 1 48 48 SER HA H 48 4.440 4.440 4.445 -0.005 25575
4245 1 14 . 1 1 48 48 SER CA C 48 56.950 56.950 57.680 -0.730 25575
4246 1 14 . 1 1 48 48 SER CB C 48 65.810 65.810 64.384 1.426 25575
4247 1 14 . 1 1 48 48 SER H H 48 7.100 7.100 7.455 -0.355 25575
4248 1 14 . 1 1 49 49 LYS N N 49 120.650 120.650 123.082 -2.432 25575
4249 1 14 . 1 1 49 49 LYS HA H 49 3.900 3.900 4.097 -0.197 25575
4250 1 14 . 1 1 49 49 LYS CA C 49 59.570 59.570 59.720 -0.150 25575
4251 1 14 . 1 1 49 49 LYS CB C 49 31.790 31.790 31.745 0.045 25575
4252 1 14 . 1 1 49 49 LYS H H 49 8.770 8.770 8.682 0.088 25575
4253 1 14 . 1 1 50 50 ARG N N 50 118.240 118.240 118.750 -0.510 25575
4254 1 14 . 1 1 50 50 ARG HA H 50 4.040 4.040 4.060 -0.020 25575
4255 1 14 . 1 1 50 50 ARG CA C 50 59.070 59.070 58.803 0.267 25575
4256 1 14 . 1 1 50 50 ARG CB C 50 30.080 30.080 29.677 0.403 25575
4257 1 14 . 1 1 50 50 ARG H H 50 8.040 8.040 8.274 -0.234 25575
4258 1 14 . 1 1 51 51 VAL N N 51 121.680 121.680 119.257 2.423 25575
4259 1 14 . 1 1 51 51 VAL HA H 51 3.590 3.590 3.667 -0.077 25575
4260 1 14 . 1 1 51 51 VAL CA C 51 65.940 65.940 65.094 0.846 25575
4261 1 14 . 1 1 51 51 VAL CB C 51 31.620 31.620 30.974 0.646 25575
4262 1 14 . 1 1 51 51 VAL H H 51 7.350 7.350 7.857 -0.507 25575
4263 1 14 . 1 1 52 52 GLN N N 52 119.680 119.680 119.411 0.269 25575
4264 1 14 . 1 1 52 52 GLN HA H 52 3.570 3.570 3.531 0.039 25575
4265 1 14 . 1 1 52 52 GLN CA C 52 59.210 59.210 59.473 -0.263 25575
4266 1 14 . 1 1 52 52 GLN CB C 52 28.620 28.620 28.149 0.471 25575
4267 1 14 . 1 1 52 52 GLN H H 52 8.210 8.210 7.858 0.352 25575
4268 1 14 . 1 1 53 53 LYS N N 53 118.080 118.080 119.485 -1.405 25575
4269 1 14 . 1 1 53 53 LYS HA H 53 4.160 4.160 3.953 0.207 25575
4270 1 14 . 1 1 53 53 LYS CA C 53 58.670 58.670 59.372 -0.702 25575
4271 1 14 . 1 1 53 53 LYS CB C 53 32.120 32.120 32.193 -0.073 25575
4272 1 14 . 1 1 53 53 LYS H H 53 7.960 7.960 8.025 -0.065 25575
4273 1 14 . 1 1 54 54 SER N N 54 115.450 115.450 114.384 1.066 25575
4274 1 14 . 1 1 54 54 SER HA H 54 4.370 4.370 4.184 0.186 25575
4275 1 14 . 1 1 54 54 SER CA C 54 61.330 61.330 61.396 -0.066 25575
4276 1 14 . 1 1 54 54 SER CB C 54 63.690 63.690 63.138 0.552 25575
4277 1 14 . 1 1 54 54 SER H H 54 7.800 7.800 7.529 0.271 25575
4278 1 14 . 1 1 55 55 ILE N N 55 117.670 117.670 119.384 -1.714 25575
4279 1 14 . 1 1 55 55 ILE HA H 55 4.060 4.060 3.938 0.122 25575
4280 1 14 . 1 1 55 55 ILE CA C 55 63.330 63.330 64.061 -0.731 25575
4281 1 14 . 1 1 55 55 ILE CB C 55 38.980 38.980 38.487 0.493 25575
4282 1 14 . 1 1 55 55 ILE H H 55 7.840 7.840 7.660 0.180 25575
4283 1 14 . 1 1 56 56 SER N N 56 115.650 115.650 117.061 -1.411 25575
4284 1 14 . 1 1 56 56 SER HA H 56 4.490 4.490 4.071 0.419 25575
4285 1 14 . 1 1 56 56 SER CA C 56 60.220 60.220 61.720 -1.500 25575
4286 1 14 . 1 1 56 56 SER CB C 56 63.000 63.000 62.997 0.003 25575
4287 1 14 . 1 1 56 56 SER H H 56 8.060 8.060 8.536 -0.476 25575
4288 1 14 . 1 1 57 57 GLN N N 57 121.830 121.830 119.494 2.336 25575
4289 1 14 . 1 1 57 57 GLN HA H 57 4.200 4.200 4.135 0.065 25575
4290 1 14 . 1 1 57 57 GLN CA C 57 58.310 58.310 57.806 0.504 25575
4291 1 14 . 1 1 57 57 GLN CB C 57 28.850 28.850 28.877 -0.027 25575
4292 1 14 . 1 1 57 57 GLN H H 57 8.620 8.620 7.959 0.661 25575
4293 1 14 . 1 1 58 58 LYS N N 58 116.960 116.960 117.246 -0.286 25575
4294 1 14 . 1 1 58 58 LYS HA H 58 4.290 4.290 4.393 -0.103 25575
4295 1 14 . 1 1 58 58 LYS CA C 58 56.920 56.920 54.981 1.939 25575
4296 1 14 . 1 1 58 58 LYS CB C 58 32.900 32.900 33.159 -0.259 25575
4297 1 14 . 1 1 58 58 LYS H H 58 7.950 7.950 7.615 0.335 25575
4298 1 14 . 1 1 59 59 LYS N N 59 116.960 116.960 118.949 -1.989 25575
4299 1 14 . 1 1 59 59 LYS HA H 59 4.120 4.120 3.946 0.174 25575
4300 1 14 . 1 1 59 59 LYS CA C 59 57.090 57.090 57.265 -0.175 25575
4301 1 14 . 1 1 59 59 LYS CB C 59 30.080 30.080 30.538 -0.458 25575
4302 1 14 . 1 1 59 59 LYS H H 59 7.950 7.950 7.886 0.064 25575
4303 1 14 . 1 1 60 60 LEU N N 60 117.540 117.540 118.751 -1.211 25575
4304 1 14 . 1 1 60 60 LEU HA H 60 4.480 4.480 4.329 0.151 25575
4305 1 14 . 1 1 60 60 LEU CA C 60 54.500 54.500 55.203 -0.703 25575
4306 1 14 . 1 1 60 60 LEU CB C 60 42.840 42.840 42.525 0.315 25575
4307 1 14 . 1 1 60 60 LEU H H 60 7.930 7.930 7.577 0.352 25575
4308 1 14 . 1 1 61 61 LYS HA H 61 4.390 4.390 4.228 0.162 25575
4309 1 14 . 1 1 61 61 LYS CA C 61 55.540 55.540 56.357 -0.817 25575
4310 1 14 . 1 1 61 61 LYS CB C 61 30.050 30.050 30.847 -0.797 25575
4311 1 14 . 1 1 62 62 LEU N N 62 120.000 120.000 122.557 -2.557 25575
4312 1 14 . 1 1 62 62 LEU HA H 62 5.250 5.250 4.821 0.429 25575
4313 1 14 . 1 1 62 62 LEU CA C 62 53.080 53.080 54.471 -1.391 25575
4314 1 14 . 1 1 62 62 LEU CB C 62 45.760 45.760 41.075 4.685 25575
4315 1 14 . 1 1 62 62 LEU H H 62 7.470 7.470 7.554 -0.084 25575
4316 1 14 . 1 1 63 63 ASP N N 63 121.730 121.730 123.580 -1.850 25575
4317 1 14 . 1 1 63 63 ASP HA H 63 4.860 4.860 4.713 0.147 25575
4318 1 14 . 1 1 63 63 ASP CA C 63 51.890 51.890 53.149 -1.259 25575
4319 1 14 . 1 1 63 63 ASP CB C 63 44.910 44.910 43.787 1.123 25575
4320 1 14 . 1 1 63 63 ASP H H 63 8.620 8.620 8.327 0.293 25575
4321 1 14 . 1 1 64 64 ILE N N 64 118.120 118.120 119.316 -1.196 25575
4322 1 14 . 1 1 64 64 ILE HA H 64 4.210 4.210 4.354 -0.144 25575
4323 1 14 . 1 1 64 64 ILE CA C 64 60.430 60.430 58.457 1.973 25575
4324 1 14 . 1 1 64 64 ILE CB C 64 40.420 40.420 39.683 0.737 25575
4325 1 14 . 1 1 64 64 ILE H H 64 8.650 8.650 8.191 0.459 25575
4326 1 14 . 1 1 65 65 ASP N N 65 124.550 124.550 128.326 -3.776 25575
4327 1 14 . 1 1 65 65 ASP HA H 65 4.570 4.570 4.507 0.063 25575
4328 1 14 . 1 1 65 65 ASP CA C 65 53.310 53.310 54.659 -1.349 25575
4329 1 14 . 1 1 65 65 ASP CB C 65 40.440 40.440 42.027 -1.587 25575
4330 1 14 . 1 1 65 65 ASP H H 65 8.630 8.630 8.434 0.196 25575
4331 1 14 . 1 1 66 66 LYS N N 66 125.970 125.970 125.424 0.546 25575
4332 1 14 . 1 1 66 66 LYS HA H 66 4.040 4.040 4.314 -0.274 25575
4333 1 14 . 1 1 66 66 LYS CA C 66 58.140 58.140 57.296 0.844 25575
4334 1 14 . 1 1 66 66 LYS CB C 66 31.990 31.990 32.601 -0.611 25575
4335 1 14 . 1 1 66 66 LYS H H 66 8.590 8.590 8.611 -0.021 25575
4336 1 14 . 1 1 67 67 SER N N 67 114.980 114.980 116.256 -1.276 25575
4337 1 14 . 1 1 67 67 SER HA H 67 4.320 4.320 4.181 0.139 25575
4338 1 14 . 1 1 67 67 SER CA C 67 60.330 60.330 60.988 -0.658 25575
4339 1 14 . 1 1 67 67 SER CB C 67 63.710 63.710 63.237 0.473 25575
4340 1 14 . 1 1 67 67 SER H H 67 8.760 8.760 8.693 0.067 25575
4341 1 14 . 1 1 68 68 VAL HA H 68 4.250 4.250 4.045 0.205 25575
4342 1 14 . 1 1 68 68 VAL CA C 68 62.150 62.150 61.975 0.175 25575
4343 1 14 . 1 1 68 68 VAL CB C 68 31.900 31.900 31.920 -0.020 25575
4344 1 14 . 1 1 69 69 ARG CA C 69 56.960 56.960 57.705 -0.745 25575
4345 1 14 . 1 1 70 70 HIS N N 70 116.270 116.270 114.101 2.169 25575
4346 1 14 . 1 1 70 70 HIS HA H 70 4.760 4.760 4.702 0.058 25575
4347 1 14 . 1 1 70 70 HIS CA C 70 55.360 55.360 54.281 1.079 25575
4348 1 14 . 1 1 70 70 HIS CB C 70 33.100 33.100 31.113 1.987 25575
4349 1 14 . 1 1 70 70 HIS H H 70 7.390 7.390 8.007 -0.617 25575
4350 1 14 . 1 1 71 71 LEU N N 71 120.200 120.200 122.184 -1.984 25575
4351 1 14 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.611 0.449 25575
4352 1 14 . 1 1 71 71 LEU CA C 71 54.070 54.070 53.827 0.243 25575
4353 1 14 . 1 1 71 71 LEU CB C 71 42.710 42.710 40.720 1.990 25575
4354 1 14 . 1 1 71 71 LEU H H 71 7.970 7.970 8.390 -0.420 25575
4355 1 14 . 1 1 72 72 TYR HA H 72 5.030 5.030 4.695 0.335 25575
4356 1 14 . 1 1 72 72 TYR CA C 72 59.990 59.990 57.663 2.327 25575
4357 1 14 . 1 1 72 72 TYR CB C 72 39.440 39.440 40.438 -0.998 25575
4358 1 14 . 1 1 73 73 ILE N N 73 112.940 112.940 113.622 -0.682 25575
4359 1 14 . 1 1 73 73 ILE HA H 73 6.080 6.080 4.826 1.254 25575
4360 1 14 . 1 1 73 73 ILE CA C 73 58.090 58.090 58.555 -0.465 25575
4361 1 14 . 1 1 73 73 ILE CB C 73 41.820 41.820 42.351 -0.531 25575
4362 1 14 . 1 1 73 73 ILE H H 73 8.450 8.450 8.002 0.448 25575
4363 1 14 . 1 1 74 74 CYS N N 74 124.730 124.730 120.207 4.523 25575
4364 1 14 . 1 1 74 74 CYS HA H 74 5.080 5.080 5.057 0.023 25575
4365 1 14 . 1 1 74 74 CYS CA C 74 57.670 57.670 57.847 -0.177 25575
4366 1 14 . 1 1 74 74 CYS CB C 74 33.330 33.330 29.733 3.597 25575
4367 1 14 . 1 1 74 74 CYS H H 74 9.830 9.830 8.745 1.085 25575
4368 1 14 . 1 1 75 75 ASP N N 75 120.990 120.990 123.984 -2.994 25575
4369 1 14 . 1 1 75 75 ASP HA H 75 4.590 4.590 4.394 0.196 25575
4370 1 14 . 1 1 75 75 ASP CA C 75 57.320 57.320 57.867 -0.547 25575
4371 1 14 . 1 1 75 75 ASP CB C 75 39.670 39.670 41.033 -1.363 25575
4372 1 14 . 1 1 75 75 ASP H H 75 9.090 9.090 9.089 0.001 25575
4373 1 14 . 1 1 76 76 PHE N N 76 122.470 122.470 119.302 3.168 25575
4374 1 14 . 1 1 76 76 PHE HA H 76 4.230 4.230 4.096 0.134 25575
4375 1 14 . 1 1 76 76 PHE CA C 76 62.030 62.030 62.079 -0.049 25575
4376 1 14 . 1 1 76 76 PHE CB C 76 38.190 38.190 39.100 -0.910 25575
4377 1 14 . 1 1 76 76 PHE H H 76 8.330 8.330 8.530 -0.200 25575
4378 1 14 . 1 1 77 77 HIS N N 77 124.580 124.580 117.587 6.993 25575
4379 1 14 . 1 1 77 77 HIS HA H 77 4.280 4.280 4.312 -0.032 25575
4380 1 14 . 1 1 77 77 HIS CA C 77 63.880 63.880 59.319 4.561 25575
4381 1 14 . 1 1 77 77 HIS CB C 77 29.600 29.600 30.153 -0.553 25575
4382 1 14 . 1 1 77 77 HIS H H 77 10.300 10.300 7.741 2.559 25575
4383 1 14 . 1 1 78 78 LYS N N 78 122.930 122.930 120.379 2.551 25575
4384 1 14 . 1 1 78 78 LYS HA H 78 3.860 3.860 3.938 -0.078 25575
4385 1 14 . 1 1 78 78 LYS CA C 78 60.550 60.550 60.154 0.396 25575
4386 1 14 . 1 1 78 78 LYS CB C 78 32.040 32.040 32.365 -0.325 25575
4387 1 14 . 1 1 78 78 LYS H H 78 8.960 8.960 8.543 0.417 25575
4388 1 14 . 1 1 79 79 ASN N N 79 116.670 116.670 117.913 -1.243 25575
4389 1 14 . 1 1 79 79 ASN HA H 79 4.420 4.420 4.495 -0.075 25575
4390 1 14 . 1 1 79 79 ASN CA C 79 56.030 56.030 56.316 -0.286 25575
4391 1 14 . 1 1 79 79 ASN CB C 79 38.100 38.100 38.377 -0.277 25575
4392 1 14 . 1 1 79 79 ASN H H 79 8.230 8.230 8.370 -0.140 25575
4393 1 14 . 1 1 80 80 PHE N N 80 122.600 122.600 121.675 0.925 25575
4394 1 14 . 1 1 80 80 PHE HA H 80 4.180 4.180 4.114 0.066 25575
4395 1 14 . 1 1 80 80 PHE CA C 80 60.700 60.700 61.227 -0.527 25575
4396 1 14 . 1 1 80 80 PHE CB C 80 39.840 39.840 38.999 0.841 25575
4397 1 14 . 1 1 80 80 PHE H H 80 8.200 8.200 7.845 0.355 25575
4398 1 14 . 1 1 81 81 ILE N N 81 118.240 118.240 115.316 2.924 25575
4399 1 14 . 1 1 81 81 ILE HA H 81 3.320 3.320 3.539 -0.219 25575
4400 1 14 . 1 1 81 81 ILE CA C 81 65.160 65.160 63.721 1.439 25575
4401 1 14 . 1 1 81 81 ILE CB C 81 38.440 38.440 37.648 0.792 25575
4402 1 14 . 1 1 81 81 ILE H H 81 8.520 8.520 7.977 0.543 25575
4403 1 14 . 1 1 82 82 GLN N N 82 116.370 116.370 117.716 -1.346 25575
4404 1 14 . 1 1 82 82 GLN HA H 82 4.100 4.100 4.056 0.044 25575
4405 1 14 . 1 1 82 82 GLN CA C 82 57.710 57.710 58.041 -0.331 25575
4406 1 14 . 1 1 82 82 GLN CB C 82 28.710 28.710 29.067 -0.357 25575
4407 1 14 . 1 1 82 82 GLN H H 82 7.670 7.670 7.508 0.162 25575
4408 1 14 . 1 1 83 83 SER N N 83 114.440 114.440 117.360 -2.920 25575
4409 1 14 . 1 1 83 83 SER HA H 83 4.300 4.300 4.166 0.134 25575
4410 1 14 . 1 1 83 83 SER CA C 83 60.130 60.130 61.564 -1.434 25575
4411 1 14 . 1 1 83 83 SER CB C 83 63.570 63.570 63.091 0.479 25575
4412 1 14 . 1 1 83 83 SER H H 83 7.810 7.810 8.641 -0.831 25575
4413 1 14 . 1 1 84 84 VAL N N 84 120.750 120.750 118.167 2.583 25575
4414 1 14 . 1 1 84 84 VAL HA H 84 3.970 3.970 3.700 0.270 25575
4415 1 14 . 1 1 84 84 VAL CA C 84 63.430 63.430 64.778 -1.348 25575
4416 1 14 . 1 1 84 84 VAL CB C 84 31.960 31.960 31.233 0.727 25575
4417 1 14 . 1 1 84 84 VAL H H 84 7.790 7.790 7.354 0.436 25575
4418 1 14 . 1 1 85 85 ARG N N 85 122.090 122.090 118.721 3.369 25575
4419 1 14 . 1 1 85 85 ARG HA H 85 4.240 4.240 4.137 0.103 25575
4420 1 14 . 1 1 85 85 ARG CA C 85 56.850 56.850 56.629 0.221 25575
4421 1 14 . 1 1 85 85 ARG CB C 85 30.720 30.720 29.937 0.783 25575
4422 1 14 . 1 1 85 85 ARG H H 85 8.090 8.090 7.610 0.480 25575
4423 1 14 . 1 1 86 86 ASN N N 86 118.510 118.510 115.185 3.325 25575
4424 1 14 . 1 1 86 86 ASN HA H 86 4.690 4.690 4.360 0.330 25575
4425 1 14 . 1 1 86 86 ASN CA C 86 53.380 53.380 54.676 -1.296 25575
4426 1 14 . 1 1 86 86 ASN CB C 86 38.950 38.950 37.393 1.557 25575
4427 1 14 . 1 1 86 86 ASN H H 86 8.220 8.220 8.538 -0.318 25575
4428 1 14 . 1 1 87 87 LYS N N 87 121.600 121.600 118.447 3.153 25575
4429 1 14 . 1 1 87 87 LYS HA H 87 4.310 4.310 4.353 -0.043 25575
4430 1 14 . 1 1 87 87 LYS CA C 87 56.590 56.590 57.070 -0.480 25575
4431 1 14 . 1 1 87 87 LYS CB C 87 32.870 32.870 33.422 -0.552 25575
4432 1 14 . 1 1 87 87 LYS H H 87 8.150 8.150 8.291 -0.141 25575
4433 1 14 . 1 1 88 88 ARG N N 88 121.920 121.920 119.067 2.853 25575
4434 1 14 . 1 1 88 88 ARG HA H 88 4.330 4.330 4.549 -0.219 25575
4435 1 14 . 1 1 88 88 ARG CA C 88 56.110 56.110 56.028 0.083 25575
4436 1 14 . 1 1 88 88 ARG CB C 88 30.870 30.870 29.476 1.394 25575
4437 1 14 . 1 1 88 88 ARG H H 88 8.250 8.250 8.198 0.052 25575
4438 1 14 . 1 1 89 89 LYS N N 89 123.020 123.020 121.165 1.855 25575
4439 1 14 . 1 1 89 89 LYS HA H 89 4.320 4.320 4.513 -0.193 25575
4440 1 14 . 1 1 89 89 LYS CA C 89 56.330 56.330 55.212 1.118 25575
4441 1 14 . 1 1 89 89 LYS CB C 89 33.140 33.140 33.890 -0.750 25575
4442 1 14 . 1 1 89 89 LYS H H 89 8.320 8.320 8.027 0.293 25575
4443 1 14 . 1 1 90 90 ARG N N 90 122.970 122.970 123.907 -0.937 25575
4444 1 14 . 1 1 90 90 ARG HA H 90 4.360 4.360 4.231 0.129 25575
4445 1 14 . 1 1 90 90 ARG CA C 90 56.100 56.100 56.571 -0.471 25575
4446 1 14 . 1 1 90 90 ARG CB C 90 31.210 31.210 30.598 0.612 25575
4447 1 14 . 1 1 90 90 ARG H H 90 8.360 8.360 8.508 -0.148 25575
4448 1 14 . 1 1 91 91 LYS N N 91 123.680 123.680 123.187 0.493 25575
4449 1 14 . 1 1 91 91 LYS HA H 91 4.380 4.380 4.327 0.053 25575
4450 1 14 . 1 1 91 91 LYS CA C 91 56.620 56.620 56.086 0.534 25575
4451 1 14 . 1 1 91 91 LYS CB C 91 33.070 33.070 33.054 0.016 25575
4452 1 14 . 1 1 91 91 LYS H H 91 8.450 8.450 8.228 0.222 25575
4453 1 15 . 1 1 24 24 SER HA H 24 4.330 4.330 4.341 -0.011 25575
4454 1 15 . 1 1 24 24 SER CA C 24 58.130 58.130 58.472 -0.342 25575
4455 1 15 . 1 1 24 24 SER CB C 24 63.870 63.870 62.767 1.103 25575
4456 1 15 . 1 1 25 25 TYR N N 25 122.160 122.160 122.199 -0.039 25575
4457 1 15 . 1 1 25 25 TYR HA H 25 4.530 4.530 4.481 0.049 25575
4458 1 15 . 1 1 25 25 TYR CA C 25 58.420 58.420 58.422 -0.002 25575
4459 1 15 . 1 1 25 25 TYR CB C 25 38.570 38.570 39.064 -0.494 25575
4460 1 15 . 1 1 25 25 TYR H H 25 8.310 8.310 7.891 0.419 25575
4461 1 15 . 1 1 26 26 GLY N N 26 111.370 111.370 110.974 0.396 25575
4462 1 15 . 1 1 26 26 GLY CA C 26 45.330 45.330 44.832 0.498 25575
4463 1 15 . 1 1 26 26 GLY H H 26 8.300 8.300 8.402 -0.102 25575
4464 1 15 . 1 1 27 27 GLN N N 27 118.910 118.910 118.998 -0.088 25575
4465 1 15 . 1 1 27 27 GLN HA H 27 4.510 4.510 4.769 -0.259 25575
4466 1 15 . 1 1 27 27 GLN CA C 27 55.240 55.240 54.892 0.348 25575
4467 1 15 . 1 1 27 27 GLN CB C 27 29.800 29.800 32.074 -2.274 25575
4468 1 15 . 1 1 27 27 GLN H H 27 8.050 8.050 8.391 -0.341 25575
4469 1 15 . 1 1 28 28 SER N N 28 119.460 119.460 114.635 4.825 25575
4470 1 15 . 1 1 28 28 SER HA H 28 4.810 4.810 5.221 -0.411 25575
4471 1 15 . 1 1 28 28 SER CA C 28 57.710 57.710 56.995 0.715 25575
4472 1 15 . 1 1 28 28 SER CB C 28 65.530 65.530 65.708 -0.178 25575
4473 1 15 . 1 1 28 28 SER H H 28 8.800 8.800 8.565 0.235 25575
4474 1 15 . 1 1 29 29 CYS N N 29 122.160 122.160 119.348 2.812 25575
4475 1 15 . 1 1 29 29 CYS HA H 29 4.130 4.130 4.431 -0.301 25575
4476 1 15 . 1 1 29 29 CYS CA C 29 60.620 60.620 61.077 -0.457 25575
4477 1 15 . 1 1 29 29 CYS CB C 29 32.770 32.770 29.127 3.643 25575
4478 1 15 . 1 1 29 29 CYS H H 29 8.390 8.390 8.570 -0.180 25575
4479 1 15 . 1 1 30 30 CYS N N 30 122.320 122.320 122.034 0.286 25575
4480 1 15 . 1 1 30 30 CYS HA H 30 4.530 4.530 4.768 -0.238 25575
4481 1 15 . 1 1 30 30 CYS CA C 30 58.810 58.810 57.873 0.937 25575
4482 1 15 . 1 1 30 30 CYS CB C 30 28.910 28.910 27.723 1.187 25575
4483 1 15 . 1 1 30 30 CYS H H 30 8.340 8.340 8.531 -0.191 25575
4484 1 15 . 1 1 31 31 LEU N N 31 122.390 122.390 121.603 0.787 25575
4485 1 15 . 1 1 31 31 LEU HA H 31 4.640 4.640 4.902 -0.262 25575
4486 1 15 . 1 1 31 31 LEU CA C 31 55.440 55.440 54.738 0.702 25575
4487 1 15 . 1 1 31 31 LEU CB C 31 43.490 43.490 42.932 0.558 25575
4488 1 15 . 1 1 31 31 LEU H H 31 8.460 8.460 7.165 1.295 25575
4489 1 15 . 1 1 32 32 ILE N N 32 118.890 118.890 118.806 0.084 25575
4490 1 15 . 1 1 32 32 ILE HA H 32 4.200 4.200 4.856 -0.656 25575
4491 1 15 . 1 1 32 32 ILE CA C 32 60.440 60.440 59.945 0.495 25575
4492 1 15 . 1 1 32 32 ILE CB C 32 39.890 39.890 41.871 -1.981 25575
4493 1 15 . 1 1 32 32 ILE H H 32 8.680 8.680 8.095 0.585 25575
4494 1 15 . 1 1 33 33 GLU N N 33 128.400 128.400 125.900 2.500 25575
4495 1 15 . 1 1 33 33 GLU HA H 33 5.080 5.080 5.158 -0.078 25575
4496 1 15 . 1 1 33 33 GLU CA C 33 54.120 54.120 54.831 -0.711 25575
4497 1 15 . 1 1 33 33 GLU CB C 33 32.080 32.080 33.438 -1.358 25575
4498 1 15 . 1 1 33 33 GLU H H 33 8.640 8.640 8.732 -0.092 25575
4499 1 15 . 1 1 34 34 ASP N N 34 130.390 130.390 126.965 3.425 25575
4500 1 15 . 1 1 34 34 ASP HA H 34 4.310 4.310 4.342 -0.032 25575
4501 1 15 . 1 1 34 34 ASP CA C 34 55.150 55.150 55.744 -0.594 25575
4502 1 15 . 1 1 34 34 ASP CB C 34 40.050 40.050 40.597 -0.547 25575
4503 1 15 . 1 1 34 34 ASP H H 34 9.540 9.540 9.001 0.539 25575
4504 1 15 . 1 1 35 35 GLY N N 35 126.620 126.620 103.556 23.064 25575
4505 1 15 . 1 1 35 35 GLY CA C 35 45.480 45.480 44.783 0.697 25575
4506 1 15 . 1 1 35 35 GLY H H 35 8.370 8.370 8.419 -0.049 25575
4507 1 15 . 1 1 36 36 GLU N N 36 120.860 120.860 122.217 -1.357 25575
4508 1 15 . 1 1 36 36 GLU HA H 36 4.670 4.670 4.307 0.363 25575
4509 1 15 . 1 1 36 36 GLU CA C 36 54.350 54.350 55.593 -1.243 25575
4510 1 15 . 1 1 36 36 GLU CB C 36 31.630 31.630 30.385 1.245 25575
4511 1 15 . 1 1 36 36 GLU H H 36 7.820 7.820 7.928 -0.108 25575
4512 1 15 . 1 1 37 37 ARG N N 37 129.790 129.790 127.653 2.137 25575
4513 1 15 . 1 1 37 37 ARG HA H 37 4.200 4.200 4.412 -0.212 25575
4514 1 15 . 1 1 37 37 ARG CA C 37 56.440 56.440 54.705 1.736 25575
4515 1 15 . 1 1 37 37 ARG CB C 37 29.710 29.710 29.329 0.381 25575
4516 1 15 . 1 1 37 37 ARG H H 37 8.930 8.930 8.500 0.430 25575
4517 1 15 . 1 1 38 38 CYS N N 38 130.950 130.950 127.101 3.849 25575
4518 1 15 . 1 1 38 38 CYS HA H 38 4.450 4.450 4.364 0.086 25575
4519 1 15 . 1 1 38 38 CYS CA C 38 60.560 60.560 60.496 0.064 25575
4520 1 15 . 1 1 38 38 CYS CB C 38 31.250 31.250 28.053 3.197 25575
4521 1 15 . 1 1 38 38 CYS H H 38 9.050 9.050 8.240 0.810 25575
4522 1 15 . 1 1 39 39 VAL N N 39 118.270 118.270 120.527 -2.257 25575
4523 1 15 . 1 1 39 39 VAL HA H 39 4.710 4.710 4.481 0.229 25575
4524 1 15 . 1 1 39 39 VAL CA C 39 60.340 60.340 60.544 -0.204 25575
4525 1 15 . 1 1 39 39 VAL CB C 39 31.290 31.290 32.146 -0.856 25575
4526 1 15 . 1 1 39 39 VAL H H 39 8.060 8.060 8.044 0.016 25575
4527 1 15 . 1 1 40 40 ARG N N 40 127.360 127.360 123.088 4.272 25575
4528 1 15 . 1 1 40 40 ARG HA H 40 4.430 4.430 4.372 0.058 25575
4529 1 15 . 1 1 40 40 ARG CA C 40 56.150 56.150 54.767 1.383 25575
4530 1 15 . 1 1 40 40 ARG CB C 40 29.210 29.210 29.643 -0.433 25575
4531 1 15 . 1 1 40 40 ARG H H 40 8.950 8.950 7.831 1.119 25575
4532 1 15 . 1 1 41 41 PRO HA H 41 4.430 4.430 4.564 -0.134 25575
4533 1 15 . 1 1 41 41 PRO CA C 41 62.690 62.690 62.711 -0.021 25575
4534 1 15 . 1 1 41 41 PRO CB C 41 32.010 32.010 32.103 -0.093 25575
4535 1 15 . 1 1 42 42 ALA N N 42 124.260 124.260 126.728 -2.468 25575
4536 1 15 . 1 1 42 42 ALA HA H 42 3.620 3.620 4.673 -1.053 25575
4537 1 15 . 1 1 42 42 ALA CA C 42 52.930 52.930 51.248 1.682 25575
4538 1 15 . 1 1 42 42 ALA CB C 42 19.130 19.130 19.132 -0.002 25575
4539 1 15 . 1 1 42 42 ALA H H 42 8.410 8.410 7.889 0.521 25575
4540 1 15 . 1 1 43 43 GLY N N 43 112.690 112.690 110.058 2.632 25575
4541 1 15 . 1 1 43 43 GLY CA C 43 44.240 44.240 44.325 -0.085 25575
4542 1 15 . 1 1 43 43 GLY H H 43 8.090 8.090 7.829 0.261 25575
4543 1 15 . 1 1 44 44 ASN N N 44 116.980 116.980 122.939 -5.959 25575
4544 1 15 . 1 1 44 44 ASN HA H 44 4.690 4.690 4.344 0.346 25575
4545 1 15 . 1 1 44 44 ASN CA C 44 53.420 53.420 53.936 -0.516 25575
4546 1 15 . 1 1 44 44 ASN CB C 44 39.370 39.370 38.204 1.166 25575
4547 1 15 . 1 1 44 44 ASN H H 44 8.720 8.720 8.966 -0.246 25575
4548 1 15 . 1 1 45 45 ALA N N 45 124.240 124.240 119.531 4.709 25575
4549 1 15 . 1 1 45 45 ALA HA H 45 4.640 4.640 4.626 0.014 25575
4550 1 15 . 1 1 45 45 ALA CA C 45 52.240 52.240 51.763 0.477 25575
4551 1 15 . 1 1 45 45 ALA CB C 45 19.540 19.540 22.047 -2.507 25575
4552 1 15 . 1 1 45 45 ALA H H 45 8.770 8.770 8.143 0.627 25575
4553 1 15 . 1 1 46 46 SER N N 46 111.670 111.670 116.578 -4.908 25575
4554 1 15 . 1 1 46 46 SER HA H 46 5.300 5.300 4.987 0.313 25575
4555 1 15 . 1 1 46 46 SER CA C 46 56.580 56.580 57.576 -0.996 25575
4556 1 15 . 1 1 46 46 SER CB C 46 66.490 66.490 65.859 0.631 25575
4557 1 15 . 1 1 46 46 SER H H 46 8.060 8.060 8.295 -0.235 25575
4558 1 15 . 1 1 47 47 PHE HA H 47 4.520 4.520 4.610 -0.090 25575
4559 1 15 . 1 1 47 47 PHE CA C 47 57.000 57.000 56.837 0.163 25575
4560 1 15 . 1 1 47 47 PHE CB C 47 38.360 38.360 39.105 -0.745 25575
4561 1 15 . 1 1 48 48 SER N N 48 116.970 116.970 120.502 -3.532 25575
4562 1 15 . 1 1 48 48 SER HA H 48 4.440 4.440 4.466 -0.026 25575
4563 1 15 . 1 1 48 48 SER CA C 48 56.950 56.950 57.850 -0.900 25575
4564 1 15 . 1 1 48 48 SER CB C 48 65.810 65.810 64.798 1.012 25575
4565 1 15 . 1 1 48 48 SER H H 48 7.100 7.100 7.724 -0.624 25575
4566 1 15 . 1 1 49 49 LYS N N 49 120.650 120.650 123.078 -2.428 25575
4567 1 15 . 1 1 49 49 LYS HA H 49 3.900 3.900 3.963 -0.063 25575
4568 1 15 . 1 1 49 49 LYS CA C 49 59.570 59.570 58.679 0.891 25575
4569 1 15 . 1 1 49 49 LYS CB C 49 31.790 31.790 31.599 0.191 25575
4570 1 15 . 1 1 49 49 LYS H H 49 8.770 8.770 8.808 -0.038 25575
4571 1 15 . 1 1 50 50 ARG N N 50 118.240 118.240 119.252 -1.012 25575
4572 1 15 . 1 1 50 50 ARG HA H 50 4.040 4.040 4.072 -0.032 25575
4573 1 15 . 1 1 50 50 ARG CA C 50 59.070 59.070 58.103 0.967 25575
4574 1 15 . 1 1 50 50 ARG CB C 50 30.080 30.080 29.795 0.285 25575
4575 1 15 . 1 1 50 50 ARG H H 50 8.040 8.040 7.403 0.637 25575
4576 1 15 . 1 1 51 51 VAL N N 51 121.680 121.680 119.452 2.228 25575
4577 1 15 . 1 1 51 51 VAL HA H 51 3.590 3.590 3.428 0.162 25575
4578 1 15 . 1 1 51 51 VAL CA C 51 65.940 65.940 66.334 -0.394 25575
4579 1 15 . 1 1 51 51 VAL CB C 51 31.620 31.620 31.241 0.379 25575
4580 1 15 . 1 1 51 51 VAL H H 51 7.350 7.350 7.880 -0.530 25575
4581 1 15 . 1 1 52 52 GLN N N 52 119.680 119.680 117.754 1.926 25575
4582 1 15 . 1 1 52 52 GLN HA H 52 3.570 3.570 3.770 -0.200 25575
4583 1 15 . 1 1 52 52 GLN CA C 52 59.210 59.210 59.142 0.068 25575
4584 1 15 . 1 1 52 52 GLN CB C 52 28.620 28.620 28.142 0.478 25575
4585 1 15 . 1 1 52 52 GLN H H 52 8.210 8.210 7.818 0.392 25575
4586 1 15 . 1 1 53 53 LYS N N 53 118.080 118.080 119.202 -1.122 25575
4587 1 15 . 1 1 53 53 LYS HA H 53 4.160 4.160 4.053 0.107 25575
4588 1 15 . 1 1 53 53 LYS CA C 53 58.670 58.670 58.706 -0.036 25575
4589 1 15 . 1 1 53 53 LYS CB C 53 32.120 32.120 31.957 0.163 25575
4590 1 15 . 1 1 53 53 LYS H H 53 7.960 7.960 7.607 0.353 25575
4591 1 15 . 1 1 54 54 SER N N 54 115.450 115.450 115.479 -0.029 25575
4592 1 15 . 1 1 54 54 SER HA H 54 4.370 4.370 4.189 0.181 25575
4593 1 15 . 1 1 54 54 SER CA C 54 61.330 61.330 61.362 -0.032 25575
4594 1 15 . 1 1 54 54 SER CB C 54 63.690 63.690 63.020 0.669 25575
4595 1 15 . 1 1 54 54 SER H H 54 7.800 7.800 7.646 0.154 25575
4596 1 15 . 1 1 55 55 ILE N N 55 117.670 117.670 120.589 -2.919 25575
4597 1 15 . 1 1 55 55 ILE HA H 55 4.060 4.060 3.671 0.389 25575
4598 1 15 . 1 1 55 55 ILE CA C 55 63.330 63.330 64.631 -1.301 25575
4599 1 15 . 1 1 55 55 ILE CB C 55 38.980 38.980 38.096 0.884 25575
4600 1 15 . 1 1 55 55 ILE H H 55 7.840 7.840 7.499 0.341 25575
4601 1 15 . 1 1 56 56 SER N N 56 115.650 115.650 115.764 -0.114 25575
4602 1 15 . 1 1 56 56 SER HA H 56 4.490 4.490 4.079 0.411 25575
4603 1 15 . 1 1 56 56 SER CA C 56 60.220 60.220 61.636 -1.416 25575
4604 1 15 . 1 1 56 56 SER CB C 56 63.000 63.000 63.234 -0.234 25575
4605 1 15 . 1 1 56 56 SER H H 56 8.060 8.060 8.461 -0.401 25575
4606 1 15 . 1 1 57 57 GLN N N 57 121.830 121.830 118.744 3.086 25575
4607 1 15 . 1 1 57 57 GLN HA H 57 4.200 4.200 4.232 -0.032 25575
4608 1 15 . 1 1 57 57 GLN CA C 57 58.310 58.310 57.135 1.175 25575
4609 1 15 . 1 1 57 57 GLN CB C 57 28.850 28.850 28.508 0.342 25575
4610 1 15 . 1 1 57 57 GLN H H 57 8.620 8.620 7.748 0.872 25575
4611 1 15 . 1 1 58 58 LYS N N 58 116.960 116.960 117.421 -0.461 25575
4612 1 15 . 1 1 58 58 LYS HA H 58 4.290 4.290 4.422 -0.132 25575
4613 1 15 . 1 1 58 58 LYS CA C 58 56.920 56.920 55.321 1.599 25575
4614 1 15 . 1 1 58 58 LYS CB C 58 32.900 32.900 33.921 -1.021 25575
4615 1 15 . 1 1 58 58 LYS H H 58 7.950 7.950 7.724 0.226 25575
4616 1 15 . 1 1 59 59 LYS N N 59 116.960 116.960 119.331 -2.371 25575
4617 1 15 . 1 1 59 59 LYS HA H 59 4.120 4.120 3.937 0.183 25575
4618 1 15 . 1 1 59 59 LYS CA C 59 57.090 57.090 56.726 0.364 25575
4619 1 15 . 1 1 59 59 LYS CB C 59 30.080 30.080 30.483 -0.403 25575
4620 1 15 . 1 1 59 59 LYS H H 59 7.950 7.950 8.153 -0.203 25575
4621 1 15 . 1 1 60 60 LEU N N 60 117.540 117.540 118.291 -0.751 25575
4622 1 15 . 1 1 60 60 LEU HA H 60 4.480 4.480 4.312 0.168 25575
4623 1 15 . 1 1 60 60 LEU CA C 60 54.500 54.500 55.476 -0.976 25575
4624 1 15 . 1 1 60 60 LEU CB C 60 42.840 42.840 42.435 0.405 25575
4625 1 15 . 1 1 60 60 LEU H H 60 7.930 7.930 7.491 0.439 25575
4626 1 15 . 1 1 61 61 LYS HA H 61 4.390 4.390 4.266 0.124 25575
4627 1 15 . 1 1 61 61 LYS CA C 61 55.540 55.540 56.209 -0.669 25575
4628 1 15 . 1 1 61 61 LYS CB C 61 30.050 30.050 30.659 -0.609 25575
4629 1 15 . 1 1 62 62 LEU N N 62 120.000 120.000 121.372 -1.372 25575
4630 1 15 . 1 1 62 62 LEU HA H 62 5.250 5.250 4.980 0.270 25575
4631 1 15 . 1 1 62 62 LEU CA C 62 53.080 53.080 54.157 -1.077 25575
4632 1 15 . 1 1 62 62 LEU CB C 62 45.760 45.760 42.557 3.203 25575
4633 1 15 . 1 1 62 62 LEU H H 62 7.470 7.470 7.519 -0.049 25575
4634 1 15 . 1 1 63 63 ASP N N 63 121.730 121.730 124.980 -3.250 25575
4635 1 15 . 1 1 63 63 ASP HA H 63 4.860 4.860 4.826 0.034 25575
4636 1 15 . 1 1 63 63 ASP CA C 63 51.890 51.890 52.230 -0.340 25575
4637 1 15 . 1 1 63 63 ASP CB C 63 44.910 44.910 44.368 0.542 25575
4638 1 15 . 1 1 63 63 ASP H H 63 8.620 8.620 8.517 0.103 25575
4639 1 15 . 1 1 64 64 ILE N N 64 118.120 118.120 120.513 -2.393 25575
4640 1 15 . 1 1 64 64 ILE HA H 64 4.210 4.210 4.340 -0.130 25575
4641 1 15 . 1 1 64 64 ILE CA C 64 60.430 60.430 58.669 1.761 25575
4642 1 15 . 1 1 64 64 ILE CB C 64 40.420 40.420 38.798 1.622 25575
4643 1 15 . 1 1 64 64 ILE H H 64 8.650 8.650 8.222 0.428 25575
4644 1 15 . 1 1 65 65 ASP N N 65 124.550 124.550 128.755 -4.205 25575
4645 1 15 . 1 1 65 65 ASP HA H 65 4.570 4.570 4.429 0.141 25575
4646 1 15 . 1 1 65 65 ASP CA C 65 53.310 53.310 54.765 -1.455 25575
4647 1 15 . 1 1 65 65 ASP CB C 65 40.440 40.440 41.496 -1.056 25575
4648 1 15 . 1 1 65 65 ASP H H 65 8.630 8.630 8.150 0.480 25575
4649 1 15 . 1 1 66 66 LYS N N 66 125.970 125.970 125.753 0.217 25575
4650 1 15 . 1 1 66 66 LYS HA H 66 4.040 4.040 4.255 -0.215 25575
4651 1 15 . 1 1 66 66 LYS CA C 66 58.140 58.140 57.533 0.607 25575
4652 1 15 . 1 1 66 66 LYS CB C 66 31.990 31.990 32.621 -0.631 25575
4653 1 15 . 1 1 66 66 LYS H H 66 8.590 8.590 8.505 0.085 25575
4654 1 15 . 1 1 67 67 SER N N 67 114.980 114.980 117.355 -2.375 25575
4655 1 15 . 1 1 67 67 SER HA H 67 4.320 4.320 4.201 0.119 25575
4656 1 15 . 1 1 67 67 SER CA C 67 60.330 60.330 61.495 -1.165 25575
4657 1 15 . 1 1 67 67 SER CB C 67 63.710 63.710 63.271 0.439 25575
4658 1 15 . 1 1 67 67 SER H H 67 8.760 8.760 8.708 0.052 25575
4659 1 15 . 1 1 68 68 VAL HA H 68 4.250 4.250 3.907 0.343 25575
4660 1 15 . 1 1 68 68 VAL CA C 68 62.150 62.150 62.691 -0.541 25575
4661 1 15 . 1 1 68 68 VAL CB C 68 31.900 31.900 31.795 0.105 25575
4662 1 15 . 1 1 69 69 ARG CA C 69 56.960 56.960 57.517 -0.557 25575
4663 1 15 . 1 1 70 70 HIS N N 70 116.270 116.270 114.957 1.313 25575
4664 1 15 . 1 1 70 70 HIS HA H 70 4.760 4.760 4.795 -0.035 25575
4665 1 15 . 1 1 70 70 HIS CA C 70 55.360 55.360 54.352 1.008 25575
4666 1 15 . 1 1 70 70 HIS CB C 70 33.100 33.100 31.665 1.435 25575
4667 1 15 . 1 1 70 70 HIS H H 70 7.390 7.390 8.102 -0.712 25575
4668 1 15 . 1 1 71 71 LEU N N 71 120.200 120.200 122.084 -1.884 25575
4669 1 15 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.596 0.464 25575
4670 1 15 . 1 1 71 71 LEU CA C 71 54.070 54.070 53.246 0.824 25575
4671 1 15 . 1 1 71 71 LEU CB C 71 42.710 42.710 41.617 1.093 25575
4672 1 15 . 1 1 71 71 LEU H H 71 7.970 7.970 8.426 -0.456 25575
4673 1 15 . 1 1 72 72 TYR HA H 72 5.030 5.030 4.640 0.390 25575
4674 1 15 . 1 1 72 72 TYR CA C 72 59.990 59.990 57.770 2.220 25575
4675 1 15 . 1 1 72 72 TYR CB C 72 39.440 39.440 40.230 -0.790 25575
4676 1 15 . 1 1 73 73 ILE N N 73 112.940 112.940 113.603 -0.663 25575
4677 1 15 . 1 1 73 73 ILE HA H 73 6.080 6.080 4.802 1.278 25575
4678 1 15 . 1 1 73 73 ILE CA C 73 58.090 58.090 58.537 -0.447 25575
4679 1 15 . 1 1 73 73 ILE CB C 73 41.820 41.820 42.312 -0.492 25575
4680 1 15 . 1 1 73 73 ILE H H 73 8.450 8.450 8.070 0.380 25575
4681 1 15 . 1 1 74 74 CYS N N 74 124.730 124.730 119.365 5.365 25575
4682 1 15 . 1 1 74 74 CYS HA H 74 5.080 5.080 5.097 -0.017 25575
4683 1 15 . 1 1 74 74 CYS CA C 74 57.670 57.670 57.484 0.186 25575
4684 1 15 . 1 1 74 74 CYS CB C 74 33.330 33.330 30.368 2.962 25575
4685 1 15 . 1 1 74 74 CYS H H 74 9.830 9.830 8.634 1.196 25575
4686 1 15 . 1 1 75 75 ASP N N 75 120.990 120.990 123.169 -2.179 25575
4687 1 15 . 1 1 75 75 ASP HA H 75 4.590 4.590 4.353 0.237 25575
4688 1 15 . 1 1 75 75 ASP CA C 75 57.320 57.320 57.305 0.015 25575
4689 1 15 . 1 1 75 75 ASP CB C 75 39.670 39.670 40.427 -0.757 25575
4690 1 15 . 1 1 75 75 ASP H H 75 9.090 9.090 8.734 0.356 25575
4691 1 15 . 1 1 76 76 PHE N N 76 122.470 122.470 122.152 0.318 25575
4692 1 15 . 1 1 76 76 PHE HA H 76 4.230 4.230 4.186 0.044 25575
4693 1 15 . 1 1 76 76 PHE CA C 76 62.030 62.030 61.830 0.200 25575
4694 1 15 . 1 1 76 76 PHE CB C 76 38.190 38.190 39.187 -0.997 25575
4695 1 15 . 1 1 76 76 PHE H H 76 8.330 8.330 8.136 0.194 25575
4696 1 15 . 1 1 77 77 HIS N N 77 124.580 124.580 118.105 6.475 25575
4697 1 15 . 1 1 77 77 HIS HA H 77 4.280 4.280 4.346 -0.066 25575
4698 1 15 . 1 1 77 77 HIS CA C 77 63.880 63.880 59.727 4.153 25575
4699 1 15 . 1 1 77 77 HIS CB C 77 29.600 29.600 30.096 -0.496 25575
4700 1 15 . 1 1 77 77 HIS H H 77 10.300 10.300 7.985 2.315 25575
4701 1 15 . 1 1 78 78 LYS N N 78 122.930 122.930 120.015 2.915 25575
4702 1 15 . 1 1 78 78 LYS HA H 78 3.860 3.860 3.971 -0.111 25575
4703 1 15 . 1 1 78 78 LYS CA C 78 60.550 60.550 59.898 0.652 25575
4704 1 15 . 1 1 78 78 LYS CB C 78 32.040 32.040 32.491 -0.451 25575
4705 1 15 . 1 1 78 78 LYS H H 78 8.960 8.960 8.531 0.429 25575
4706 1 15 . 1 1 79 79 ASN N N 79 116.670 116.670 117.401 -0.731 25575
4707 1 15 . 1 1 79 79 ASN HA H 79 4.420 4.420 4.544 -0.124 25575
4708 1 15 . 1 1 79 79 ASN CA C 79 56.030 56.030 55.576 0.454 25575
4709 1 15 . 1 1 79 79 ASN CB C 79 38.100 38.100 38.367 -0.267 25575
4710 1 15 . 1 1 79 79 ASN H H 79 8.230 8.230 7.904 0.326 25575
4711 1 15 . 1 1 80 80 PHE N N 80 122.600 122.600 122.313 0.287 25575
4712 1 15 . 1 1 80 80 PHE HA H 80 4.180 4.180 4.211 -0.031 25575
4713 1 15 . 1 1 80 80 PHE CA C 80 60.700 60.700 61.458 -0.757 25575
4714 1 15 . 1 1 80 80 PHE CB C 80 39.840 39.840 39.288 0.552 25575
4715 1 15 . 1 1 80 80 PHE H H 80 8.200 8.200 8.074 0.126 25575
4716 1 15 . 1 1 81 81 ILE N N 81 118.240 118.240 116.914 1.326 25575
4717 1 15 . 1 1 81 81 ILE HA H 81 3.320 3.320 3.603 -0.283 25575
4718 1 15 . 1 1 81 81 ILE CA C 81 65.160 65.160 64.227 0.933 25575
4719 1 15 . 1 1 81 81 ILE CB C 81 38.440 38.440 37.786 0.654 25575
4720 1 15 . 1 1 81 81 ILE H H 81 8.520 8.520 8.067 0.453 25575
4721 1 15 . 1 1 82 82 GLN N N 82 116.370 116.370 118.604 -2.234 25575
4722 1 15 . 1 1 82 82 GLN HA H 82 4.100 4.100 4.164 -0.064 25575
4723 1 15 . 1 1 82 82 GLN CA C 82 57.710 57.710 58.095 -0.385 25575
4724 1 15 . 1 1 82 82 GLN CB C 82 28.710 28.710 28.908 -0.198 25575
4725 1 15 . 1 1 82 82 GLN H H 82 7.670 7.670 7.864 -0.194 25575
4726 1 15 . 1 1 83 83 SER N N 83 114.440 114.440 115.813 -1.373 25575
4727 1 15 . 1 1 83 83 SER HA H 83 4.300 4.300 4.140 0.160 25575
4728 1 15 . 1 1 83 83 SER CA C 83 60.130 60.130 61.739 -1.609 25575
4729 1 15 . 1 1 83 83 SER CB C 83 63.570 63.570 62.791 0.779 25575
4730 1 15 . 1 1 83 83 SER H H 83 7.810 7.810 8.370 -0.560 25575
4731 1 15 . 1 1 84 84 VAL N N 84 120.750 120.750 116.264 4.486 25575
4732 1 15 . 1 1 84 84 VAL HA H 84 3.970 3.970 3.753 0.217 25575
4733 1 15 . 1 1 84 84 VAL CA C 84 63.430 63.430 64.036 -0.606 25575
4734 1 15 . 1 1 84 84 VAL CB C 84 31.960 31.960 31.335 0.625 25575
4735 1 15 . 1 1 84 84 VAL H H 84 7.790 7.790 7.184 0.606 25575
4736 1 15 . 1 1 85 85 ARG N N 85 122.090 122.090 117.704 4.386 25575
4737 1 15 . 1 1 85 85 ARG HA H 85 4.240 4.240 4.160 0.080 25575
4738 1 15 . 1 1 85 85 ARG CA C 85 56.850 56.850 56.895 -0.045 25575
4739 1 15 . 1 1 85 85 ARG CB C 85 30.720 30.720 29.825 0.895 25575
4740 1 15 . 1 1 85 85 ARG H H 85 8.090 8.090 7.753 0.337 25575
4741 1 15 . 1 1 86 86 ASN N N 86 118.510 118.510 118.638 -0.128 25575
4742 1 15 . 1 1 86 86 ASN HA H 86 4.690 4.690 4.622 0.068 25575
4743 1 15 . 1 1 86 86 ASN CA C 86 53.380 53.380 53.231 0.149 25575
4744 1 15 . 1 1 86 86 ASN CB C 86 38.950 38.950 39.134 -0.184 25575
4745 1 15 . 1 1 86 86 ASN H H 86 8.220 8.220 7.632 0.588 25575
4746 1 15 . 1 1 87 87 LYS N N 87 121.600 121.600 120.254 1.346 25575
4747 1 15 . 1 1 87 87 LYS HA H 87 4.310 4.310 4.100 0.210 25575
4748 1 15 . 1 1 87 87 LYS CA C 87 56.590 56.590 57.024 -0.434 25575
4749 1 15 . 1 1 87 87 LYS CB C 87 32.870 32.870 31.545 1.325 25575
4750 1 15 . 1 1 87 87 LYS H H 87 8.150 8.150 8.360 -0.210 25575
4751 1 15 . 1 1 88 88 ARG N N 88 121.920 121.920 124.689 -2.769 25575
4752 1 15 . 1 1 88 88 ARG HA H 88 4.330 4.330 4.170 0.160 25575
4753 1 15 . 1 1 88 88 ARG CA C 88 56.110 56.110 56.538 -0.428 25575
4754 1 15 . 1 1 88 88 ARG CB C 88 30.870 30.870 30.877 -0.007 25575
4755 1 15 . 1 1 88 88 ARG H H 88 8.250 8.250 8.474 -0.224 25575
4756 1 15 . 1 1 89 89 LYS N N 89 123.020 123.020 121.457 1.563 25575
4757 1 15 . 1 1 89 89 LYS HA H 89 4.320 4.320 4.507 -0.187 25575
4758 1 15 . 1 1 89 89 LYS CA C 89 56.330 56.330 55.807 0.523 25575
4759 1 15 . 1 1 89 89 LYS CB C 89 33.140 33.140 32.845 0.295 25575
4760 1 15 . 1 1 89 89 LYS H H 89 8.320 8.320 8.557 -0.237 25575
4761 1 15 . 1 1 90 90 ARG N N 90 122.970 122.970 121.119 1.851 25575
4762 1 15 . 1 1 90 90 ARG HA H 90 4.360 4.360 4.240 0.120 25575
4763 1 15 . 1 1 90 90 ARG CA C 90 56.100 56.100 57.840 -1.740 25575
4764 1 15 . 1 1 90 90 ARG CB C 90 31.210 31.210 30.741 0.468 25575
4765 1 15 . 1 1 90 90 ARG H H 90 8.360 8.360 7.985 0.375 25575
4766 1 15 . 1 1 91 91 LYS N N 91 123.680 123.680 117.117 6.563 25575
4767 1 15 . 1 1 91 91 LYS HA H 91 4.380 4.380 4.466 -0.086 25575
4768 1 15 . 1 1 91 91 LYS CA C 91 56.620 56.620 55.982 0.638 25575
4769 1 15 . 1 1 91 91 LYS CB C 91 33.070 33.070 33.398 -0.328 25575
4770 1 15 . 1 1 91 91 LYS H H 91 8.450 8.450 7.747 0.703 25575
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 61 3.939 -0.797 3.890 25575
2 1 1 "Average Difference" HA 70 0.302 -0.024 0.303 25575
3 1 1 "Average Difference" C 0 0.000 0.000 0.000 25575
4 1 1 "Average Difference" CA 68 1.064 -0.169 1.059 25575
5 1 1 "Average Difference" CB 64 1.179 -0.252 1.161 25575
6 1 1 "Average Difference" HN 61 0.599 -0.239 0.554 25575
7 1 2 "Average Difference" N 61 4.080 -0.882 4.017 25575
8 1 2 "Average Difference" HA 70 0.312 -0.053 0.309 25575
9 1 2 "Average Difference" C 0 0.000 0.000 0.000 25575
10 1 2 "Average Difference" CA 68 1.117 -0.026 1.125 25575
11 1 2 "Average Difference" CB 64 1.250 -0.259 1.233 25575
12 1 2 "Average Difference" HN 61 0.589 -0.165 0.570 25575
13 1 3 "Average Difference" N 61 4.103 -0.447 4.112 25575
14 1 3 "Average Difference" HA 70 0.283 -0.046 0.281 25575
15 1 3 "Average Difference" C 0 0.000 0.000 0.000 25575
16 1 3 "Average Difference" CA 68 1.115 -0.018 1.123 25575
17 1 3 "Average Difference" CB 64 1.413 -0.306 1.390 25575
18 1 3 "Average Difference" HN 61 0.559 -0.152 0.543 25575
19 1 4 "Average Difference" N 61 4.141 -0.647 4.124 25575
20 1 4 "Average Difference" HA 70 0.293 -0.033 0.293 25575
21 1 4 "Average Difference" C 0 0.000 0.000 0.000 25575
22 1 4 "Average Difference" CA 68 1.160 0.009 1.169 25575
23 1 4 "Average Difference" CB 64 1.332 -0.263 1.316 25575
24 1 4 "Average Difference" HN 61 0.615 -0.241 0.570 25575
25 1 5 "Average Difference" N 61 4.109 -0.699 4.083 25575
26 1 5 "Average Difference" HA 70 0.298 -0.060 0.293 25575
27 1 5 "Average Difference" C 0 0.000 0.000 0.000 25575
28 1 5 "Average Difference" CA 68 1.116 -0.080 1.121 25575
29 1 5 "Average Difference" CB 64 1.407 -0.439 1.347 25575
30 1 5 "Average Difference" HN 61 0.601 -0.175 0.580 25575
31 1 6 "Average Difference" N 61 3.911 -0.436 3.919 25575
32 1 6 "Average Difference" HA 70 0.300 -0.057 0.296 25575
33 1 6 "Average Difference" C 0 0.000 0.000 0.000 25575
34 1 6 "Average Difference" CA 68 1.151 0.029 1.160 25575
35 1 6 "Average Difference" CB 64 1.425 -0.445 1.365 25575
36 1 6 "Average Difference" HN 61 0.565 -0.214 0.527 25575
37 1 7 "Average Difference" N 61 3.944 -0.651 3.923 25575
38 1 7 "Average Difference" HA 70 0.310 -0.041 0.309 25575
39 1 7 "Average Difference" C 0 0.000 0.000 0.000 25575
40 1 7 "Average Difference" CA 68 1.118 -0.058 1.125 25575
41 1 7 "Average Difference" CB 64 1.161 -0.338 1.119 25575
42 1 7 "Average Difference" HN 61 0.626 -0.235 0.585 25575
43 1 8 "Average Difference" N 61 3.905 -0.689 3.875 25575
44 1 8 "Average Difference" HA 70 0.294 -0.030 0.294 25575
45 1 8 "Average Difference" C 0 0.000 0.000 0.000 25575
46 1 8 "Average Difference" CA 68 1.102 -0.137 1.102 25575
47 1 8 "Average Difference" CB 64 1.260 -0.281 1.239 25575
48 1 8 "Average Difference" HN 61 0.587 -0.228 0.546 25575
49 1 9 "Average Difference" N 61 4.055 -0.796 4.009 25575
50 1 9 "Average Difference" HA 70 0.302 -0.002 0.304 25575
51 1 9 "Average Difference" C 0 0.000 0.000 0.000 25575
52 1 9 "Average Difference" CA 68 1.164 -0.205 1.154 25575
53 1 9 "Average Difference" CB 64 1.259 -0.165 1.258 25575
54 1 9 "Average Difference" HN 61 0.562 -0.214 0.524 25575
55 1 10 "Average Difference" N 61 3.950 -0.640 3.930 25575
56 1 10 "Average Difference" HA 70 0.272 -0.049 0.269 25575
57 1 10 "Average Difference" C 0 0.000 0.000 0.000 25575
58 1 10 "Average Difference" CA 68 1.025 -0.022 1.032 25575
59 1 10 "Average Difference" CB 64 1.308 -0.439 1.242 25575
60 1 10 "Average Difference" HN 61 0.600 -0.174 0.579 25575
61 1 11 "Average Difference" N 61 3.923 -0.515 3.922 25575
62 1 11 "Average Difference" HA 70 0.289 -0.024 0.290 25575
63 1 11 "Average Difference" C 0 0.000 0.000 0.000 25575
64 1 11 "Average Difference" CA 68 1.114 -0.106 1.117 25575
65 1 11 "Average Difference" CB 64 1.340 -0.312 1.313 25575
66 1 11 "Average Difference" HN 61 0.571 -0.211 0.535 25575
67 1 12 "Average Difference" N 61 4.234 -1.019 4.144 25575
68 1 12 "Average Difference" HA 70 0.318 -0.053 0.316 25575
69 1 12 "Average Difference" C 0 0.000 0.000 0.000 25575
70 1 12 "Average Difference" CA 68 1.129 -0.094 1.133 25575
71 1 12 "Average Difference" CB 64 1.319 -0.353 1.282 25575
72 1 12 "Average Difference" HN 61 0.591 -0.212 0.556 25575
73 1 13 "Average Difference" N 61 3.978 -0.671 3.953 25575
74 1 13 "Average Difference" HA 70 0.290 -0.050 0.287 25575
75 1 13 "Average Difference" C 0 0.000 0.000 0.000 25575
76 1 13 "Average Difference" CA 68 0.949 -0.014 0.956 25575
77 1 13 "Average Difference" CB 64 1.288 -0.429 1.224 25575
78 1 13 "Average Difference" HN 61 0.593 -0.222 0.555 25575
79 1 14 "Average Difference" N 61 3.885 -0.955 3.797 25575
80 1 14 "Average Difference" HA 70 0.274 -0.046 0.272 25575
81 1 14 "Average Difference" C 0 0.000 0.000 0.000 25575
82 1 14 "Average Difference" CA 68 1.032 -0.033 1.039 25575
83 1 14 "Average Difference" CB 64 1.366 -0.357 1.329 25575
84 1 14 "Average Difference" HN 61 0.575 -0.195 0.546 25575
85 1 15 "Average Difference" N 61 4.076 -0.722 4.045 25575
86 1 15 "Average Difference" HA 70 0.300 -0.031 0.300 25575
87 1 15 "Average Difference" C 0 0.000 0.000 0.000 25575
88 1 15 "Average Difference" CA 68 1.008 -0.100 1.011 25575
89 1 15 "Average Difference" CB 64 1.176 -0.227 1.163 25575
90 1 15 "Average Difference" HN 61 0.560 -0.227 0.516 25575
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 25575
_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 24 24 SER HA H 24 4.330 4.330 4.426 -0.096 25575
2 1 . 1 1 24 24 SER CA C 24 58.130 58.130 58.449 -0.319 25575
3 1 . 1 1 24 24 SER CB C 24 63.870 63.870 63.649 0.221 25575
4 1 . 1 1 25 25 TYR N N 25 122.160 122.160 121.691 0.469 25575
5 1 . 1 1 25 25 TYR HA H 25 4.530 4.530 4.542 -0.012 25575
6 1 . 1 1 25 25 TYR CA C 25 58.420 58.420 58.225 0.195 25575
7 1 . 1 1 25 25 TYR CB C 25 38.570 38.570 38.410 0.160 25575
8 1 . 1 1 25 25 TYR H H 25 8.310 8.310 8.061 0.249 25575
9 1 . 1 1 26 26 GLY N N 26 111.370 111.370 110.301 1.069 25575
10 1 . 1 1 26 26 GLY CA C 26 45.330 45.330 45.259 0.071 25575
11 1 . 1 1 26 26 GLY H H 26 8.300 8.300 8.357 -0.057 25575
12 1 . 1 1 27 27 GLN N N 27 118.910 118.910 122.003 -3.093 25575
13 1 . 1 1 27 27 GLN HA H 27 4.510 4.510 4.378 0.132 25575
14 1 . 1 1 27 27 GLN CA C 27 55.240 55.240 55.149 0.091 25575
15 1 . 1 1 27 27 GLN CB C 27 29.800 29.800 28.717 1.083 25575
16 1 . 1 1 27 27 GLN H H 27 8.050 8.050 8.283 -0.233 25575
17 1 . 1 1 28 28 SER N N 28 119.460 119.460 115.296 4.164 25575
18 1 . 1 1 28 28 SER HA H 28 4.810 4.810 5.115 -0.305 25575
19 1 . 1 1 28 28 SER CA C 28 57.710 57.710 56.696 1.014 25575
20 1 . 1 1 28 28 SER CB C 28 65.530 65.530 65.849 -0.319 25575
21 1 . 1 1 28 28 SER H H 28 8.800 8.800 8.134 0.666 25575
22 1 . 1 1 29 29 CYS N N 29 122.160 122.160 119.176 2.984 25575
23 1 . 1 1 29 29 CYS HA H 29 4.130 4.130 4.450 -0.320 25575
24 1 . 1 1 29 29 CYS CA C 29 60.620 60.620 61.361 -0.741 25575
25 1 . 1 1 29 29 CYS CB C 29 32.770 32.770 28.810 3.960 25575
26 1 . 1 1 29 29 CYS H H 29 8.390 8.390 8.540 -0.150 25575
27 1 . 1 1 30 30 CYS N N 30 122.320 122.320 120.239 2.081 25575
28 1 . 1 1 30 30 CYS HA H 30 4.530 4.530 4.810 -0.280 25575
29 1 . 1 1 30 30 CYS CA C 30 58.810 58.810 57.698 1.112 25575
30 1 . 1 1 30 30 CYS CB C 30 28.910 28.910 27.858 1.052 25575
31 1 . 1 1 30 30 CYS H H 30 8.340 8.340 8.571 -0.231 25575
32 1 . 1 1 31 31 LEU N N 31 122.390 122.390 122.038 0.352 25575
33 1 . 1 1 31 31 LEU HA H 31 4.640 4.640 4.878 -0.238 25575
34 1 . 1 1 31 31 LEU CA C 31 55.440 55.440 54.569 0.871 25575
35 1 . 1 1 31 31 LEU CB C 31 43.490 43.490 42.961 0.529 25575
36 1 . 1 1 31 31 LEU H H 31 8.460 8.460 7.184 1.276 25575
37 1 . 1 1 32 32 ILE N N 32 118.890 118.890 118.039 0.851 25575
38 1 . 1 1 32 32 ILE HA H 32 4.200 4.200 4.759 -0.559 25575
39 1 . 1 1 32 32 ILE CA C 32 60.440 60.440 60.143 0.297 25575
40 1 . 1 1 32 32 ILE CB C 32 39.890 39.890 41.740 -1.850 25575
41 1 . 1 1 32 32 ILE H H 32 8.680 8.680 8.157 0.523 25575
42 1 . 1 1 33 33 GLU N N 33 128.400 128.400 126.453 1.947 25575
43 1 . 1 1 33 33 GLU HA H 33 5.080 5.080 5.172 -0.092 25575
44 1 . 1 1 33 33 GLU CA C 33 54.120 54.120 54.774 -0.654 25575
45 1 . 1 1 33 33 GLU CB C 33 32.080 32.080 33.022 -0.942 25575
46 1 . 1 1 33 33 GLU H H 33 8.640 8.640 8.702 -0.062 25575
47 1 . 1 1 34 34 ASP N N 34 130.390 130.390 127.404 2.986 25575
48 1 . 1 1 34 34 ASP HA H 34 4.310 4.310 4.293 0.017 25575
49 1 . 1 1 34 34 ASP CA C 34 55.150 55.150 55.970 -0.820 25575
50 1 . 1 1 34 34 ASP CB C 34 40.050 40.050 40.588 -0.538 25575
51 1 . 1 1 34 34 ASP H H 34 9.540 9.540 8.886 0.654 25575
52 1 . 1 1 35 35 GLY N N 35 126.620 126.620 103.917 22.703 25575
53 1 . 1 1 35 35 GLY CA C 35 45.480 45.480 44.862 0.618 25575
54 1 . 1 1 35 35 GLY H H 35 8.370 8.370 8.179 0.191 25575
55 1 . 1 1 36 36 GLU N N 36 120.860 120.860 122.963 -2.103 25575
56 1 . 1 1 36 36 GLU HA H 36 4.670 4.670 4.234 0.436 25575
57 1 . 1 1 36 36 GLU CA C 36 54.350 54.350 55.691 -1.341 25575
58 1 . 1 1 36 36 GLU CB C 36 31.630 31.630 30.100 1.530 25575
59 1 . 1 1 36 36 GLU H H 36 7.820 7.820 7.938 -0.118 25575
60 1 . 1 1 37 37 ARG N N 37 129.790 129.790 127.720 2.070 25575
61 1 . 1 1 37 37 ARG HA H 37 4.200 4.200 4.340 -0.140 25575
62 1 . 1 1 37 37 ARG CA C 37 56.440 56.440 54.971 1.469 25575
63 1 . 1 1 37 37 ARG CB C 37 29.710 29.710 28.972 0.738 25575
64 1 . 1 1 37 37 ARG H H 37 8.930 8.930 8.402 0.528 25575
65 1 . 1 1 38 38 CYS N N 38 130.950 130.950 126.225 4.725 25575
66 1 . 1 1 38 38 CYS HA H 38 4.450 4.450 4.331 0.119 25575
67 1 . 1 1 38 38 CYS CA C 38 60.560 60.560 60.430 0.130 25575
68 1 . 1 1 38 38 CYS CB C 38 31.250 31.250 27.958 3.292 25575
69 1 . 1 1 38 38 CYS H H 38 9.050 9.050 8.326 0.724 25575
70 1 . 1 1 39 39 VAL N N 39 118.270 118.270 121.155 -2.885 25575
71 1 . 1 1 39 39 VAL HA H 39 4.710 4.710 4.435 0.275 25575
72 1 . 1 1 39 39 VAL CA C 39 60.340 60.340 60.766 -0.426 25575
73 1 . 1 1 39 39 VAL CB C 39 31.290 31.290 31.906 -0.615 25575
74 1 . 1 1 39 39 VAL H H 39 8.060 8.060 8.142 -0.082 25575
75 1 . 1 1 40 40 ARG N N 40 127.360 127.360 122.867 4.493 25575
76 1 . 1 1 40 40 ARG HA H 40 4.430 4.430 4.338 0.092 25575
77 1 . 1 1 40 40 ARG CA C 40 56.150 56.150 54.911 1.239 25575
78 1 . 1 1 40 40 ARG CB C 40 29.210 29.210 29.551 -0.341 25575
79 1 . 1 1 40 40 ARG H H 40 8.950 8.950 7.729 1.221 25575
80 1 . 1 1 41 41 PRO HA H 41 4.430 4.430 4.507 -0.077 25575
81 1 . 1 1 41 41 PRO CA C 41 62.690 62.690 62.806 -0.116 25575
82 1 . 1 1 41 41 PRO CB C 41 32.010 32.010 32.125 -0.115 25575
83 1 . 1 1 42 42 ALA N N 42 124.260 124.260 126.005 -1.745 25575
84 1 . 1 1 42 42 ALA HA H 42 3.620 3.620 4.550 -0.930 25575
85 1 . 1 1 42 42 ALA CA C 42 52.930 52.930 51.261 1.669 25575
86 1 . 1 1 42 42 ALA CB C 42 19.130 19.130 20.228 -1.098 25575
87 1 . 1 1 42 42 ALA H H 42 8.410 8.410 8.159 0.251 25575
88 1 . 1 1 43 43 GLY N N 43 112.690 112.690 109.146 3.544 25575
89 1 . 1 1 43 43 GLY CA C 43 44.240 44.240 44.749 -0.509 25575
90 1 . 1 1 43 43 GLY H H 43 8.090 8.090 8.167 -0.077 25575
91 1 . 1 1 44 44 ASN N N 44 116.980 116.980 120.440 -3.460 25575
92 1 . 1 1 44 44 ASN HA H 44 4.690 4.690 4.625 0.065 25575
93 1 . 1 1 44 44 ASN CA C 44 53.420 53.420 53.615 -0.195 25575
94 1 . 1 1 44 44 ASN CB C 44 39.370 39.370 37.581 1.789 25575
95 1 . 1 1 44 44 ASN H H 44 8.720 8.720 8.671 0.049 25575
96 1 . 1 1 45 45 ALA N N 45 124.240 124.240 122.286 1.954 25575
97 1 . 1 1 45 45 ALA HA H 45 4.640 4.640 4.699 -0.059 25575
98 1 . 1 1 45 45 ALA CA C 45 52.240 52.240 51.603 0.637 25575
99 1 . 1 1 45 45 ALA CB C 45 19.540 19.540 21.277 -1.737 25575
100 1 . 1 1 45 45 ALA H H 45 8.770 8.770 8.087 0.683 25575
101 1 . 1 1 46 46 SER N N 46 111.670 111.670 117.394 -5.724 25575
102 1 . 1 1 46 46 SER HA H 46 5.300 5.300 4.852 0.448 25575
103 1 . 1 1 46 46 SER CA C 46 56.580 56.580 56.983 -0.403 25575
104 1 . 1 1 46 46 SER CB C 46 66.490 66.490 65.840 0.650 25575
105 1 . 1 1 46 46 SER H H 46 8.060 8.060 8.320 -0.260 25575
106 1 . 1 1 47 47 PHE HA H 47 4.520 4.520 4.549 -0.029 25575
107 1 . 1 1 47 47 PHE CA C 47 57.000 57.000 56.881 0.119 25575
108 1 . 1 1 47 47 PHE CB C 47 38.360 38.360 38.509 -0.149 25575
109 1 . 1 1 48 48 SER N N 48 116.970 116.970 118.284 -1.314 25575
110 1 . 1 1 48 48 SER HA H 48 4.440 4.440 4.361 0.079 25575
111 1 . 1 1 48 48 SER CA C 48 56.950 56.950 58.244 -1.294 25575
112 1 . 1 1 48 48 SER CB C 48 65.810 65.810 64.347 1.463 25575
113 1 . 1 1 48 48 SER H H 48 7.100 7.100 7.742 -0.642 25575
114 1 . 1 1 49 49 LYS N N 49 120.650 120.650 124.643 -3.993 25575
115 1 . 1 1 49 49 LYS HA H 49 3.900 3.900 3.948 -0.048 25575
116 1 . 1 1 49 49 LYS CA C 49 59.570 59.570 59.380 0.190 25575
117 1 . 1 1 49 49 LYS CB C 49 31.790 31.790 32.123 -0.333 25575
118 1 . 1 1 49 49 LYS H H 49 8.770 8.770 8.777 -0.007 25575
119 1 . 1 1 50 50 ARG N N 50 118.240 118.240 117.872 0.368 25575
120 1 . 1 1 50 50 ARG HA H 50 4.040 4.040 4.053 -0.013 25575
121 1 . 1 1 50 50 ARG CA C 50 59.070 59.070 58.487 0.583 25575
122 1 . 1 1 50 50 ARG CB C 50 30.080 30.080 29.663 0.417 25575
123 1 . 1 1 50 50 ARG H H 50 8.040 8.040 8.002 0.038 25575
124 1 . 1 1 51 51 VAL N N 51 121.680 121.680 119.401 2.279 25575
125 1 . 1 1 51 51 VAL HA H 51 3.590 3.590 3.597 -0.007 25575
126 1 . 1 1 51 51 VAL CA C 51 65.940 65.940 65.418 0.522 25575
127 1 . 1 1 51 51 VAL CB C 51 31.620 31.620 31.210 0.410 25575
128 1 . 1 1 51 51 VAL H H 51 7.350 7.350 7.960 -0.610 25575
129 1 . 1 1 52 52 GLN N N 52 119.680 119.680 118.628 1.052 25575
130 1 . 1 1 52 52 GLN HA H 52 3.570 3.570 3.770 -0.200 25575
131 1 . 1 1 52 52 GLN CA C 52 59.210 59.210 59.187 0.023 25575
132 1 . 1 1 52 52 GLN CB C 52 28.620 28.620 28.080 0.540 25575
133 1 . 1 1 52 52 GLN H H 52 8.210 8.210 7.664 0.546 25575
134 1 . 1 1 53 53 LYS N N 53 118.080 118.080 119.264 -1.184 25575
135 1 . 1 1 53 53 LYS HA H 53 4.160 4.160 3.974 0.186 25575
136 1 . 1 1 53 53 LYS CA C 53 58.670 58.670 59.267 -0.597 25575
137 1 . 1 1 53 53 LYS CB C 53 32.120 32.120 31.846 0.274 25575
138 1 . 1 1 53 53 LYS H H 53 7.960 7.960 7.687 0.273 25575
139 1 . 1 1 54 54 SER N N 54 115.450 115.450 114.652 0.798 25575
140 1 . 1 1 54 54 SER HA H 54 4.370 4.370 4.196 0.174 25575
141 1 . 1 1 54 54 SER CA C 54 61.330 61.330 61.195 0.135 25575
142 1 . 1 1 54 54 SER CB C 54 63.690 63.690 62.911 0.779 25575
143 1 . 1 1 54 54 SER H H 54 7.800 7.800 7.607 0.193 25575
144 1 . 1 1 55 55 ILE N N 55 117.670 117.670 120.254 -2.584 25575
145 1 . 1 1 55 55 ILE HA H 55 4.060 4.060 3.818 0.242 25575
146 1 . 1 1 55 55 ILE CA C 55 63.330 63.330 64.469 -1.139 25575
147 1 . 1 1 55 55 ILE CB C 55 38.980 38.980 38.279 0.701 25575
148 1 . 1 1 55 55 ILE H H 55 7.840 7.840 7.510 0.330 25575
149 1 . 1 1 56 56 SER N N 56 115.650 115.650 116.152 -0.502 25575
150 1 . 1 1 56 56 SER HA H 56 4.490 4.490 4.114 0.376 25575
151 1 . 1 1 56 56 SER CA C 56 60.220 60.220 61.726 -1.506 25575
152 1 . 1 1 56 56 SER CB C 56 63.000 63.000 63.051 -0.051 25575
153 1 . 1 1 56 56 SER H H 56 8.060 8.060 8.396 -0.336 25575
154 1 . 1 1 57 57 GLN N N 57 121.830 121.830 119.572 2.258 25575
155 1 . 1 1 57 57 GLN HA H 57 4.200 4.200 4.175 0.025 25575
156 1 . 1 1 57 57 GLN CA C 57 58.310 58.310 57.757 0.553 25575
157 1 . 1 1 57 57 GLN CB C 57 28.850 28.850 28.694 0.156 25575
158 1 . 1 1 57 57 GLN H H 57 8.620 8.620 7.956 0.664 25575
159 1 . 1 1 58 58 LYS N N 58 116.960 116.960 117.437 -0.477 25575
160 1 . 1 1 58 58 LYS HA H 58 4.290 4.290 4.386 -0.096 25575
161 1 . 1 1 58 58 LYS CA C 58 56.920 56.920 55.325 1.595 25575
162 1 . 1 1 58 58 LYS CB C 58 32.900 32.900 33.362 -0.462 25575
163 1 . 1 1 58 58 LYS H H 58 7.950 7.950 7.598 0.352 25575
164 1 . 1 1 59 59 LYS N N 59 116.960 116.960 118.877 -1.917 25575
165 1 . 1 1 59 59 LYS HA H 59 4.120 4.120 3.936 0.184 25575
166 1 . 1 1 59 59 LYS CA C 59 57.090 57.090 56.978 0.112 25575
167 1 . 1 1 59 59 LYS CB C 59 30.080 30.080 30.145 -0.065 25575
168 1 . 1 1 59 59 LYS H H 59 7.950 7.950 7.822 0.128 25575
169 1 . 1 1 60 60 LEU N N 60 117.540 117.540 119.169 -1.629 25575
170 1 . 1 1 60 60 LEU HA H 60 4.480 4.480 4.326 0.154 25575
171 1 . 1 1 60 60 LEU CA C 60 54.500 54.500 55.231 -0.731 25575
172 1 . 1 1 60 60 LEU CB C 60 42.840 42.840 42.598 0.242 25575
173 1 . 1 1 60 60 LEU H H 60 7.930 7.930 7.558 0.372 25575
174 1 . 1 1 61 61 LYS HA H 61 4.390 4.390 4.300 0.090 25575
175 1 . 1 1 61 61 LYS CA C 61 55.540 55.540 56.173 -0.633 25575
176 1 . 1 1 61 61 LYS CB C 61 30.050 30.050 31.253 -1.204 25575
177 1 . 1 1 62 62 LEU N N 62 120.000 120.000 122.109 -2.109 25575
178 1 . 1 1 62 62 LEU HA H 62 5.250 5.250 5.061 0.189 25575
179 1 . 1 1 62 62 LEU CA C 62 53.080 53.080 54.107 -1.027 25575
180 1 . 1 1 62 62 LEU CB C 62 45.760 45.760 42.692 3.068 25575
181 1 . 1 1 62 62 LEU H H 62 7.470 7.470 7.673 -0.203 25575
182 1 . 1 1 63 63 ASP N N 63 121.730 121.730 124.862 -3.132 25575
183 1 . 1 1 63 63 ASP HA H 63 4.860 4.860 4.846 0.014 25575
184 1 . 1 1 63 63 ASP CA C 63 51.890 51.890 52.508 -0.618 25575
185 1 . 1 1 63 63 ASP CB C 63 44.910 44.910 44.455 0.455 25575
186 1 . 1 1 63 63 ASP H H 63 8.620 8.620 8.709 -0.089 25575
187 1 . 1 1 64 64 ILE N N 64 118.120 118.120 119.363 -1.243 25575
188 1 . 1 1 64 64 ILE HA H 64 4.210 4.210 4.392 -0.182 25575
189 1 . 1 1 64 64 ILE CA C 64 60.430 60.430 58.538 1.892 25575
190 1 . 1 1 64 64 ILE CB C 64 40.420 40.420 39.553 0.867 25575
191 1 . 1 1 64 64 ILE H H 64 8.650 8.650 8.208 0.442 25575
192 1 . 1 1 65 65 ASP N N 65 124.550 124.550 128.512 -3.962 25575
193 1 . 1 1 65 65 ASP HA H 65 4.570 4.570 4.486 0.084 25575
194 1 . 1 1 65 65 ASP CA C 65 53.310 53.310 54.234 -0.924 25575
195 1 . 1 1 65 65 ASP CB C 65 40.440 40.440 41.422 -0.982 25575
196 1 . 1 1 65 65 ASP H H 65 8.630 8.630 8.608 0.022 25575
197 1 . 1 1 66 66 LYS N N 66 125.970 125.970 125.528 0.442 25575
198 1 . 1 1 66 66 LYS HA H 66 4.040 4.040 4.228 -0.188 25575
199 1 . 1 1 66 66 LYS CA C 66 58.140 58.140 57.319 0.822 25575
200 1 . 1 1 66 66 LYS CB C 66 31.990 31.990 32.416 -0.426 25575
201 1 . 1 1 66 66 LYS H H 66 8.590 8.590 8.440 0.150 25575
202 1 . 1 1 67 67 SER N N 67 114.980 114.980 115.900 -0.920 25575
203 1 . 1 1 67 67 SER HA H 67 4.320 4.320 4.231 0.089 25575
204 1 . 1 1 67 67 SER CA C 67 60.330 60.330 61.153 -0.823 25575
205 1 . 1 1 67 67 SER CB C 67 63.710 63.710 63.248 0.462 25575
206 1 . 1 1 67 67 SER H H 67 8.760 8.760 8.572 0.188 25575
207 1 . 1 1 68 68 VAL HA H 68 4.250 4.250 3.956 0.294 25575
208 1 . 1 1 68 68 VAL CA C 68 62.150 62.150 62.414 -0.264 25575
209 1 . 1 1 68 68 VAL CB C 68 31.900 31.900 31.851 0.048 25575
210 1 . 1 1 69 69 ARG CA C 69 56.960 56.960 57.511 -0.551 25575
211 1 . 1 1 70 70 HIS N N 70 116.270 116.270 114.602 1.668 25575
212 1 . 1 1 70 70 HIS HA H 70 4.760 4.760 4.719 0.041 25575
213 1 . 1 1 70 70 HIS CA C 70 55.360 55.360 54.185 1.175 25575
214 1 . 1 1 70 70 HIS CB C 70 33.100 33.100 31.411 1.689 25575
215 1 . 1 1 70 70 HIS H H 70 7.390 7.390 8.005 -0.615 25575
216 1 . 1 1 71 71 LEU N N 71 120.200 120.200 121.924 -1.724 25575
217 1 . 1 1 71 71 LEU HA H 71 5.060 5.060 4.595 0.465 25575
218 1 . 1 1 71 71 LEU CA C 71 54.070 54.070 53.991 0.079 25575
219 1 . 1 1 71 71 LEU CB C 71 42.710 42.710 40.926 1.784 25575
220 1 . 1 1 71 71 LEU H H 71 7.970 7.970 8.476 -0.506 25575
221 1 . 1 1 72 72 TYR HA H 72 5.030 5.030 4.804 0.226 25575
222 1 . 1 1 72 72 TYR CA C 72 59.990 59.990 57.722 2.268 25575
223 1 . 1 1 72 72 TYR CB C 72 39.440 39.440 40.966 -1.526 25575
224 1 . 1 1 73 73 ILE N N 73 112.940 112.940 114.114 -1.174 25575
225 1 . 1 1 73 73 ILE HA H 73 6.080 6.080 4.844 1.236 25575
226 1 . 1 1 73 73 ILE CA C 73 58.090 58.090 58.506 -0.416 25575
227 1 . 1 1 73 73 ILE CB C 73 41.820 41.820 42.467 -0.647 25575
228 1 . 1 1 73 73 ILE H H 73 8.450 8.450 8.221 0.229 25575
229 1 . 1 1 74 74 CYS N N 74 124.730 124.730 119.138 5.592 25575
230 1 . 1 1 74 74 CYS HA H 74 5.080 5.080 5.106 -0.026 25575
231 1 . 1 1 74 74 CYS CA C 74 57.670 57.670 57.481 0.189 25575
232 1 . 1 1 74 74 CYS CB C 74 33.330 33.330 30.030 3.300 25575
233 1 . 1 1 74 74 CYS H H 74 9.830 9.830 8.552 1.278 25575
234 1 . 1 1 75 75 ASP N N 75 120.990 120.990 123.082 -2.092 25575
235 1 . 1 1 75 75 ASP HA H 75 4.590 4.590 4.377 0.213 25575
236 1 . 1 1 75 75 ASP CA C 75 57.320 57.320 57.768 -0.448 25575
237 1 . 1 1 75 75 ASP CB C 75 39.670 39.670 40.587 -0.917 25575
238 1 . 1 1 75 75 ASP H H 75 9.090 9.090 9.015 0.075 25575
239 1 . 1 1 76 76 PHE N N 76 122.470 122.470 120.366 2.104 25575
240 1 . 1 1 76 76 PHE HA H 76 4.230 4.230 4.166 0.064 25575
241 1 . 1 1 76 76 PHE CA C 76 62.030 62.030 61.895 0.135 25575
242 1 . 1 1 76 76 PHE CB C 76 38.190 38.190 39.162 -0.972 25575
243 1 . 1 1 76 76 PHE H H 76 8.330 8.330 8.253 0.077 25575
244 1 . 1 1 77 77 HIS N N 77 124.580 124.580 117.918 6.662 25575
245 1 . 1 1 77 77 HIS HA H 77 4.280 4.280 4.334 -0.054 25575
246 1 . 1 1 77 77 HIS CA C 77 63.880 63.880 59.475 4.405 25575
247 1 . 1 1 77 77 HIS CB C 77 29.600 29.600 30.086 -0.486 25575
248 1 . 1 1 77 77 HIS H H 77 10.300 10.300 7.830 2.470 25575
249 1 . 1 1 78 78 LYS N N 78 122.930 122.930 120.156 2.774 25575
250 1 . 1 1 78 78 LYS HA H 78 3.860 3.860 3.963 -0.103 25575
251 1 . 1 1 78 78 LYS CA C 78 60.550 60.550 60.048 0.502 25575
252 1 . 1 1 78 78 LYS CB C 78 32.040 32.040 32.417 -0.377 25575
253 1 . 1 1 78 78 LYS H H 78 8.960 8.960 8.494 0.466 25575
254 1 . 1 1 79 79 ASN N N 79 116.670 116.670 117.715 -1.045 25575
255 1 . 1 1 79 79 ASN HA H 79 4.420 4.420 4.545 -0.125 25575
256 1 . 1 1 79 79 ASN CA C 79 56.030 56.030 55.957 0.073 25575
257 1 . 1 1 79 79 ASN CB C 79 38.100 38.100 38.418 -0.318 25575
258 1 . 1 1 79 79 ASN H H 79 8.230 8.230 7.949 0.281 25575
259 1 . 1 1 80 80 PHE N N 80 122.600 122.600 121.793 0.807 25575
260 1 . 1 1 80 80 PHE HA H 80 4.180 4.180 4.148 0.032 25575
261 1 . 1 1 80 80 PHE CA C 80 60.700 60.700 61.396 -0.696 25575
262 1 . 1 1 80 80 PHE CB C 80 39.840 39.840 39.096 0.744 25575
263 1 . 1 1 80 80 PHE H H 80 8.200 8.200 8.038 0.162 25575
264 1 . 1 1 81 81 ILE N N 81 118.240 118.240 116.970 1.270 25575
265 1 . 1 1 81 81 ILE HA H 81 3.320 3.320 3.520 -0.200 25575
266 1 . 1 1 81 81 ILE CA C 81 65.160 65.160 64.511 0.649 25575
267 1 . 1 1 81 81 ILE CB C 81 38.440 38.440 37.670 0.770 25575
268 1 . 1 1 81 81 ILE H H 81 8.520 8.520 7.973 0.547 25575
269 1 . 1 1 82 82 GLN N N 82 116.370 116.370 118.543 -2.173 25575
270 1 . 1 1 82 82 GLN HA H 82 4.100 4.100 4.065 0.035 25575
271 1 . 1 1 82 82 GLN CA C 82 57.710 57.710 58.251 -0.541 25575
272 1 . 1 1 82 82 GLN CB C 82 28.710 28.710 28.604 0.105 25575
273 1 . 1 1 82 82 GLN H H 82 7.670 7.670 7.842 -0.172 25575
274 1 . 1 1 83 83 SER N N 83 114.440 114.440 116.399 -1.959 25575
275 1 . 1 1 83 83 SER HA H 83 4.300 4.300 4.170 0.130 25575
276 1 . 1 1 83 83 SER CA C 83 60.130 60.130 61.726 -1.596 25575
277 1 . 1 1 83 83 SER CB C 83 63.570 63.570 63.031 0.539 25575
278 1 . 1 1 83 83 SER H H 83 7.810 7.810 8.459 -0.649 25575
279 1 . 1 1 84 84 VAL N N 84 120.750 120.750 118.253 2.497 25575
280 1 . 1 1 84 84 VAL HA H 84 3.970 3.970 3.798 0.172 25575
281 1 . 1 1 84 84 VAL CA C 84 63.430 63.430 64.729 -1.299 25575
282 1 . 1 1 84 84 VAL CB C 84 31.960 31.960 31.008 0.952 25575
283 1 . 1 1 84 84 VAL H H 84 7.790 7.790 7.509 0.281 25575
284 1 . 1 1 85 85 ARG N N 85 122.090 122.090 119.236 2.854 25575
285 1 . 1 1 85 85 ARG HA H 85 4.240 4.240 4.156 0.084 25575
286 1 . 1 1 85 85 ARG CA C 85 56.850 56.850 57.268 -0.418 25575
287 1 . 1 1 85 85 ARG CB C 85 30.720 30.720 30.344 0.376 25575
288 1 . 1 1 85 85 ARG H H 85 8.090 8.090 7.655 0.435 25575
289 1 . 1 1 86 86 ASN N N 86 118.510 118.510 117.337 1.173 25575
290 1 . 1 1 86 86 ASN HA H 86 4.690 4.690 4.638 0.052 25575
291 1 . 1 1 86 86 ASN CA C 86 53.380 53.380 53.938 -0.558 25575
292 1 . 1 1 86 86 ASN CB C 86 38.950 38.950 38.840 0.110 25575
293 1 . 1 1 86 86 ASN H H 86 8.220 8.220 7.900 0.320 25575
294 1 . 1 1 87 87 LYS N N 87 121.600 121.600 119.922 1.678 25575
295 1 . 1 1 87 87 LYS HA H 87 4.310 4.310 4.313 -0.003 25575
296 1 . 1 1 87 87 LYS CA C 87 56.590 56.590 56.027 0.563 25575
297 1 . 1 1 87 87 LYS CB C 87 32.870 32.870 31.926 0.944 25575
298 1 . 1 1 87 87 LYS H H 87 8.150 8.150 8.137 0.013 25575
299 1 . 1 1 88 88 ARG N N 88 121.920 121.920 121.593 0.327 25575
300 1 . 1 1 88 88 ARG HA H 88 4.330 4.330 4.289 0.041 25575
301 1 . 1 1 88 88 ARG CA C 88 56.110 56.110 56.301 -0.191 25575
302 1 . 1 1 88 88 ARG CB C 88 30.870 30.870 30.089 0.781 25575
303 1 . 1 1 88 88 ARG H H 88 8.250 8.250 8.188 0.062 25575
304 1 . 1 1 89 89 LYS N N 89 123.020 123.020 122.017 1.003 25575
305 1 . 1 1 89 89 LYS HA H 89 4.320 4.320 4.311 0.009 25575
306 1 . 1 1 89 89 LYS CA C 89 56.330 56.330 56.417 -0.087 25575
307 1 . 1 1 89 89 LYS CB C 89 33.140 33.140 32.898 0.242 25575
308 1 . 1 1 89 89 LYS H H 89 8.320 8.320 8.272 0.048 25575
309 1 . 1 1 90 90 ARG N N 90 122.970 122.970 121.584 1.386 25575
310 1 . 1 1 90 90 ARG HA H 90 4.360 4.360 4.356 0.004 25575
311 1 . 1 1 90 90 ARG CA C 90 56.100 56.100 56.018 0.082 25575
312 1 . 1 1 90 90 ARG CB C 90 31.210 31.210 30.858 0.352 25575
313 1 . 1 1 90 90 ARG H H 90 8.360 8.360 8.184 0.176 25575
314 1 . 1 1 91 91 LYS N N 91 123.680 123.680 121.954 1.726 25575
315 1 . 1 1 91 91 LYS HA H 91 4.380 4.380 4.484 -0.104 25575
316 1 . 1 1 91 91 LYS CA C 91 56.620 56.620 56.190 0.430 25575
317 1 . 1 1 91 91 LYS CB C 91 33.070 33.070 33.426 -0.356 25575
318 1 . 1 1 91 91 LYS H H 91 8.450 8.450 8.360 0.090 25575
stop_
save_