data_18222
save_entry_information
_Entry.Sf_category entry_information
_Entry.NMR_STAR_version 3.0.9.13
_Entry.Entry_ID 18222
_Entry.PDB_ID 2LOR
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 18222
_Entity_delta_chem_shifts.ID 1
loop_
_Delta_CS.Atom_chem_shift_ID
_Delta_CS.Entity_delta_chem_shifts_ID
_Delta_CS.Conformer_ID
_Delta_CS.Assembly_atom_ID
_Delta_CS.Entity_assembly_ID
_Delta_CS.Entity_ID
_Delta_CS.Comp_index_ID
_Delta_CS.Seq_ID
_Delta_CS.Comp_ID
_Delta_CS.Atom_ID
_Delta_CS.Atom_type
_Delta_CS.Auth_seq_ID
_Delta_CS.Original_CS_value
_Delta_CS.Corrected_CS_value
_Delta_CS.Sparta_CS_value
_Delta_CS.Delta_CS_value
_Delta_CS.Entry_ID
1 1 1 . 1 1 2 2 VAL N N 2 121.590 121.590 120.258 1.332 18222
2 1 1 . 1 1 2 2 VAL CA C 2 61.600 61.600 62.118 -0.518 18222
3 1 1 . 1 1 2 2 VAL CB C 2 31.900 31.900 32.854 -0.954 18222
4 1 1 . 1 1 2 2 VAL H H 2 8.010 8.010 8.449 -0.439 18222
5 1 1 . 1 1 3 3 ASN N N 3 122.520 122.520 125.050 -2.530 18222
6 1 1 . 1 1 3 3 ASN HA H 3 4.020 4.020 4.762 -0.742 18222
7 1 1 . 1 1 3 3 ASN CA C 3 52.640 52.640 53.798 -1.159 18222
8 1 1 . 1 1 3 3 ASN CB C 3 38.330 38.330 39.481 -1.151 18222
9 1 1 . 1 1 3 3 ASN H H 3 8.360 8.360 9.043 -0.683 18222
10 1 1 . 1 1 4 4 LEU N N 4 123.830 123.830 116.271 7.559 18222
11 1 1 . 1 1 4 4 LEU HA H 4 4.220 4.220 4.752 -0.532 18222
12 1 1 . 1 1 4 4 LEU CA C 4 54.620 54.620 54.823 -0.203 18222
13 1 1 . 1 1 4 4 LEU CB C 4 41.680 41.680 44.566 -2.886 18222
14 1 1 . 1 1 4 4 LEU H H 4 8.220 8.220 7.620 0.600 18222
15 1 1 . 1 1 5 5 GLY N N 5 106.810 106.810 111.944 -5.134 18222
16 1 1 . 1 1 5 5 GLY CA C 5 45.800 45.800 45.298 0.502 18222
17 1 1 . 1 1 5 5 GLY H H 5 8.030 8.030 8.139 -0.109 18222
18 1 1 . 1 1 6 6 LEU N N 6 120.820 120.820 120.030 0.790 18222
19 1 1 . 1 1 6 6 LEU HA H 6 4.050 4.050 4.507 -0.457 18222
20 1 1 . 1 1 6 6 LEU CA C 6 55.990 55.990 57.125 -1.135 18222
21 1 1 . 1 1 6 6 LEU CB C 6 40.800 40.800 41.043 -0.243 18222
22 1 1 . 1 1 6 6 LEU H H 6 8.030 8.030 8.308 -0.278 18222
23 1 1 . 1 1 7 7 SER N N 7 115.540 115.540 117.109 -1.569 18222
24 1 1 . 1 1 7 7 SER HA H 7 4.100 4.100 4.180 -0.080 18222
25 1 1 . 1 1 7 7 SER CA C 7 60.580 60.580 62.190 -1.610 18222
26 1 1 . 1 1 7 7 SER CB C 7 62.060 62.060 62.480 -0.420 18222
27 1 1 . 1 1 7 7 SER H H 7 8.360 8.360 8.466 -0.106 18222
28 1 1 . 1 1 8 8 ARG N N 8 120.690 120.690 121.889 -1.199 18222
29 1 1 . 1 1 8 8 ARG HA H 8 4.160 4.160 4.071 0.089 18222
30 1 1 . 1 1 8 8 ARG CA C 8 57.350 57.350 59.052 -1.702 18222
31 1 1 . 1 1 8 8 ARG CB C 8 29.230 29.230 30.119 -0.889 18222
32 1 1 . 1 1 8 8 ARG H H 8 7.830 7.830 7.616 0.214 18222
33 1 1 . 1 1 9 9 VAL N N 9 119.330 119.330 121.234 -1.904 18222
34 1 1 . 1 1 9 9 VAL HA H 9 4.170 4.170 3.554 0.616 18222
35 1 1 . 1 1 9 9 VAL CA C 9 64.720 64.720 67.398 -2.678 18222
36 1 1 . 1 1 9 9 VAL CB C 9 30.900 30.900 31.672 -0.772 18222
37 1 1 . 1 1 9 9 VAL H H 9 7.620 7.620 7.640 -0.020 18222
38 1 1 . 1 1 10 10 ASP N N 10 119.520 119.520 120.119 -0.599 18222
39 1 1 . 1 1 10 10 ASP CA C 10 54.960 54.960 58.017 -3.057 18222
40 1 1 . 1 1 10 10 ASP CB C 10 37.800 37.800 40.546 -2.746 18222
41 1 1 . 1 1 10 10 ASP H H 10 8.180 8.180 8.444 -0.264 18222
42 1 1 . 1 1 11 11 ASP N N 11 121.550 121.550 120.946 0.604 18222
43 1 1 . 1 1 11 11 ASP CA C 11 54.440 54.440 57.786 -3.346 18222
44 1 1 . 1 1 11 11 ASP CB C 11 37.840 37.840 40.512 -2.672 18222
45 1 1 . 1 1 11 11 ASP H H 11 7.950 7.950 8.128 -0.178 18222
46 1 1 . 1 1 12 12 ALA N N 12 120.220 120.220 122.168 -1.948 18222
47 1 1 . 1 1 12 12 ALA CA C 12 54.370 54.370 55.124 -0.755 18222
48 1 1 . 1 1 12 12 ALA CB C 12 24.730 24.730 18.557 6.173 18222
49 1 1 . 1 1 12 12 ALA H H 12 8.090 8.090 8.172 -0.082 18222
50 1 1 . 1 1 13 13 VAL N N 13 116.910 116.910 119.049 -2.139 18222
51 1 1 . 1 1 13 13 VAL HA H 13 4.140 4.140 3.623 0.517 18222
52 1 1 . 1 1 13 13 VAL CA C 13 64.900 64.900 67.044 -2.144 18222
53 1 1 . 1 1 13 13 VAL CB C 13 31.000 31.000 31.548 -0.548 18222
54 1 1 . 1 1 13 13 VAL H H 13 7.980 7.980 7.980 -0.000 18222
55 1 1 . 1 1 14 14 ALA N N 14 122.200 122.200 122.542 -0.342 18222
56 1 1 . 1 1 14 14 ALA HA H 14 4.020 4.020 4.125 -0.105 18222
57 1 1 . 1 1 14 14 ALA CA C 14 53.800 53.800 55.100 -1.300 18222
58 1 1 . 1 1 14 14 ALA CB C 14 17.790 17.790 18.608 -0.818 18222
59 1 1 . 1 1 14 14 ALA H H 14 8.030 8.030 8.147 -0.117 18222
60 1 1 . 1 1 15 15 ALA N N 15 118.600 118.600 118.499 0.101 18222
61 1 1 . 1 1 15 15 ALA CA C 15 53.230 53.230 54.387 -1.157 18222
62 1 1 . 1 1 15 15 ALA CB C 15 18.010 18.010 18.667 -0.657 18222
63 1 1 . 1 1 15 15 ALA H H 15 7.530 7.530 8.118 -0.588 18222
64 1 1 . 1 1 16 16 LYS N N 16 115.820 115.820 117.777 -1.957 18222
65 1 1 . 1 1 16 16 LYS HA H 16 4.080 4.080 4.241 -0.161 18222
66 1 1 . 1 1 16 16 LYS CA C 16 55.670 55.670 57.338 -1.668 18222
67 1 1 . 1 1 16 16 LYS CB C 16 32.640 32.640 33.604 -0.964 18222
68 1 1 . 1 1 16 16 LYS H H 16 7.490 7.490 7.753 -0.263 18222
69 1 1 . 1 1 17 17 HIS N N 17 116.790 116.790 118.928 -2.138 18222
70 1 1 . 1 1 17 17 HIS HA H 17 4.100 4.100 4.916 -0.816 18222
71 1 1 . 1 1 17 17 HIS CA C 17 52.820 52.820 53.105 -0.285 18222
72 1 1 . 1 1 17 17 HIS CB C 17 28.400 28.400 30.631 -2.231 18222
73 1 1 . 1 1 17 17 HIS H H 17 8.130 8.130 8.116 0.014 18222
74 1 1 . 1 1 18 18 PRO CA C 18 63.800 63.800 63.200 0.600 18222
75 1 1 . 1 1 18 18 PRO CB C 18 30.800 30.800 31.774 -0.974 18222
76 1 1 . 1 1 19 19 GLY N N 19 110.260 110.260 110.557 -0.297 18222
77 1 1 . 1 1 19 19 GLY CA C 19 45.490 45.490 46.371 -0.881 18222
78 1 1 . 1 1 19 19 GLY H H 19 8.730 8.730 8.141 0.589 18222
79 1 1 . 1 1 20 20 LEU N N 20 122.650 122.650 124.058 -1.408 18222
80 1 1 . 1 1 20 20 LEU HA H 20 4.090 4.090 4.321 -0.231 18222
81 1 1 . 1 1 20 20 LEU CA C 20 57.060 57.060 56.972 0.088 18222
82 1 1 . 1 1 20 20 LEU H H 20 7.980 7.980 8.260 -0.280 18222
83 1 1 . 1 1 21 21 GLY N N 21 107.000 107.000 106.496 0.504 18222
84 1 1 . 1 1 21 21 GLY CA C 21 46.710 46.710 46.976 -0.266 18222
85 1 1 . 1 1 21 21 GLY H H 21 8.570 8.570 8.754 -0.184 18222
86 1 1 . 1 1 22 22 GLU N N 22 121.610 121.610 121.532 0.078 18222
87 1 1 . 1 1 22 22 GLU HA H 22 3.990 3.990 3.996 -0.006 18222
88 1 1 . 1 1 22 22 GLU CA C 22 58.280 58.280 59.689 -1.409 18222
89 1 1 . 1 1 22 22 GLU CB C 22 28.010 28.010 29.579 -1.569 18222
90 1 1 . 1 1 22 22 GLU H H 22 8.100 8.100 8.265 -0.165 18222
91 1 1 . 1 1 23 23 TYR N N 23 120.870 120.870 120.595 0.275 18222
92 1 1 . 1 1 23 23 TYR CA C 23 60.380 60.380 61.634 -1.254 18222
93 1 1 . 1 1 23 23 TYR CB C 23 37.750 37.750 38.319 -0.570 18222
94 1 1 . 1 1 23 23 TYR H H 23 7.910 7.910 7.513 0.397 18222
95 1 1 . 1 1 24 24 ALA N N 24 121.420 121.420 121.307 0.113 18222
96 1 1 . 1 1 24 24 ALA HA H 24 4.140 4.140 3.840 0.300 18222
97 1 1 . 1 1 24 24 ALA CA C 24 54.260 54.260 55.073 -0.813 18222
98 1 1 . 1 1 24 24 ALA H H 24 8.410 8.410 8.442 -0.032 18222
99 1 1 . 1 1 25 25 ALA N N 25 120.220 120.220 121.814 -1.594 18222
100 1 1 . 1 1 25 25 ALA CA C 25 54.370 54.370 54.774 -0.404 18222
101 1 1 . 1 1 25 25 ALA H H 25 8.090 8.090 8.202 -0.112 18222
102 1 1 . 1 1 26 26 CYS N N 26 116.760 116.760 117.584 -0.824 18222
103 1 1 . 1 1 26 26 CYS CA C 26 61.180 61.180 63.307 -2.127 18222
104 1 1 . 1 1 26 26 CYS CB C 26 26.390 26.390 27.331 -0.941 18222
105 1 1 . 1 1 26 26 CYS H H 26 7.950 7.950 8.487 -0.537 18222
106 1 1 . 1 1 27 27 GLN N N 27 118.690 118.690 120.655 -1.965 18222
107 1 1 . 1 1 27 27 GLN CA C 27 55.970 55.970 59.205 -3.235 18222
108 1 1 . 1 1 27 27 GLN H H 27 8.060 8.060 8.138 -0.078 18222
109 1 1 . 1 1 28 28 SER N N 28 115.490 115.490 115.161 0.329 18222
110 1 1 . 1 1 28 28 SER HA H 28 3.990 3.990 4.171 -0.181 18222
111 1 1 . 1 1 28 28 SER CA C 28 61.110 61.110 61.494 -0.384 18222
112 1 1 . 1 1 28 28 SER H H 28 7.980 7.980 8.355 -0.375 18222
113 1 1 . 1 1 29 29 HIS N N 29 120.880 120.880 122.754 -1.874 18222
114 1 1 . 1 1 29 29 HIS CA C 29 58.190 58.190 59.590 -1.400 18222
115 1 1 . 1 1 29 29 HIS CB C 29 27.460 27.460 30.224 -2.764 18222
116 1 1 . 1 1 29 29 HIS H H 29 8.180 8.180 8.364 -0.184 18222
117 1 1 . 1 1 30 30 ALA N N 30 122.920 122.920 122.453 0.467 18222
118 1 1 . 1 1 30 30 ALA CA C 30 54.560 54.560 55.090 -0.530 18222
119 1 1 . 1 1 30 30 ALA CB C 30 17.490 17.490 18.180 -0.690 18222
120 1 1 . 1 1 30 30 ALA H H 30 8.040 8.040 7.961 0.079 18222
121 1 1 . 1 1 31 31 PHE N N 31 119.340 119.340 119.887 -0.547 18222
122 1 1 . 1 1 31 31 PHE CA C 31 60.370 60.370 61.366 -0.996 18222
123 1 1 . 1 1 31 31 PHE CB C 31 38.520 38.520 39.328 -0.807 18222
124 1 1 . 1 1 31 31 PHE H H 31 8.230 8.230 8.343 -0.113 18222
125 1 1 . 1 1 32 32 MET N N 32 118.110 118.110 119.548 -1.438 18222
126 1 1 . 1 1 32 32 MET HA H 32 4.050 4.050 3.904 0.146 18222
127 1 1 . 1 1 32 32 MET CA C 32 58.280 58.280 59.143 -0.863 18222
128 1 1 . 1 1 32 32 MET CB C 32 31.090 31.090 32.534 -1.444 18222
129 1 1 . 1 1 32 32 MET H H 32 8.120 8.120 8.493 -0.373 18222
130 1 1 . 1 1 33 33 LYS N N 33 119.040 119.040 120.181 -1.141 18222
131 1 1 . 1 1 33 33 LYS HA H 33 3.930 3.930 3.928 0.002 18222
132 1 1 . 1 1 33 33 LYS CA C 33 59.040 59.040 59.718 -0.678 18222
133 1 1 . 1 1 33 33 LYS CB C 33 30.990 30.990 32.256 -1.266 18222
134 1 1 . 1 1 33 33 LYS H H 33 7.970 7.970 8.246 -0.276 18222
135 1 1 . 1 1 34 34 GLY N N 34 108.840 108.840 106.888 1.952 18222
136 1 1 . 1 1 34 34 GLY CA C 34 46.610 46.610 47.196 -0.585 18222
137 1 1 . 1 1 34 34 GLY H H 34 8.030 8.030 8.114 -0.084 18222
138 1 1 . 1 1 35 35 VAL N N 35 122.910 122.910 122.309 0.601 18222
139 1 1 . 1 1 35 35 VAL HA H 35 4.220 4.220 3.537 0.683 18222
140 1 1 . 1 1 35 35 VAL CA C 35 66.310 66.310 66.720 -0.410 18222
141 1 1 . 1 1 35 35 VAL CB C 35 30.560 30.560 31.517 -0.957 18222
142 1 1 . 1 1 35 35 VAL H H 35 8.090 8.090 7.891 0.199 18222
143 1 1 . 1 1 36 36 PHE N N 36 120.020 120.020 120.225 -0.205 18222
144 1 1 . 1 1 36 36 PHE CA C 36 61.350 61.350 61.985 -0.635 18222
145 1 1 . 1 1 36 36 PHE CB C 36 38.090 38.090 39.288 -1.198 18222
146 1 1 . 1 1 36 36 PHE H H 36 8.350 8.350 8.309 0.041 18222
147 1 1 . 1 1 37 37 THR N N 37 116.980 116.980 114.026 2.954 18222
148 1 1 . 1 1 37 37 THR HA H 37 4.050 4.050 3.848 0.202 18222
149 1 1 . 1 1 37 37 THR CA C 37 66.000 66.000 65.635 0.365 18222
150 1 1 . 1 1 37 37 THR CB C 37 68.270 68.270 68.805 -0.535 18222
151 1 1 . 1 1 37 37 THR H H 37 8.520 8.520 8.207 0.313 18222
152 1 1 . 1 1 38 38 PHE N N 38 123.090 123.090 121.011 2.079 18222
153 1 1 . 1 1 38 38 PHE HA H 38 4.360 4.360 4.209 0.151 18222
154 1 1 . 1 1 38 38 PHE CA C 38 61.140 61.140 61.050 0.090 18222
155 1 1 . 1 1 38 38 PHE CB C 38 41.200 41.200 39.558 1.642 18222
156 1 1 . 1 1 38 38 PHE H H 38 8.010 8.010 7.944 0.066 18222
157 1 1 . 1 1 39 39 VAL N N 39 117.280 117.280 120.332 -3.052 18222
158 1 1 . 1 1 39 39 VAL HA H 39 4.210 4.210 3.678 0.532 18222
159 1 1 . 1 1 39 39 VAL CA C 39 66.000 66.000 66.151 -0.151 18222
160 1 1 . 1 1 39 39 VAL CB C 39 30.860 30.860 31.959 -1.099 18222
161 1 1 . 1 1 39 39 VAL H H 39 8.530 8.530 8.661 -0.131 18222
162 1 1 . 1 1 40 40 THR N N 40 109.470 109.470 113.201 -3.731 18222
163 1 1 . 1 1 40 40 THR HA H 40 4.060 4.060 4.065 -0.005 18222
164 1 1 . 1 1 40 40 THR CA C 40 63.390 63.390 62.912 0.478 18222
165 1 1 . 1 1 40 40 THR CB C 40 68.650 68.650 67.637 1.013 18222
166 1 1 . 1 1 40 40 THR H H 40 7.700 7.700 7.709 -0.009 18222
167 1 1 . 1 1 41 41 GLY N N 41 110.770 110.770 109.038 1.732 18222
168 1 1 . 1 1 41 41 GLY CA C 41 45.580 45.580 45.363 0.217 18222
169 1 1 . 1 1 41 41 GLY H H 41 7.700 7.700 7.846 -0.146 18222
170 1 1 . 1 1 42 42 THR N N 42 114.520 114.520 116.361 -1.841 18222
171 1 1 . 1 1 42 42 THR CA C 42 63.300 63.300 60.831 2.469 18222
172 1 1 . 1 1 42 42 THR CB C 42 69.490 69.490 68.509 0.981 18222
173 1 1 . 1 1 42 42 THR H H 42 7.720 7.720 7.194 0.526 18222
174 1 1 . 1 1 43 43 GLY N N 43 109.540 109.540 110.087 -0.547 18222
175 1 1 . 1 1 43 43 GLY CA C 43 46.250 46.250 46.637 -0.387 18222
176 1 1 . 1 1 43 43 GLY H H 43 8.110 8.110 7.947 0.163 18222
177 1 1 . 1 1 44 44 MET N N 44 120.240 120.240 121.053 -0.813 18222
178 1 1 . 1 1 44 44 MET HA H 44 4.100 4.100 3.991 0.109 18222
179 1 1 . 1 1 44 44 MET CA C 44 57.700 57.700 59.037 -1.337 18222
180 1 1 . 1 1 44 44 MET CB C 44 32.030 32.030 32.227 -0.198 18222
181 1 1 . 1 1 44 44 MET H H 44 7.730 7.730 7.837 -0.107 18222
182 1 1 . 1 1 45 45 ALA N N 45 121.560 121.560 121.345 0.215 18222
183 1 1 . 1 1 45 45 ALA CA C 45 54.440 54.440 55.103 -0.663 18222
184 1 1 . 1 1 45 45 ALA CB C 45 17.400 17.400 18.023 -0.624 18222
185 1 1 . 1 1 45 45 ALA H H 45 7.950 7.950 7.809 0.141 18222
186 1 1 . 1 1 46 46 PHE N N 46 118.260 118.260 119.027 -0.767 18222
187 1 1 . 1 1 46 46 PHE HA H 46 3.930 3.930 4.283 -0.353 18222
188 1 1 . 1 1 46 46 PHE CA C 46 59.820 59.820 59.569 0.251 18222
189 1 1 . 1 1 46 46 PHE CB C 46 38.260 38.260 38.443 -0.183 18222
190 1 1 . 1 1 46 46 PHE H H 46 7.860 7.860 8.137 -0.277 18222
191 1 1 . 1 1 47 47 GLY N N 47 107.300 107.300 108.665 -1.365 18222
192 1 1 . 1 1 47 47 GLY CA C 47 46.560 46.560 47.225 -0.665 18222
193 1 1 . 1 1 47 47 GLY H H 47 8.200 8.200 8.576 -0.376 18222
194 1 1 . 1 1 48 48 LEU N N 48 121.920 121.920 122.991 -1.071 18222
195 1 1 . 1 1 48 48 LEU HA H 48 4.040 4.040 4.102 -0.062 18222
196 1 1 . 1 1 48 48 LEU CA C 48 57.580 57.580 57.900 -0.320 18222
197 1 1 . 1 1 48 48 LEU CB C 48 40.790 40.790 41.817 -1.027 18222
198 1 1 . 1 1 48 48 LEU H H 48 8.180 8.180 8.261 -0.081 18222
199 1 1 . 1 1 49 49 GLN N N 49 118.270 118.270 118.176 0.094 18222
200 1 1 . 1 1 49 49 GLN HA H 49 3.830 3.830 3.947 -0.117 18222
201 1 1 . 1 1 49 49 GLN CA C 49 58.880 58.880 59.196 -0.316 18222
202 1 1 . 1 1 49 49 GLN CB C 49 27.240 27.240 28.529 -1.289 18222
203 1 1 . 1 1 49 49 GLN H H 49 8.080 8.080 8.177 -0.097 18222
204 1 1 . 1 1 50 50 MET N N 50 117.630 117.630 119.903 -2.273 18222
205 1 1 . 1 1 50 50 MET HA H 50 4.010 4.010 4.110 -0.100 18222
206 1 1 . 1 1 50 50 MET CA C 50 57.730 57.730 58.972 -1.242 18222
207 1 1 . 1 1 50 50 MET CB C 50 27.160 27.160 32.593 -5.433 18222
208 1 1 . 1 1 50 50 MET H H 50 7.880 7.880 8.074 -0.194 18222
209 1 1 . 1 1 51 51 PHE N N 51 119.550 119.550 120.155 -0.605 18222
210 1 1 . 1 1 51 51 PHE CA C 51 60.850 60.850 61.741 -0.891 18222
211 1 1 . 1 1 51 51 PHE CB C 51 38.720 38.720 39.327 -0.607 18222
212 1 1 . 1 1 51 51 PHE H H 51 7.890 7.890 8.301 -0.411 18222
213 1 1 . 1 1 52 52 ILE N N 52 117.950 117.950 118.918 -0.968 18222
214 1 1 . 1 1 52 52 ILE HA H 52 4.050 4.050 4.010 0.040 18222
215 1 1 . 1 1 52 52 ILE CA C 52 63.560 63.560 63.809 -0.249 18222
216 1 1 . 1 1 52 52 ILE CB C 52 36.810 36.810 37.677 -0.867 18222
217 1 1 . 1 1 52 52 ILE H H 52 8.110 8.110 8.378 -0.268 18222
218 1 1 . 1 1 53 53 GLN N N 53 117.360 117.360 119.323 -1.963 18222
219 1 1 . 1 1 53 53 GLN CA C 53 57.200 57.200 58.259 -1.059 18222
220 1 1 . 1 1 53 53 GLN CB C 53 27.870 27.870 28.343 -0.472 18222
221 1 1 . 1 1 53 53 GLN H H 53 7.930 7.930 8.142 -0.212 18222
222 1 1 . 1 1 54 54 ARG N N 54 116.840 116.840 118.611 -1.771 18222
223 1 1 . 1 1 54 54 ARG HA H 54 3.950 3.950 4.137 -0.187 18222
224 1 1 . 1 1 54 54 ARG CA C 54 56.480 56.480 57.352 -0.872 18222
225 1 1 . 1 1 54 54 ARG CB C 54 28.970 28.970 30.060 -1.090 18222
226 1 1 . 1 1 54 54 ARG H H 54 7.540 7.540 7.856 -0.316 18222
227 1 1 . 1 1 55 55 LYS N N 55 117.900 117.900 117.643 0.257 18222
228 1 1 . 1 1 55 55 LYS HA H 55 4.080 4.080 4.199 -0.119 18222
229 1 1 . 1 1 55 55 LYS CA C 55 55.030 55.030 57.021 -1.991 18222
230 1 1 . 1 1 55 55 LYS CB C 55 32.010 32.010 32.181 -0.171 18222
231 1 1 . 1 1 55 55 LYS H H 55 7.660 7.660 7.446 0.214 18222
232 1 1 . 1 1 56 56 PHE N N 56 121.060 121.060 122.204 -1.144 18222
233 1 1 . 1 1 56 56 PHE CA C 56 55.190 55.190 55.022 0.168 18222
234 1 1 . 1 1 56 56 PHE CB C 56 38.970 38.970 40.094 -1.124 18222
235 1 1 . 1 1 56 56 PHE H H 56 8.080 8.080 7.802 0.278 18222
236 1 1 . 1 1 57 57 PRO CA C 57 62.390 62.390 63.594 -1.204 18222
237 1 1 . 1 1 57 57 PRO CB C 57 30.580 30.580 31.813 -1.233 18222
238 1 1 . 1 1 58 58 TYR N N 58 120.240 120.240 120.919 -0.679 18222
239 1 1 . 1 1 58 58 TYR CA C 58 55.770 55.770 55.345 0.425 18222
240 1 1 . 1 1 58 58 TYR CB C 58 40.220 40.220 39.503 0.717 18222
241 1 1 . 1 1 58 58 TYR H H 58 7.700 7.700 7.937 -0.237 18222
242 1 1 . 1 1 59 59 PRO CA C 59 62.130 62.130 63.727 -1.597 18222
243 1 1 . 1 1 59 59 PRO CB C 59 33.340 33.340 32.188 1.152 18222
244 1 1 . 1 1 60 60 LEU N N 60 122.210 122.210 120.368 1.842 18222
245 1 1 . 1 1 60 60 LEU CA C 60 54.250 54.250 54.608 -0.358 18222
246 1 1 . 1 1 60 60 LEU CB C 60 41.470 41.470 42.530 -1.060 18222
247 1 1 . 1 1 60 60 LEU H H 60 7.880 7.880 7.753 0.127 18222
248 1 1 . 1 1 61 61 GLN N N 61 122.470 122.470 120.190 2.280 18222
249 1 1 . 1 1 61 61 GLN CA C 61 54.170 54.170 55.456 -1.286 18222
250 1 1 . 1 1 61 61 GLN H H 61 7.970 7.970 8.220 -0.250 18222
251 1 1 . 1 1 62 62 TRP N N 62 124.590 124.590 127.794 -3.204 18222
252 1 1 . 1 1 62 62 TRP CA C 62 59.830 59.830 61.894 -2.064 18222
253 1 1 . 1 1 62 62 TRP CB C 62 28.800 28.800 29.192 -0.392 18222
254 1 1 . 1 1 62 62 TRP H H 62 8.240 8.240 8.489 -0.249 18222
255 1 1 . 1 1 63 63 SER N N 63 113.320 113.320 113.278 0.042 18222
256 1 1 . 1 1 63 63 SER CA C 63 61.100 61.100 61.253 -0.153 18222
257 1 1 . 1 1 63 63 SER H H 63 8.410 8.410 8.353 0.057 18222
258 1 1 . 1 1 64 64 LEU N N 64 123.230 123.230 122.862 0.368 18222
259 1 1 . 1 1 64 64 LEU CA C 64 56.880 56.880 57.388 -0.508 18222
260 1 1 . 1 1 64 64 LEU CB C 64 40.830 40.830 42.026 -1.196 18222
261 1 1 . 1 1 64 64 LEU H H 64 7.230 7.230 7.147 0.083 18222
262 1 1 . 1 1 65 65 LEU N N 65 119.400 119.400 120.257 -0.857 18222
263 1 1 . 1 1 65 65 LEU HA H 65 3.890 3.890 4.034 -0.144 18222
264 1 1 . 1 1 65 65 LEU CA C 65 57.580 57.580 58.570 -0.990 18222
265 1 1 . 1 1 65 65 LEU CB C 65 40.710 40.710 42.040 -1.330 18222
266 1 1 . 1 1 65 65 LEU H H 65 7.510 7.510 8.731 -1.221 18222
267 1 1 . 1 1 66 66 VAL N N 66 116.950 116.950 119.224 -2.274 18222
268 1 1 . 1 1 66 66 VAL HA H 66 3.960 3.960 3.614 0.346 18222
269 1 1 . 1 1 66 66 VAL CA C 66 66.260 66.260 65.529 0.730 18222
270 1 1 . 1 1 66 66 VAL CB C 66 30.570 30.570 31.325 -0.755 18222
271 1 1 . 1 1 66 66 VAL H H 66 7.950 7.950 8.108 -0.158 18222
272 1 1 . 1 1 67 67 ALA N N 67 120.650 120.650 122.280 -1.630 18222
273 1 1 . 1 1 67 67 ALA HA H 67 4.000 4.000 4.182 -0.182 18222
274 1 1 . 1 1 67 67 ALA CA C 67 54.780 54.780 55.219 -0.439 18222
275 1 1 . 1 1 67 67 ALA CB C 67 17.440 17.440 18.416 -0.976 18222
276 1 1 . 1 1 67 67 ALA H H 67 7.450 7.450 8.049 -0.599 18222
277 1 1 . 1 1 68 68 VAL N N 68 118.440 118.440 118.258 0.182 18222
278 1 1 . 1 1 68 68 VAL HA H 68 3.750 3.750 3.633 0.117 18222
279 1 1 . 1 1 68 68 VAL CA C 68 65.250 65.250 66.960 -1.710 18222
280 1 1 . 1 1 68 68 VAL CB C 68 30.850 30.850 32.001 -1.151 18222
281 1 1 . 1 1 68 68 VAL H H 68 7.960 7.960 7.845 0.115 18222
282 1 1 . 1 1 69 69 VAL N N 69 120.800 120.800 120.511 0.289 18222
283 1 1 . 1 1 69 69 VAL HA H 69 4.220 4.220 3.621 0.599 18222
284 1 1 . 1 1 69 69 VAL CA C 69 66.020 66.020 67.611 -1.591 18222
285 1 1 . 1 1 69 69 VAL CB C 69 30.850 30.850 31.571 -0.721 18222
286 1 1 . 1 1 69 69 VAL H H 69 8.080 8.080 8.550 -0.470 18222
287 1 1 . 1 1 70 70 ALA N N 70 121.740 121.740 120.722 1.018 18222
288 1 1 . 1 1 70 70 ALA HA H 70 3.920 3.920 4.211 -0.291 18222
289 1 1 . 1 1 70 70 ALA CA C 70 54.920 54.920 55.399 -0.479 18222
290 1 1 . 1 1 70 70 ALA CB C 70 17.620 17.620 17.999 -0.379 18222
291 1 1 . 1 1 70 70 ALA H H 70 8.660 8.660 8.528 0.132 18222
292 1 1 . 1 1 71 71 GLY N N 71 103.450 103.450 106.991 -3.541 18222
293 1 1 . 1 1 71 71 GLY CA C 71 46.300 46.300 46.981 -0.681 18222
294 1 1 . 1 1 71 71 GLY H H 71 8.010 8.010 8.077 -0.067 18222
295 1 1 . 1 1 72 72 SER N N 72 118.160 118.160 118.143 0.017 18222
296 1 1 . 1 1 72 72 SER CA C 72 61.260 61.260 61.435 -0.175 18222
297 1 1 . 1 1 72 72 SER CB C 72 62.870 62.870 63.112 -0.242 18222
298 1 1 . 1 1 72 72 SER H H 72 7.870 7.870 8.083 -0.213 18222
299 1 1 . 1 1 73 73 VAL N N 73 121.340 121.340 122.202 -0.862 18222
300 1 1 . 1 1 73 73 VAL CA C 73 65.750 65.750 67.405 -1.655 18222
301 1 1 . 1 1 73 73 VAL CB C 73 30.740 30.740 31.934 -1.194 18222
302 1 1 . 1 1 73 73 VAL H H 73 8.050 8.050 8.263 -0.213 18222
303 1 1 . 1 1 74 74 VAL N N 74 118.680 118.680 118.794 -0.114 18222
304 1 1 . 1 1 74 74 VAL CA C 74 65.770 65.770 66.947 -1.177 18222
305 1 1 . 1 1 74 74 VAL CB C 74 30.740 30.740 30.761 -0.021 18222
306 1 1 . 1 1 74 74 VAL H H 74 7.880 7.880 8.552 -0.672 18222
307 1 1 . 1 1 75 75 SER N N 75 114.750 114.750 116.427 -1.677 18222
308 1 1 . 1 1 75 75 SER HA H 75 4.100 4.100 4.132 -0.032 18222
309 1 1 . 1 1 75 75 SER CA C 75 60.870 60.870 61.881 -1.011 18222
310 1 1 . 1 1 75 75 SER CB C 75 62.340 62.340 62.981 -0.641 18222
311 1 1 . 1 1 75 75 SER H H 75 7.870 7.870 8.009 -0.139 18222
312 1 1 . 1 1 76 76 TYR N N 76 121.110 121.110 121.827 -0.717 18222
313 1 1 . 1 1 76 76 TYR CA C 76 60.050 60.050 61.770 -1.720 18222
314 1 1 . 1 1 76 76 TYR CB C 76 37.980 37.980 38.384 -0.404 18222
315 1 1 . 1 1 76 76 TYR H H 76 7.860 7.860 8.320 -0.460 18222
316 1 1 . 1 1 77 77 GLY N N 77 107.300 107.300 107.256 0.044 18222
317 1 1 . 1 1 77 77 GLY CA C 77 46.560 46.560 47.164 -0.604 18222
318 1 1 . 1 1 77 77 GLY H H 77 8.200 8.200 8.460 -0.260 18222
319 1 1 . 1 1 78 78 VAL N N 78 119.470 119.470 121.420 -1.950 18222
320 1 1 . 1 1 78 78 VAL HA H 78 4.170 4.170 3.732 0.438 18222
321 1 1 . 1 1 78 78 VAL CA C 78 64.650 64.650 66.124 -1.474 18222
322 1 1 . 1 1 78 78 VAL H H 78 8.140 8.140 8.814 -0.674 18222
323 1 1 . 1 1 79 79 THR N N 79 112.100 112.100 116.070 -3.970 18222
324 1 1 . 1 1 79 79 THR CA C 79 63.460 63.460 66.889 -3.429 18222
325 1 1 . 1 1 79 79 THR CB C 79 68.650 68.650 68.581 0.069 18222
326 1 1 . 1 1 79 79 THR H H 79 7.640 7.640 8.076 -0.436 18222
327 1 1 . 1 1 80 80 ARG N N 80 120.770 120.770 122.067 -1.297 18222
328 1 1 . 1 1 80 80 ARG HA H 80 4.160 4.160 4.225 -0.065 18222
329 1 1 . 1 1 80 80 ARG CA C 80 56.790 56.790 59.457 -2.667 18222
330 1 1 . 1 1 80 80 ARG CB C 80 29.430 29.430 30.078 -0.648 18222
331 1 1 . 1 1 80 80 ARG H H 80 7.680 7.680 8.130 -0.450 18222
332 1 1 . 1 1 81 81 VAL N N 81 118.370 118.370 120.548 -2.178 18222
333 1 1 . 1 1 81 81 VAL HA H 81 3.920 3.920 3.903 0.017 18222
334 1 1 . 1 1 81 81 VAL CA C 81 63.340 63.340 66.100 -2.760 18222
335 1 1 . 1 1 81 81 VAL CB C 81 31.260 31.260 31.774 -0.514 18222
336 1 1 . 1 1 81 81 VAL H H 81 7.730 7.730 8.360 -0.630 18222
337 1 1 . 1 1 82 82 GLU N N 82 120.620 120.620 120.178 0.442 18222
338 1 1 . 1 1 82 82 GLU CA C 82 56.320 56.320 59.765 -3.445 18222
339 1 1 . 1 1 82 82 GLU CB C 82 27.930 27.930 29.277 -1.347 18222
340 1 1 . 1 1 82 82 GLU H H 82 7.920 7.920 8.770 -0.850 18222
341 1 1 . 1 1 83 83 SER N N 83 116.240 116.240 116.060 0.180 18222
342 1 1 . 1 1 83 83 SER CA C 83 59.250 59.250 61.608 -2.358 18222
343 1 1 . 1 1 83 83 SER CB C 83 63.160 63.160 62.906 0.254 18222
344 1 1 . 1 1 83 83 SER H H 83 7.960 7.960 8.301 -0.341 18222
345 1 1 . 1 1 84 84 GLU N N 84 123.280 123.280 122.147 1.133 18222
346 1 1 . 1 1 84 84 GLU HA H 84 4.080 4.080 4.060 0.020 18222
347 1 1 . 1 1 84 84 GLU CA C 84 57.860 57.860 59.626 -1.766 18222
348 1 1 . 1 1 84 84 GLU CB C 84 28.190 28.190 29.673 -1.483 18222
349 1 1 . 1 1 84 84 GLU H H 84 8.470 8.470 8.088 0.382 18222
350 1 1 . 1 1 85 85 LYS N N 85 118.650 118.650 119.484 -0.834 18222
351 1 1 . 1 1 85 85 LYS HA H 85 4.100 4.100 4.170 -0.070 18222
352 1 1 . 1 1 85 85 LYS CA C 85 57.780 57.780 59.370 -1.591 18222
353 1 1 . 1 1 85 85 LYS CB C 85 31.380 31.380 32.684 -1.304 18222
354 1 1 . 1 1 85 85 LYS H H 85 7.940 7.940 8.179 -0.239 18222
355 1 1 . 1 1 86 86 CYS N N 86 117.070 117.070 118.348 -1.278 18222
356 1 1 . 1 1 86 86 CYS CA C 86 60.910 60.910 62.397 -1.487 18222
357 1 1 . 1 1 86 86 CYS CB C 86 26.740 26.740 26.497 0.243 18222
358 1 1 . 1 1 86 86 CYS H H 86 7.840 7.840 8.469 -0.629 18222
359 1 1 . 1 1 87 87 ASN N N 87 119.370 119.370 119.904 -0.534 18222
360 1 1 . 1 1 87 87 ASN HA H 87 4.130 4.130 4.531 -0.401 18222
361 1 1 . 1 1 87 87 ASN CA C 87 55.750 55.750 56.280 -0.530 18222
362 1 1 . 1 1 87 87 ASN CB C 87 38.050 38.050 38.310 -0.260 18222
363 1 1 . 1 1 87 87 ASN H H 87 8.110 8.110 8.354 -0.244 18222
364 1 1 . 1 1 88 88 ASN N N 88 117.570 117.570 119.384 -1.814 18222
365 1 1 . 1 1 88 88 ASN HA H 88 4.280 4.280 4.393 -0.113 18222
366 1 1 . 1 1 88 88 ASN CA C 88 55.190 55.190 56.134 -0.944 18222
367 1 1 . 1 1 88 88 ASN CB C 88 37.400 37.400 38.428 -1.028 18222
368 1 1 . 1 1 88 88 ASN H H 88 8.280 8.280 8.246 0.034 18222
369 1 1 . 1 1 89 89 LEU N N 89 121.940 121.940 121.631 0.309 18222
370 1 1 . 1 1 89 89 LEU HA H 89 4.070 4.070 4.482 -0.412 18222
371 1 1 . 1 1 89 89 LEU CA C 89 57.580 57.580 59.024 -1.444 18222
372 1 1 . 1 1 89 89 LEU CB C 89 40.490 40.490 42.055 -1.565 18222
373 1 1 . 1 1 89 89 LEU H H 89 7.790 7.790 8.695 -0.905 18222
374 1 1 . 1 1 90 90 TRP N N 90 119.220 119.220 121.758 -2.538 18222
375 1 1 . 1 1 90 90 TRP CA C 90 59.120 59.120 61.313 -2.193 18222
376 1 1 . 1 1 90 90 TRP CB C 90 28.800 28.800 29.270 -0.470 18222
377 1 1 . 1 1 90 90 TRP H H 90 7.850 7.850 8.332 -0.483 18222
378 1 1 . 1 1 91 91 LEU N N 91 117.870 117.870 120.702 -2.832 18222
379 1 1 . 1 1 91 91 LEU CA C 91 57.300 57.300 58.147 -0.847 18222
380 1 1 . 1 1 91 91 LEU CB C 91 40.610 40.610 41.748 -1.138 18222
381 1 1 . 1 1 91 91 LEU H H 91 7.920 7.920 8.303 -0.383 18222
382 1 1 . 1 1 92 92 PHE N N 92 121.280 121.280 118.504 2.776 18222
383 1 1 . 1 1 92 92 PHE CA C 92 60.390 60.390 62.157 -1.767 18222
384 1 1 . 1 1 92 92 PHE CB C 92 37.980 37.980 38.492 -0.512 18222
385 1 1 . 1 1 92 92 PHE H H 92 7.860 7.860 7.987 -0.127 18222
386 1 1 . 1 1 93 93 LEU N N 93 119.860 119.860 119.244 0.616 18222
387 1 1 . 1 1 93 93 LEU CA C 93 56.860 56.860 58.005 -1.145 18222
388 1 1 . 1 1 93 93 LEU CB C 93 40.550 40.550 41.971 -1.421 18222
389 1 1 . 1 1 93 93 LEU H H 93 7.980 7.980 8.724 -0.744 18222
390 1 1 . 1 1 94 94 GLU N N 94 114.660 114.660 117.589 -2.929 18222
391 1 1 . 1 1 94 94 GLU HA H 94 3.810 3.810 4.095 -0.285 18222
392 1 1 . 1 1 94 94 GLU CA C 94 57.210 57.210 58.791 -1.581 18222
393 1 1 . 1 1 94 94 GLU CB C 94 28.470 28.470 29.672 -1.202 18222
394 1 1 . 1 1 94 94 GLU H H 94 7.890 7.890 7.938 -0.048 18222
395 1 1 . 1 1 95 95 THR N N 95 108.260 108.260 111.912 -3.652 18222
396 1 1 . 1 1 95 95 THR CA C 95 62.150 62.150 63.279 -1.129 18222
397 1 1 . 1 1 95 95 THR CB C 95 70.810 70.810 70.079 0.731 18222
398 1 1 . 1 1 95 95 THR H H 95 7.690 7.690 7.400 0.290 18222
399 1 1 . 1 1 96 96 GLY N N 96 112.220 112.220 110.533 1.687 18222
400 1 1 . 1 1 96 96 GLY CA C 96 45.410 45.410 44.789 0.621 18222
401 1 1 . 1 1 96 96 GLY H H 96 8.240 8.240 7.748 0.492 18222
402 1 1 . 1 1 97 97 GLN N N 97 117.950 117.950 119.379 -1.429 18222
403 1 1 . 1 1 97 97 GLN HA H 97 4.200 4.200 4.114 0.086 18222
404 1 1 . 1 1 97 97 GLN CA C 97 54.430 54.430 56.818 -2.388 18222
405 1 1 . 1 1 97 97 GLN CB C 97 29.910 29.910 29.794 0.116 18222
406 1 1 . 1 1 97 97 GLN H H 97 7.640 7.640 8.232 -0.592 18222
407 1 1 . 1 1 98 98 LEU N N 98 123.810 123.810 121.768 2.042 18222
408 1 1 . 1 1 98 98 LEU HA H 98 4.360 4.360 4.287 0.073 18222
409 1 1 . 1 1 98 98 LEU CA C 98 52.650 52.650 54.862 -2.212 18222
410 1 1 . 1 1 98 98 LEU CB C 98 40.460 40.460 41.359 -0.899 18222
411 1 1 . 1 1 98 98 LEU H H 98 8.270 8.270 8.553 -0.283 18222
412 1 1 . 1 1 99 99 PRO CA C 99 63.180 63.180 62.621 0.559 18222
413 1 1 . 1 1 99 99 PRO CB C 99 30.840 30.840 32.597 -1.757 18222
414 1 1 . 1 1 100 100 LYS N N 100 120.630 120.630 118.969 1.661 18222
415 1 1 . 1 1 100 100 LYS CA C 100 55.730 55.730 56.000 -0.270 18222
416 1 1 . 1 1 100 100 LYS CB C 100 32.280 32.280 32.785 -0.505 18222
417 1 1 . 1 1 100 100 LYS H H 100 8.090 8.090 8.419 -0.329 18222
418 1 1 . 1 1 101 101 ASP N N 101 120.920 120.920 121.484 -0.564 18222
419 1 1 . 1 1 101 101 ASP HA H 101 4.190 4.190 4.603 -0.413 18222
420 1 1 . 1 1 101 101 ASP CA C 101 54.000 54.000 55.185 -1.185 18222
421 1 1 . 1 1 101 101 ASP CB C 101 40.330 40.330 41.370 -1.040 18222
422 1 1 . 1 1 101 101 ASP H H 101 8.190 8.190 8.173 0.017 18222
423 1 1 . 1 1 102 102 ARG N N 102 122.210 122.210 119.594 2.616 18222
424 1 1 . 1 1 102 102 ARG CA C 102 55.590 55.590 55.558 0.032 18222
425 1 1 . 1 1 102 102 ARG CB C 102 29.630 29.630 32.236 -2.606 18222
426 1 1 . 1 1 102 102 ARG H H 102 8.130 8.130 8.403 -0.273 18222
427 1 1 . 1 1 103 103 SER N N 103 117.230 117.230 116.651 0.579 18222
428 1 1 . 1 1 103 103 SER HA H 103 4.280 4.280 4.905 -0.625 18222
429 1 1 . 1 1 103 103 SER CA C 103 58.470 58.470 57.860 0.610 18222
430 1 1 . 1 1 103 103 SER CB C 103 63.080 63.080 64.057 -0.977 18222
431 1 1 . 1 1 103 103 SER H H 103 8.290 8.290 8.573 -0.283 18222
432 1 1 . 1 1 104 104 THR N N 104 115.430 115.430 115.882 -0.452 18222
433 1 1 . 1 1 104 104 THR CA C 104 61.570 61.570 62.795 -1.225 18222
434 1 1 . 1 1 104 104 THR CB C 104 69.030 69.030 69.599 -0.569 18222
435 1 1 . 1 1 104 104 THR H H 104 8.020 8.020 8.519 -0.499 18222
436 1 1 . 1 1 105 105 ASP N N 105 122.780 122.780 120.232 2.548 18222
437 1 1 . 1 1 105 105 ASP CA C 105 54.210 54.210 55.875 -1.665 18222
438 1 1 . 1 1 105 105 ASP CB C 105 40.380 40.380 40.307 0.073 18222
439 1 1 . 1 1 105 105 ASP H H 105 8.120 8.120 8.569 -0.449 18222
440 1 1 . 1 1 106 106 GLN N N 106 120.960 120.960 117.789 3.171 18222
441 1 1 . 1 1 106 106 GLN CA C 106 55.420 55.420 56.921 -1.501 18222
442 1 1 . 1 1 106 106 GLN CB C 106 28.310 28.310 29.255 -0.945 18222
443 1 1 . 1 1 106 106 GLN H H 106 8.140 8.140 8.150 -0.010 18222
444 1 1 . 1 1 107 107 ARG N N 107 123.010 123.010 122.254 0.756 18222
445 1 1 . 1 1 107 107 ARG HA H 107 4.210 4.210 4.620 -0.410 18222
446 1 1 . 1 1 107 107 ARG CA C 107 55.560 55.560 55.872 -0.312 18222
447 1 1 . 1 1 107 107 ARG CB C 107 29.920 29.920 32.050 -2.130 18222
448 1 1 . 1 1 107 107 ARG H H 107 8.180 8.180 8.602 -0.422 18222
449 1 2 . 1 1 2 2 VAL N N 2 121.590 121.590 123.330 -1.740 18222
450 1 2 . 1 1 2 2 VAL CA C 2 61.600 61.600 61.565 0.035 18222
451 1 2 . 1 1 2 2 VAL CB C 2 31.900 31.900 33.123 -1.223 18222
452 1 2 . 1 1 2 2 VAL H H 2 8.010 8.010 8.422 -0.412 18222
453 1 2 . 1 1 3 3 ASN N N 3 122.520 122.520 122.436 0.084 18222
454 1 2 . 1 1 3 3 ASN HA H 3 4.020 4.020 4.470 -0.450 18222
455 1 2 . 1 1 3 3 ASN CA C 3 52.640 52.640 53.725 -1.085 18222
456 1 2 . 1 1 3 3 ASN CB C 3 38.330 38.330 39.458 -1.128 18222
457 1 2 . 1 1 3 3 ASN H H 3 8.360 8.360 8.590 -0.230 18222
458 1 2 . 1 1 4 4 LEU N N 4 123.830 123.830 123.113 0.717 18222
459 1 2 . 1 1 4 4 LEU HA H 4 4.220 4.220 4.511 -0.291 18222
460 1 2 . 1 1 4 4 LEU CA C 4 54.620 54.620 55.451 -0.831 18222
461 1 2 . 1 1 4 4 LEU CB C 4 41.680 41.680 42.642 -0.962 18222
462 1 2 . 1 1 4 4 LEU H H 4 8.220 8.220 8.208 0.012 18222
463 1 2 . 1 1 5 5 GLY N N 5 106.810 106.810 105.964 0.846 18222
464 1 2 . 1 1 5 5 GLY CA C 5 45.800 45.800 45.138 0.662 18222
465 1 2 . 1 1 5 5 GLY H H 5 8.030 8.030 7.879 0.151 18222
466 1 2 . 1 1 6 6 LEU N N 6 120.820 120.820 121.582 -0.762 18222
467 1 2 . 1 1 6 6 LEU HA H 6 4.050 4.050 4.487 -0.437 18222
468 1 2 . 1 1 6 6 LEU CA C 6 55.990 55.990 54.617 1.373 18222
469 1 2 . 1 1 6 6 LEU CB C 6 40.800 40.800 41.821 -1.021 18222
470 1 2 . 1 1 6 6 LEU H H 6 8.030 8.030 8.151 -0.121 18222
471 1 2 . 1 1 7 7 SER N N 7 115.540 115.540 116.213 -0.673 18222
472 1 2 . 1 1 7 7 SER HA H 7 4.100 4.100 4.233 -0.133 18222
473 1 2 . 1 1 7 7 SER CA C 7 60.580 60.580 61.836 -1.256 18222
474 1 2 . 1 1 7 7 SER CB C 7 62.060 62.060 62.791 -0.731 18222
475 1 2 . 1 1 7 7 SER H H 7 8.360 8.360 8.492 -0.132 18222
476 1 2 . 1 1 8 8 ARG N N 8 120.690 120.690 119.839 0.851 18222
477 1 2 . 1 1 8 8 ARG HA H 8 4.160 4.160 4.069 0.091 18222
478 1 2 . 1 1 8 8 ARG CA C 8 57.350 57.350 59.156 -1.806 18222
479 1 2 . 1 1 8 8 ARG CB C 8 29.230 29.230 29.425 -0.195 18222
480 1 2 . 1 1 8 8 ARG H H 8 7.830 7.830 7.556 0.274 18222
481 1 2 . 1 1 9 9 VAL N N 9 119.330 119.330 119.734 -0.404 18222
482 1 2 . 1 1 9 9 VAL HA H 9 4.170 4.170 3.888 0.282 18222
483 1 2 . 1 1 9 9 VAL CA C 9 64.720 64.720 65.495 -0.775 18222
484 1 2 . 1 1 9 9 VAL CB C 9 30.900 30.900 31.444 -0.544 18222
485 1 2 . 1 1 9 9 VAL H H 9 7.620 7.620 7.819 -0.199 18222
486 1 2 . 1 1 10 10 ASP N N 10 119.520 119.520 120.832 -1.312 18222
487 1 2 . 1 1 10 10 ASP CA C 10 54.960 54.960 57.898 -2.938 18222
488 1 2 . 1 1 10 10 ASP CB C 10 37.800 37.800 40.807 -3.007 18222
489 1 2 . 1 1 10 10 ASP H H 10 8.180 8.180 8.165 0.015 18222
490 1 2 . 1 1 11 11 ASP N N 11 121.550 121.550 119.949 1.601 18222
491 1 2 . 1 1 11 11 ASP CA C 11 54.440 54.440 56.507 -2.067 18222
492 1 2 . 1 1 11 11 ASP CB C 11 37.840 37.840 40.872 -3.032 18222
493 1 2 . 1 1 11 11 ASP H H 11 7.950 7.950 8.193 -0.243 18222
494 1 2 . 1 1 12 12 ALA N N 12 120.220 120.220 122.941 -2.721 18222
495 1 2 . 1 1 12 12 ALA CA C 12 54.370 54.370 55.125 -0.755 18222
496 1 2 . 1 1 12 12 ALA CB C 12 24.730 24.730 18.575 6.155 18222
497 1 2 . 1 1 12 12 ALA H H 12 8.090 8.090 7.947 0.143 18222
498 1 2 . 1 1 13 13 VAL N N 13 116.910 116.910 118.459 -1.549 18222
499 1 2 . 1 1 13 13 VAL HA H 13 4.140 4.140 3.788 0.352 18222
500 1 2 . 1 1 13 13 VAL CA C 13 64.900 64.900 64.710 0.190 18222
501 1 2 . 1 1 13 13 VAL CB C 13 31.000 31.000 31.308 -0.308 18222
502 1 2 . 1 1 13 13 VAL H H 13 7.980 7.980 8.174 -0.194 18222
503 1 2 . 1 1 14 14 ALA N N 14 122.200 122.200 122.219 -0.019 18222
504 1 2 . 1 1 14 14 ALA HA H 14 4.020 4.020 4.104 -0.084 18222
505 1 2 . 1 1 14 14 ALA CA C 14 53.800 53.800 54.897 -1.097 18222
506 1 2 . 1 1 14 14 ALA CB C 14 17.790 17.790 18.263 -0.473 18222
507 1 2 . 1 1 14 14 ALA H H 14 8.030 8.030 8.000 0.030 18222
508 1 2 . 1 1 15 15 ALA N N 15 118.600 118.600 118.779 -0.179 18222
509 1 2 . 1 1 15 15 ALA CA C 15 53.230 53.230 53.733 -0.503 18222
510 1 2 . 1 1 15 15 ALA CB C 15 18.010 18.010 18.711 -0.701 18222
511 1 2 . 1 1 15 15 ALA H H 15 7.530 7.530 7.713 -0.183 18222
512 1 2 . 1 1 16 16 LYS N N 16 115.820 115.820 117.825 -2.005 18222
513 1 2 . 1 1 16 16 LYS HA H 16 4.080 4.080 4.111 -0.031 18222
514 1 2 . 1 1 16 16 LYS CA C 16 55.670 55.670 56.945 -1.275 18222
515 1 2 . 1 1 16 16 LYS CB C 16 32.640 32.640 32.731 -0.091 18222
516 1 2 . 1 1 16 16 LYS H H 16 7.490 7.490 7.314 0.176 18222
517 1 2 . 1 1 17 17 HIS N N 17 116.790 116.790 118.908 -2.118 18222
518 1 2 . 1 1 17 17 HIS HA H 17 4.100 4.100 4.842 -0.742 18222
519 1 2 . 1 1 17 17 HIS CA C 17 52.820 52.820 53.405 -0.585 18222
520 1 2 . 1 1 17 17 HIS CB C 17 28.400 28.400 30.978 -2.578 18222
521 1 2 . 1 1 17 17 HIS H H 17 8.130 8.130 7.319 0.811 18222
522 1 2 . 1 1 18 18 PRO CA C 18 63.800 63.800 64.023 -0.223 18222
523 1 2 . 1 1 18 18 PRO CB C 18 30.800 30.800 32.560 -1.760 18222
524 1 2 . 1 1 19 19 GLY N N 19 110.260 110.260 105.716 4.544 18222
525 1 2 . 1 1 19 19 GLY CA C 19 45.490 45.490 45.197 0.293 18222
526 1 2 . 1 1 19 19 GLY H H 19 8.730 8.730 8.118 0.612 18222
527 1 2 . 1 1 20 20 LEU N N 20 122.650 122.650 121.963 0.687 18222
528 1 2 . 1 1 20 20 LEU HA H 20 4.090 4.090 4.345 -0.255 18222
529 1 2 . 1 1 20 20 LEU CA C 20 57.060 57.060 57.343 -0.283 18222
530 1 2 . 1 1 20 20 LEU H H 20 7.980 7.980 8.394 -0.414 18222
531 1 2 . 1 1 21 21 GLY N N 21 107.000 107.000 108.937 -1.937 18222
532 1 2 . 1 1 21 21 GLY CA C 21 46.710 46.710 46.780 -0.070 18222
533 1 2 . 1 1 21 21 GLY H H 21 8.570 8.570 8.282 0.288 18222
534 1 2 . 1 1 22 22 GLU N N 22 121.610 121.610 122.588 -0.978 18222
535 1 2 . 1 1 22 22 GLU HA H 22 3.990 3.990 3.529 0.461 18222
536 1 2 . 1 1 22 22 GLU CA C 22 58.280 58.280 58.938 -0.658 18222
537 1 2 . 1 1 22 22 GLU CB C 22 28.010 28.010 29.283 -1.273 18222
538 1 2 . 1 1 22 22 GLU H H 22 8.100 8.100 7.648 0.452 18222
539 1 2 . 1 1 23 23 TYR N N 23 120.870 120.870 120.474 0.396 18222
540 1 2 . 1 1 23 23 TYR CA C 23 60.380 60.380 61.460 -1.080 18222
541 1 2 . 1 1 23 23 TYR CB C 23 37.750 37.750 38.449 -0.699 18222
542 1 2 . 1 1 23 23 TYR H H 23 7.910 7.910 7.636 0.274 18222
543 1 2 . 1 1 24 24 ALA N N 24 121.420 121.420 121.272 0.148 18222
544 1 2 . 1 1 24 24 ALA HA H 24 4.140 4.140 3.770 0.370 18222
545 1 2 . 1 1 24 24 ALA CA C 24 54.260 54.260 54.945 -0.685 18222
546 1 2 . 1 1 24 24 ALA H H 24 8.410 8.410 8.479 -0.069 18222
547 1 2 . 1 1 25 25 ALA N N 25 120.220 120.220 121.284 -1.064 18222
548 1 2 . 1 1 25 25 ALA CA C 25 54.370 54.370 54.444 -0.074 18222
549 1 2 . 1 1 25 25 ALA H H 25 8.090 8.090 8.128 -0.038 18222
550 1 2 . 1 1 26 26 CYS N N 26 116.760 116.760 117.477 -0.717 18222
551 1 2 . 1 1 26 26 CYS CA C 26 61.180 61.180 62.450 -1.270 18222
552 1 2 . 1 1 26 26 CYS CB C 26 26.390 26.390 26.572 -0.182 18222
553 1 2 . 1 1 26 26 CYS H H 26 7.950 7.950 7.876 0.074 18222
554 1 2 . 1 1 27 27 GLN N N 27 118.690 118.690 120.787 -2.097 18222
555 1 2 . 1 1 27 27 GLN CA C 27 55.970 55.970 58.956 -2.986 18222
556 1 2 . 1 1 27 27 GLN H H 27 8.060 8.060 8.208 -0.148 18222
557 1 2 . 1 1 28 28 SER N N 28 115.490 115.490 115.220 0.270 18222
558 1 2 . 1 1 28 28 SER HA H 28 3.990 3.990 4.269 -0.279 18222
559 1 2 . 1 1 28 28 SER CA C 28 61.110 61.110 61.625 -0.515 18222
560 1 2 . 1 1 28 28 SER H H 28 7.980 7.980 8.063 -0.083 18222
561 1 2 . 1 1 29 29 HIS N N 29 120.880 120.880 122.982 -2.102 18222
562 1 2 . 1 1 29 29 HIS CA C 29 58.190 58.190 60.129 -1.939 18222
563 1 2 . 1 1 29 29 HIS CB C 29 27.460 27.460 30.108 -2.648 18222
564 1 2 . 1 1 29 29 HIS H H 29 8.180 8.180 8.286 -0.106 18222
565 1 2 . 1 1 30 30 ALA N N 30 122.920 122.920 122.303 0.617 18222
566 1 2 . 1 1 30 30 ALA CA C 30 54.560 54.560 55.167 -0.607 18222
567 1 2 . 1 1 30 30 ALA CB C 30 17.490 17.490 18.065 -0.575 18222
568 1 2 . 1 1 30 30 ALA H H 30 8.040 8.040 8.043 -0.003 18222
569 1 2 . 1 1 31 31 PHE N N 31 119.340 119.340 118.986 0.354 18222
570 1 2 . 1 1 31 31 PHE CA C 31 60.370 60.370 61.599 -1.228 18222
571 1 2 . 1 1 31 31 PHE CB C 31 38.520 38.520 39.310 -0.790 18222
572 1 2 . 1 1 31 31 PHE H H 31 8.230 8.230 8.344 -0.114 18222
573 1 2 . 1 1 32 32 MET N N 32 118.110 118.110 120.006 -1.896 18222
574 1 2 . 1 1 32 32 MET HA H 32 4.050 4.050 3.952 0.098 18222
575 1 2 . 1 1 32 32 MET CA C 32 58.280 58.280 59.547 -1.267 18222
576 1 2 . 1 1 32 32 MET CB C 32 31.090 31.090 32.143 -1.053 18222
577 1 2 . 1 1 32 32 MET H H 32 8.120 8.120 8.589 -0.469 18222
578 1 2 . 1 1 33 33 LYS N N 33 119.040 119.040 119.145 -0.105 18222
579 1 2 . 1 1 33 33 LYS HA H 33 3.930 3.930 3.901 0.029 18222
580 1 2 . 1 1 33 33 LYS CA C 33 59.040 59.040 59.672 -0.632 18222
581 1 2 . 1 1 33 33 LYS CB C 33 30.990 30.990 32.379 -1.389 18222
582 1 2 . 1 1 33 33 LYS H H 33 7.970 7.970 8.319 -0.349 18222
583 1 2 . 1 1 34 34 GLY N N 34 108.840 108.840 108.100 0.740 18222
584 1 2 . 1 1 34 34 GLY CA C 34 46.610 46.610 47.249 -0.639 18222
585 1 2 . 1 1 34 34 GLY H H 34 8.030 8.030 8.235 -0.205 18222
586 1 2 . 1 1 35 35 VAL N N 35 122.910 122.910 122.201 0.709 18222
587 1 2 . 1 1 35 35 VAL HA H 35 4.220 4.220 3.893 0.327 18222
588 1 2 . 1 1 35 35 VAL CA C 35 66.310 66.310 65.303 1.007 18222
589 1 2 . 1 1 35 35 VAL CB C 35 30.560 30.560 31.501 -0.941 18222
590 1 2 . 1 1 35 35 VAL H H 35 8.090 8.090 8.614 -0.524 18222
591 1 2 . 1 1 36 36 PHE N N 36 120.020 120.020 119.437 0.583 18222
592 1 2 . 1 1 36 36 PHE CA C 36 61.350 61.350 61.447 -0.097 18222
593 1 2 . 1 1 36 36 PHE CB C 36 38.090 38.090 38.301 -0.211 18222
594 1 2 . 1 1 36 36 PHE H H 36 8.350 8.350 8.454 -0.104 18222
595 1 2 . 1 1 37 37 THR N N 37 116.980 116.980 113.702 3.278 18222
596 1 2 . 1 1 37 37 THR HA H 37 4.050 4.050 3.970 0.080 18222
597 1 2 . 1 1 37 37 THR CA C 37 66.000 66.000 66.125 -0.125 18222
598 1 2 . 1 1 37 37 THR CB C 37 68.270 68.270 68.888 -0.618 18222
599 1 2 . 1 1 37 37 THR H H 37 8.520 8.520 8.387 0.133 18222
600 1 2 . 1 1 38 38 PHE N N 38 123.090 123.090 121.856 1.234 18222
601 1 2 . 1 1 38 38 PHE HA H 38 4.360 4.360 4.313 0.047 18222
602 1 2 . 1 1 38 38 PHE CA C 38 61.140 61.140 61.598 -0.458 18222
603 1 2 . 1 1 38 38 PHE CB C 38 41.200 41.200 39.536 1.664 18222
604 1 2 . 1 1 38 38 PHE H H 38 8.010 8.010 8.137 -0.127 18222
605 1 2 . 1 1 39 39 VAL N N 39 117.280 117.280 119.988 -2.708 18222
606 1 2 . 1 1 39 39 VAL HA H 39 4.210 4.210 3.786 0.424 18222
607 1 2 . 1 1 39 39 VAL CA C 39 66.000 66.000 66.130 -0.130 18222
608 1 2 . 1 1 39 39 VAL CB C 39 30.860 30.860 31.836 -0.976 18222
609 1 2 . 1 1 39 39 VAL H H 39 8.530 8.530 8.803 -0.273 18222
610 1 2 . 1 1 40 40 THR N N 40 109.470 109.470 115.963 -6.493 18222
611 1 2 . 1 1 40 40 THR HA H 40 4.060 4.060 4.146 -0.086 18222
612 1 2 . 1 1 40 40 THR CA C 40 63.390 63.390 65.998 -2.608 18222
613 1 2 . 1 1 40 40 THR CB C 40 68.650 68.650 68.375 0.275 18222
614 1 2 . 1 1 40 40 THR H H 40 7.700 7.700 8.117 -0.417 18222
615 1 2 . 1 1 41 41 GLY N N 41 110.770 110.770 107.119 3.651 18222
616 1 2 . 1 1 41 41 GLY CA C 41 45.580 45.580 45.350 0.230 18222
617 1 2 . 1 1 41 41 GLY H H 41 7.700 7.700 7.426 0.274 18222
618 1 2 . 1 1 42 42 THR N N 42 114.520 114.520 116.485 -1.965 18222
619 1 2 . 1 1 42 42 THR CA C 42 63.300 63.300 60.734 2.566 18222
620 1 2 . 1 1 42 42 THR CB C 42 69.490 69.490 68.305 1.185 18222
621 1 2 . 1 1 42 42 THR H H 42 7.720 7.720 7.678 0.042 18222
622 1 2 . 1 1 43 43 GLY N N 43 109.540 109.540 110.139 -0.599 18222
623 1 2 . 1 1 43 43 GLY CA C 43 46.250 46.250 47.166 -0.916 18222
624 1 2 . 1 1 43 43 GLY H H 43 8.110 8.110 8.057 0.053 18222
625 1 2 . 1 1 44 44 MET N N 44 120.240 120.240 120.873 -0.633 18222
626 1 2 . 1 1 44 44 MET HA H 44 4.100 4.100 4.052 0.048 18222
627 1 2 . 1 1 44 44 MET CA C 44 57.700 57.700 58.901 -1.201 18222
628 1 2 . 1 1 44 44 MET CB C 44 32.030 32.030 32.392 -0.362 18222
629 1 2 . 1 1 44 44 MET H H 44 7.730 7.730 7.948 -0.218 18222
630 1 2 . 1 1 45 45 ALA N N 45 121.560 121.560 122.324 -0.764 18222
631 1 2 . 1 1 45 45 ALA CA C 45 54.440 54.440 55.495 -1.055 18222
632 1 2 . 1 1 45 45 ALA CB C 45 17.400 17.400 17.935 -0.535 18222
633 1 2 . 1 1 45 45 ALA H H 45 7.950 7.950 7.873 0.076 18222
634 1 2 . 1 1 46 46 PHE N N 46 118.260 118.260 118.794 -0.534 18222
635 1 2 . 1 1 46 46 PHE HA H 46 3.930 3.930 4.167 -0.237 18222
636 1 2 . 1 1 46 46 PHE CA C 46 59.820 59.820 61.193 -1.373 18222
637 1 2 . 1 1 46 46 PHE CB C 46 38.260 38.260 38.704 -0.444 18222
638 1 2 . 1 1 46 46 PHE H H 46 7.860 7.860 7.660 0.200 18222
639 1 2 . 1 1 47 47 GLY N N 47 107.300 107.300 108.319 -1.019 18222
640 1 2 . 1 1 47 47 GLY CA C 47 46.560 46.560 47.310 -0.750 18222
641 1 2 . 1 1 47 47 GLY H H 47 8.200 8.200 8.484 -0.284 18222
642 1 2 . 1 1 48 48 LEU N N 48 121.920 121.920 122.935 -1.015 18222
643 1 2 . 1 1 48 48 LEU HA H 48 4.040 4.040 4.007 0.033 18222
644 1 2 . 1 1 48 48 LEU CA C 48 57.580 57.580 58.324 -0.744 18222
645 1 2 . 1 1 48 48 LEU CB C 48 40.790 40.790 41.989 -1.199 18222
646 1 2 . 1 1 48 48 LEU H H 48 8.180 8.180 8.324 -0.144 18222
647 1 2 . 1 1 49 49 GLN N N 49 118.270 118.270 117.911 0.359 18222
648 1 2 . 1 1 49 49 GLN HA H 49 3.830 3.830 3.952 -0.122 18222
649 1 2 . 1 1 49 49 GLN CA C 49 58.880 58.880 59.343 -0.463 18222
650 1 2 . 1 1 49 49 GLN CB C 49 27.240 27.240 28.478 -1.238 18222
651 1 2 . 1 1 49 49 GLN H H 49 8.080 8.080 8.236 -0.156 18222
652 1 2 . 1 1 50 50 MET N N 50 117.630 117.630 119.397 -1.767 18222
653 1 2 . 1 1 50 50 MET HA H 50 4.010 4.010 4.205 -0.195 18222
654 1 2 . 1 1 50 50 MET CA C 50 57.730 57.730 59.629 -1.899 18222
655 1 2 . 1 1 50 50 MET CB C 50 27.160 27.160 32.654 -5.494 18222
656 1 2 . 1 1 50 50 MET H H 50 7.880 7.880 8.461 -0.581 18222
657 1 2 . 1 1 51 51 PHE N N 51 119.550 119.550 120.452 -0.902 18222
658 1 2 . 1 1 51 51 PHE CA C 51 60.850 60.850 62.010 -1.160 18222
659 1 2 . 1 1 51 51 PHE CB C 51 38.720 38.720 39.281 -0.561 18222
660 1 2 . 1 1 51 51 PHE H H 51 7.890 7.890 8.234 -0.344 18222
661 1 2 . 1 1 52 52 ILE N N 52 117.950 117.950 117.730 0.220 18222
662 1 2 . 1 1 52 52 ILE HA H 52 4.050 4.050 3.950 0.100 18222
663 1 2 . 1 1 52 52 ILE CA C 52 63.560 63.560 63.895 -0.335 18222
664 1 2 . 1 1 52 52 ILE CB C 52 36.810 36.810 38.517 -1.707 18222
665 1 2 . 1 1 52 52 ILE H H 52 8.110 8.110 8.237 -0.127 18222
666 1 2 . 1 1 53 53 GLN N N 53 117.360 117.360 120.164 -2.804 18222
667 1 2 . 1 1 53 53 GLN CA C 53 57.200 57.200 59.421 -2.221 18222
668 1 2 . 1 1 53 53 GLN CB C 53 27.870 27.870 28.504 -0.634 18222
669 1 2 . 1 1 53 53 GLN H H 53 7.930 7.930 8.655 -0.725 18222
670 1 2 . 1 1 54 54 ARG N N 54 116.840 116.840 117.476 -0.636 18222
671 1 2 . 1 1 54 54 ARG HA H 54 3.950 3.950 4.157 -0.207 18222
672 1 2 . 1 1 54 54 ARG CA C 54 56.480 56.480 58.309 -1.829 18222
673 1 2 . 1 1 54 54 ARG CB C 54 28.970 28.970 30.156 -1.186 18222
674 1 2 . 1 1 54 54 ARG H H 54 7.540 7.540 7.847 -0.307 18222
675 1 2 . 1 1 55 55 LYS N N 55 117.900 117.900 117.482 0.418 18222
676 1 2 . 1 1 55 55 LYS HA H 55 4.080 4.080 4.275 -0.195 18222
677 1 2 . 1 1 55 55 LYS CA C 55 55.030 55.030 56.973 -1.943 18222
678 1 2 . 1 1 55 55 LYS CB C 55 32.010 32.010 33.451 -1.441 18222
679 1 2 . 1 1 55 55 LYS H H 55 7.660 7.660 7.700 -0.040 18222
680 1 2 . 1 1 56 56 PHE N N 56 121.060 121.060 120.373 0.687 18222
681 1 2 . 1 1 56 56 PHE CA C 56 55.190 55.190 55.164 0.026 18222
682 1 2 . 1 1 56 56 PHE CB C 56 38.970 38.970 40.058 -1.088 18222
683 1 2 . 1 1 56 56 PHE H H 56 8.080 8.080 8.087 -0.007 18222
684 1 2 . 1 1 57 57 PRO CA C 57 62.390 62.390 63.675 -1.285 18222
685 1 2 . 1 1 57 57 PRO CB C 57 30.580 30.580 31.878 -1.298 18222
686 1 2 . 1 1 58 58 TYR N N 58 120.240 120.240 120.152 0.088 18222
687 1 2 . 1 1 58 58 TYR CA C 58 55.770 55.770 55.035 0.735 18222
688 1 2 . 1 1 58 58 TYR CB C 58 40.220 40.220 39.341 0.879 18222
689 1 2 . 1 1 58 58 TYR H H 58 7.700 7.700 7.989 -0.289 18222
690 1 2 . 1 1 59 59 PRO CA C 59 62.130 62.130 63.948 -1.818 18222
691 1 2 . 1 1 59 59 PRO CB C 59 33.340 33.340 32.345 0.995 18222
692 1 2 . 1 1 60 60 LEU N N 60 122.210 122.210 119.979 2.231 18222
693 1 2 . 1 1 60 60 LEU CA C 60 54.250 54.250 53.766 0.484 18222
694 1 2 . 1 1 60 60 LEU CB C 60 41.470 41.470 43.755 -2.285 18222
695 1 2 . 1 1 60 60 LEU H H 60 7.880 7.880 7.737 0.143 18222
696 1 2 . 1 1 61 61 GLN N N 61 122.470 122.470 122.470 0.000 18222
697 1 2 . 1 1 61 61 GLN CA C 61 54.170 54.170 55.430 -1.260 18222
698 1 2 . 1 1 61 61 GLN H H 61 7.970 7.970 8.458 -0.488 18222
699 1 2 . 1 1 62 62 TRP N N 62 124.590 124.590 124.910 -0.320 18222
700 1 2 . 1 1 62 62 TRP CA C 62 59.830 59.830 60.098 -0.268 18222
701 1 2 . 1 1 62 62 TRP CB C 62 28.800 28.800 29.492 -0.692 18222
702 1 2 . 1 1 62 62 TRP H H 62 8.240 8.240 8.689 -0.449 18222
703 1 2 . 1 1 63 63 SER N N 63 113.320 113.320 114.863 -1.543 18222
704 1 2 . 1 1 63 63 SER CA C 63 61.100 61.100 61.722 -0.622 18222
705 1 2 . 1 1 63 63 SER H H 63 8.410 8.410 8.128 0.282 18222
706 1 2 . 1 1 64 64 LEU N N 64 123.230 123.230 122.528 0.702 18222
707 1 2 . 1 1 64 64 LEU CA C 64 56.880 56.880 57.680 -0.800 18222
708 1 2 . 1 1 64 64 LEU CB C 64 40.830 40.830 42.163 -1.333 18222
709 1 2 . 1 1 64 64 LEU H H 64 7.230 7.230 7.851 -0.621 18222
710 1 2 . 1 1 65 65 LEU N N 65 119.400 119.400 119.940 -0.540 18222
711 1 2 . 1 1 65 65 LEU HA H 65 3.890 3.890 4.033 -0.143 18222
712 1 2 . 1 1 65 65 LEU CA C 65 57.580 57.580 58.371 -0.791 18222
713 1 2 . 1 1 65 65 LEU CB C 65 40.710 40.710 41.942 -1.232 18222
714 1 2 . 1 1 65 65 LEU H H 65 7.510 7.510 8.693 -1.183 18222
715 1 2 . 1 1 66 66 VAL N N 66 116.950 116.950 118.932 -1.982 18222
716 1 2 . 1 1 66 66 VAL HA H 66 3.960 3.960 3.488 0.472 18222
717 1 2 . 1 1 66 66 VAL CA C 66 66.260 66.260 66.285 -0.025 18222
718 1 2 . 1 1 66 66 VAL CB C 66 30.570 30.570 30.766 -0.196 18222
719 1 2 . 1 1 66 66 VAL H H 66 7.950 7.950 8.096 -0.146 18222
720 1 2 . 1 1 67 67 ALA N N 67 120.650 120.650 122.730 -2.080 18222
721 1 2 . 1 1 67 67 ALA HA H 67 4.000 4.000 4.028 -0.028 18222
722 1 2 . 1 1 67 67 ALA CA C 67 54.780 54.780 55.191 -0.411 18222
723 1 2 . 1 1 67 67 ALA CB C 67 17.440 17.440 18.227 -0.787 18222
724 1 2 . 1 1 67 67 ALA H H 67 7.450 7.450 7.906 -0.456 18222
725 1 2 . 1 1 68 68 VAL N N 68 118.440 118.440 118.502 -0.062 18222
726 1 2 . 1 1 68 68 VAL HA H 68 3.750 3.750 3.538 0.212 18222
727 1 2 . 1 1 68 68 VAL CA C 68 65.250 65.250 66.651 -1.401 18222
728 1 2 . 1 1 68 68 VAL CB C 68 30.850 30.850 32.043 -1.193 18222
729 1 2 . 1 1 68 68 VAL H H 68 7.960 7.960 7.755 0.205 18222
730 1 2 . 1 1 69 69 VAL N N 69 120.800 120.800 119.926 0.874 18222
731 1 2 . 1 1 69 69 VAL HA H 69 4.220 4.220 3.531 0.689 18222
732 1 2 . 1 1 69 69 VAL CA C 69 66.020 66.020 67.038 -1.018 18222
733 1 2 . 1 1 69 69 VAL CB C 69 30.850 30.850 31.342 -0.492 18222
734 1 2 . 1 1 69 69 VAL H H 69 8.080 8.080 8.435 -0.355 18222
735 1 2 . 1 1 70 70 ALA N N 70 121.740 121.740 120.751 0.989 18222
736 1 2 . 1 1 70 70 ALA HA H 70 3.920 3.920 4.123 -0.203 18222
737 1 2 . 1 1 70 70 ALA CA C 70 54.920 54.920 55.316 -0.396 18222
738 1 2 . 1 1 70 70 ALA CB C 70 17.620 17.620 18.019 -0.399 18222
739 1 2 . 1 1 70 70 ALA H H 70 8.660 8.660 8.496 0.164 18222
740 1 2 . 1 1 71 71 GLY N N 71 103.450 103.450 106.730 -3.280 18222
741 1 2 . 1 1 71 71 GLY CA C 71 46.300 46.300 46.947 -0.646 18222
742 1 2 . 1 1 71 71 GLY H H 71 8.010 8.010 8.062 -0.052 18222
743 1 2 . 1 1 72 72 SER N N 72 118.160 118.160 118.468 -0.308 18222
744 1 2 . 1 1 72 72 SER CA C 72 61.260 61.260 62.545 -1.285 18222
745 1 2 . 1 1 72 72 SER CB C 72 62.870 62.870 63.220 -0.350 18222
746 1 2 . 1 1 72 72 SER H H 72 7.870 7.870 7.975 -0.105 18222
747 1 2 . 1 1 73 73 VAL N N 73 121.340 121.340 122.422 -1.082 18222
748 1 2 . 1 1 73 73 VAL CA C 73 65.750 65.750 67.057 -1.307 18222
749 1 2 . 1 1 73 73 VAL CB C 73 30.740 30.740 31.835 -1.095 18222
750 1 2 . 1 1 73 73 VAL H H 73 8.050 8.050 8.193 -0.143 18222
751 1 2 . 1 1 74 74 VAL N N 74 118.680 118.680 119.283 -0.603 18222
752 1 2 . 1 1 74 74 VAL CA C 74 65.770 65.770 66.604 -0.834 18222
753 1 2 . 1 1 74 74 VAL CB C 74 30.740 30.740 31.306 -0.567 18222
754 1 2 . 1 1 74 74 VAL H H 74 7.880 7.880 8.578 -0.698 18222
755 1 2 . 1 1 75 75 SER N N 75 114.750 114.750 116.623 -1.873 18222
756 1 2 . 1 1 75 75 SER HA H 75 4.100 4.100 4.230 -0.130 18222
757 1 2 . 1 1 75 75 SER CA C 75 60.870 60.870 62.441 -1.571 18222
758 1 2 . 1 1 75 75 SER CB C 75 62.340 62.340 63.175 -0.835 18222
759 1 2 . 1 1 75 75 SER H H 75 7.870 7.870 7.986 -0.116 18222
760 1 2 . 1 1 76 76 TYR N N 76 121.110 121.110 121.864 -0.754 18222
761 1 2 . 1 1 76 76 TYR CA C 76 60.050 60.050 61.838 -1.788 18222
762 1 2 . 1 1 76 76 TYR CB C 76 37.980 37.980 38.422 -0.442 18222
763 1 2 . 1 1 76 76 TYR H H 76 7.860 7.860 8.796 -0.936 18222
764 1 2 . 1 1 77 77 GLY N N 77 107.300 107.300 106.893 0.407 18222
765 1 2 . 1 1 77 77 GLY CA C 77 46.560 46.560 47.288 -0.728 18222
766 1 2 . 1 1 77 77 GLY H H 77 8.200 8.200 8.417 -0.217 18222
767 1 2 . 1 1 78 78 VAL N N 78 119.470 119.470 121.824 -2.354 18222
768 1 2 . 1 1 78 78 VAL HA H 78 4.170 4.170 3.663 0.507 18222
769 1 2 . 1 1 78 78 VAL CA C 78 64.650 64.650 66.559 -1.909 18222
770 1 2 . 1 1 78 78 VAL H H 78 8.140 8.140 8.602 -0.462 18222
771 1 2 . 1 1 79 79 THR N N 79 112.100 112.100 116.575 -4.475 18222
772 1 2 . 1 1 79 79 THR CA C 79 63.460 63.460 65.524 -2.064 18222
773 1 2 . 1 1 79 79 THR CB C 79 68.650 68.650 68.299 0.351 18222
774 1 2 . 1 1 79 79 THR H H 79 7.640 7.640 8.108 -0.468 18222
775 1 2 . 1 1 80 80 ARG N N 80 120.770 120.770 122.171 -1.401 18222
776 1 2 . 1 1 80 80 ARG HA H 80 4.160 4.160 4.213 -0.053 18222
777 1 2 . 1 1 80 80 ARG CA C 80 56.790 56.790 58.714 -1.924 18222
778 1 2 . 1 1 80 80 ARG CB C 80 29.430 29.430 29.797 -0.367 18222
779 1 2 . 1 1 80 80 ARG H H 80 7.680 7.680 8.096 -0.416 18222
780 1 2 . 1 1 81 81 VAL N N 81 118.370 118.370 120.333 -1.963 18222
781 1 2 . 1 1 81 81 VAL HA H 81 3.920 3.920 3.881 0.039 18222
782 1 2 . 1 1 81 81 VAL CA C 81 63.340 63.340 66.186 -2.846 18222
783 1 2 . 1 1 81 81 VAL CB C 81 31.260 31.260 31.719 -0.459 18222
784 1 2 . 1 1 81 81 VAL H H 81 7.730 7.730 8.297 -0.567 18222
785 1 2 . 1 1 82 82 GLU N N 82 120.620 120.620 120.324 0.296 18222
786 1 2 . 1 1 82 82 GLU CA C 82 56.320 56.320 59.737 -3.417 18222
787 1 2 . 1 1 82 82 GLU CB C 82 27.930 27.930 29.487 -1.557 18222
788 1 2 . 1 1 82 82 GLU H H 82 7.920 7.920 8.507 -0.587 18222
789 1 2 . 1 1 83 83 SER N N 83 116.240 116.240 116.366 -0.126 18222
790 1 2 . 1 1 83 83 SER CA C 83 59.250 59.250 61.645 -2.395 18222
791 1 2 . 1 1 83 83 SER CB C 83 63.160 63.160 63.167 -0.007 18222
792 1 2 . 1 1 83 83 SER H H 83 7.960 7.960 8.265 -0.305 18222
793 1 2 . 1 1 84 84 GLU N N 84 123.280 123.280 121.276 2.004 18222
794 1 2 . 1 1 84 84 GLU HA H 84 4.080 4.080 4.007 0.073 18222
795 1 2 . 1 1 84 84 GLU CA C 84 57.860 57.860 59.493 -1.633 18222
796 1 2 . 1 1 84 84 GLU CB C 84 28.190 28.190 29.795 -1.605 18222
797 1 2 . 1 1 84 84 GLU H H 84 8.470 8.470 7.955 0.515 18222
798 1 2 . 1 1 85 85 LYS N N 85 118.650 118.650 118.741 -0.091 18222
799 1 2 . 1 1 85 85 LYS HA H 85 4.100 4.100 4.079 0.021 18222
800 1 2 . 1 1 85 85 LYS CA C 85 57.780 57.780 59.138 -1.358 18222
801 1 2 . 1 1 85 85 LYS CB C 85 31.380 31.380 31.933 -0.553 18222
802 1 2 . 1 1 85 85 LYS H H 85 7.940 7.940 8.017 -0.077 18222
803 1 2 . 1 1 86 86 CYS N N 86 117.070 117.070 119.121 -2.051 18222
804 1 2 . 1 1 86 86 CYS CA C 86 60.910 60.910 62.676 -1.766 18222
805 1 2 . 1 1 86 86 CYS CB C 86 26.740 26.740 25.735 1.005 18222
806 1 2 . 1 1 86 86 CYS H H 86 7.840 7.840 7.914 -0.074 18222
807 1 2 . 1 1 87 87 ASN N N 87 119.370 119.370 118.902 0.468 18222
808 1 2 . 1 1 87 87 ASN HA H 87 4.130 4.130 4.477 -0.347 18222
809 1 2 . 1 1 87 87 ASN CA C 87 55.750 55.750 56.245 -0.495 18222
810 1 2 . 1 1 87 87 ASN CB C 87 38.050 38.050 38.182 -0.133 18222
811 1 2 . 1 1 87 87 ASN H H 87 8.110 8.110 8.169 -0.059 18222
812 1 2 . 1 1 88 88 ASN N N 88 117.570 117.570 119.270 -1.700 18222
813 1 2 . 1 1 88 88 ASN HA H 88 4.280 4.280 4.357 -0.077 18222
814 1 2 . 1 1 88 88 ASN CA C 88 55.190 55.190 55.779 -0.589 18222
815 1 2 . 1 1 88 88 ASN CB C 88 37.400 37.400 38.443 -1.043 18222
816 1 2 . 1 1 88 88 ASN H H 88 8.280 8.280 8.161 0.119 18222
817 1 2 . 1 1 89 89 LEU N N 89 121.940 121.940 122.259 -0.319 18222
818 1 2 . 1 1 89 89 LEU HA H 89 4.070 4.070 4.172 -0.102 18222
819 1 2 . 1 1 89 89 LEU CA C 89 57.580 57.580 58.597 -1.017 18222
820 1 2 . 1 1 89 89 LEU CB C 89 40.490 40.490 42.011 -1.521 18222
821 1 2 . 1 1 89 89 LEU H H 89 7.790 7.790 8.203 -0.413 18222
822 1 2 . 1 1 90 90 TRP N N 90 119.220 119.220 118.652 0.568 18222
823 1 2 . 1 1 90 90 TRP CA C 90 59.120 59.120 59.993 -0.873 18222
824 1 2 . 1 1 90 90 TRP CB C 90 28.800 28.800 28.462 0.338 18222
825 1 2 . 1 1 90 90 TRP H H 90 7.850 7.850 8.055 -0.205 18222
826 1 2 . 1 1 91 91 LEU N N 91 117.870 117.870 120.395 -2.525 18222
827 1 2 . 1 1 91 91 LEU CA C 91 57.300 57.300 58.513 -1.213 18222
828 1 2 . 1 1 91 91 LEU CB C 91 40.610 40.610 41.559 -0.949 18222
829 1 2 . 1 1 91 91 LEU H H 91 7.920 7.920 8.455 -0.535 18222
830 1 2 . 1 1 92 92 PHE N N 92 121.280 121.280 117.028 4.252 18222
831 1 2 . 1 1 92 92 PHE CA C 92 60.390 60.390 61.229 -0.839 18222
832 1 2 . 1 1 92 92 PHE CB C 92 37.980 37.980 38.447 -0.466 18222
833 1 2 . 1 1 92 92 PHE H H 92 7.860 7.860 8.113 -0.253 18222
834 1 2 . 1 1 93 93 LEU N N 93 119.860 119.860 121.629 -1.769 18222
835 1 2 . 1 1 93 93 LEU CA C 93 56.860 56.860 58.065 -1.205 18222
836 1 2 . 1 1 93 93 LEU CB C 93 40.550 40.550 42.042 -1.492 18222
837 1 2 . 1 1 93 93 LEU H H 93 7.980 7.980 8.684 -0.704 18222
838 1 2 . 1 1 94 94 GLU N N 94 114.660 114.660 119.111 -4.451 18222
839 1 2 . 1 1 94 94 GLU HA H 94 3.810 3.810 4.215 -0.405 18222
840 1 2 . 1 1 94 94 GLU CA C 94 57.210 57.210 58.916 -1.706 18222
841 1 2 . 1 1 94 94 GLU CB C 94 28.470 28.470 29.174 -0.704 18222
842 1 2 . 1 1 94 94 GLU H H 94 7.890 7.890 8.443 -0.553 18222
843 1 2 . 1 1 95 95 THR N N 95 108.260 108.260 112.759 -4.499 18222
844 1 2 . 1 1 95 95 THR CA C 95 62.150 62.150 62.713 -0.563 18222
845 1 2 . 1 1 95 95 THR CB C 95 70.810 70.810 68.778 2.032 18222
846 1 2 . 1 1 95 95 THR H H 95 7.690 7.690 7.372 0.318 18222
847 1 2 . 1 1 96 96 GLY N N 96 112.220 112.220 109.893 2.327 18222
848 1 2 . 1 1 96 96 GLY CA C 96 45.410 45.410 44.959 0.451 18222
849 1 2 . 1 1 96 96 GLY H H 96 8.240 8.240 7.608 0.632 18222
850 1 2 . 1 1 97 97 GLN N N 97 117.950 117.950 120.136 -2.186 18222
851 1 2 . 1 1 97 97 GLN HA H 97 4.200 4.200 4.312 -0.112 18222
852 1 2 . 1 1 97 97 GLN CA C 97 54.430 54.430 56.362 -1.932 18222
853 1 2 . 1 1 97 97 GLN CB C 97 29.910 29.910 30.193 -0.283 18222
854 1 2 . 1 1 97 97 GLN H H 97 7.640 7.640 8.372 -0.732 18222
855 1 2 . 1 1 98 98 LEU N N 98 123.810 123.810 121.823 1.987 18222
856 1 2 . 1 1 98 98 LEU HA H 98 4.360 4.360 4.317 0.043 18222
857 1 2 . 1 1 98 98 LEU CA C 98 52.650 52.650 54.626 -1.976 18222
858 1 2 . 1 1 98 98 LEU CB C 98 40.460 40.460 41.270 -0.810 18222
859 1 2 . 1 1 98 98 LEU H H 98 8.270 8.270 8.496 -0.226 18222
860 1 2 . 1 1 99 99 PRO CA C 99 63.180 63.180 63.685 -0.505 18222
861 1 2 . 1 1 99 99 PRO CB C 99 30.840 30.840 32.215 -1.375 18222
862 1 2 . 1 1 100 100 LYS N N 100 120.630 120.630 120.971 -0.341 18222
863 1 2 . 1 1 100 100 LYS CA C 100 55.730 55.730 56.342 -0.612 18222
864 1 2 . 1 1 100 100 LYS CB C 100 32.280 32.280 32.264 0.016 18222
865 1 2 . 1 1 100 100 LYS H H 100 8.090 8.090 7.971 0.119 18222
866 1 2 . 1 1 101 101 ASP N N 101 120.920 120.920 120.259 0.661 18222
867 1 2 . 1 1 101 101 ASP HA H 101 4.190 4.190 4.432 -0.242 18222
868 1 2 . 1 1 101 101 ASP CA C 101 54.000 54.000 54.891 -0.891 18222
869 1 2 . 1 1 101 101 ASP CB C 101 40.330 40.330 41.313 -0.983 18222
870 1 2 . 1 1 101 101 ASP H H 101 8.190 8.190 8.214 -0.025 18222
871 1 2 . 1 1 102 102 ARG N N 102 122.210 122.210 121.720 0.490 18222
872 1 2 . 1 1 102 102 ARG CA C 102 55.590 55.590 55.455 0.135 18222
873 1 2 . 1 1 102 102 ARG CB C 102 29.630 29.630 31.791 -2.161 18222
874 1 2 . 1 1 102 102 ARG H H 102 8.130 8.130 8.311 -0.181 18222
875 1 2 . 1 1 103 103 SER N N 103 117.230 117.230 119.391 -2.161 18222
876 1 2 . 1 1 103 103 SER HA H 103 4.280 4.280 4.638 -0.358 18222
877 1 2 . 1 1 103 103 SER CA C 103 58.470 58.470 58.642 -0.172 18222
878 1 2 . 1 1 103 103 SER CB C 103 63.080 63.080 63.522 -0.442 18222
879 1 2 . 1 1 103 103 SER H H 103 8.290 8.290 8.701 -0.411 18222
880 1 2 . 1 1 104 104 THR N N 104 115.430 115.430 117.840 -2.410 18222
881 1 2 . 1 1 104 104 THR CA C 104 61.570 61.570 61.696 -0.126 18222
882 1 2 . 1 1 104 104 THR CB C 104 69.030 69.030 69.529 -0.499 18222
883 1 2 . 1 1 104 104 THR H H 104 8.020 8.020 8.711 -0.691 18222
884 1 2 . 1 1 105 105 ASP N N 105 122.780 122.780 122.295 0.485 18222
885 1 2 . 1 1 105 105 ASP CA C 105 54.210 54.210 54.166 0.044 18222
886 1 2 . 1 1 105 105 ASP CB C 105 40.380 40.380 41.160 -0.780 18222
887 1 2 . 1 1 105 105 ASP H H 105 8.120 8.120 8.123 -0.003 18222
888 1 2 . 1 1 106 106 GLN N N 106 120.960 120.960 121.108 -0.148 18222
889 1 2 . 1 1 106 106 GLN CA C 106 55.420 55.420 54.978 0.442 18222
890 1 2 . 1 1 106 106 GLN CB C 106 28.310 28.310 30.639 -2.329 18222
891 1 2 . 1 1 106 106 GLN H H 106 8.140 8.140 8.585 -0.445 18222
892 1 2 . 1 1 107 107 ARG N N 107 123.010 123.010 122.561 0.449 18222
893 1 2 . 1 1 107 107 ARG HA H 107 4.210 4.210 4.541 -0.331 18222
894 1 2 . 1 1 107 107 ARG CA C 107 55.560 55.560 55.980 -0.420 18222
895 1 2 . 1 1 107 107 ARG CB C 107 29.920 29.920 29.941 -0.021 18222
896 1 2 . 1 1 107 107 ARG H H 107 8.180 8.180 8.650 -0.470 18222
897 1 3 . 1 1 2 2 VAL N N 2 121.590 121.590 122.800 -1.210 18222
898 1 3 . 1 1 2 2 VAL CA C 2 61.600 61.600 62.218 -0.618 18222
899 1 3 . 1 1 2 2 VAL CB C 2 31.900 31.900 32.768 -0.868 18222
900 1 3 . 1 1 2 2 VAL H H 2 8.010 8.010 8.403 -0.393 18222
901 1 3 . 1 1 3 3 ASN N N 3 122.520 122.520 124.609 -2.089 18222
902 1 3 . 1 1 3 3 ASN HA H 3 4.020 4.020 4.882 -0.862 18222
903 1 3 . 1 1 3 3 ASN CA C 3 52.640 52.640 52.652 -0.012 18222
904 1 3 . 1 1 3 3 ASN CB C 3 38.330 38.330 40.227 -1.897 18222
905 1 3 . 1 1 3 3 ASN H H 3 8.360 8.360 8.528 -0.168 18222
906 1 3 . 1 1 4 4 LEU N N 4 123.830 123.830 121.958 1.872 18222
907 1 3 . 1 1 4 4 LEU HA H 4 4.220 4.220 4.224 -0.004 18222
908 1 3 . 1 1 4 4 LEU CA C 4 54.620 54.620 56.766 -2.146 18222
909 1 3 . 1 1 4 4 LEU CB C 4 41.680 41.680 41.914 -0.235 18222
910 1 3 . 1 1 4 4 LEU H H 4 8.220 8.220 8.447 -0.227 18222
911 1 3 . 1 1 5 5 GLY N N 5 106.810 106.810 105.295 1.515 18222
912 1 3 . 1 1 5 5 GLY CA C 5 45.800 45.800 44.606 1.194 18222
913 1 3 . 1 1 5 5 GLY H H 5 8.030 8.030 7.869 0.161 18222
914 1 3 . 1 1 6 6 LEU N N 6 120.820 120.820 122.691 -1.871 18222
915 1 3 . 1 1 6 6 LEU HA H 6 4.050 4.050 4.545 -0.495 18222
916 1 3 . 1 1 6 6 LEU CA C 6 55.990 55.990 54.983 1.007 18222
917 1 3 . 1 1 6 6 LEU CB C 6 40.800 40.800 42.337 -1.537 18222
918 1 3 . 1 1 6 6 LEU H H 6 8.030 8.030 8.432 -0.402 18222
919 1 3 . 1 1 7 7 SER N N 7 115.540 115.540 116.293 -0.753 18222
920 1 3 . 1 1 7 7 SER HA H 7 4.100 4.100 4.150 -0.050 18222
921 1 3 . 1 1 7 7 SER CA C 7 60.580 60.580 62.242 -1.661 18222
922 1 3 . 1 1 7 7 SER CB C 7 62.060 62.060 62.960 -0.900 18222
923 1 3 . 1 1 7 7 SER H H 7 8.360 8.360 8.509 -0.149 18222
924 1 3 . 1 1 8 8 ARG N N 8 120.690 120.690 120.443 0.247 18222
925 1 3 . 1 1 8 8 ARG HA H 8 4.160 4.160 4.072 0.088 18222
926 1 3 . 1 1 8 8 ARG CA C 8 57.350 57.350 59.250 -1.900 18222
927 1 3 . 1 1 8 8 ARG CB C 8 29.230 29.230 29.272 -0.042 18222
928 1 3 . 1 1 8 8 ARG H H 8 7.830 7.830 8.066 -0.236 18222
929 1 3 . 1 1 9 9 VAL N N 9 119.330 119.330 120.963 -1.633 18222
930 1 3 . 1 1 9 9 VAL HA H 9 4.170 4.170 3.668 0.502 18222
931 1 3 . 1 1 9 9 VAL CA C 9 64.720 64.720 67.015 -2.295 18222
932 1 3 . 1 1 9 9 VAL CB C 9 30.900 30.900 31.319 -0.419 18222
933 1 3 . 1 1 9 9 VAL H H 9 7.620 7.620 7.792 -0.172 18222
934 1 3 . 1 1 10 10 ASP N N 10 119.520 119.520 120.028 -0.508 18222
935 1 3 . 1 1 10 10 ASP CA C 10 54.960 54.960 57.411 -2.451 18222
936 1 3 . 1 1 10 10 ASP CB C 10 37.800 37.800 40.557 -2.757 18222
937 1 3 . 1 1 10 10 ASP H H 10 8.180 8.180 8.249 -0.069 18222
938 1 3 . 1 1 11 11 ASP N N 11 121.550 121.550 121.094 0.456 18222
939 1 3 . 1 1 11 11 ASP CA C 11 54.440 54.440 57.980 -3.540 18222
940 1 3 . 1 1 11 11 ASP CB C 11 37.840 37.840 40.764 -2.924 18222
941 1 3 . 1 1 11 11 ASP H H 11 7.950 7.950 8.243 -0.293 18222
942 1 3 . 1 1 12 12 ALA N N 12 120.220 120.220 122.493 -2.273 18222
943 1 3 . 1 1 12 12 ALA CA C 12 54.370 54.370 55.379 -1.009 18222
944 1 3 . 1 1 12 12 ALA CB C 12 24.730 24.730 18.478 6.252 18222
945 1 3 . 1 1 12 12 ALA H H 12 8.090 8.090 8.301 -0.211 18222
946 1 3 . 1 1 13 13 VAL N N 13 116.910 116.910 118.096 -1.186 18222
947 1 3 . 1 1 13 13 VAL HA H 13 4.140 4.140 3.634 0.506 18222
948 1 3 . 1 1 13 13 VAL CA C 13 64.900 64.900 65.901 -1.001 18222
949 1 3 . 1 1 13 13 VAL CB C 13 31.000 31.000 30.939 0.061 18222
950 1 3 . 1 1 13 13 VAL H H 13 7.980 7.980 8.104 -0.124 18222
951 1 3 . 1 1 14 14 ALA N N 14 122.200 122.200 122.379 -0.179 18222
952 1 3 . 1 1 14 14 ALA HA H 14 4.020 4.020 3.996 0.024 18222
953 1 3 . 1 1 14 14 ALA CA C 14 53.800 53.800 54.998 -1.198 18222
954 1 3 . 1 1 14 14 ALA CB C 14 17.790 17.790 18.237 -0.447 18222
955 1 3 . 1 1 14 14 ALA H H 14 8.030 8.030 8.100 -0.070 18222
956 1 3 . 1 1 15 15 ALA N N 15 118.600 118.600 118.071 0.529 18222
957 1 3 . 1 1 15 15 ALA CA C 15 53.230 53.230 53.945 -0.715 18222
958 1 3 . 1 1 15 15 ALA CB C 15 18.010 18.010 18.830 -0.820 18222
959 1 3 . 1 1 15 15 ALA H H 15 7.530 7.530 7.889 -0.359 18222
960 1 3 . 1 1 16 16 LYS N N 16 115.820 115.820 116.439 -0.619 18222
961 1 3 . 1 1 16 16 LYS HA H 16 4.080 4.080 4.287 -0.207 18222
962 1 3 . 1 1 16 16 LYS CA C 16 55.670 55.670 56.687 -1.017 18222
963 1 3 . 1 1 16 16 LYS CB C 16 32.640 32.640 32.770 -0.130 18222
964 1 3 . 1 1 16 16 LYS H H 16 7.490 7.490 7.428 0.062 18222
965 1 3 . 1 1 17 17 HIS N N 17 116.790 116.790 119.368 -2.578 18222
966 1 3 . 1 1 17 17 HIS HA H 17 4.100 4.100 4.867 -0.767 18222
967 1 3 . 1 1 17 17 HIS CA C 17 52.820 52.820 52.658 0.161 18222
968 1 3 . 1 1 17 17 HIS CB C 17 28.400 28.400 30.578 -2.178 18222
969 1 3 . 1 1 17 17 HIS H H 17 8.130 8.130 7.602 0.528 18222
970 1 3 . 1 1 18 18 PRO CA C 18 63.800 63.800 62.828 0.972 18222
971 1 3 . 1 1 18 18 PRO CB C 18 30.800 30.800 33.012 -2.212 18222
972 1 3 . 1 1 19 19 GLY N N 19 110.260 110.260 109.251 1.009 18222
973 1 3 . 1 1 19 19 GLY CA C 19 45.490 45.490 45.066 0.424 18222
974 1 3 . 1 1 19 19 GLY H H 19 8.730 8.730 8.001 0.729 18222
975 1 3 . 1 1 20 20 LEU N N 20 122.650 122.650 125.954 -3.304 18222
976 1 3 . 1 1 20 20 LEU HA H 20 4.090 4.090 4.346 -0.256 18222
977 1 3 . 1 1 20 20 LEU CA C 20 57.060 57.060 58.426 -1.366 18222
978 1 3 . 1 1 20 20 LEU H H 20 7.980 7.980 8.862 -0.882 18222
979 1 3 . 1 1 21 21 GLY N N 21 107.000 107.000 106.154 0.846 18222
980 1 3 . 1 1 21 21 GLY CA C 21 46.710 46.710 46.969 -0.259 18222
981 1 3 . 1 1 21 21 GLY H H 21 8.570 8.570 8.484 0.086 18222
982 1 3 . 1 1 22 22 GLU N N 22 121.610 121.610 122.387 -0.777 18222
983 1 3 . 1 1 22 22 GLU HA H 22 3.990 3.990 4.105 -0.115 18222
984 1 3 . 1 1 22 22 GLU CA C 22 58.280 58.280 59.626 -1.346 18222
985 1 3 . 1 1 22 22 GLU CB C 22 28.010 28.010 29.463 -1.453 18222
986 1 3 . 1 1 22 22 GLU H H 22 8.100 8.100 8.334 -0.234 18222
987 1 3 . 1 1 23 23 TYR N N 23 120.870 120.870 119.416 1.454 18222
988 1 3 . 1 1 23 23 TYR CA C 23 60.380 60.380 61.791 -1.411 18222
989 1 3 . 1 1 23 23 TYR CB C 23 37.750 37.750 38.050 -0.300 18222
990 1 3 . 1 1 23 23 TYR H H 23 7.910 7.910 9.025 -1.115 18222
991 1 3 . 1 1 24 24 ALA N N 24 121.420 121.420 121.665 -0.245 18222
992 1 3 . 1 1 24 24 ALA HA H 24 4.140 4.140 3.913 0.227 18222
993 1 3 . 1 1 24 24 ALA CA C 24 54.260 54.260 54.963 -0.703 18222
994 1 3 . 1 1 24 24 ALA H H 24 8.410 8.410 8.409 0.001 18222
995 1 3 . 1 1 25 25 ALA N N 25 120.220 120.220 121.702 -1.482 18222
996 1 3 . 1 1 25 25 ALA CA C 25 54.370 54.370 55.256 -0.886 18222
997 1 3 . 1 1 25 25 ALA H H 25 8.090 8.090 8.199 -0.109 18222
998 1 3 . 1 1 26 26 CYS N N 26 116.760 116.760 117.143 -0.383 18222
999 1 3 . 1 1 26 26 CYS CA C 26 61.180 61.180 63.508 -2.328 18222
1000 1 3 . 1 1 26 26 CYS CB C 26 26.390 26.390 26.754 -0.364 18222
1001 1 3 . 1 1 26 26 CYS H H 26 7.950 7.950 8.335 -0.385 18222
1002 1 3 . 1 1 27 27 GLN N N 27 118.690 118.690 120.699 -2.009 18222
1003 1 3 . 1 1 27 27 GLN CA C 27 55.970 55.970 59.396 -3.426 18222
1004 1 3 . 1 1 27 27 GLN H H 27 8.060 8.060 8.480 -0.420 18222
1005 1 3 . 1 1 28 28 SER N N 28 115.490 115.490 116.138 -0.648 18222
1006 1 3 . 1 1 28 28 SER HA H 28 3.990 3.990 4.264 -0.274 18222
1007 1 3 . 1 1 28 28 SER CA C 28 61.110 61.110 62.341 -1.231 18222
1008 1 3 . 1 1 28 28 SER H H 28 7.980 7.980 8.421 -0.441 18222
1009 1 3 . 1 1 29 29 HIS N N 29 120.880 120.880 121.363 -0.483 18222
1010 1 3 . 1 1 29 29 HIS CA C 29 58.190 58.190 60.019 -1.829 18222
1011 1 3 . 1 1 29 29 HIS CB C 29 27.460 27.460 30.457 -2.997 18222
1012 1 3 . 1 1 29 29 HIS H H 29 8.180 8.180 8.435 -0.255 18222
1013 1 3 . 1 1 30 30 ALA N N 30 122.920 122.920 122.025 0.895 18222
1014 1 3 . 1 1 30 30 ALA CA C 30 54.560 54.560 55.119 -0.559 18222
1015 1 3 . 1 1 30 30 ALA CB C 30 17.490 17.490 18.415 -0.925 18222
1016 1 3 . 1 1 30 30 ALA H H 30 8.040 8.040 8.349 -0.309 18222
1017 1 3 . 1 1 31 31 PHE N N 31 119.340 119.340 119.745 -0.405 18222
1018 1 3 . 1 1 31 31 PHE CA C 31 60.370 60.370 61.159 -0.789 18222
1019 1 3 . 1 1 31 31 PHE CB C 31 38.520 38.520 39.343 -0.823 18222
1020 1 3 . 1 1 31 31 PHE H H 31 8.230 8.230 8.573 -0.343 18222
1021 1 3 . 1 1 32 32 MET N N 32 118.110 118.110 119.126 -1.016 18222
1022 1 3 . 1 1 32 32 MET HA H 32 4.050 4.050 3.958 0.092 18222
1023 1 3 . 1 1 32 32 MET CA C 32 58.280 58.280 59.352 -1.071 18222
1024 1 3 . 1 1 32 32 MET CB C 32 31.090 31.090 32.409 -1.319 18222
1025 1 3 . 1 1 32 32 MET H H 32 8.120 8.120 8.483 -0.363 18222
1026 1 3 . 1 1 33 33 LYS N N 33 119.040 119.040 119.895 -0.855 18222
1027 1 3 . 1 1 33 33 LYS HA H 33 3.930 3.930 3.991 -0.061 18222
1028 1 3 . 1 1 33 33 LYS CA C 33 59.040 59.040 59.718 -0.678 18222
1029 1 3 . 1 1 33 33 LYS CB C 33 30.990 30.990 32.341 -1.351 18222
1030 1 3 . 1 1 33 33 LYS H H 33 7.970 7.970 8.232 -0.262 18222
1031 1 3 . 1 1 34 34 GLY N N 34 108.840 108.840 107.381 1.459 18222
1032 1 3 . 1 1 34 34 GLY CA C 34 46.610 46.610 47.127 -0.517 18222
1033 1 3 . 1 1 34 34 GLY H H 34 8.030 8.030 8.425 -0.395 18222
1034 1 3 . 1 1 35 35 VAL N N 35 122.910 122.910 122.222 0.688 18222
1035 1 3 . 1 1 35 35 VAL HA H 35 4.220 4.220 3.595 0.625 18222
1036 1 3 . 1 1 35 35 VAL CA C 35 66.310 66.310 65.087 1.224 18222
1037 1 3 . 1 1 35 35 VAL CB C 35 30.560 30.560 31.547 -0.987 18222
1038 1 3 . 1 1 35 35 VAL H H 35 8.090 8.090 8.225 -0.135 18222
1039 1 3 . 1 1 36 36 PHE N N 36 120.020 120.020 120.646 -0.626 18222
1040 1 3 . 1 1 36 36 PHE CA C 36 61.350 61.350 61.717 -0.367 18222
1041 1 3 . 1 1 36 36 PHE CB C 36 38.090 38.090 39.029 -0.939 18222
1042 1 3 . 1 1 36 36 PHE H H 36 8.350 8.350 8.303 0.047 18222
1043 1 3 . 1 1 37 37 THR N N 37 116.980 116.980 116.136 0.844 18222
1044 1 3 . 1 1 37 37 THR HA H 37 4.050 4.050 3.784 0.266 18222
1045 1 3 . 1 1 37 37 THR CA C 37 66.000 66.000 66.124 -0.124 18222
1046 1 3 . 1 1 37 37 THR CB C 37 68.270 68.270 68.688 -0.418 18222
1047 1 3 . 1 1 37 37 THR H H 37 8.520 8.520 8.566 -0.046 18222
1048 1 3 . 1 1 38 38 PHE N N 38 123.090 123.090 120.534 2.556 18222
1049 1 3 . 1 1 38 38 PHE HA H 38 4.360 4.360 4.243 0.117 18222
1050 1 3 . 1 1 38 38 PHE CA C 38 61.140 61.140 61.663 -0.523 18222
1051 1 3 . 1 1 38 38 PHE CB C 38 41.200 41.200 39.366 1.834 18222
1052 1 3 . 1 1 38 38 PHE H H 38 8.010 8.010 8.028 -0.018 18222
1053 1 3 . 1 1 39 39 VAL N N 39 117.280 117.280 117.012 0.268 18222
1054 1 3 . 1 1 39 39 VAL HA H 39 4.210 4.210 3.696 0.514 18222
1055 1 3 . 1 1 39 39 VAL CA C 39 66.000 66.000 64.696 1.304 18222
1056 1 3 . 1 1 39 39 VAL CB C 39 30.860 30.860 31.868 -1.008 18222
1057 1 3 . 1 1 39 39 VAL H H 39 8.530 8.530 8.283 0.247 18222
1058 1 3 . 1 1 40 40 THR N N 40 109.470 109.470 113.430 -3.960 18222
1059 1 3 . 1 1 40 40 THR HA H 40 4.060 4.060 3.826 0.234 18222
1060 1 3 . 1 1 40 40 THR CA C 40 63.390 63.390 65.605 -2.215 18222
1061 1 3 . 1 1 40 40 THR CB C 40 68.650 68.650 69.008 -0.358 18222
1062 1 3 . 1 1 40 40 THR H H 40 7.700 7.700 7.587 0.113 18222
1063 1 3 . 1 1 41 41 GLY N N 41 110.770 110.770 107.940 2.830 18222
1064 1 3 . 1 1 41 41 GLY CA C 41 45.580 45.580 45.514 0.066 18222
1065 1 3 . 1 1 41 41 GLY H H 41 7.700 7.700 8.269 -0.569 18222
1066 1 3 . 1 1 42 42 THR N N 42 114.520 114.520 111.325 3.195 18222
1067 1 3 . 1 1 42 42 THR CA C 42 63.300 63.300 62.234 1.066 18222
1068 1 3 . 1 1 42 42 THR CB C 42 69.490 69.490 68.492 0.998 18222
1069 1 3 . 1 1 42 42 THR H H 42 7.720 7.720 7.818 -0.098 18222
1070 1 3 . 1 1 43 43 GLY N N 43 109.540 109.540 111.105 -1.565 18222
1071 1 3 . 1 1 43 43 GLY CA C 43 46.250 46.250 46.355 -0.105 18222
1072 1 3 . 1 1 43 43 GLY H H 43 8.110 8.110 8.597 -0.487 18222
1073 1 3 . 1 1 44 44 MET N N 44 120.240 120.240 121.303 -1.063 18222
1074 1 3 . 1 1 44 44 MET HA H 44 4.100 4.100 4.018 0.082 18222
1075 1 3 . 1 1 44 44 MET CA C 44 57.700 57.700 58.801 -1.101 18222
1076 1 3 . 1 1 44 44 MET CB C 44 32.030 32.030 32.406 -0.376 18222
1077 1 3 . 1 1 44 44 MET H H 44 7.730 7.730 8.135 -0.405 18222
1078 1 3 . 1 1 45 45 ALA N N 45 121.560 121.560 121.062 0.498 18222
1079 1 3 . 1 1 45 45 ALA CA C 45 54.440 54.440 55.197 -0.757 18222
1080 1 3 . 1 1 45 45 ALA CB C 45 17.400 17.400 17.809 -0.409 18222
1081 1 3 . 1 1 45 45 ALA H H 45 7.950 7.950 7.749 0.201 18222
1082 1 3 . 1 1 46 46 PHE N N 46 118.260 118.260 118.823 -0.563 18222
1083 1 3 . 1 1 46 46 PHE HA H 46 3.930 3.930 4.238 -0.308 18222
1084 1 3 . 1 1 46 46 PHE CA C 46 59.820 59.820 60.844 -1.024 18222
1085 1 3 . 1 1 46 46 PHE CB C 46 38.260 38.260 38.461 -0.201 18222
1086 1 3 . 1 1 46 46 PHE H H 46 7.860 7.860 8.044 -0.184 18222
1087 1 3 . 1 1 47 47 GLY N N 47 107.300 107.300 108.739 -1.439 18222
1088 1 3 . 1 1 47 47 GLY CA C 47 46.560 46.560 47.176 -0.616 18222
1089 1 3 . 1 1 47 47 GLY H H 47 8.200 8.200 8.688 -0.488 18222
1090 1 3 . 1 1 48 48 LEU N N 48 121.920 121.920 122.870 -0.950 18222
1091 1 3 . 1 1 48 48 LEU HA H 48 4.040 4.040 4.011 0.029 18222
1092 1 3 . 1 1 48 48 LEU CA C 48 57.580 57.580 57.817 -0.237 18222
1093 1 3 . 1 1 48 48 LEU CB C 48 40.790 40.790 41.752 -0.962 18222
1094 1 3 . 1 1 48 48 LEU H H 48 8.180 8.180 8.182 -0.002 18222
1095 1 3 . 1 1 49 49 GLN N N 49 118.270 118.270 117.919 0.351 18222
1096 1 3 . 1 1 49 49 GLN HA H 49 3.830 3.830 3.884 -0.054 18222
1097 1 3 . 1 1 49 49 GLN CA C 49 58.880 58.880 59.239 -0.359 18222
1098 1 3 . 1 1 49 49 GLN CB C 49 27.240 27.240 28.589 -1.349 18222
1099 1 3 . 1 1 49 49 GLN H H 49 8.080 8.080 8.165 -0.085 18222
1100 1 3 . 1 1 50 50 MET N N 50 117.630 117.630 119.099 -1.469 18222
1101 1 3 . 1 1 50 50 MET HA H 50 4.010 4.010 4.245 -0.235 18222
1102 1 3 . 1 1 50 50 MET CA C 50 57.730 57.730 58.291 -0.561 18222
1103 1 3 . 1 1 50 50 MET CB C 50 27.160 27.160 32.498 -5.338 18222
1104 1 3 . 1 1 50 50 MET H H 50 7.880 7.880 8.242 -0.362 18222
1105 1 3 . 1 1 51 51 PHE N N 51 119.550 119.550 120.060 -0.510 18222
1106 1 3 . 1 1 51 51 PHE CA C 51 60.850 60.850 61.568 -0.718 18222
1107 1 3 . 1 1 51 51 PHE CB C 51 38.720 38.720 39.332 -0.612 18222
1108 1 3 . 1 1 51 51 PHE H H 51 7.890 7.890 8.335 -0.445 18222
1109 1 3 . 1 1 52 52 ILE N N 52 117.950 117.950 119.485 -1.535 18222
1110 1 3 . 1 1 52 52 ILE HA H 52 4.050 4.050 3.974 0.076 18222
1111 1 3 . 1 1 52 52 ILE CA C 52 63.560 63.560 64.424 -0.864 18222
1112 1 3 . 1 1 52 52 ILE CB C 52 36.810 36.810 38.467 -1.657 18222
1113 1 3 . 1 1 52 52 ILE H H 52 8.110 8.110 8.260 -0.150 18222
1114 1 3 . 1 1 53 53 GLN N N 53 117.360 117.360 119.429 -2.069 18222
1115 1 3 . 1 1 53 53 GLN CA C 53 57.200 57.200 58.373 -1.173 18222
1116 1 3 . 1 1 53 53 GLN CB C 53 27.870 27.870 28.528 -0.658 18222
1117 1 3 . 1 1 53 53 GLN H H 53 7.930 7.930 8.178 -0.248 18222
1118 1 3 . 1 1 54 54 ARG N N 54 116.840 116.840 117.665 -0.825 18222
1119 1 3 . 1 1 54 54 ARG HA H 54 3.950 3.950 4.186 -0.236 18222
1120 1 3 . 1 1 54 54 ARG CA C 54 56.480 56.480 57.533 -1.053 18222
1121 1 3 . 1 1 54 54 ARG CB C 54 28.970 28.970 30.036 -1.066 18222
1122 1 3 . 1 1 54 54 ARG H H 54 7.540 7.540 7.716 -0.176 18222
1123 1 3 . 1 1 55 55 LYS N N 55 117.900 117.900 117.580 0.320 18222
1124 1 3 . 1 1 55 55 LYS HA H 55 4.080 4.080 4.253 -0.173 18222
1125 1 3 . 1 1 55 55 LYS CA C 55 55.030 55.030 56.901 -1.871 18222
1126 1 3 . 1 1 55 55 LYS CB C 55 32.010 32.010 32.525 -0.515 18222
1127 1 3 . 1 1 55 55 LYS H H 55 7.660 7.660 7.322 0.338 18222
1128 1 3 . 1 1 56 56 PHE N N 56 121.060 121.060 120.420 0.640 18222
1129 1 3 . 1 1 56 56 PHE CA C 56 55.190 55.190 54.749 0.441 18222
1130 1 3 . 1 1 56 56 PHE CB C 56 38.970 38.970 39.913 -0.943 18222
1131 1 3 . 1 1 56 56 PHE H H 56 8.080 8.080 7.773 0.307 18222
1132 1 3 . 1 1 57 57 PRO CA C 57 62.390 62.390 63.568 -1.178 18222
1133 1 3 . 1 1 57 57 PRO CB C 57 30.580 30.580 31.751 -1.171 18222
1134 1 3 . 1 1 58 58 TYR N N 58 120.240 120.240 120.901 -0.661 18222
1135 1 3 . 1 1 58 58 TYR CA C 58 55.770 55.770 55.278 0.492 18222
1136 1 3 . 1 1 58 58 TYR CB C 58 40.220 40.220 39.662 0.558 18222
1137 1 3 . 1 1 58 58 TYR H H 58 7.700 7.700 7.862 -0.162 18222
1138 1 3 . 1 1 59 59 PRO CA C 59 62.130 62.130 63.656 -1.526 18222
1139 1 3 . 1 1 59 59 PRO CB C 59 33.340 33.340 32.183 1.157 18222
1140 1 3 . 1 1 60 60 LEU N N 60 122.210 122.210 120.958 1.252 18222
1141 1 3 . 1 1 60 60 LEU CA C 60 54.250 54.250 55.156 -0.906 18222
1142 1 3 . 1 1 60 60 LEU CB C 60 41.470 41.470 42.294 -0.824 18222
1143 1 3 . 1 1 60 60 LEU H H 60 7.880 7.880 7.918 -0.038 18222
1144 1 3 . 1 1 61 61 GLN N N 61 122.470 122.470 121.931 0.539 18222
1145 1 3 . 1 1 61 61 GLN CA C 61 54.170 54.170 55.275 -1.105 18222
1146 1 3 . 1 1 61 61 GLN H H 61 7.970 7.970 8.334 -0.364 18222
1147 1 3 . 1 1 62 62 TRP N N 62 124.590 124.590 125.336 -0.746 18222
1148 1 3 . 1 1 62 62 TRP CA C 62 59.830 59.830 61.482 -1.652 18222
1149 1 3 . 1 1 62 62 TRP CB C 62 28.800 28.800 29.386 -0.586 18222
1150 1 3 . 1 1 62 62 TRP H H 62 8.240 8.240 8.875 -0.635 18222
1151 1 3 . 1 1 63 63 SER N N 63 113.320 113.320 115.833 -2.513 18222
1152 1 3 . 1 1 63 63 SER CA C 63 61.100 61.100 62.254 -1.154 18222
1153 1 3 . 1 1 63 63 SER H H 63 8.410 8.410 8.470 -0.060 18222
1154 1 3 . 1 1 64 64 LEU N N 64 123.230 123.230 122.295 0.935 18222
1155 1 3 . 1 1 64 64 LEU CA C 64 56.880 56.880 57.628 -0.748 18222
1156 1 3 . 1 1 64 64 LEU CB C 64 40.830 40.830 41.817 -0.987 18222
1157 1 3 . 1 1 64 64 LEU H H 64 7.230 7.230 8.170 -0.940 18222
1158 1 3 . 1 1 65 65 LEU N N 65 119.400 119.400 120.501 -1.101 18222
1159 1 3 . 1 1 65 65 LEU HA H 65 3.890 3.890 3.939 -0.049 18222
1160 1 3 . 1 1 65 65 LEU CA C 65 57.580 57.580 58.191 -0.611 18222
1161 1 3 . 1 1 65 65 LEU CB C 65 40.710 40.710 41.834 -1.124 18222
1162 1 3 . 1 1 65 65 LEU H H 65 7.510 7.510 8.621 -1.111 18222
1163 1 3 . 1 1 66 66 VAL N N 66 116.950 116.950 119.309 -2.359 18222
1164 1 3 . 1 1 66 66 VAL HA H 66 3.960 3.960 3.617 0.343 18222
1165 1 3 . 1 1 66 66 VAL CA C 66 66.260 66.260 65.150 1.110 18222
1166 1 3 . 1 1 66 66 VAL CB C 66 30.570 30.570 30.556 0.014 18222
1167 1 3 . 1 1 66 66 VAL H H 66 7.950 7.950 8.236 -0.286 18222
1168 1 3 . 1 1 67 67 ALA N N 67 120.650 120.650 122.517 -1.867 18222
1169 1 3 . 1 1 67 67 ALA HA H 67 4.000 4.000 4.177 -0.177 18222
1170 1 3 . 1 1 67 67 ALA CA C 67 54.780 54.780 55.292 -0.512 18222
1171 1 3 . 1 1 67 67 ALA CB C 67 17.440 17.440 18.338 -0.898 18222
1172 1 3 . 1 1 67 67 ALA H H 67 7.450 7.450 8.030 -0.580 18222
1173 1 3 . 1 1 68 68 VAL N N 68 118.440 118.440 119.172 -0.732 18222
1174 1 3 . 1 1 68 68 VAL HA H 68 3.750 3.750 3.671 0.079 18222
1175 1 3 . 1 1 68 68 VAL CA C 68 65.250 65.250 67.370 -2.119 18222
1176 1 3 . 1 1 68 68 VAL CB C 68 30.850 30.850 31.932 -1.082 18222
1177 1 3 . 1 1 68 68 VAL H H 68 7.960 7.960 7.898 0.062 18222
1178 1 3 . 1 1 69 69 VAL N N 69 120.800 120.800 120.013 0.787 18222
1179 1 3 . 1 1 69 69 VAL HA H 69 4.220 4.220 3.583 0.637 18222
1180 1 3 . 1 1 69 69 VAL CA C 69 66.020 66.020 66.383 -0.363 18222
1181 1 3 . 1 1 69 69 VAL CB C 69 30.850 30.850 30.684 0.166 18222
1182 1 3 . 1 1 69 69 VAL H H 69 8.080 8.080 8.438 -0.358 18222
1183 1 3 . 1 1 70 70 ALA N N 70 121.740 121.740 120.910 0.830 18222
1184 1 3 . 1 1 70 70 ALA HA H 70 3.920 3.920 4.177 -0.257 18222
1185 1 3 . 1 1 70 70 ALA CA C 70 54.920 54.920 55.359 -0.439 18222
1186 1 3 . 1 1 70 70 ALA CB C 70 17.620 17.620 18.251 -0.631 18222
1187 1 3 . 1 1 70 70 ALA H H 70 8.660 8.660 8.574 0.086 18222
1188 1 3 . 1 1 71 71 GLY N N 71 103.450 103.450 106.832 -3.382 18222
1189 1 3 . 1 1 71 71 GLY CA C 71 46.300 46.300 46.894 -0.594 18222
1190 1 3 . 1 1 71 71 GLY H H 71 8.010 8.010 8.051 -0.041 18222
1191 1 3 . 1 1 72 72 SER N N 72 118.160 118.160 118.011 0.149 18222
1192 1 3 . 1 1 72 72 SER CA C 72 61.260 61.260 61.712 -0.452 18222
1193 1 3 . 1 1 72 72 SER CB C 72 62.870 62.870 63.104 -0.234 18222
1194 1 3 . 1 1 72 72 SER H H 72 7.870 7.870 8.007 -0.137 18222
1195 1 3 . 1 1 73 73 VAL N N 73 121.340 121.340 122.213 -0.873 18222
1196 1 3 . 1 1 73 73 VAL CA C 73 65.750 65.750 66.833 -1.083 18222
1197 1 3 . 1 1 73 73 VAL CB C 73 30.740 30.740 31.823 -1.083 18222
1198 1 3 . 1 1 73 73 VAL H H 73 8.050 8.050 8.196 -0.146 18222
1199 1 3 . 1 1 74 74 VAL N N 74 118.680 118.680 118.547 0.133 18222
1200 1 3 . 1 1 74 74 VAL CA C 74 65.770 65.770 65.949 -0.179 18222
1201 1 3 . 1 1 74 74 VAL CB C 74 30.740 30.740 30.520 0.220 18222
1202 1 3 . 1 1 74 74 VAL H H 74 7.880 7.880 8.466 -0.586 18222
1203 1 3 . 1 1 75 75 SER N N 75 114.750 114.750 116.097 -1.347 18222
1204 1 3 . 1 1 75 75 SER HA H 75 4.100 4.100 4.187 -0.087 18222
1205 1 3 . 1 1 75 75 SER CA C 75 60.870 60.870 61.607 -0.737 18222
1206 1 3 . 1 1 75 75 SER CB C 75 62.340 62.340 63.042 -0.702 18222
1207 1 3 . 1 1 75 75 SER H H 75 7.870 7.870 8.048 -0.178 18222
1208 1 3 . 1 1 76 76 TYR N N 76 121.110 121.110 122.270 -1.160 18222
1209 1 3 . 1 1 76 76 TYR CA C 76 60.050 60.050 61.004 -0.954 18222
1210 1 3 . 1 1 76 76 TYR CB C 76 37.980 37.980 38.264 -0.284 18222
1211 1 3 . 1 1 76 76 TYR H H 76 7.860 7.860 8.562 -0.702 18222
1212 1 3 . 1 1 77 77 GLY N N 77 107.300 107.300 107.298 0.002 18222
1213 1 3 . 1 1 77 77 GLY CA C 77 46.560 46.560 47.315 -0.755 18222
1214 1 3 . 1 1 77 77 GLY H H 77 8.200 8.200 8.482 -0.282 18222
1215 1 3 . 1 1 78 78 VAL N N 78 119.470 119.470 122.291 -2.821 18222
1216 1 3 . 1 1 78 78 VAL HA H 78 4.170 4.170 3.746 0.424 18222
1217 1 3 . 1 1 78 78 VAL CA C 78 64.650 64.650 66.314 -1.664 18222
1218 1 3 . 1 1 78 78 VAL H H 78 8.140 8.140 8.623 -0.483 18222
1219 1 3 . 1 1 79 79 THR N N 79 112.100 112.100 115.921 -3.821 18222
1220 1 3 . 1 1 79 79 THR CA C 79 63.460 63.460 66.105 -2.645 18222
1221 1 3 . 1 1 79 79 THR CB C 79 68.650 68.650 68.207 0.443 18222
1222 1 3 . 1 1 79 79 THR H H 79 7.640 7.640 8.342 -0.702 18222
1223 1 3 . 1 1 80 80 ARG N N 80 120.770 120.770 122.094 -1.324 18222
1224 1 3 . 1 1 80 80 ARG HA H 80 4.160 4.160 4.169 -0.009 18222
1225 1 3 . 1 1 80 80 ARG CA C 80 56.790 56.790 59.137 -2.347 18222
1226 1 3 . 1 1 80 80 ARG CB C 80 29.430 29.430 30.096 -0.666 18222
1227 1 3 . 1 1 80 80 ARG H H 80 7.680 7.680 7.963 -0.283 18222
1228 1 3 . 1 1 81 81 VAL N N 81 118.370 118.370 117.592 0.778 18222
1229 1 3 . 1 1 81 81 VAL HA H 81 3.920 3.920 3.881 0.039 18222
1230 1 3 . 1 1 81 81 VAL CA C 81 63.340 63.340 66.814 -3.474 18222
1231 1 3 . 1 1 81 81 VAL CB C 81 31.260 31.260 31.096 0.164 18222
1232 1 3 . 1 1 81 81 VAL H H 81 7.730 7.730 8.262 -0.532 18222
1233 1 3 . 1 1 82 82 GLU N N 82 120.620 120.620 119.797 0.823 18222
1234 1 3 . 1 1 82 82 GLU CA C 82 56.320 56.320 59.616 -3.296 18222
1235 1 3 . 1 1 82 82 GLU CB C 82 27.930 27.930 29.361 -1.431 18222
1236 1 3 . 1 1 82 82 GLU H H 82 7.920 7.920 8.659 -0.739 18222
1237 1 3 . 1 1 83 83 SER N N 83 116.240 116.240 115.622 0.618 18222
1238 1 3 . 1 1 83 83 SER CA C 83 59.250 59.250 61.740 -2.490 18222
1239 1 3 . 1 1 83 83 SER CB C 83 63.160 63.160 62.765 0.395 18222
1240 1 3 . 1 1 83 83 SER H H 83 7.960 7.960 8.093 -0.133 18222
1241 1 3 . 1 1 84 84 GLU N N 84 123.280 123.280 121.947 1.333 18222
1242 1 3 . 1 1 84 84 GLU HA H 84 4.080 4.080 3.990 0.090 18222
1243 1 3 . 1 1 84 84 GLU CA C 84 57.860 57.860 60.077 -2.217 18222
1244 1 3 . 1 1 84 84 GLU CB C 84 28.190 28.190 29.660 -1.470 18222
1245 1 3 . 1 1 84 84 GLU H H 84 8.470 8.470 8.058 0.412 18222
1246 1 3 . 1 1 85 85 LYS N N 85 118.650 118.650 119.052 -0.402 18222
1247 1 3 . 1 1 85 85 LYS HA H 85 4.100 4.100 4.105 -0.005 18222
1248 1 3 . 1 1 85 85 LYS CA C 85 57.780 57.780 59.181 -1.401 18222
1249 1 3 . 1 1 85 85 LYS CB C 85 31.380 31.380 32.368 -0.988 18222
1250 1 3 . 1 1 85 85 LYS H H 85 7.940 7.940 8.223 -0.282 18222
1251 1 3 . 1 1 86 86 CYS N N 86 117.070 117.070 119.318 -2.248 18222
1252 1 3 . 1 1 86 86 CYS CA C 86 60.910 60.910 63.977 -3.067 18222
1253 1 3 . 1 1 86 86 CYS CB C 86 26.740 26.740 26.972 -0.232 18222
1254 1 3 . 1 1 86 86 CYS H H 86 7.840 7.840 8.124 -0.284 18222
1255 1 3 . 1 1 87 87 ASN N N 87 119.370 119.370 118.773 0.597 18222
1256 1 3 . 1 1 87 87 ASN HA H 87 4.130 4.130 4.622 -0.492 18222
1257 1 3 . 1 1 87 87 ASN CA C 87 55.750 55.750 56.659 -0.909 18222
1258 1 3 . 1 1 87 87 ASN CB C 87 38.050 38.050 38.408 -0.358 18222
1259 1 3 . 1 1 87 87 ASN H H 87 8.110 8.110 8.632 -0.522 18222
1260 1 3 . 1 1 88 88 ASN N N 88 117.570 117.570 119.574 -2.004 18222
1261 1 3 . 1 1 88 88 ASN HA H 88 4.280 4.280 4.524 -0.244 18222
1262 1 3 . 1 1 88 88 ASN CA C 88 55.190 55.190 56.337 -1.147 18222
1263 1 3 . 1 1 88 88 ASN CB C 88 37.400 37.400 38.499 -1.099 18222
1264 1 3 . 1 1 88 88 ASN H H 88 8.280 8.280 8.244 0.036 18222
1265 1 3 . 1 1 89 89 LEU N N 89 121.940 121.940 122.107 -0.167 18222
1266 1 3 . 1 1 89 89 LEU HA H 89 4.070 4.070 4.013 0.057 18222
1267 1 3 . 1 1 89 89 LEU CA C 89 57.580 57.580 58.783 -1.203 18222
1268 1 3 . 1 1 89 89 LEU CB C 89 40.490 40.490 42.076 -1.586 18222
1269 1 3 . 1 1 89 89 LEU H H 89 7.790 7.790 8.466 -0.676 18222
1270 1 3 . 1 1 90 90 TRP N N 90 119.220 119.220 120.547 -1.327 18222
1271 1 3 . 1 1 90 90 TRP CA C 90 59.120 59.120 60.167 -1.048 18222
1272 1 3 . 1 1 90 90 TRP CB C 90 28.800 28.800 29.608 -0.808 18222
1273 1 3 . 1 1 90 90 TRP H H 90 7.850 7.850 8.154 -0.304 18222
1274 1 3 . 1 1 91 91 LEU N N 91 117.870 117.870 120.845 -2.975 18222
1275 1 3 . 1 1 91 91 LEU CA C 91 57.300 57.300 57.993 -0.693 18222
1276 1 3 . 1 1 91 91 LEU CB C 91 40.610 40.610 41.906 -1.296 18222
1277 1 3 . 1 1 91 91 LEU H H 91 7.920 7.920 8.312 -0.392 18222
1278 1 3 . 1 1 92 92 PHE N N 92 121.280 121.280 118.031 3.249 18222
1279 1 3 . 1 1 92 92 PHE CA C 92 60.390 60.390 61.683 -1.293 18222
1280 1 3 . 1 1 92 92 PHE CB C 92 37.980 37.980 38.623 -0.644 18222
1281 1 3 . 1 1 92 92 PHE H H 92 7.860 7.860 8.363 -0.503 18222
1282 1 3 . 1 1 93 93 LEU N N 93 119.860 119.860 120.952 -1.092 18222
1283 1 3 . 1 1 93 93 LEU CA C 93 56.860 56.860 58.267 -1.407 18222
1284 1 3 . 1 1 93 93 LEU CB C 93 40.550 40.550 41.908 -1.358 18222
1285 1 3 . 1 1 93 93 LEU H H 93 7.980 7.980 8.733 -0.753 18222
1286 1 3 . 1 1 94 94 GLU N N 94 114.660 114.660 117.056 -2.396 18222
1287 1 3 . 1 1 94 94 GLU HA H 94 3.810 3.810 3.683 0.127 18222
1288 1 3 . 1 1 94 94 GLU CA C 94 57.210 57.210 58.493 -1.283 18222
1289 1 3 . 1 1 94 94 GLU CB C 94 28.470 28.470 29.204 -0.734 18222
1290 1 3 . 1 1 94 94 GLU H H 94 7.890 7.890 7.638 0.252 18222
1291 1 3 . 1 1 95 95 THR N N 95 108.260 108.260 111.440 -3.180 18222
1292 1 3 . 1 1 95 95 THR CA C 95 62.150 62.150 62.555 -0.405 18222
1293 1 3 . 1 1 95 95 THR CB C 95 70.810 70.810 69.660 1.150 18222
1294 1 3 . 1 1 95 95 THR H H 95 7.690 7.690 7.578 0.112 18222
1295 1 3 . 1 1 96 96 GLY N N 96 112.220 112.220 109.576 2.644 18222
1296 1 3 . 1 1 96 96 GLY CA C 96 45.410 45.410 44.790 0.620 18222
1297 1 3 . 1 1 96 96 GLY H H 96 8.240 8.240 7.543 0.697 18222
1298 1 3 . 1 1 97 97 GLN N N 97 117.950 117.950 120.623 -2.673 18222
1299 1 3 . 1 1 97 97 GLN HA H 97 4.200 4.200 4.312 -0.112 18222
1300 1 3 . 1 1 97 97 GLN CA C 97 54.430 54.430 55.332 -0.902 18222
1301 1 3 . 1 1 97 97 GLN CB C 97 29.910 29.910 28.538 1.372 18222
1302 1 3 . 1 1 97 97 GLN H H 97 7.640 7.640 8.232 -0.592 18222
1303 1 3 . 1 1 98 98 LEU N N 98 123.810 123.810 127.027 -3.217 18222
1304 1 3 . 1 1 98 98 LEU HA H 98 4.360 4.360 4.406 -0.046 18222
1305 1 3 . 1 1 98 98 LEU CA C 98 52.650 52.650 53.751 -1.101 18222
1306 1 3 . 1 1 98 98 LEU CB C 98 40.460 40.460 41.849 -1.389 18222
1307 1 3 . 1 1 98 98 LEU H H 98 8.270 8.270 7.946 0.324 18222
1308 1 3 . 1 1 99 99 PRO CA C 99 63.180 63.180 62.069 1.111 18222
1309 1 3 . 1 1 99 99 PRO CB C 99 30.840 30.840 32.584 -1.744 18222
1310 1 3 . 1 1 100 100 LYS N N 100 120.630 120.630 119.033 1.597 18222
1311 1 3 . 1 1 100 100 LYS CA C 100 55.730 55.730 58.301 -2.571 18222
1312 1 3 . 1 1 100 100 LYS CB C 100 32.280 32.280 32.517 -0.237 18222
1313 1 3 . 1 1 100 100 LYS H H 100 8.090 8.090 8.369 -0.279 18222
1314 1 3 . 1 1 101 101 ASP N N 101 120.920 120.920 117.836 3.084 18222
1315 1 3 . 1 1 101 101 ASP HA H 101 4.190 4.190 4.746 -0.556 18222
1316 1 3 . 1 1 101 101 ASP CA C 101 54.000 54.000 54.185 -0.185 18222
1317 1 3 . 1 1 101 101 ASP CB C 101 40.330 40.330 41.301 -0.971 18222
1318 1 3 . 1 1 101 101 ASP H H 101 8.190 8.190 7.995 0.195 18222
1319 1 3 . 1 1 102 102 ARG N N 102 122.210 122.210 124.645 -2.435 18222
1320 1 3 . 1 1 102 102 ARG CA C 102 55.590 55.590 56.859 -1.269 18222
1321 1 3 . 1 1 102 102 ARG CB C 102 29.630 29.630 31.181 -1.551 18222
1322 1 3 . 1 1 102 102 ARG H H 102 8.130 8.130 8.352 -0.222 18222
1323 1 3 . 1 1 103 103 SER N N 103 117.230 117.230 118.218 -0.988 18222
1324 1 3 . 1 1 103 103 SER HA H 103 4.280 4.280 4.531 -0.251 18222
1325 1 3 . 1 1 103 103 SER CA C 103 58.470 58.470 58.360 0.110 18222
1326 1 3 . 1 1 103 103 SER CB C 103 63.080 63.080 63.673 -0.593 18222
1327 1 3 . 1 1 103 103 SER H H 103 8.290 8.290 8.522 -0.232 18222
1328 1 3 . 1 1 104 104 THR N N 104 115.430 115.430 120.381 -4.951 18222
1329 1 3 . 1 1 104 104 THR CA C 104 61.570 61.570 63.605 -2.035 18222
1330 1 3 . 1 1 104 104 THR CB C 104 69.030 69.030 68.983 0.047 18222
1331 1 3 . 1 1 104 104 THR H H 104 8.020 8.020 8.298 -0.278 18222
1332 1 3 . 1 1 105 105 ASP N N 105 122.780 122.780 124.292 -1.512 18222
1333 1 3 . 1 1 105 105 ASP CA C 105 54.210 54.210 53.835 0.375 18222
1334 1 3 . 1 1 105 105 ASP CB C 105 40.380 40.380 41.987 -1.607 18222
1335 1 3 . 1 1 105 105 ASP H H 105 8.120 8.120 7.961 0.159 18222
1336 1 3 . 1 1 106 106 GLN N N 106 120.960 120.960 118.816 2.144 18222
1337 1 3 . 1 1 106 106 GLN CA C 106 55.420 55.420 56.627 -1.207 18222
1338 1 3 . 1 1 106 106 GLN CB C 106 28.310 28.310 30.746 -2.436 18222
1339 1 3 . 1 1 106 106 GLN H H 106 8.140 8.140 8.395 -0.255 18222
1340 1 3 . 1 1 107 107 ARG N N 107 123.010 123.010 122.936 0.074 18222
1341 1 3 . 1 1 107 107 ARG HA H 107 4.210 4.210 4.578 -0.368 18222
1342 1 3 . 1 1 107 107 ARG CA C 107 55.560 55.560 56.320 -0.760 18222
1343 1 3 . 1 1 107 107 ARG CB C 107 29.920 29.920 30.614 -0.694 18222
1344 1 3 . 1 1 107 107 ARG H H 107 8.180 8.180 8.671 -0.491 18222
1345 1 4 . 1 1 2 2 VAL N N 2 121.590 121.590 121.371 0.219 18222
1346 1 4 . 1 1 2 2 VAL CA C 2 61.600 61.600 62.029 -0.429 18222
1347 1 4 . 1 1 2 2 VAL CB C 2 31.900 31.900 33.014 -1.114 18222
1348 1 4 . 1 1 2 2 VAL H H 2 8.010 8.010 8.411 -0.401 18222
1349 1 4 . 1 1 3 3 ASN N N 3 122.520 122.520 123.743 -1.223 18222
1350 1 4 . 1 1 3 3 ASN HA H 3 4.020 4.020 4.904 -0.884 18222
1351 1 4 . 1 1 3 3 ASN CA C 3 52.640 52.640 52.904 -0.264 18222
1352 1 4 . 1 1 3 3 ASN CB C 3 38.330 38.330 38.806 -0.476 18222
1353 1 4 . 1 1 3 3 ASN H H 3 8.360 8.360 8.578 -0.218 18222
1354 1 4 . 1 1 4 4 LEU N N 4 123.830 123.830 121.866 1.964 18222
1355 1 4 . 1 1 4 4 LEU HA H 4 4.220 4.220 3.725 0.495 18222
1356 1 4 . 1 1 4 4 LEU CA C 4 54.620 54.620 56.959 -2.340 18222
1357 1 4 . 1 1 4 4 LEU CB C 4 41.680 41.680 41.318 0.362 18222
1358 1 4 . 1 1 4 4 LEU H H 4 8.220 8.220 8.800 -0.580 18222
1359 1 4 . 1 1 5 5 GLY N N 5 106.810 106.810 105.489 1.321 18222
1360 1 4 . 1 1 5 5 GLY CA C 5 45.800 45.800 45.367 0.433 18222
1361 1 4 . 1 1 5 5 GLY H H 5 8.030 8.030 8.101 -0.071 18222
1362 1 4 . 1 1 6 6 LEU N N 6 120.820 120.820 123.520 -2.700 18222
1363 1 4 . 1 1 6 6 LEU HA H 6 4.050 4.050 4.170 -0.120 18222
1364 1 4 . 1 1 6 6 LEU CA C 6 55.990 55.990 58.095 -2.105 18222
1365 1 4 . 1 1 6 6 LEU CB C 6 40.800 40.800 41.963 -1.163 18222
1366 1 4 . 1 1 6 6 LEU H H 6 8.030 8.030 8.581 -0.551 18222
1367 1 4 . 1 1 7 7 SER N N 7 115.540 115.540 113.747 1.793 18222
1368 1 4 . 1 1 7 7 SER HA H 7 4.100 4.100 4.149 -0.049 18222
1369 1 4 . 1 1 7 7 SER CA C 7 60.580 60.580 61.822 -1.242 18222
1370 1 4 . 1 1 7 7 SER CB C 7 62.060 62.060 62.661 -0.601 18222
1371 1 4 . 1 1 7 7 SER H H 7 8.360 8.360 8.245 0.115 18222
1372 1 4 . 1 1 8 8 ARG N N 8 120.690 120.690 122.235 -1.545 18222
1373 1 4 . 1 1 8 8 ARG HA H 8 4.160 4.160 4.065 0.095 18222
1374 1 4 . 1 1 8 8 ARG CA C 8 57.350 57.350 59.614 -2.264 18222
1375 1 4 . 1 1 8 8 ARG CB C 8 29.230 29.230 29.967 -0.737 18222
1376 1 4 . 1 1 8 8 ARG H H 8 7.830 7.830 8.322 -0.492 18222
1377 1 4 . 1 1 9 9 VAL N N 9 119.330 119.330 119.884 -0.554 18222
1378 1 4 . 1 1 9 9 VAL HA H 9 4.170 4.170 3.557 0.613 18222
1379 1 4 . 1 1 9 9 VAL CA C 9 64.720 64.720 67.133 -2.413 18222
1380 1 4 . 1 1 9 9 VAL CB C 9 30.900 30.900 31.652 -0.752 18222
1381 1 4 . 1 1 9 9 VAL H H 9 7.620 7.620 8.504 -0.884 18222
1382 1 4 . 1 1 10 10 ASP N N 10 119.520 119.520 119.465 0.055 18222
1383 1 4 . 1 1 10 10 ASP CA C 10 54.960 54.960 57.554 -2.594 18222
1384 1 4 . 1 1 10 10 ASP CB C 10 37.800 37.800 40.651 -2.851 18222
1385 1 4 . 1 1 10 10 ASP H H 10 8.180 8.180 8.262 -0.082 18222
1386 1 4 . 1 1 11 11 ASP N N 11 121.550 121.550 120.755 0.795 18222
1387 1 4 . 1 1 11 11 ASP CA C 11 54.440 54.440 58.048 -3.608 18222
1388 1 4 . 1 1 11 11 ASP CB C 11 37.840 37.840 41.057 -3.217 18222
1389 1 4 . 1 1 11 11 ASP H H 11 7.950 7.950 8.152 -0.202 18222
1390 1 4 . 1 1 12 12 ALA N N 12 120.220 120.220 123.068 -2.848 18222
1391 1 4 . 1 1 12 12 ALA CA C 12 54.370 54.370 55.435 -1.065 18222
1392 1 4 . 1 1 12 12 ALA CB C 12 24.730 24.730 18.474 6.256 18222
1393 1 4 . 1 1 12 12 ALA H H 12 8.090 8.090 8.403 -0.313 18222
1394 1 4 . 1 1 13 13 VAL N N 13 116.910 116.910 118.547 -1.637 18222
1395 1 4 . 1 1 13 13 VAL HA H 13 4.140 4.140 3.669 0.471 18222
1396 1 4 . 1 1 13 13 VAL CA C 13 64.900 64.900 65.256 -0.356 18222
1397 1 4 . 1 1 13 13 VAL CB C 13 31.000 31.000 30.809 0.191 18222
1398 1 4 . 1 1 13 13 VAL H H 13 7.980 7.980 8.173 -0.193 18222
1399 1 4 . 1 1 14 14 ALA N N 14 122.200 122.200 122.296 -0.096 18222
1400 1 4 . 1 1 14 14 ALA HA H 14 4.020 4.020 4.157 -0.137 18222
1401 1 4 . 1 1 14 14 ALA CA C 14 53.800 53.800 55.079 -1.279 18222
1402 1 4 . 1 1 14 14 ALA CB C 14 17.790 17.790 18.302 -0.512 18222
1403 1 4 . 1 1 14 14 ALA H H 14 8.030 8.030 8.038 -0.008 18222
1404 1 4 . 1 1 15 15 ALA N N 15 118.600 118.600 119.657 -1.057 18222
1405 1 4 . 1 1 15 15 ALA CA C 15 53.230 53.230 54.073 -0.843 18222
1406 1 4 . 1 1 15 15 ALA CB C 15 18.010 18.010 18.581 -0.571 18222
1407 1 4 . 1 1 15 15 ALA H H 15 7.530 7.530 8.451 -0.921 18222
1408 1 4 . 1 1 16 16 LYS N N 16 115.820 115.820 116.767 -0.947 18222
1409 1 4 . 1 1 16 16 LYS HA H 16 4.080 4.080 4.231 -0.151 18222
1410 1 4 . 1 1 16 16 LYS CA C 16 55.670 55.670 56.883 -1.213 18222
1411 1 4 . 1 1 16 16 LYS CB C 16 32.640 32.640 33.159 -0.519 18222
1412 1 4 . 1 1 16 16 LYS H H 16 7.490 7.490 7.549 -0.059 18222
1413 1 4 . 1 1 17 17 HIS N N 17 116.790 116.790 118.814 -2.024 18222
1414 1 4 . 1 1 17 17 HIS HA H 17 4.100 4.100 4.873 -0.773 18222
1415 1 4 . 1 1 17 17 HIS CA C 17 52.820 52.820 52.978 -0.158 18222
1416 1 4 . 1 1 17 17 HIS CB C 17 28.400 28.400 30.266 -1.866 18222
1417 1 4 . 1 1 17 17 HIS H H 17 8.130 8.130 7.673 0.458 18222
1418 1 4 . 1 1 18 18 PRO CA C 18 63.800 63.800 62.111 1.689 18222
1419 1 4 . 1 1 18 18 PRO CB C 18 30.800 30.800 32.460 -1.660 18222
1420 1 4 . 1 1 19 19 GLY N N 19 110.260 110.260 108.880 1.380 18222
1421 1 4 . 1 1 19 19 GLY CA C 19 45.490 45.490 45.411 0.079 18222
1422 1 4 . 1 1 19 19 GLY H H 19 8.730 8.730 7.869 0.861 18222
1423 1 4 . 1 1 20 20 LEU N N 20 122.650 122.650 122.464 0.186 18222
1424 1 4 . 1 1 20 20 LEU HA H 20 4.090 4.090 4.189 -0.099 18222
1425 1 4 . 1 1 20 20 LEU CA C 20 57.060 57.060 57.562 -0.502 18222
1426 1 4 . 1 1 20 20 LEU H H 20 7.980 7.980 8.283 -0.303 18222
1427 1 4 . 1 1 21 21 GLY N N 21 107.000 107.000 107.472 -0.472 18222
1428 1 4 . 1 1 21 21 GLY CA C 21 46.710 46.710 46.799 -0.089 18222
1429 1 4 . 1 1 21 21 GLY H H 21 8.570 8.570 8.398 0.172 18222
1430 1 4 . 1 1 22 22 GLU N N 22 121.610 121.610 122.391 -0.781 18222
1431 1 4 . 1 1 22 22 GLU HA H 22 3.990 3.990 4.253 -0.263 18222
1432 1 4 . 1 1 22 22 GLU CA C 22 58.280 58.280 59.548 -1.268 18222
1433 1 4 . 1 1 22 22 GLU CB C 22 28.010 28.010 29.715 -1.705 18222
1434 1 4 . 1 1 22 22 GLU H H 22 8.100 8.100 8.440 -0.340 18222
1435 1 4 . 1 1 23 23 TYR N N 23 120.870 120.870 119.514 1.356 18222
1436 1 4 . 1 1 23 23 TYR CA C 23 60.380 60.380 61.521 -1.141 18222
1437 1 4 . 1 1 23 23 TYR CB C 23 37.750 37.750 38.187 -0.437 18222
1438 1 4 . 1 1 23 23 TYR H H 23 7.910 7.910 9.268 -1.358 18222
1439 1 4 . 1 1 24 24 ALA N N 24 121.420 121.420 121.780 -0.360 18222
1440 1 4 . 1 1 24 24 ALA HA H 24 4.140 4.140 3.959 0.181 18222
1441 1 4 . 1 1 24 24 ALA CA C 24 54.260 54.260 54.710 -0.450 18222
1442 1 4 . 1 1 24 24 ALA H H 24 8.410 8.410 8.397 0.013 18222
1443 1 4 . 1 1 25 25 ALA N N 25 120.220 120.220 122.421 -2.201 18222
1444 1 4 . 1 1 25 25 ALA CA C 25 54.370 54.370 54.786 -0.416 18222
1445 1 4 . 1 1 25 25 ALA H H 25 8.090 8.090 8.125 -0.035 18222
1446 1 4 . 1 1 26 26 CYS N N 26 116.760 116.760 117.281 -0.521 18222
1447 1 4 . 1 1 26 26 CYS CA C 26 61.180 61.180 62.984 -1.804 18222
1448 1 4 . 1 1 26 26 CYS CB C 26 26.390 26.390 27.080 -0.690 18222
1449 1 4 . 1 1 26 26 CYS H H 26 7.950 7.950 8.599 -0.649 18222
1450 1 4 . 1 1 27 27 GLN N N 27 118.690 118.690 120.475 -1.785 18222
1451 1 4 . 1 1 27 27 GLN CA C 27 55.970 55.970 58.514 -2.545 18222
1452 1 4 . 1 1 27 27 GLN H H 27 8.060 8.060 8.342 -0.282 18222
1453 1 4 . 1 1 28 28 SER N N 28 115.490 115.490 116.298 -0.808 18222
1454 1 4 . 1 1 28 28 SER HA H 28 3.990 3.990 4.079 -0.089 18222
1455 1 4 . 1 1 28 28 SER CA C 28 61.110 61.110 61.542 -0.432 18222
1456 1 4 . 1 1 28 28 SER H H 28 7.980 7.980 8.140 -0.160 18222
1457 1 4 . 1 1 29 29 HIS N N 29 120.880 120.880 122.761 -1.881 18222
1458 1 4 . 1 1 29 29 HIS CA C 29 58.190 58.190 60.104 -1.914 18222
1459 1 4 . 1 1 29 29 HIS CB C 29 27.460 27.460 30.404 -2.944 18222
1460 1 4 . 1 1 29 29 HIS H H 29 8.180 8.180 8.301 -0.121 18222
1461 1 4 . 1 1 30 30 ALA N N 30 122.920 122.920 121.248 1.672 18222
1462 1 4 . 1 1 30 30 ALA CA C 30 54.560 54.560 55.013 -0.452 18222
1463 1 4 . 1 1 30 30 ALA CB C 30 17.490 17.490 18.200 -0.710 18222
1464 1 4 . 1 1 30 30 ALA H H 30 8.040 8.040 8.294 -0.254 18222
1465 1 4 . 1 1 31 31 PHE N N 31 119.340 119.340 119.630 -0.290 18222
1466 1 4 . 1 1 31 31 PHE CA C 31 60.370 60.370 60.991 -0.621 18222
1467 1 4 . 1 1 31 31 PHE CB C 31 38.520 38.520 39.327 -0.807 18222
1468 1 4 . 1 1 31 31 PHE H H 31 8.230 8.230 8.199 0.031 18222
1469 1 4 . 1 1 32 32 MET N N 32 118.110 118.110 120.325 -2.215 18222
1470 1 4 . 1 1 32 32 MET HA H 32 4.050 4.050 3.932 0.118 18222
1471 1 4 . 1 1 32 32 MET CA C 32 58.280 58.280 59.709 -1.429 18222
1472 1 4 . 1 1 32 32 MET CB C 32 31.090 31.090 32.509 -1.419 18222
1473 1 4 . 1 1 32 32 MET H H 32 8.120 8.120 8.413 -0.293 18222
1474 1 4 . 1 1 33 33 LYS N N 33 119.040 119.040 118.654 0.386 18222
1475 1 4 . 1 1 33 33 LYS HA H 33 3.930 3.930 3.894 0.036 18222
1476 1 4 . 1 1 33 33 LYS CA C 33 59.040 59.040 59.448 -0.408 18222
1477 1 4 . 1 1 33 33 LYS CB C 33 30.990 30.990 32.257 -1.266 18222
1478 1 4 . 1 1 33 33 LYS H H 33 7.970 7.970 8.039 -0.069 18222
1479 1 4 . 1 1 34 34 GLY N N 34 108.840 108.840 107.388 1.452 18222
1480 1 4 . 1 1 34 34 GLY CA C 34 46.610 46.610 47.174 -0.564 18222
1481 1 4 . 1 1 34 34 GLY H H 34 8.030 8.030 7.995 0.035 18222
1482 1 4 . 1 1 35 35 VAL N N 35 122.910 122.910 121.993 0.917 18222
1483 1 4 . 1 1 35 35 VAL HA H 35 4.220 4.220 3.592 0.628 18222
1484 1 4 . 1 1 35 35 VAL CA C 35 66.310 66.310 65.241 1.069 18222
1485 1 4 . 1 1 35 35 VAL CB C 35 30.560 30.560 31.535 -0.975 18222
1486 1 4 . 1 1 35 35 VAL H H 35 8.090 8.090 8.088 0.002 18222
1487 1 4 . 1 1 36 36 PHE N N 36 120.020 120.020 120.758 -0.738 18222
1488 1 4 . 1 1 36 36 PHE CA C 36 61.350 61.350 61.891 -0.541 18222
1489 1 4 . 1 1 36 36 PHE CB C 36 38.090 38.090 38.588 -0.498 18222
1490 1 4 . 1 1 36 36 PHE H H 36 8.350 8.350 8.279 0.071 18222
1491 1 4 . 1 1 37 37 THR N N 37 116.980 116.980 115.985 0.995 18222
1492 1 4 . 1 1 37 37 THR HA H 37 4.050 4.050 3.910 0.140 18222
1493 1 4 . 1 1 37 37 THR CA C 37 66.000 66.000 67.476 -1.476 18222
1494 1 4 . 1 1 37 37 THR CB C 37 68.270 68.270 68.849 -0.579 18222
1495 1 4 . 1 1 37 37 THR H H 37 8.520 8.520 8.229 0.291 18222
1496 1 4 . 1 1 38 38 PHE N N 38 123.090 123.090 120.480 2.610 18222
1497 1 4 . 1 1 38 38 PHE HA H 38 4.360 4.360 4.144 0.216 18222
1498 1 4 . 1 1 38 38 PHE CA C 38 61.140 61.140 61.369 -0.229 18222
1499 1 4 . 1 1 38 38 PHE CB C 38 41.200 41.200 39.041 2.159 18222
1500 1 4 . 1 1 38 38 PHE H H 38 8.010 8.010 8.046 -0.036 18222
1501 1 4 . 1 1 39 39 VAL N N 39 117.280 117.280 119.606 -2.326 18222
1502 1 4 . 1 1 39 39 VAL HA H 39 4.210 4.210 3.706 0.504 18222
1503 1 4 . 1 1 39 39 VAL CA C 39 66.000 66.000 66.038 -0.038 18222
1504 1 4 . 1 1 39 39 VAL CB C 39 30.860 30.860 30.741 0.119 18222
1505 1 4 . 1 1 39 39 VAL H H 39 8.530 8.530 8.738 -0.208 18222
1506 1 4 . 1 1 40 40 THR N N 40 109.470 109.470 114.567 -5.097 18222
1507 1 4 . 1 1 40 40 THR HA H 40 4.060 4.060 4.062 -0.002 18222
1508 1 4 . 1 1 40 40 THR CA C 40 63.390 63.390 65.392 -2.002 18222
1509 1 4 . 1 1 40 40 THR CB C 40 68.650 68.650 68.285 0.365 18222
1510 1 4 . 1 1 40 40 THR H H 40 7.700 7.700 8.041 -0.341 18222
1511 1 4 . 1 1 41 41 GLY N N 41 110.770 110.770 108.341 2.429 18222
1512 1 4 . 1 1 41 41 GLY CA C 41 45.580 45.580 45.469 0.111 18222
1513 1 4 . 1 1 41 41 GLY H H 41 7.700 7.700 7.896 -0.196 18222
1514 1 4 . 1 1 42 42 THR N N 42 114.520 114.520 116.683 -2.163 18222
1515 1 4 . 1 1 42 42 THR CA C 42 63.300 63.300 61.191 2.109 18222
1516 1 4 . 1 1 42 42 THR CB C 42 69.490 69.490 68.684 0.806 18222
1517 1 4 . 1 1 42 42 THR H H 42 7.720 7.720 7.602 0.118 18222
1518 1 4 . 1 1 43 43 GLY N N 43 109.540 109.540 109.820 -0.280 18222
1519 1 4 . 1 1 43 43 GLY CA C 43 46.250 46.250 46.598 -0.348 18222
1520 1 4 . 1 1 43 43 GLY H H 43 8.110 8.110 7.824 0.286 18222
1521 1 4 . 1 1 44 44 MET N N 44 120.240 120.240 121.061 -0.821 18222
1522 1 4 . 1 1 44 44 MET HA H 44 4.100 4.100 4.082 0.018 18222
1523 1 4 . 1 1 44 44 MET CA C 44 57.700 57.700 58.785 -1.085 18222
1524 1 4 . 1 1 44 44 MET CB C 44 32.030 32.030 32.473 -0.443 18222
1525 1 4 . 1 1 44 44 MET H H 44 7.730 7.730 7.993 -0.263 18222
1526 1 4 . 1 1 45 45 ALA N N 45 121.560 121.560 121.127 0.433 18222
1527 1 4 . 1 1 45 45 ALA CA C 45 54.440 54.440 55.116 -0.676 18222
1528 1 4 . 1 1 45 45 ALA CB C 45 17.400 17.400 17.908 -0.508 18222
1529 1 4 . 1 1 45 45 ALA H H 45 7.950 7.950 8.233 -0.283 18222
1530 1 4 . 1 1 46 46 PHE N N 46 118.260 118.260 119.485 -1.225 18222
1531 1 4 . 1 1 46 46 PHE HA H 46 3.930 3.930 4.208 -0.278 18222
1532 1 4 . 1 1 46 46 PHE CA C 46 59.820 59.820 60.778 -0.958 18222
1533 1 4 . 1 1 46 46 PHE CB C 46 38.260 38.260 38.960 -0.700 18222
1534 1 4 . 1 1 46 46 PHE H H 46 7.860 7.860 7.925 -0.065 18222
1535 1 4 . 1 1 47 47 GLY N N 47 107.300 107.300 107.762 -0.462 18222
1536 1 4 . 1 1 47 47 GLY CA C 47 46.560 46.560 47.100 -0.540 18222
1537 1 4 . 1 1 47 47 GLY H H 47 8.200 8.200 8.462 -0.262 18222
1538 1 4 . 1 1 48 48 LEU N N 48 121.920 121.920 123.504 -1.584 18222
1539 1 4 . 1 1 48 48 LEU HA H 48 4.040 4.040 4.080 -0.040 18222
1540 1 4 . 1 1 48 48 LEU CA C 48 57.580 57.580 58.152 -0.572 18222
1541 1 4 . 1 1 48 48 LEU CB C 48 40.790 40.790 42.116 -1.326 18222
1542 1 4 . 1 1 48 48 LEU H H 48 8.180 8.180 8.391 -0.211 18222
1543 1 4 . 1 1 49 49 GLN N N 49 118.270 118.270 118.014 0.256 18222
1544 1 4 . 1 1 49 49 GLN HA H 49 3.830 3.830 3.984 -0.154 18222
1545 1 4 . 1 1 49 49 GLN CA C 49 58.880 58.880 58.450 0.430 18222
1546 1 4 . 1 1 49 49 GLN CB C 49 27.240 27.240 28.327 -1.087 18222
1547 1 4 . 1 1 49 49 GLN H H 49 8.080 8.080 8.308 -0.228 18222
1548 1 4 . 1 1 50 50 MET N N 50 117.630 117.630 121.364 -3.734 18222
1549 1 4 . 1 1 50 50 MET HA H 50 4.010 4.010 4.232 -0.222 18222
1550 1 4 . 1 1 50 50 MET CA C 50 57.730 57.730 58.408 -0.678 18222
1551 1 4 . 1 1 50 50 MET CB C 50 27.160 27.160 32.639 -5.479 18222
1552 1 4 . 1 1 50 50 MET H H 50 7.880 7.880 8.044 -0.164 18222
1553 1 4 . 1 1 51 51 PHE N N 51 119.550 119.550 119.083 0.467 18222
1554 1 4 . 1 1 51 51 PHE CA C 51 60.850 60.850 61.478 -0.628 18222
1555 1 4 . 1 1 51 51 PHE CB C 51 38.720 38.720 39.246 -0.526 18222
1556 1 4 . 1 1 51 51 PHE H H 51 7.890 7.890 8.304 -0.414 18222
1557 1 4 . 1 1 52 52 ILE N N 52 117.950 117.950 117.113 0.837 18222
1558 1 4 . 1 1 52 52 ILE HA H 52 4.050 4.050 4.005 0.045 18222
1559 1 4 . 1 1 52 52 ILE CA C 52 63.560 63.560 63.839 -0.279 18222
1560 1 4 . 1 1 52 52 ILE CB C 52 36.810 36.810 38.538 -1.728 18222
1561 1 4 . 1 1 52 52 ILE H H 52 8.110 8.110 8.102 0.008 18222
1562 1 4 . 1 1 53 53 GLN N N 53 117.360 117.360 120.330 -2.970 18222
1563 1 4 . 1 1 53 53 GLN CA C 53 57.200 57.200 58.649 -1.449 18222
1564 1 4 . 1 1 53 53 GLN CB C 53 27.870 27.870 28.414 -0.544 18222
1565 1 4 . 1 1 53 53 GLN H H 53 7.930 7.930 8.172 -0.242 18222
1566 1 4 . 1 1 54 54 ARG N N 54 116.840 116.840 118.625 -1.785 18222
1567 1 4 . 1 1 54 54 ARG HA H 54 3.950 3.950 4.218 -0.268 18222
1568 1 4 . 1 1 54 54 ARG CA C 54 56.480 56.480 58.058 -1.578 18222
1569 1 4 . 1 1 54 54 ARG CB C 54 28.970 28.970 30.024 -1.054 18222
1570 1 4 . 1 1 54 54 ARG H H 54 7.540 7.540 7.887 -0.347 18222
1571 1 4 . 1 1 55 55 LYS N N 55 117.900 117.900 117.350 0.550 18222
1572 1 4 . 1 1 55 55 LYS HA H 55 4.080 4.080 4.265 -0.185 18222
1573 1 4 . 1 1 55 55 LYS CA C 55 55.030 55.030 57.496 -2.466 18222
1574 1 4 . 1 1 55 55 LYS CB C 55 32.010 32.010 32.892 -0.882 18222
1575 1 4 . 1 1 55 55 LYS H H 55 7.660 7.660 7.386 0.274 18222
1576 1 4 . 1 1 56 56 PHE N N 56 121.060 121.060 120.299 0.761 18222
1577 1 4 . 1 1 56 56 PHE CA C 56 55.190 55.190 55.575 -0.385 18222
1578 1 4 . 1 1 56 56 PHE CB C 56 38.970 38.970 39.873 -0.903 18222
1579 1 4 . 1 1 56 56 PHE H H 56 8.080 8.080 7.910 0.170 18222
1580 1 4 . 1 1 57 57 PRO CA C 57 62.390 62.390 63.793 -1.403 18222
1581 1 4 . 1 1 57 57 PRO CB C 57 30.580 30.580 32.000 -1.420 18222
1582 1 4 . 1 1 58 58 TYR N N 58 120.240 120.240 120.237 0.003 18222
1583 1 4 . 1 1 58 58 TYR CA C 58 55.770 55.770 55.027 0.743 18222
1584 1 4 . 1 1 58 58 TYR CB C 58 40.220 40.220 39.828 0.392 18222
1585 1 4 . 1 1 58 58 TYR H H 58 7.700 7.700 7.928 -0.228 18222
1586 1 4 . 1 1 59 59 PRO CA C 59 62.130 62.130 63.789 -1.659 18222
1587 1 4 . 1 1 59 59 PRO CB C 59 33.340 33.340 32.221 1.119 18222
1588 1 4 . 1 1 60 60 LEU N N 60 122.210 122.210 114.228 7.982 18222
1589 1 4 . 1 1 60 60 LEU CA C 60 54.250 54.250 53.593 0.657 18222
1590 1 4 . 1 1 60 60 LEU CB C 60 41.470 41.470 43.434 -1.964 18222
1591 1 4 . 1 1 60 60 LEU H H 60 7.880 7.880 7.642 0.238 18222
1592 1 4 . 1 1 61 61 GLN N N 61 122.470 122.470 122.060 0.410 18222
1593 1 4 . 1 1 61 61 GLN CA C 61 54.170 54.170 55.002 -0.832 18222
1594 1 4 . 1 1 61 61 GLN H H 61 7.970 7.970 8.490 -0.520 18222
1595 1 4 . 1 1 62 62 TRP N N 62 124.590 124.590 123.711 0.879 18222
1596 1 4 . 1 1 62 62 TRP CA C 62 59.830 59.830 60.257 -0.427 18222
1597 1 4 . 1 1 62 62 TRP CB C 62 28.800 28.800 29.265 -0.465 18222
1598 1 4 . 1 1 62 62 TRP H H 62 8.240 8.240 8.904 -0.664 18222
1599 1 4 . 1 1 63 63 SER N N 63 113.320 113.320 114.740 -1.420 18222
1600 1 4 . 1 1 63 63 SER CA C 63 61.100 61.100 62.557 -1.457 18222
1601 1 4 . 1 1 63 63 SER H H 63 8.410 8.410 7.806 0.604 18222
1602 1 4 . 1 1 64 64 LEU N N 64 123.230 123.230 121.223 2.007 18222
1603 1 4 . 1 1 64 64 LEU CA C 64 56.880 56.880 57.615 -0.735 18222
1604 1 4 . 1 1 64 64 LEU CB C 64 40.830 40.830 41.086 -0.256 18222
1605 1 4 . 1 1 64 64 LEU H H 64 7.230 7.230 8.066 -0.836 18222
1606 1 4 . 1 1 65 65 LEU N N 65 119.400 119.400 120.527 -1.127 18222
1607 1 4 . 1 1 65 65 LEU HA H 65 3.890 3.890 4.065 -0.175 18222
1608 1 4 . 1 1 65 65 LEU CA C 65 57.580 57.580 58.114 -0.534 18222
1609 1 4 . 1 1 65 65 LEU CB C 65 40.710 40.710 41.864 -1.154 18222
1610 1 4 . 1 1 65 65 LEU H H 65 7.510 7.510 8.629 -1.119 18222
1611 1 4 . 1 1 66 66 VAL N N 66 116.950 116.950 119.269 -2.319 18222
1612 1 4 . 1 1 66 66 VAL HA H 66 3.960 3.960 3.502 0.458 18222
1613 1 4 . 1 1 66 66 VAL CA C 66 66.260 66.260 66.686 -0.426 18222
1614 1 4 . 1 1 66 66 VAL CB C 66 30.570 30.570 31.318 -0.748 18222
1615 1 4 . 1 1 66 66 VAL H H 66 7.950 7.950 8.137 -0.187 18222
1616 1 4 . 1 1 67 67 ALA N N 67 120.650 120.650 122.487 -1.837 18222
1617 1 4 . 1 1 67 67 ALA HA H 67 4.000 4.000 4.070 -0.070 18222
1618 1 4 . 1 1 67 67 ALA CA C 67 54.780 54.780 55.146 -0.366 18222
1619 1 4 . 1 1 67 67 ALA CB C 67 17.440 17.440 18.257 -0.817 18222
1620 1 4 . 1 1 67 67 ALA H H 67 7.450 7.450 7.880 -0.430 18222
1621 1 4 . 1 1 68 68 VAL N N 68 118.440 118.440 118.474 -0.034 18222
1622 1 4 . 1 1 68 68 VAL HA H 68 3.750 3.750 3.536 0.214 18222
1623 1 4 . 1 1 68 68 VAL CA C 68 65.250 65.250 67.205 -1.955 18222
1624 1 4 . 1 1 68 68 VAL CB C 68 30.850 30.850 32.171 -1.321 18222
1625 1 4 . 1 1 68 68 VAL H H 68 7.960 7.960 7.817 0.143 18222
1626 1 4 . 1 1 69 69 VAL N N 69 120.800 120.800 119.827 0.973 18222
1627 1 4 . 1 1 69 69 VAL HA H 69 4.220 4.220 3.529 0.691 18222
1628 1 4 . 1 1 69 69 VAL CA C 69 66.020 66.020 67.050 -1.030 18222
1629 1 4 . 1 1 69 69 VAL CB C 69 30.850 30.850 31.439 -0.589 18222
1630 1 4 . 1 1 69 69 VAL H H 69 8.080 8.080 8.432 -0.352 18222
1631 1 4 . 1 1 70 70 ALA N N 70 121.740 121.740 120.923 0.817 18222
1632 1 4 . 1 1 70 70 ALA HA H 70 3.920 3.920 4.126 -0.206 18222
1633 1 4 . 1 1 70 70 ALA CA C 70 54.920 54.920 55.470 -0.550 18222
1634 1 4 . 1 1 70 70 ALA CB C 70 17.620 17.620 18.040 -0.420 18222
1635 1 4 . 1 1 70 70 ALA H H 70 8.660 8.660 8.552 0.108 18222
1636 1 4 . 1 1 71 71 GLY N N 71 103.450 103.450 106.164 -2.714 18222
1637 1 4 . 1 1 71 71 GLY CA C 71 46.300 46.300 46.980 -0.680 18222
1638 1 4 . 1 1 71 71 GLY H H 71 8.010 8.010 8.184 -0.174 18222
1639 1 4 . 1 1 72 72 SER N N 72 118.160 118.160 117.462 0.698 18222
1640 1 4 . 1 1 72 72 SER CA C 72 61.260 61.260 61.536 -0.277 18222
1641 1 4 . 1 1 72 72 SER CB C 72 62.870 62.870 62.862 0.008 18222
1642 1 4 . 1 1 72 72 SER H H 72 7.870 7.870 7.838 0.032 18222
1643 1 4 . 1 1 73 73 VAL N N 73 121.340 121.340 122.755 -1.415 18222
1644 1 4 . 1 1 73 73 VAL CA C 73 65.750 65.750 66.046 -0.296 18222
1645 1 4 . 1 1 73 73 VAL CB C 73 30.740 30.740 31.986 -1.246 18222
1646 1 4 . 1 1 73 73 VAL H H 73 8.050 8.050 8.044 0.006 18222
1647 1 4 . 1 1 74 74 VAL N N 74 118.680 118.680 119.182 -0.502 18222
1648 1 4 . 1 1 74 74 VAL CA C 74 65.770 65.770 66.961 -1.191 18222
1649 1 4 . 1 1 74 74 VAL CB C 74 30.740 30.740 31.391 -0.651 18222
1650 1 4 . 1 1 74 74 VAL H H 74 7.880 7.880 8.676 -0.796 18222
1651 1 4 . 1 1 75 75 SER N N 75 114.750 114.750 116.300 -1.550 18222
1652 1 4 . 1 1 75 75 SER HA H 75 4.100 4.100 4.244 -0.144 18222
1653 1 4 . 1 1 75 75 SER CA C 75 60.870 60.870 61.954 -1.084 18222
1654 1 4 . 1 1 75 75 SER CB C 75 62.340 62.340 62.879 -0.539 18222
1655 1 4 . 1 1 75 75 SER H H 75 7.870 7.870 7.937 -0.067 18222
1656 1 4 . 1 1 76 76 TYR N N 76 121.110 121.110 122.734 -1.624 18222
1657 1 4 . 1 1 76 76 TYR CA C 76 60.050 60.050 61.103 -1.053 18222
1658 1 4 . 1 1 76 76 TYR CB C 76 37.980 37.980 38.483 -0.503 18222
1659 1 4 . 1 1 76 76 TYR H H 76 7.860 7.860 8.594 -0.734 18222
1660 1 4 . 1 1 77 77 GLY N N 77 107.300 107.300 106.819 0.481 18222
1661 1 4 . 1 1 77 77 GLY CA C 77 46.560 46.560 47.211 -0.651 18222
1662 1 4 . 1 1 77 77 GLY H H 77 8.200 8.200 8.726 -0.526 18222
1663 1 4 . 1 1 78 78 VAL N N 78 119.470 119.470 120.957 -1.487 18222
1664 1 4 . 1 1 78 78 VAL HA H 78 4.170 4.170 3.731 0.439 18222
1665 1 4 . 1 1 78 78 VAL CA C 78 64.650 64.650 65.550 -0.900 18222
1666 1 4 . 1 1 78 78 VAL H H 78 8.140 8.140 8.625 -0.485 18222
1667 1 4 . 1 1 79 79 THR N N 79 112.100 112.100 116.727 -4.627 18222
1668 1 4 . 1 1 79 79 THR CA C 79 63.460 63.460 67.444 -3.984 18222
1669 1 4 . 1 1 79 79 THR CB C 79 68.650 68.650 68.645 0.005 18222
1670 1 4 . 1 1 79 79 THR H H 79 7.640 7.640 7.979 -0.339 18222
1671 1 4 . 1 1 80 80 ARG N N 80 120.770 120.770 121.787 -1.017 18222
1672 1 4 . 1 1 80 80 ARG HA H 80 4.160 4.160 4.000 0.160 18222
1673 1 4 . 1 1 80 80 ARG CA C 80 56.790 56.790 59.768 -2.978 18222
1674 1 4 . 1 1 80 80 ARG CB C 80 29.430 29.430 30.157 -0.727 18222
1675 1 4 . 1 1 80 80 ARG H H 80 7.680 7.680 7.935 -0.255 18222
1676 1 4 . 1 1 81 81 VAL N N 81 118.370 118.370 119.444 -1.074 18222
1677 1 4 . 1 1 81 81 VAL HA H 81 3.920 3.920 3.566 0.354 18222
1678 1 4 . 1 1 81 81 VAL CA C 81 63.340 63.340 67.391 -4.051 18222
1679 1 4 . 1 1 81 81 VAL CB C 81 31.260 31.260 31.820 -0.560 18222
1680 1 4 . 1 1 81 81 VAL H H 81 7.730 7.730 8.239 -0.509 18222
1681 1 4 . 1 1 82 82 GLU N N 82 120.620 120.620 119.269 1.351 18222
1682 1 4 . 1 1 82 82 GLU CA C 82 56.320 56.320 59.371 -3.051 18222
1683 1 4 . 1 1 82 82 GLU CB C 82 27.930 27.930 28.623 -0.694 18222
1684 1 4 . 1 1 82 82 GLU H H 82 7.920 7.920 8.523 -0.603 18222
1685 1 4 . 1 1 83 83 SER N N 83 116.240 116.240 117.066 -0.826 18222
1686 1 4 . 1 1 83 83 SER CA C 83 59.250 59.250 62.097 -2.847 18222
1687 1 4 . 1 1 83 83 SER CB C 83 63.160 63.160 62.897 0.263 18222
1688 1 4 . 1 1 83 83 SER H H 83 7.960 7.960 7.840 0.120 18222
1689 1 4 . 1 1 84 84 GLU N N 84 123.280 123.280 121.272 2.008 18222
1690 1 4 . 1 1 84 84 GLU HA H 84 4.080 4.080 3.938 0.142 18222
1691 1 4 . 1 1 84 84 GLU CA C 84 57.860 57.860 59.546 -1.686 18222
1692 1 4 . 1 1 84 84 GLU CB C 84 28.190 28.190 29.611 -1.421 18222
1693 1 4 . 1 1 84 84 GLU H H 84 8.470 8.470 7.966 0.504 18222
1694 1 4 . 1 1 85 85 LYS N N 85 118.650 118.650 119.222 -0.572 18222
1695 1 4 . 1 1 85 85 LYS HA H 85 4.100 4.100 4.003 0.097 18222
1696 1 4 . 1 1 85 85 LYS CA C 85 57.780 57.780 59.133 -1.353 18222
1697 1 4 . 1 1 85 85 LYS CB C 85 31.380 31.380 32.264 -0.884 18222
1698 1 4 . 1 1 85 85 LYS H H 85 7.940 7.940 8.074 -0.134 18222
1699 1 4 . 1 1 86 86 CYS N N 86 117.070 117.070 118.314 -1.244 18222
1700 1 4 . 1 1 86 86 CYS CA C 86 60.910 60.910 63.493 -2.583 18222
1701 1 4 . 1 1 86 86 CYS CB C 86 26.740 26.740 26.443 0.297 18222
1702 1 4 . 1 1 86 86 CYS H H 86 7.840 7.840 7.981 -0.141 18222
1703 1 4 . 1 1 87 87 ASN N N 87 119.370 119.370 118.934 0.436 18222
1704 1 4 . 1 1 87 87 ASN HA H 87 4.130 4.130 4.421 -0.291 18222
1705 1 4 . 1 1 87 87 ASN CA C 87 55.750 55.750 56.924 -1.174 18222
1706 1 4 . 1 1 87 87 ASN CB C 87 38.050 38.050 38.483 -0.433 18222
1707 1 4 . 1 1 87 87 ASN H H 87 8.110 8.110 8.270 -0.160 18222
1708 1 4 . 1 1 88 88 ASN N N 88 117.570 117.570 119.175 -1.605 18222
1709 1 4 . 1 1 88 88 ASN HA H 88 4.280 4.280 4.443 -0.163 18222
1710 1 4 . 1 1 88 88 ASN CA C 88 55.190 55.190 56.247 -1.057 18222
1711 1 4 . 1 1 88 88 ASN CB C 88 37.400 37.400 38.394 -0.994 18222
1712 1 4 . 1 1 88 88 ASN H H 88 8.280 8.280 8.284 -0.004 18222
1713 1 4 . 1 1 89 89 LEU N N 89 121.940 121.940 122.457 -0.517 18222
1714 1 4 . 1 1 89 89 LEU HA H 89 4.070 4.070 3.825 0.245 18222
1715 1 4 . 1 1 89 89 LEU CA C 89 57.580 57.580 58.793 -1.213 18222
1716 1 4 . 1 1 89 89 LEU CB C 89 40.490 40.490 41.992 -1.502 18222
1717 1 4 . 1 1 89 89 LEU H H 89 7.790 7.790 8.303 -0.513 18222
1718 1 4 . 1 1 90 90 TRP N N 90 119.220 119.220 120.160 -0.940 18222
1719 1 4 . 1 1 90 90 TRP CA C 90 59.120 59.120 60.500 -1.380 18222
1720 1 4 . 1 1 90 90 TRP CB C 90 28.800 28.800 29.950 -1.150 18222
1721 1 4 . 1 1 90 90 TRP H H 90 7.850 7.850 8.220 -0.370 18222
1722 1 4 . 1 1 91 91 LEU N N 91 117.870 117.870 119.773 -1.903 18222
1723 1 4 . 1 1 91 91 LEU CA C 91 57.300 57.300 58.730 -1.430 18222
1724 1 4 . 1 1 91 91 LEU CB C 91 40.610 40.610 41.939 -1.329 18222
1725 1 4 . 1 1 91 91 LEU H H 91 7.920 7.920 8.357 -0.437 18222
1726 1 4 . 1 1 92 92 PHE N N 92 121.280 121.280 118.039 3.241 18222
1727 1 4 . 1 1 92 92 PHE CA C 92 60.390 60.390 59.839 0.551 18222
1728 1 4 . 1 1 92 92 PHE CB C 92 37.980 37.980 38.322 -0.342 18222
1729 1 4 . 1 1 92 92 PHE H H 92 7.860 7.860 8.643 -0.783 18222
1730 1 4 . 1 1 93 93 LEU N N 93 119.860 119.860 120.470 -0.610 18222
1731 1 4 . 1 1 93 93 LEU CA C 93 56.860 56.860 57.307 -0.447 18222
1732 1 4 . 1 1 93 93 LEU CB C 93 40.550 40.550 41.221 -0.671 18222
1733 1 4 . 1 1 93 93 LEU H H 93 7.980 7.980 8.547 -0.567 18222
1734 1 4 . 1 1 94 94 GLU N N 94 114.660 114.660 116.365 -1.705 18222
1735 1 4 . 1 1 94 94 GLU HA H 94 3.810 3.810 4.061 -0.251 18222
1736 1 4 . 1 1 94 94 GLU CA C 94 57.210 57.210 58.330 -1.120 18222
1737 1 4 . 1 1 94 94 GLU CB C 94 28.470 28.470 29.598 -1.128 18222
1738 1 4 . 1 1 94 94 GLU H H 94 7.890 7.890 8.122 -0.232 18222
1739 1 4 . 1 1 95 95 THR N N 95 108.260 108.260 111.713 -3.453 18222
1740 1 4 . 1 1 95 95 THR CA C 95 62.150 62.150 62.223 -0.073 18222
1741 1 4 . 1 1 95 95 THR CB C 95 70.810 70.810 69.711 1.099 18222
1742 1 4 . 1 1 95 95 THR H H 95 7.690 7.690 7.444 0.246 18222
1743 1 4 . 1 1 96 96 GLY N N 96 112.220 112.220 108.715 3.505 18222
1744 1 4 . 1 1 96 96 GLY CA C 96 45.410 45.410 44.681 0.729 18222
1745 1 4 . 1 1 96 96 GLY H H 96 8.240 8.240 7.562 0.678 18222
1746 1 4 . 1 1 97 97 GLN N N 97 117.950 117.950 119.683 -1.733 18222
1747 1 4 . 1 1 97 97 GLN HA H 97 4.200 4.200 4.057 0.143 18222
1748 1 4 . 1 1 97 97 GLN CA C 97 54.430 54.430 56.678 -2.248 18222
1749 1 4 . 1 1 97 97 GLN CB C 97 29.910 29.910 29.404 0.506 18222
1750 1 4 . 1 1 97 97 GLN H H 97 7.640 7.640 8.103 -0.463 18222
1751 1 4 . 1 1 98 98 LEU N N 98 123.810 123.810 122.178 1.632 18222
1752 1 4 . 1 1 98 98 LEU HA H 98 4.360 4.360 4.214 0.146 18222
1753 1 4 . 1 1 98 98 LEU CA C 98 52.650 52.650 55.261 -2.611 18222
1754 1 4 . 1 1 98 98 LEU CB C 98 40.460 40.460 41.474 -1.014 18222
1755 1 4 . 1 1 98 98 LEU H H 98 8.270 8.270 8.429 -0.159 18222
1756 1 4 . 1 1 99 99 PRO CA C 99 63.180 63.180 62.478 0.702 18222
1757 1 4 . 1 1 99 99 PRO CB C 99 30.840 30.840 32.393 -1.553 18222
1758 1 4 . 1 1 100 100 LYS N N 100 120.630 120.630 120.097 0.533 18222
1759 1 4 . 1 1 100 100 LYS CA C 100 55.730 55.730 55.607 0.123 18222
1760 1 4 . 1 1 100 100 LYS CB C 100 32.280 32.280 34.610 -2.330 18222
1761 1 4 . 1 1 100 100 LYS H H 100 8.090 8.090 8.184 -0.094 18222
1762 1 4 . 1 1 101 101 ASP N N 101 120.920 120.920 123.989 -3.069 18222
1763 1 4 . 1 1 101 101 ASP HA H 101 4.190 4.190 4.581 -0.391 18222
1764 1 4 . 1 1 101 101 ASP CA C 101 54.000 54.000 55.366 -1.366 18222
1765 1 4 . 1 1 101 101 ASP CB C 101 40.330 40.330 41.171 -0.841 18222
1766 1 4 . 1 1 101 101 ASP H H 101 8.190 8.190 8.269 -0.079 18222
1767 1 4 . 1 1 102 102 ARG N N 102 122.210 122.210 122.915 -0.705 18222
1768 1 4 . 1 1 102 102 ARG CA C 102 55.590 55.590 55.349 0.241 18222
1769 1 4 . 1 1 102 102 ARG CB C 102 29.630 29.630 32.280 -2.650 18222
1770 1 4 . 1 1 102 102 ARG H H 102 8.130 8.130 8.577 -0.447 18222
1771 1 4 . 1 1 103 103 SER N N 103 117.230 117.230 115.570 1.660 18222
1772 1 4 . 1 1 103 103 SER HA H 103 4.280 4.280 5.034 -0.754 18222
1773 1 4 . 1 1 103 103 SER CA C 103 58.470 58.470 57.848 0.622 18222
1774 1 4 . 1 1 103 103 SER CB C 103 63.080 63.080 65.368 -2.288 18222
1775 1 4 . 1 1 103 103 SER H H 103 8.290 8.290 8.579 -0.289 18222
1776 1 4 . 1 1 104 104 THR N N 104 115.430 115.430 116.801 -1.371 18222
1777 1 4 . 1 1 104 104 THR CA C 104 61.570 61.570 62.252 -0.682 18222
1778 1 4 . 1 1 104 104 THR CB C 104 69.030 69.030 70.289 -1.259 18222
1779 1 4 . 1 1 104 104 THR H H 104 8.020 8.020 8.347 -0.327 18222
1780 1 4 . 1 1 105 105 ASP N N 105 122.780 122.780 122.299 0.481 18222
1781 1 4 . 1 1 105 105 ASP CA C 105 54.210 54.210 53.541 0.669 18222
1782 1 4 . 1 1 105 105 ASP CB C 105 40.380 40.380 42.077 -1.697 18222
1783 1 4 . 1 1 105 105 ASP H H 105 8.120 8.120 8.431 -0.311 18222
1784 1 4 . 1 1 106 106 GLN N N 106 120.960 120.960 119.115 1.845 18222
1785 1 4 . 1 1 106 106 GLN CA C 106 55.420 55.420 55.317 0.103 18222
1786 1 4 . 1 1 106 106 GLN CB C 106 28.310 28.310 29.690 -1.380 18222
1787 1 4 . 1 1 106 106 GLN H H 106 8.140 8.140 8.353 -0.213 18222
1788 1 4 . 1 1 107 107 ARG N N 107 123.010 123.010 119.882 3.128 18222
1789 1 4 . 1 1 107 107 ARG HA H 107 4.210 4.210 4.571 -0.361 18222
1790 1 4 . 1 1 107 107 ARG CA C 107 55.560 55.560 55.682 -0.122 18222
1791 1 4 . 1 1 107 107 ARG CB C 107 29.920 29.920 31.427 -1.507 18222
1792 1 4 . 1 1 107 107 ARG H H 107 8.180 8.180 8.501 -0.321 18222
1793 1 5 . 1 1 2 2 VAL N N 2 121.590 121.590 123.466 -1.876 18222
1794 1 5 . 1 1 2 2 VAL CA C 2 61.600 61.600 62.546 -0.946 18222
1795 1 5 . 1 1 2 2 VAL CB C 2 31.900 31.900 32.820 -0.920 18222
1796 1 5 . 1 1 2 2 VAL H H 2 8.010 8.010 8.406 -0.396 18222
1797 1 5 . 1 1 3 3 ASN N N 3 122.520 122.520 124.561 -2.041 18222
1798 1 5 . 1 1 3 3 ASN HA H 3 4.020 4.020 4.794 -0.774 18222
1799 1 5 . 1 1 3 3 ASN CA C 3 52.640 52.640 53.362 -0.722 18222
1800 1 5 . 1 1 3 3 ASN CB C 3 38.330 38.330 38.865 -0.535 18222
1801 1 5 . 1 1 3 3 ASN H H 3 8.360 8.360 8.668 -0.308 18222
1802 1 5 . 1 1 4 4 LEU N N 4 123.830 123.830 119.412 4.418 18222
1803 1 5 . 1 1 4 4 LEU HA H 4 4.220 4.220 4.043 0.177 18222
1804 1 5 . 1 1 4 4 LEU CA C 4 54.620 54.620 56.776 -2.156 18222
1805 1 5 . 1 1 4 4 LEU CB C 4 41.680 41.680 41.618 0.062 18222
1806 1 5 . 1 1 4 4 LEU H H 4 8.220 8.220 8.324 -0.104 18222
1807 1 5 . 1 1 5 5 GLY N N 5 106.810 106.810 106.453 0.357 18222
1808 1 5 . 1 1 5 5 GLY CA C 5 45.800 45.800 45.015 0.785 18222
1809 1 5 . 1 1 5 5 GLY H H 5 8.030 8.030 8.201 -0.171 18222
1810 1 5 . 1 1 6 6 LEU N N 6 120.820 120.820 123.513 -2.693 18222
1811 1 5 . 1 1 6 6 LEU HA H 6 4.050 4.050 4.454 -0.404 18222
1812 1 5 . 1 1 6 6 LEU CA C 6 55.990 55.990 55.219 0.771 18222
1813 1 5 . 1 1 6 6 LEU CB C 6 40.800 40.800 42.545 -1.745 18222
1814 1 5 . 1 1 6 6 LEU H H 6 8.030 8.030 8.341 -0.311 18222
1815 1 5 . 1 1 7 7 SER N N 7 115.540 115.540 116.702 -1.162 18222
1816 1 5 . 1 1 7 7 SER HA H 7 4.100 4.100 4.290 -0.190 18222
1817 1 5 . 1 1 7 7 SER CA C 7 60.580 60.580 61.835 -1.255 18222
1818 1 5 . 1 1 7 7 SER CB C 7 62.060 62.060 62.815 -0.755 18222
1819 1 5 . 1 1 7 7 SER H H 7 8.360 8.360 8.469 -0.109 18222
1820 1 5 . 1 1 8 8 ARG N N 8 120.690 120.690 120.311 0.379 18222
1821 1 5 . 1 1 8 8 ARG HA H 8 4.160 4.160 4.118 0.042 18222
1822 1 5 . 1 1 8 8 ARG CA C 8 57.350 57.350 59.431 -2.080 18222
1823 1 5 . 1 1 8 8 ARG CB C 8 29.230 29.230 30.029 -0.799 18222
1824 1 5 . 1 1 8 8 ARG H H 8 7.830 7.830 8.385 -0.555 18222
1825 1 5 . 1 1 9 9 VAL N N 9 119.330 119.330 119.583 -0.253 18222
1826 1 5 . 1 1 9 9 VAL HA H 9 4.170 4.170 3.737 0.433 18222
1827 1 5 . 1 1 9 9 VAL CA C 9 64.720 64.720 66.885 -2.165 18222
1828 1 5 . 1 1 9 9 VAL CB C 9 30.900 30.900 31.755 -0.855 18222
1829 1 5 . 1 1 9 9 VAL H H 9 7.620 7.620 7.758 -0.138 18222
1830 1 5 . 1 1 10 10 ASP N N 10 119.520 119.520 119.555 -0.035 18222
1831 1 5 . 1 1 10 10 ASP CA C 10 54.960 54.960 57.534 -2.574 18222
1832 1 5 . 1 1 10 10 ASP CB C 10 37.800 37.800 40.800 -3.000 18222
1833 1 5 . 1 1 10 10 ASP H H 10 8.180 8.180 8.124 0.056 18222
1834 1 5 . 1 1 11 11 ASP N N 11 121.550 121.550 120.024 1.526 18222
1835 1 5 . 1 1 11 11 ASP CA C 11 54.440 54.440 56.761 -2.321 18222
1836 1 5 . 1 1 11 11 ASP CB C 11 37.840 37.840 40.842 -3.002 18222
1837 1 5 . 1 1 11 11 ASP H H 11 7.950 7.950 8.246 -0.296 18222
1838 1 5 . 1 1 12 12 ALA N N 12 120.220 120.220 122.836 -2.616 18222
1839 1 5 . 1 1 12 12 ALA CA C 12 54.370 54.370 55.175 -0.805 18222
1840 1 5 . 1 1 12 12 ALA CB C 12 24.730 24.730 18.506 6.224 18222
1841 1 5 . 1 1 12 12 ALA H H 12 8.090 8.090 7.808 0.282 18222
1842 1 5 . 1 1 13 13 VAL N N 13 116.910 116.910 118.437 -1.527 18222
1843 1 5 . 1 1 13 13 VAL HA H 13 4.140 4.140 3.738 0.402 18222
1844 1 5 . 1 1 13 13 VAL CA C 13 64.900 64.900 65.206 -0.306 18222
1845 1 5 . 1 1 13 13 VAL CB C 13 31.000 31.000 31.737 -0.737 18222
1846 1 5 . 1 1 13 13 VAL H H 13 7.980 7.980 8.204 -0.224 18222
1847 1 5 . 1 1 14 14 ALA N N 14 122.200 122.200 122.986 -0.786 18222
1848 1 5 . 1 1 14 14 ALA HA H 14 4.020 4.020 4.015 0.005 18222
1849 1 5 . 1 1 14 14 ALA CA C 14 53.800 53.800 55.022 -1.222 18222
1850 1 5 . 1 1 14 14 ALA CB C 14 17.790 17.790 18.481 -0.691 18222
1851 1 5 . 1 1 14 14 ALA H H 14 8.030 8.030 7.805 0.225 18222
1852 1 5 . 1 1 15 15 ALA N N 15 118.600 118.600 118.444 0.156 18222
1853 1 5 . 1 1 15 15 ALA CA C 15 53.230 53.230 54.023 -0.793 18222
1854 1 5 . 1 1 15 15 ALA CB C 15 18.010 18.010 18.805 -0.795 18222
1855 1 5 . 1 1 15 15 ALA H H 15 7.530 7.530 7.754 -0.224 18222
1856 1 5 . 1 1 16 16 LYS N N 16 115.820 115.820 117.171 -1.351 18222
1857 1 5 . 1 1 16 16 LYS HA H 16 4.080 4.080 4.246 -0.166 18222
1858 1 5 . 1 1 16 16 LYS CA C 16 55.670 55.670 57.128 -1.458 18222
1859 1 5 . 1 1 16 16 LYS CB C 16 32.640 32.640 33.027 -0.387 18222
1860 1 5 . 1 1 16 16 LYS H H 16 7.490 7.490 7.674 -0.184 18222
1861 1 5 . 1 1 17 17 HIS N N 17 116.790 116.790 119.064 -2.274 18222
1862 1 5 . 1 1 17 17 HIS HA H 17 4.100 4.100 4.770 -0.670 18222
1863 1 5 . 1 1 17 17 HIS CA C 17 52.820 52.820 54.413 -1.593 18222
1864 1 5 . 1 1 17 17 HIS CB C 17 28.400 28.400 30.862 -2.462 18222
1865 1 5 . 1 1 17 17 HIS H H 17 8.130 8.130 7.882 0.248 18222
1866 1 5 . 1 1 18 18 PRO CA C 18 63.800 63.800 63.084 0.716 18222
1867 1 5 . 1 1 18 18 PRO CB C 18 30.800 30.800 31.842 -1.042 18222
1868 1 5 . 1 1 19 19 GLY N N 19 110.260 110.260 111.102 -0.842 18222
1869 1 5 . 1 1 19 19 GLY CA C 19 45.490 45.490 45.461 0.029 18222
1870 1 5 . 1 1 19 19 GLY H H 19 8.730 8.730 8.304 0.426 18222
1871 1 5 . 1 1 20 20 LEU N N 20 122.650 122.650 122.311 0.339 18222
1872 1 5 . 1 1 20 20 LEU HA H 20 4.090 4.090 4.192 -0.102 18222
1873 1 5 . 1 1 20 20 LEU CA C 20 57.060 57.060 57.966 -0.906 18222
1874 1 5 . 1 1 20 20 LEU H H 20 7.980 7.980 8.200 -0.220 18222
1875 1 5 . 1 1 21 21 GLY N N 21 107.000 107.000 106.557 0.443 18222
1876 1 5 . 1 1 21 21 GLY CA C 21 46.710 46.710 47.338 -0.628 18222
1877 1 5 . 1 1 21 21 GLY H H 21 8.570 8.570 8.642 -0.072 18222
1878 1 5 . 1 1 22 22 GLU N N 22 121.610 121.610 121.835 -0.225 18222
1879 1 5 . 1 1 22 22 GLU HA H 22 3.990 3.990 4.127 -0.137 18222
1880 1 5 . 1 1 22 22 GLU CA C 22 58.280 58.280 59.460 -1.180 18222
1881 1 5 . 1 1 22 22 GLU CB C 22 28.010 28.010 29.384 -1.375 18222
1882 1 5 . 1 1 22 22 GLU H H 22 8.100 8.100 8.353 -0.253 18222
1883 1 5 . 1 1 23 23 TYR N N 23 120.870 120.870 121.120 -0.250 18222
1884 1 5 . 1 1 23 23 TYR CA C 23 60.380 60.380 61.558 -1.178 18222
1885 1 5 . 1 1 23 23 TYR CB C 23 37.750 37.750 38.514 -0.764 18222
1886 1 5 . 1 1 23 23 TYR H H 23 7.910 7.910 7.852 0.058 18222
1887 1 5 . 1 1 24 24 ALA N N 24 121.420 121.420 121.014 0.406 18222
1888 1 5 . 1 1 24 24 ALA HA H 24 4.140 4.140 3.988 0.152 18222
1889 1 5 . 1 1 24 24 ALA CA C 24 54.260 54.260 55.294 -1.034 18222
1890 1 5 . 1 1 24 24 ALA H H 24 8.410 8.410 8.970 -0.560 18222
1891 1 5 . 1 1 25 25 ALA N N 25 120.220 120.220 122.371 -2.151 18222
1892 1 5 . 1 1 25 25 ALA CA C 25 54.370 54.370 54.950 -0.580 18222
1893 1 5 . 1 1 25 25 ALA H H 25 8.090 8.090 8.319 -0.229 18222
1894 1 5 . 1 1 26 26 CYS N N 26 116.760 116.760 117.361 -0.601 18222
1895 1 5 . 1 1 26 26 CYS CA C 26 61.180 61.180 62.541 -1.361 18222
1896 1 5 . 1 1 26 26 CYS CB C 26 26.390 26.390 27.148 -0.758 18222
1897 1 5 . 1 1 26 26 CYS H H 26 7.950 7.950 8.129 -0.179 18222
1898 1 5 . 1 1 27 27 GLN N N 27 118.690 118.690 120.719 -2.029 18222
1899 1 5 . 1 1 27 27 GLN CA C 27 55.970 55.970 58.787 -2.817 18222
1900 1 5 . 1 1 27 27 GLN H H 27 8.060 8.060 8.148 -0.088 18222
1901 1 5 . 1 1 28 28 SER N N 28 115.490 115.490 115.566 -0.076 18222
1902 1 5 . 1 1 28 28 SER HA H 28 3.990 3.990 4.205 -0.215 18222
1903 1 5 . 1 1 28 28 SER CA C 28 61.110 61.110 62.327 -1.217 18222
1904 1 5 . 1 1 28 28 SER H H 28 7.980 7.980 8.495 -0.515 18222
1905 1 5 . 1 1 29 29 HIS N N 29 120.880 120.880 120.758 0.122 18222
1906 1 5 . 1 1 29 29 HIS CA C 29 58.190 58.190 59.602 -1.413 18222
1907 1 5 . 1 1 29 29 HIS CB C 29 27.460 27.460 30.213 -2.753 18222
1908 1 5 . 1 1 29 29 HIS H H 29 8.180 8.180 8.310 -0.130 18222
1909 1 5 . 1 1 30 30 ALA N N 30 122.920 122.920 122.709 0.211 18222
1910 1 5 . 1 1 30 30 ALA CA C 30 54.560 54.560 55.354 -0.794 18222
1911 1 5 . 1 1 30 30 ALA CB C 30 17.490 17.490 18.328 -0.838 18222
1912 1 5 . 1 1 30 30 ALA H H 30 8.040 8.040 8.055 -0.015 18222
1913 1 5 . 1 1 31 31 PHE N N 31 119.340 119.340 119.825 -0.485 18222
1914 1 5 . 1 1 31 31 PHE CA C 31 60.370 60.370 61.713 -1.343 18222
1915 1 5 . 1 1 31 31 PHE CB C 31 38.520 38.520 39.284 -0.764 18222
1916 1 5 . 1 1 31 31 PHE H H 31 8.230 8.230 8.337 -0.107 18222
1917 1 5 . 1 1 32 32 MET N N 32 118.110 118.110 118.645 -0.535 18222
1918 1 5 . 1 1 32 32 MET HA H 32 4.050 4.050 3.875 0.175 18222
1919 1 5 . 1 1 32 32 MET CA C 32 58.280 58.280 58.089 0.191 18222
1920 1 5 . 1 1 32 32 MET CB C 32 31.090 31.090 31.913 -0.823 18222
1921 1 5 . 1 1 32 32 MET H H 32 8.120 8.120 8.682 -0.562 18222
1922 1 5 . 1 1 33 33 LYS N N 33 119.040 119.040 119.603 -0.563 18222
1923 1 5 . 1 1 33 33 LYS HA H 33 3.930 3.930 4.186 -0.256 18222
1924 1 5 . 1 1 33 33 LYS CA C 33 59.040 59.040 59.914 -0.875 18222
1925 1 5 . 1 1 33 33 LYS CB C 33 30.990 30.990 32.509 -1.519 18222
1926 1 5 . 1 1 33 33 LYS H H 33 7.970 7.970 8.374 -0.404 18222
1927 1 5 . 1 1 34 34 GLY N N 34 108.840 108.840 107.944 0.896 18222
1928 1 5 . 1 1 34 34 GLY CA C 34 46.610 46.610 47.186 -0.576 18222
1929 1 5 . 1 1 34 34 GLY H H 34 8.030 8.030 8.177 -0.147 18222
1930 1 5 . 1 1 35 35 VAL N N 35 122.910 122.910 121.974 0.936 18222
1931 1 5 . 1 1 35 35 VAL HA H 35 4.220 4.220 3.609 0.611 18222
1932 1 5 . 1 1 35 35 VAL CA C 35 66.310 66.310 65.244 1.066 18222
1933 1 5 . 1 1 35 35 VAL CB C 35 30.560 30.560 31.634 -1.074 18222
1934 1 5 . 1 1 35 35 VAL H H 35 8.090 8.090 7.850 0.240 18222
1935 1 5 . 1 1 36 36 PHE N N 36 120.020 120.020 121.198 -1.178 18222
1936 1 5 . 1 1 36 36 PHE CA C 36 61.350 61.350 61.324 0.026 18222
1937 1 5 . 1 1 36 36 PHE CB C 36 38.090 38.090 38.628 -0.538 18222
1938 1 5 . 1 1 36 36 PHE H H 36 8.350 8.350 8.095 0.255 18222
1939 1 5 . 1 1 37 37 THR N N 37 116.980 116.980 116.629 0.351 18222
1940 1 5 . 1 1 37 37 THR HA H 37 4.050 4.050 3.329 0.721 18222
1941 1 5 . 1 1 37 37 THR CA C 37 66.000 66.000 66.601 -0.601 18222
1942 1 5 . 1 1 37 37 THR CB C 37 68.270 68.270 68.667 -0.397 18222
1943 1 5 . 1 1 37 37 THR H H 37 8.520 8.520 8.310 0.210 18222
1944 1 5 . 1 1 38 38 PHE N N 38 123.090 123.090 122.282 0.808 18222
1945 1 5 . 1 1 38 38 PHE HA H 38 4.360 4.360 4.042 0.318 18222
1946 1 5 . 1 1 38 38 PHE CA C 38 61.140 61.140 61.624 -0.484 18222
1947 1 5 . 1 1 38 38 PHE CB C 38 41.200 41.200 38.908 2.292 18222
1948 1 5 . 1 1 38 38 PHE H H 38 8.010 8.010 8.105 -0.095 18222
1949 1 5 . 1 1 39 39 VAL N N 39 117.280 117.280 119.922 -2.642 18222
1950 1 5 . 1 1 39 39 VAL HA H 39 4.210 4.210 3.769 0.441 18222
1951 1 5 . 1 1 39 39 VAL CA C 39 66.000 66.000 65.826 0.174 18222
1952 1 5 . 1 1 39 39 VAL CB C 39 30.860 30.860 31.042 -0.182 18222
1953 1 5 . 1 1 39 39 VAL H H 39 8.530 8.530 8.636 -0.106 18222
1954 1 5 . 1 1 40 40 THR N N 40 109.470 109.470 116.163 -6.693 18222
1955 1 5 . 1 1 40 40 THR HA H 40 4.060 4.060 3.979 0.081 18222
1956 1 5 . 1 1 40 40 THR CA C 40 63.390 63.390 66.064 -2.674 18222
1957 1 5 . 1 1 40 40 THR CB C 40 68.650 68.650 67.573 1.077 18222
1958 1 5 . 1 1 40 40 THR H H 40 7.700 7.700 8.123 -0.423 18222
1959 1 5 . 1 1 41 41 GLY N N 41 110.770 110.770 108.248 2.522 18222
1960 1 5 . 1 1 41 41 GLY CA C 41 45.580 45.580 46.690 -1.110 18222
1961 1 5 . 1 1 41 41 GLY H H 41 7.700 7.700 7.525 0.175 18222
1962 1 5 . 1 1 42 42 THR N N 42 114.520 114.520 116.398 -1.878 18222
1963 1 5 . 1 1 42 42 THR CA C 42 63.300 63.300 60.941 2.359 18222
1964 1 5 . 1 1 42 42 THR CB C 42 69.490 69.490 67.924 1.566 18222
1965 1 5 . 1 1 42 42 THR H H 42 7.720 7.720 7.870 -0.150 18222
1966 1 5 . 1 1 43 43 GLY N N 43 109.540 109.540 109.439 0.101 18222
1967 1 5 . 1 1 43 43 GLY CA C 43 46.250 46.250 46.625 -0.375 18222
1968 1 5 . 1 1 43 43 GLY H H 43 8.110 8.110 8.243 -0.133 18222
1969 1 5 . 1 1 44 44 MET N N 44 120.240 120.240 120.867 -0.627 18222
1970 1 5 . 1 1 44 44 MET HA H 44 4.100 4.100 3.966 0.134 18222
1971 1 5 . 1 1 44 44 MET CA C 44 57.700 57.700 59.270 -1.570 18222
1972 1 5 . 1 1 44 44 MET CB C 44 32.030 32.030 32.338 -0.308 18222
1973 1 5 . 1 1 44 44 MET H H 44 7.730 7.730 8.076 -0.346 18222
1974 1 5 . 1 1 45 45 ALA N N 45 121.560 121.560 121.088 0.472 18222
1975 1 5 . 1 1 45 45 ALA CA C 45 54.440 54.440 54.979 -0.539 18222
1976 1 5 . 1 1 45 45 ALA CB C 45 17.400 17.400 17.988 -0.588 18222
1977 1 5 . 1 1 45 45 ALA H H 45 7.950 7.950 7.907 0.043 18222
1978 1 5 . 1 1 46 46 PHE N N 46 118.260 118.260 119.578 -1.318 18222
1979 1 5 . 1 1 46 46 PHE HA H 46 3.930 3.930 4.281 -0.351 18222
1980 1 5 . 1 1 46 46 PHE CA C 46 59.820 59.820 59.756 0.064 18222
1981 1 5 . 1 1 46 46 PHE CB C 46 38.260 38.260 38.790 -0.530 18222
1982 1 5 . 1 1 46 46 PHE H H 46 7.860 7.860 8.198 -0.338 18222
1983 1 5 . 1 1 47 47 GLY N N 47 107.300 107.300 108.602 -1.302 18222
1984 1 5 . 1 1 47 47 GLY CA C 47 46.560 46.560 47.264 -0.704 18222
1985 1 5 . 1 1 47 47 GLY H H 47 8.200 8.200 8.609 -0.409 18222
1986 1 5 . 1 1 48 48 LEU N N 48 121.920 121.920 123.112 -1.192 18222
1987 1 5 . 1 1 48 48 LEU HA H 48 4.040 4.040 4.075 -0.035 18222
1988 1 5 . 1 1 48 48 LEU CA C 48 57.580 57.580 57.913 -0.333 18222
1989 1 5 . 1 1 48 48 LEU CB C 48 40.790 40.790 41.913 -1.123 18222
1990 1 5 . 1 1 48 48 LEU H H 48 8.180 8.180 8.317 -0.137 18222
1991 1 5 . 1 1 49 49 GLN N N 49 118.270 118.270 118.365 -0.095 18222
1992 1 5 . 1 1 49 49 GLN HA H 49 3.830 3.830 3.975 -0.145 18222
1993 1 5 . 1 1 49 49 GLN CA C 49 58.880 58.880 59.425 -0.545 18222
1994 1 5 . 1 1 49 49 GLN CB C 49 27.240 27.240 28.513 -1.273 18222
1995 1 5 . 1 1 49 49 GLN H H 49 8.080 8.080 8.185 -0.105 18222
1996 1 5 . 1 1 50 50 MET N N 50 117.630 117.630 120.262 -2.632 18222
1997 1 5 . 1 1 50 50 MET HA H 50 4.010 4.010 4.201 -0.191 18222
1998 1 5 . 1 1 50 50 MET CA C 50 57.730 57.730 58.989 -1.259 18222
1999 1 5 . 1 1 50 50 MET CB C 50 27.160 27.160 32.812 -5.652 18222
2000 1 5 . 1 1 50 50 MET H H 50 7.880 7.880 8.322 -0.443 18222
2001 1 5 . 1 1 51 51 PHE N N 51 119.550 119.550 119.959 -0.409 18222
2002 1 5 . 1 1 51 51 PHE CA C 51 60.850 60.850 61.515 -0.665 18222
2003 1 5 . 1 1 51 51 PHE CB C 51 38.720 38.720 39.446 -0.726 18222
2004 1 5 . 1 1 51 51 PHE H H 51 7.890 7.890 8.315 -0.425 18222
2005 1 5 . 1 1 52 52 ILE N N 52 117.950 117.950 114.572 3.378 18222
2006 1 5 . 1 1 52 52 ILE HA H 52 4.050 4.050 4.106 -0.056 18222
2007 1 5 . 1 1 52 52 ILE CA C 52 63.560 63.560 64.204 -0.644 18222
2008 1 5 . 1 1 52 52 ILE CB C 52 36.810 36.810 37.922 -1.112 18222
2009 1 5 . 1 1 52 52 ILE H H 52 8.110 8.110 8.255 -0.145 18222
2010 1 5 . 1 1 53 53 GLN N N 53 117.360 117.360 120.168 -2.808 18222
2011 1 5 . 1 1 53 53 GLN CA C 53 57.200 57.200 58.263 -1.063 18222
2012 1 5 . 1 1 53 53 GLN CB C 53 27.870 27.870 28.235 -0.365 18222
2013 1 5 . 1 1 53 53 GLN H H 53 7.930 7.930 8.453 -0.523 18222
2014 1 5 . 1 1 54 54 ARG N N 54 116.840 116.840 118.428 -1.588 18222
2015 1 5 . 1 1 54 54 ARG HA H 54 3.950 3.950 4.210 -0.260 18222
2016 1 5 . 1 1 54 54 ARG CA C 54 56.480 56.480 57.587 -1.107 18222
2017 1 5 . 1 1 54 54 ARG CB C 54 28.970 28.970 29.916 -0.946 18222
2018 1 5 . 1 1 54 54 ARG H H 54 7.540 7.540 7.865 -0.325 18222
2019 1 5 . 1 1 55 55 LYS N N 55 117.900 117.900 118.111 -0.211 18222
2020 1 5 . 1 1 55 55 LYS HA H 55 4.080 4.080 4.246 -0.166 18222
2021 1 5 . 1 1 55 55 LYS CA C 55 55.030 55.030 56.109 -1.079 18222
2022 1 5 . 1 1 55 55 LYS CB C 55 32.010 32.010 32.504 -0.494 18222
2023 1 5 . 1 1 55 55 LYS H H 55 7.660 7.660 7.339 0.321 18222
2024 1 5 . 1 1 56 56 PHE N N 56 121.060 121.060 120.998 0.062 18222
2025 1 5 . 1 1 56 56 PHE CA C 56 55.190 55.190 55.791 -0.601 18222
2026 1 5 . 1 1 56 56 PHE CB C 56 38.970 38.970 39.710 -0.740 18222
2027 1 5 . 1 1 56 56 PHE H H 56 8.080 8.080 7.782 0.298 18222
2028 1 5 . 1 1 57 57 PRO CA C 57 62.390 62.390 63.686 -1.296 18222
2029 1 5 . 1 1 57 57 PRO CB C 57 30.580 30.580 31.825 -1.245 18222
2030 1 5 . 1 1 58 58 TYR N N 58 120.240 120.240 120.444 -0.204 18222
2031 1 5 . 1 1 58 58 TYR CA C 58 55.770 55.770 55.204 0.566 18222
2032 1 5 . 1 1 58 58 TYR CB C 58 40.220 40.220 38.947 1.273 18222
2033 1 5 . 1 1 58 58 TYR H H 58 7.700 7.700 8.033 -0.333 18222
2034 1 5 . 1 1 59 59 PRO CA C 59 62.130 62.130 63.746 -1.616 18222
2035 1 5 . 1 1 59 59 PRO CB C 59 33.340 33.340 32.278 1.062 18222
2036 1 5 . 1 1 60 60 LEU N N 60 122.210 122.210 120.208 2.002 18222
2037 1 5 . 1 1 60 60 LEU CA C 60 54.250 54.250 54.697 -0.447 18222
2038 1 5 . 1 1 60 60 LEU CB C 60 41.470 41.470 43.113 -1.643 18222
2039 1 5 . 1 1 60 60 LEU H H 60 7.880 7.880 7.884 -0.004 18222
2040 1 5 . 1 1 61 61 GLN N N 61 122.470 122.470 120.799 1.671 18222
2041 1 5 . 1 1 61 61 GLN CA C 61 54.170 54.170 55.823 -1.653 18222
2042 1 5 . 1 1 61 61 GLN H H 61 7.970 7.970 8.254 -0.284 18222
2043 1 5 . 1 1 62 62 TRP N N 62 124.590 124.590 123.845 0.745 18222
2044 1 5 . 1 1 62 62 TRP CA C 62 59.830 59.830 62.026 -2.196 18222
2045 1 5 . 1 1 62 62 TRP CB C 62 28.800 28.800 29.581 -0.781 18222
2046 1 5 . 1 1 62 62 TRP H H 62 8.240 8.240 8.790 -0.550 18222
2047 1 5 . 1 1 63 63 SER N N 63 113.320 113.320 114.724 -1.404 18222
2048 1 5 . 1 1 63 63 SER CA C 63 61.100 61.100 62.033 -0.934 18222
2049 1 5 . 1 1 63 63 SER H H 63 8.410 8.410 7.959 0.451 18222
2050 1 5 . 1 1 64 64 LEU N N 64 123.230 123.230 120.561 2.669 18222
2051 1 5 . 1 1 64 64 LEU CA C 64 56.880 56.880 57.077 -0.197 18222
2052 1 5 . 1 1 64 64 LEU CB C 64 40.830 40.830 40.918 -0.088 18222
2053 1 5 . 1 1 64 64 LEU H H 64 7.230 7.230 8.139 -0.909 18222
2054 1 5 . 1 1 65 65 LEU N N 65 119.400 119.400 121.396 -1.996 18222
2055 1 5 . 1 1 65 65 LEU HA H 65 3.890 3.890 4.057 -0.167 18222
2056 1 5 . 1 1 65 65 LEU CA C 65 57.580 57.580 58.347 -0.767 18222
2057 1 5 . 1 1 65 65 LEU CB C 65 40.710 40.710 41.562 -0.853 18222
2058 1 5 . 1 1 65 65 LEU H H 65 7.510 7.510 8.529 -1.019 18222
2059 1 5 . 1 1 66 66 VAL N N 66 116.950 116.950 119.192 -2.242 18222
2060 1 5 . 1 1 66 66 VAL HA H 66 3.960 3.960 3.699 0.261 18222
2061 1 5 . 1 1 66 66 VAL CA C 66 66.260 66.260 65.796 0.464 18222
2062 1 5 . 1 1 66 66 VAL CB C 66 30.570 30.570 31.295 -0.725 18222
2063 1 5 . 1 1 66 66 VAL H H 66 7.950 7.950 8.326 -0.376 18222
2064 1 5 . 1 1 67 67 ALA N N 67 120.650 120.650 122.751 -2.101 18222
2065 1 5 . 1 1 67 67 ALA HA H 67 4.000 4.000 4.201 -0.201 18222
2066 1 5 . 1 1 67 67 ALA CA C 67 54.780 54.780 55.274 -0.494 18222
2067 1 5 . 1 1 67 67 ALA CB C 67 17.440 17.440 18.552 -1.113 18222
2068 1 5 . 1 1 67 67 ALA H H 67 7.450 7.450 8.053 -0.603 18222
2069 1 5 . 1 1 68 68 VAL N N 68 118.440 118.440 119.218 -0.778 18222
2070 1 5 . 1 1 68 68 VAL HA H 68 3.750 3.750 3.644 0.106 18222
2071 1 5 . 1 1 68 68 VAL CA C 68 65.250 65.250 67.046 -1.796 18222
2072 1 5 . 1 1 68 68 VAL CB C 68 30.850 30.850 32.002 -1.152 18222
2073 1 5 . 1 1 68 68 VAL H H 68 7.960 7.960 7.806 0.154 18222
2074 1 5 . 1 1 69 69 VAL N N 69 120.800 120.800 119.899 0.901 18222
2075 1 5 . 1 1 69 69 VAL HA H 69 4.220 4.220 3.593 0.627 18222
2076 1 5 . 1 1 69 69 VAL CA C 69 66.020 66.020 67.029 -1.009 18222
2077 1 5 . 1 1 69 69 VAL CB C 69 30.850 30.850 31.055 -0.205 18222
2078 1 5 . 1 1 69 69 VAL H H 69 8.080 8.080 8.333 -0.253 18222
2079 1 5 . 1 1 70 70 ALA N N 70 121.740 121.740 120.867 0.873 18222
2080 1 5 . 1 1 70 70 ALA HA H 70 3.920 3.920 4.191 -0.271 18222
2081 1 5 . 1 1 70 70 ALA CA C 70 54.920 54.920 55.341 -0.421 18222
2082 1 5 . 1 1 70 70 ALA CB C 70 17.620 17.620 18.250 -0.630 18222
2083 1 5 . 1 1 70 70 ALA H H 70 8.660 8.660 8.608 0.052 18222
2084 1 5 . 1 1 71 71 GLY N N 71 103.450 103.450 106.648 -3.198 18222
2085 1 5 . 1 1 71 71 GLY CA C 71 46.300 46.300 46.722 -0.422 18222
2086 1 5 . 1 1 71 71 GLY H H 71 8.010 8.010 8.083 -0.073 18222
2087 1 5 . 1 1 72 72 SER N N 72 118.160 118.160 117.721 0.439 18222
2088 1 5 . 1 1 72 72 SER CA C 72 61.260 61.260 61.257 0.003 18222
2089 1 5 . 1 1 72 72 SER CB C 72 62.870 62.870 63.237 -0.367 18222
2090 1 5 . 1 1 72 72 SER H H 72 7.870 7.870 7.993 -0.123 18222
2091 1 5 . 1 1 73 73 VAL N N 73 121.340 121.340 122.252 -0.912 18222
2092 1 5 . 1 1 73 73 VAL CA C 73 65.750 65.750 65.956 -0.205 18222
2093 1 5 . 1 1 73 73 VAL CB C 73 30.740 30.740 31.924 -1.185 18222
2094 1 5 . 1 1 73 73 VAL H H 73 8.050 8.050 8.124 -0.074 18222
2095 1 5 . 1 1 74 74 VAL N N 74 118.680 118.680 119.043 -0.363 18222
2096 1 5 . 1 1 74 74 VAL CA C 74 65.770 65.770 66.351 -0.581 18222
2097 1 5 . 1 1 74 74 VAL CB C 74 30.740 30.740 30.588 0.152 18222
2098 1 5 . 1 1 74 74 VAL H H 74 7.880 7.880 8.370 -0.490 18222
2099 1 5 . 1 1 75 75 SER N N 75 114.750 114.750 116.912 -2.162 18222
2100 1 5 . 1 1 75 75 SER HA H 75 4.100 4.100 4.232 -0.132 18222
2101 1 5 . 1 1 75 75 SER CA C 75 60.870 60.870 61.382 -0.512 18222
2102 1 5 . 1 1 75 75 SER CB C 75 62.340 62.340 63.032 -0.692 18222
2103 1 5 . 1 1 75 75 SER H H 75 7.870 7.870 8.105 -0.235 18222
2104 1 5 . 1 1 76 76 TYR N N 76 121.110 121.110 122.336 -1.226 18222
2105 1 5 . 1 1 76 76 TYR CA C 76 60.050 60.050 61.883 -1.833 18222
2106 1 5 . 1 1 76 76 TYR CB C 76 37.980 37.980 38.748 -0.768 18222
2107 1 5 . 1 1 76 76 TYR H H 76 7.860 7.860 8.431 -0.571 18222
2108 1 5 . 1 1 77 77 GLY N N 77 107.300 107.300 106.587 0.713 18222
2109 1 5 . 1 1 77 77 GLY CA C 77 46.560 46.560 47.394 -0.834 18222
2110 1 5 . 1 1 77 77 GLY H H 77 8.200 8.200 8.537 -0.337 18222
2111 1 5 . 1 1 78 78 VAL N N 78 119.470 119.470 121.632 -2.162 18222
2112 1 5 . 1 1 78 78 VAL HA H 78 4.170 4.170 3.805 0.365 18222
2113 1 5 . 1 1 78 78 VAL CA C 78 64.650 64.650 66.371 -1.721 18222
2114 1 5 . 1 1 78 78 VAL H H 78 8.140 8.140 8.620 -0.480 18222
2115 1 5 . 1 1 79 79 THR N N 79 112.100 112.100 116.690 -4.590 18222
2116 1 5 . 1 1 79 79 THR CA C 79 63.460 63.460 67.208 -3.748 18222
2117 1 5 . 1 1 79 79 THR CB C 79 68.650 68.650 68.444 0.206 18222
2118 1 5 . 1 1 79 79 THR H H 79 7.640 7.640 8.032 -0.392 18222
2119 1 5 . 1 1 80 80 ARG N N 80 120.770 120.770 122.437 -1.667 18222
2120 1 5 . 1 1 80 80 ARG HA H 80 4.160 4.160 4.031 0.129 18222
2121 1 5 . 1 1 80 80 ARG CA C 80 56.790 56.790 59.690 -2.900 18222
2122 1 5 . 1 1 80 80 ARG CB C 80 29.430 29.430 30.196 -0.766 18222
2123 1 5 . 1 1 80 80 ARG H H 80 7.680 7.680 8.068 -0.388 18222
2124 1 5 . 1 1 81 81 VAL N N 81 118.370 118.370 119.653 -1.283 18222
2125 1 5 . 1 1 81 81 VAL HA H 81 3.920 3.920 3.731 0.189 18222
2126 1 5 . 1 1 81 81 VAL CA C 81 63.340 63.340 66.614 -3.273 18222
2127 1 5 . 1 1 81 81 VAL CB C 81 31.260 31.260 31.651 -0.391 18222
2128 1 5 . 1 1 81 81 VAL H H 81 7.730 7.730 8.292 -0.562 18222
2129 1 5 . 1 1 82 82 GLU N N 82 120.620 120.620 119.659 0.961 18222
2130 1 5 . 1 1 82 82 GLU CA C 82 56.320 56.320 59.803 -3.482 18222
2131 1 5 . 1 1 82 82 GLU CB C 82 27.930 27.930 29.278 -1.348 18222
2132 1 5 . 1 1 82 82 GLU H H 82 7.920 7.920 8.527 -0.607 18222
2133 1 5 . 1 1 83 83 SER N N 83 116.240 116.240 116.438 -0.198 18222
2134 1 5 . 1 1 83 83 SER CA C 83 59.250 59.250 61.994 -2.744 18222
2135 1 5 . 1 1 83 83 SER CB C 83 63.160 63.160 62.820 0.340 18222
2136 1 5 . 1 1 83 83 SER H H 83 7.960 7.960 8.009 -0.049 18222
2137 1 5 . 1 1 84 84 GLU N N 84 123.280 123.280 122.051 1.229 18222
2138 1 5 . 1 1 84 84 GLU HA H 84 4.080 4.080 4.041 0.039 18222
2139 1 5 . 1 1 84 84 GLU CA C 84 57.860 57.860 59.836 -1.976 18222
2140 1 5 . 1 1 84 84 GLU CB C 84 28.190 28.190 29.658 -1.468 18222
2141 1 5 . 1 1 84 84 GLU H H 84 8.470 8.470 8.066 0.404 18222
2142 1 5 . 1 1 85 85 LYS N N 85 118.650 118.650 119.881 -1.231 18222
2143 1 5 . 1 1 85 85 LYS HA H 85 4.100 4.100 4.055 0.045 18222
2144 1 5 . 1 1 85 85 LYS CA C 85 57.780 57.780 59.602 -1.823 18222
2145 1 5 . 1 1 85 85 LYS CB C 85 31.380 31.380 32.484 -1.104 18222
2146 1 5 . 1 1 85 85 LYS H H 85 7.940 7.940 8.063 -0.123 18222
2147 1 5 . 1 1 86 86 CYS N N 86 117.070 117.070 118.712 -1.642 18222
2148 1 5 . 1 1 86 86 CYS CA C 86 60.910 60.910 62.575 -1.665 18222
2149 1 5 . 1 1 86 86 CYS CB C 86 26.740 26.740 27.058 -0.318 18222
2150 1 5 . 1 1 86 86 CYS H H 86 7.840 7.840 8.459 -0.619 18222
2151 1 5 . 1 1 87 87 ASN N N 87 119.370 119.370 118.850 0.520 18222
2152 1 5 . 1 1 87 87 ASN HA H 87 4.130 4.130 4.720 -0.590 18222
2153 1 5 . 1 1 87 87 ASN CA C 87 55.750 55.750 56.650 -0.900 18222
2154 1 5 . 1 1 87 87 ASN CB C 87 38.050 38.050 38.092 -0.042 18222
2155 1 5 . 1 1 87 87 ASN H H 87 8.110 8.110 8.594 -0.484 18222
2156 1 5 . 1 1 88 88 ASN N N 88 117.570 117.570 119.744 -2.174 18222
2157 1 5 . 1 1 88 88 ASN HA H 88 4.280 4.280 4.569 -0.289 18222
2158 1 5 . 1 1 88 88 ASN CA C 88 55.190 55.190 56.327 -1.137 18222
2159 1 5 . 1 1 88 88 ASN CB C 88 37.400 37.400 38.561 -1.161 18222
2160 1 5 . 1 1 88 88 ASN H H 88 8.280 8.280 8.194 0.086 18222
2161 1 5 . 1 1 89 89 LEU N N 89 121.940 121.940 121.831 0.109 18222
2162 1 5 . 1 1 89 89 LEU HA H 89 4.070 4.070 3.973 0.097 18222
2163 1 5 . 1 1 89 89 LEU CA C 89 57.580 57.580 59.415 -1.835 18222
2164 1 5 . 1 1 89 89 LEU CB C 89 40.490 40.490 41.930 -1.440 18222
2165 1 5 . 1 1 89 89 LEU H H 89 7.790 7.790 8.591 -0.801 18222
2166 1 5 . 1 1 90 90 TRP N N 90 119.220 119.220 120.782 -1.562 18222
2167 1 5 . 1 1 90 90 TRP CA C 90 59.120 59.120 61.097 -1.977 18222
2168 1 5 . 1 1 90 90 TRP CB C 90 28.800 28.800 28.876 -0.076 18222
2169 1 5 . 1 1 90 90 TRP H H 90 7.850 7.850 8.391 -0.541 18222
2170 1 5 . 1 1 91 91 LEU N N 91 117.870 117.870 120.633 -2.763 18222
2171 1 5 . 1 1 91 91 LEU CA C 91 57.300 57.300 58.264 -0.964 18222
2172 1 5 . 1 1 91 91 LEU CB C 91 40.610 40.610 41.731 -1.121 18222
2173 1 5 . 1 1 91 91 LEU H H 91 7.920 7.920 8.204 -0.284 18222
2174 1 5 . 1 1 92 92 PHE N N 92 121.280 121.280 117.779 3.501 18222
2175 1 5 . 1 1 92 92 PHE CA C 92 60.390 60.390 62.349 -1.959 18222
2176 1 5 . 1 1 92 92 PHE CB C 92 37.980 37.980 38.646 -0.666 18222
2177 1 5 . 1 1 92 92 PHE H H 92 7.860 7.860 8.425 -0.565 18222
2178 1 5 . 1 1 93 93 LEU N N 93 119.860 119.860 120.312 -0.452 18222
2179 1 5 . 1 1 93 93 LEU CA C 93 56.860 56.860 58.703 -1.843 18222
2180 1 5 . 1 1 93 93 LEU CB C 93 40.550 40.550 42.089 -1.539 18222
2181 1 5 . 1 1 93 93 LEU H H 93 7.980 7.980 8.826 -0.846 18222
2182 1 5 . 1 1 94 94 GLU N N 94 114.660 114.660 119.064 -4.404 18222
2183 1 5 . 1 1 94 94 GLU HA H 94 3.810 3.810 4.069 -0.259 18222
2184 1 5 . 1 1 94 94 GLU CA C 94 57.210 57.210 59.052 -1.842 18222
2185 1 5 . 1 1 94 94 GLU CB C 94 28.470 28.470 29.370 -0.900 18222
2186 1 5 . 1 1 94 94 GLU H H 94 7.890 7.890 8.261 -0.371 18222
2187 1 5 . 1 1 95 95 THR N N 95 108.260 108.260 112.034 -3.774 18222
2188 1 5 . 1 1 95 95 THR CA C 95 62.150 62.150 63.068 -0.918 18222
2189 1 5 . 1 1 95 95 THR CB C 95 70.810 70.810 69.818 0.992 18222
2190 1 5 . 1 1 95 95 THR H H 95 7.690 7.690 7.615 0.075 18222
2191 1 5 . 1 1 96 96 GLY N N 96 112.220 112.220 109.488 2.732 18222
2192 1 5 . 1 1 96 96 GLY CA C 96 45.410 45.410 44.876 0.534 18222
2193 1 5 . 1 1 96 96 GLY H H 96 8.240 8.240 7.885 0.355 18222
2194 1 5 . 1 1 97 97 GLN N N 97 117.950 117.950 120.774 -2.824 18222
2195 1 5 . 1 1 97 97 GLN HA H 97 4.200 4.200 4.507 -0.307 18222
2196 1 5 . 1 1 97 97 GLN CA C 97 54.430 54.430 54.356 0.074 18222
2197 1 5 . 1 1 97 97 GLN CB C 97 29.910 29.910 28.612 1.298 18222
2198 1 5 . 1 1 97 97 GLN H H 97 7.640 7.640 7.926 -0.286 18222
2199 1 5 . 1 1 98 98 LEU N N 98 123.810 123.810 121.883 1.927 18222
2200 1 5 . 1 1 98 98 LEU HA H 98 4.360 4.360 4.726 -0.366 18222
2201 1 5 . 1 1 98 98 LEU CA C 98 52.650 52.650 53.725 -1.075 18222
2202 1 5 . 1 1 98 98 LEU CB C 98 40.460 40.460 41.033 -0.573 18222
2203 1 5 . 1 1 98 98 LEU H H 98 8.270 8.270 7.793 0.477 18222
2204 1 5 . 1 1 99 99 PRO CA C 99 63.180 63.180 63.286 -0.106 18222
2205 1 5 . 1 1 99 99 PRO CB C 99 30.840 30.840 31.840 -1.000 18222
2206 1 5 . 1 1 100 100 LYS N N 100 120.630 120.630 120.462 0.168 18222
2207 1 5 . 1 1 100 100 LYS CA C 100 55.730 55.730 56.790 -1.060 18222
2208 1 5 . 1 1 100 100 LYS CB C 100 32.280 32.280 31.878 0.402 18222
2209 1 5 . 1 1 100 100 LYS H H 100 8.090 8.090 8.373 -0.283 18222
2210 1 5 . 1 1 101 101 ASP N N 101 120.920 120.920 121.391 -0.471 18222
2211 1 5 . 1 1 101 101 ASP HA H 101 4.190 4.190 4.743 -0.553 18222
2212 1 5 . 1 1 101 101 ASP CA C 101 54.000 54.000 53.776 0.224 18222
2213 1 5 . 1 1 101 101 ASP CB C 101 40.330 40.330 42.514 -2.184 18222
2214 1 5 . 1 1 101 101 ASP H H 101 8.190 8.190 8.127 0.063 18222
2215 1 5 . 1 1 102 102 ARG N N 102 122.210 122.210 121.901 0.309 18222
2216 1 5 . 1 1 102 102 ARG CA C 102 55.590 55.590 56.775 -1.185 18222
2217 1 5 . 1 1 102 102 ARG CB C 102 29.630 29.630 30.735 -1.105 18222
2218 1 5 . 1 1 102 102 ARG H H 102 8.130 8.130 8.472 -0.342 18222
2219 1 5 . 1 1 103 103 SER N N 103 117.230 117.230 116.085 1.145 18222
2220 1 5 . 1 1 103 103 SER HA H 103 4.280 4.280 4.791 -0.511 18222
2221 1 5 . 1 1 103 103 SER CA C 103 58.470 58.470 57.636 0.834 18222
2222 1 5 . 1 1 103 103 SER CB C 103 63.080 63.080 63.978 -0.898 18222
2223 1 5 . 1 1 103 103 SER H H 103 8.290 8.290 8.432 -0.142 18222
2224 1 5 . 1 1 104 104 THR N N 104 115.430 115.430 116.504 -1.074 18222
2225 1 5 . 1 1 104 104 THR CA C 104 61.570 61.570 61.759 -0.189 18222
2226 1 5 . 1 1 104 104 THR CB C 104 69.030 69.030 69.967 -0.937 18222
2227 1 5 . 1 1 104 104 THR H H 104 8.020 8.020 8.306 -0.286 18222
2228 1 5 . 1 1 105 105 ASP N N 105 122.780 122.780 119.537 3.243 18222
2229 1 5 . 1 1 105 105 ASP CA C 105 54.210 54.210 53.662 0.548 18222
2230 1 5 . 1 1 105 105 ASP CB C 105 40.380 40.380 42.150 -1.770 18222
2231 1 5 . 1 1 105 105 ASP H H 105 8.120 8.120 8.258 -0.138 18222
2232 1 5 . 1 1 106 106 GLN N N 106 120.960 120.960 120.846 0.114 18222
2233 1 5 . 1 1 106 106 GLN CA C 106 55.420 55.420 55.858 -0.438 18222
2234 1 5 . 1 1 106 106 GLN CB C 106 28.310 28.310 29.803 -1.493 18222
2235 1 5 . 1 1 106 106 GLN H H 106 8.140 8.140 8.277 -0.137 18222
2236 1 5 . 1 1 107 107 ARG N N 107 123.010 123.010 122.440 0.570 18222
2237 1 5 . 1 1 107 107 ARG HA H 107 4.210 4.210 4.407 -0.197 18222
2238 1 5 . 1 1 107 107 ARG CA C 107 55.560 55.560 56.248 -0.688 18222
2239 1 5 . 1 1 107 107 ARG CB C 107 29.920 29.920 30.128 -0.208 18222
2240 1 5 . 1 1 107 107 ARG H H 107 8.180 8.180 8.576 -0.396 18222
2241 1 6 . 1 1 2 2 VAL N N 2 121.590 121.590 124.543 -2.953 18222
2242 1 6 . 1 1 2 2 VAL CA C 2 61.600 61.600 62.232 -0.632 18222
2243 1 6 . 1 1 2 2 VAL CB C 2 31.900 31.900 32.347 -0.447 18222
2244 1 6 . 1 1 2 2 VAL H H 2 8.010 8.010 8.476 -0.466 18222
2245 1 6 . 1 1 3 3 ASN N N 3 122.520 122.520 124.434 -1.914 18222
2246 1 6 . 1 1 3 3 ASN HA H 3 4.020 4.020 4.752 -0.732 18222
2247 1 6 . 1 1 3 3 ASN CA C 3 52.640 52.640 53.597 -0.957 18222
2248 1 6 . 1 1 3 3 ASN CB C 3 38.330 38.330 39.335 -1.005 18222
2249 1 6 . 1 1 3 3 ASN H H 3 8.360 8.360 8.540 -0.180 18222
2250 1 6 . 1 1 4 4 LEU N N 4 123.830 123.830 121.485 2.345 18222
2251 1 6 . 1 1 4 4 LEU HA H 4 4.220 4.220 4.699 -0.479 18222
2252 1 6 . 1 1 4 4 LEU CA C 4 54.620 54.620 55.042 -0.422 18222
2253 1 6 . 1 1 4 4 LEU CB C 4 41.680 41.680 42.175 -0.495 18222
2254 1 6 . 1 1 4 4 LEU H H 4 8.220 8.220 8.571 -0.351 18222
2255 1 6 . 1 1 5 5 GLY N N 5 106.810 106.810 106.966 -0.156 18222
2256 1 6 . 1 1 5 5 GLY CA C 5 45.800 45.800 44.599 1.201 18222
2257 1 6 . 1 1 5 5 GLY H H 5 8.030 8.030 7.777 0.253 18222
2258 1 6 . 1 1 6 6 LEU N N 6 120.820 120.820 120.818 0.002 18222
2259 1 6 . 1 1 6 6 LEU HA H 6 4.050 4.050 4.453 -0.403 18222
2260 1 6 . 1 1 6 6 LEU CA C 6 55.990 55.990 56.971 -0.981 18222
2261 1 6 . 1 1 6 6 LEU CB C 6 40.800 40.800 42.346 -1.546 18222
2262 1 6 . 1 1 6 6 LEU H H 6 8.030 8.030 8.464 -0.434 18222
2263 1 6 . 1 1 7 7 SER N N 7 115.540 115.540 115.362 0.178 18222
2264 1 6 . 1 1 7 7 SER HA H 7 4.100 4.100 4.220 -0.120 18222
2265 1 6 . 1 1 7 7 SER CA C 7 60.580 60.580 62.379 -1.799 18222
2266 1 6 . 1 1 7 7 SER CB C 7 62.060 62.060 62.832 -0.772 18222
2267 1 6 . 1 1 7 7 SER H H 7 8.360 8.360 8.398 -0.038 18222
2268 1 6 . 1 1 8 8 ARG N N 8 120.690 120.690 122.388 -1.698 18222
2269 1 6 . 1 1 8 8 ARG HA H 8 4.160 4.160 4.081 0.079 18222
2270 1 6 . 1 1 8 8 ARG CA C 8 57.350 57.350 59.184 -1.834 18222
2271 1 6 . 1 1 8 8 ARG CB C 8 29.230 29.230 29.841 -0.611 18222
2272 1 6 . 1 1 8 8 ARG H H 8 7.830 7.830 8.231 -0.401 18222
2273 1 6 . 1 1 9 9 VAL N N 9 119.330 119.330 119.840 -0.510 18222
2274 1 6 . 1 1 9 9 VAL HA H 9 4.170 4.170 3.562 0.608 18222
2275 1 6 . 1 1 9 9 VAL CA C 9 64.720 64.720 66.628 -1.908 18222
2276 1 6 . 1 1 9 9 VAL CB C 9 30.900 30.900 31.534 -0.634 18222
2277 1 6 . 1 1 9 9 VAL H H 9 7.620 7.620 7.552 0.068 18222
2278 1 6 . 1 1 10 10 ASP N N 10 119.520 119.520 120.038 -0.518 18222
2279 1 6 . 1 1 10 10 ASP CA C 10 54.960 54.960 57.981 -3.021 18222
2280 1 6 . 1 1 10 10 ASP CB C 10 37.800 37.800 40.254 -2.454 18222
2281 1 6 . 1 1 10 10 ASP H H 10 8.180 8.180 8.176 0.004 18222
2282 1 6 . 1 1 11 11 ASP N N 11 121.550 121.550 120.462 1.088 18222
2283 1 6 . 1 1 11 11 ASP CA C 11 54.440 54.440 57.121 -2.681 18222
2284 1 6 . 1 1 11 11 ASP CB C 11 37.840 37.840 40.801 -2.961 18222
2285 1 6 . 1 1 11 11 ASP H H 11 7.950 7.950 8.170 -0.220 18222
2286 1 6 . 1 1 12 12 ALA N N 12 120.220 120.220 122.495 -2.275 18222
2287 1 6 . 1 1 12 12 ALA CA C 12 54.370 54.370 55.084 -0.714 18222
2288 1 6 . 1 1 12 12 ALA CB C 12 24.730 24.730 18.600 6.130 18222
2289 1 6 . 1 1 12 12 ALA H H 12 8.090 8.090 8.150 -0.060 18222
2290 1 6 . 1 1 13 13 VAL N N 13 116.910 116.910 118.949 -2.039 18222
2291 1 6 . 1 1 13 13 VAL HA H 13 4.140 4.140 3.555 0.585 18222
2292 1 6 . 1 1 13 13 VAL CA C 13 64.900 64.900 66.759 -1.859 18222
2293 1 6 . 1 1 13 13 VAL CB C 13 31.000 31.000 31.692 -0.692 18222
2294 1 6 . 1 1 13 13 VAL H H 13 7.980 7.980 8.131 -0.151 18222
2295 1 6 . 1 1 14 14 ALA N N 14 122.200 122.200 121.859 0.341 18222
2296 1 6 . 1 1 14 14 ALA HA H 14 4.020 4.020 4.011 0.009 18222
2297 1 6 . 1 1 14 14 ALA CA C 14 53.800 53.800 54.926 -1.126 18222
2298 1 6 . 1 1 14 14 ALA CB C 14 17.790 17.790 18.475 -0.685 18222
2299 1 6 . 1 1 14 14 ALA H H 14 8.030 8.030 8.001 0.029 18222
2300 1 6 . 1 1 15 15 ALA N N 15 118.600 118.600 119.038 -0.438 18222
2301 1 6 . 1 1 15 15 ALA CA C 15 53.230 53.230 54.038 -0.808 18222
2302 1 6 . 1 1 15 15 ALA CB C 15 18.010 18.010 18.276 -0.266 18222
2303 1 6 . 1 1 15 15 ALA H H 15 7.530 7.530 7.820 -0.290 18222
2304 1 6 . 1 1 16 16 LYS N N 16 115.820 115.820 117.278 -1.458 18222
2305 1 6 . 1 1 16 16 LYS HA H 16 4.080 4.080 4.187 -0.107 18222
2306 1 6 . 1 1 16 16 LYS CA C 16 55.670 55.670 57.844 -2.174 18222
2307 1 6 . 1 1 16 16 LYS CB C 16 32.640 32.640 33.378 -0.738 18222
2308 1 6 . 1 1 16 16 LYS H H 16 7.490 7.490 7.787 -0.297 18222
2309 1 6 . 1 1 17 17 HIS N N 17 116.790 116.790 117.993 -1.203 18222
2310 1 6 . 1 1 17 17 HIS HA H 17 4.100 4.100 4.998 -0.898 18222
2311 1 6 . 1 1 17 17 HIS CA C 17 52.820 52.820 52.760 0.060 18222
2312 1 6 . 1 1 17 17 HIS CB C 17 28.400 28.400 30.881 -2.481 18222
2313 1 6 . 1 1 17 17 HIS H H 17 8.130 8.130 7.794 0.336 18222
2314 1 6 . 1 1 18 18 PRO CA C 18 63.800 63.800 63.502 0.298 18222
2315 1 6 . 1 1 18 18 PRO CB C 18 30.800 30.800 32.755 -1.955 18222
2316 1 6 . 1 1 19 19 GLY N N 19 110.260 110.260 106.143 4.117 18222
2317 1 6 . 1 1 19 19 GLY CA C 19 45.490 45.490 44.877 0.614 18222
2318 1 6 . 1 1 19 19 GLY H H 19 8.730 8.730 8.068 0.662 18222
2319 1 6 . 1 1 20 20 LEU N N 20 122.650 122.650 124.372 -1.722 18222
2320 1 6 . 1 1 20 20 LEU HA H 20 4.090 4.090 4.691 -0.601 18222
2321 1 6 . 1 1 20 20 LEU CA C 20 57.060 57.060 55.502 1.558 18222
2322 1 6 . 1 1 20 20 LEU H H 20 7.980 7.980 8.514 -0.534 18222
2323 1 6 . 1 1 21 21 GLY N N 21 107.000 107.000 108.483 -1.483 18222
2324 1 6 . 1 1 21 21 GLY CA C 21 46.710 46.710 46.980 -0.271 18222
2325 1 6 . 1 1 21 21 GLY H H 21 8.570 8.570 8.578 -0.008 18222
2326 1 6 . 1 1 22 22 GLU N N 22 121.610 121.610 121.448 0.162 18222
2327 1 6 . 1 1 22 22 GLU HA H 22 3.990 3.990 4.036 -0.046 18222
2328 1 6 . 1 1 22 22 GLU CA C 22 58.280 58.280 58.931 -0.651 18222
2329 1 6 . 1 1 22 22 GLU CB C 22 28.010 28.010 29.049 -1.039 18222
2330 1 6 . 1 1 22 22 GLU H H 22 8.100 8.100 8.964 -0.864 18222
2331 1 6 . 1 1 23 23 TYR N N 23 120.870 120.870 121.766 -0.896 18222
2332 1 6 . 1 1 23 23 TYR CA C 23 60.380 60.380 61.483 -1.103 18222
2333 1 6 . 1 1 23 23 TYR CB C 23 37.750 37.750 38.644 -0.894 18222
2334 1 6 . 1 1 23 23 TYR H H 23 7.910 7.910 7.623 0.287 18222
2335 1 6 . 1 1 24 24 ALA N N 24 121.420 121.420 121.695 -0.275 18222
2336 1 6 . 1 1 24 24 ALA HA H 24 4.140 4.140 3.957 0.183 18222
2337 1 6 . 1 1 24 24 ALA CA C 24 54.260 54.260 55.048 -0.788 18222
2338 1 6 . 1 1 24 24 ALA H H 24 8.410 8.410 8.384 0.026 18222
2339 1 6 . 1 1 25 25 ALA N N 25 120.220 120.220 122.275 -2.055 18222
2340 1 6 . 1 1 25 25 ALA CA C 25 54.370 54.370 55.069 -0.700 18222
2341 1 6 . 1 1 25 25 ALA H H 25 8.090 8.090 8.426 -0.336 18222
2342 1 6 . 1 1 26 26 CYS N N 26 116.760 116.760 117.413 -0.653 18222
2343 1 6 . 1 1 26 26 CYS CA C 26 61.180 61.180 61.732 -0.552 18222
2344 1 6 . 1 1 26 26 CYS CB C 26 26.390 26.390 25.890 0.500 18222
2345 1 6 . 1 1 26 26 CYS H H 26 7.950 7.950 8.213 -0.263 18222
2346 1 6 . 1 1 27 27 GLN N N 27 118.690 118.690 121.140 -2.450 18222
2347 1 6 . 1 1 27 27 GLN CA C 27 55.970 55.970 59.620 -3.650 18222
2348 1 6 . 1 1 27 27 GLN H H 27 8.060 8.060 8.286 -0.226 18222
2349 1 6 . 1 1 28 28 SER N N 28 115.490 115.490 116.097 -0.607 18222
2350 1 6 . 1 1 28 28 SER HA H 28 3.990 3.990 4.179 -0.189 18222
2351 1 6 . 1 1 28 28 SER CA C 28 61.110 61.110 61.990 -0.880 18222
2352 1 6 . 1 1 28 28 SER H H 28 7.980 7.980 8.484 -0.504 18222
2353 1 6 . 1 1 29 29 HIS N N 29 120.880 120.880 122.441 -1.561 18222
2354 1 6 . 1 1 29 29 HIS CA C 29 58.190 58.190 59.723 -1.533 18222
2355 1 6 . 1 1 29 29 HIS CB C 29 27.460 27.460 29.976 -2.516 18222
2356 1 6 . 1 1 29 29 HIS H H 29 8.180 8.180 8.284 -0.104 18222
2357 1 6 . 1 1 30 30 ALA N N 30 122.920 122.920 121.741 1.179 18222
2358 1 6 . 1 1 30 30 ALA CA C 30 54.560 54.560 55.149 -0.589 18222
2359 1 6 . 1 1 30 30 ALA CB C 30 17.490 17.490 18.342 -0.852 18222
2360 1 6 . 1 1 30 30 ALA H H 30 8.040 8.040 8.353 -0.313 18222
2361 1 6 . 1 1 31 31 PHE N N 31 119.340 119.340 119.677 -0.337 18222
2362 1 6 . 1 1 31 31 PHE CA C 31 60.370 60.370 60.981 -0.611 18222
2363 1 6 . 1 1 31 31 PHE CB C 31 38.520 38.520 39.274 -0.754 18222
2364 1 6 . 1 1 31 31 PHE H H 31 8.230 8.230 8.441 -0.211 18222
2365 1 6 . 1 1 32 32 MET N N 32 118.110 118.110 119.865 -1.755 18222
2366 1 6 . 1 1 32 32 MET HA H 32 4.050 4.050 3.848 0.202 18222
2367 1 6 . 1 1 32 32 MET CA C 32 58.280 58.280 59.860 -1.580 18222
2368 1 6 . 1 1 32 32 MET CB C 32 31.090 31.090 32.387 -1.297 18222
2369 1 6 . 1 1 32 32 MET H H 32 8.120 8.120 8.475 -0.355 18222
2370 1 6 . 1 1 33 33 LYS N N 33 119.040 119.040 119.006 0.034 18222
2371 1 6 . 1 1 33 33 LYS HA H 33 3.930 3.930 3.730 0.200 18222
2372 1 6 . 1 1 33 33 LYS CA C 33 59.040 59.040 59.592 -0.552 18222
2373 1 6 . 1 1 33 33 LYS CB C 33 30.990 30.990 32.219 -1.229 18222
2374 1 6 . 1 1 33 33 LYS H H 33 7.970 7.970 8.040 -0.070 18222
2375 1 6 . 1 1 34 34 GLY N N 34 108.840 108.840 106.944 1.896 18222
2376 1 6 . 1 1 34 34 GLY CA C 34 46.610 46.610 47.124 -0.514 18222
2377 1 6 . 1 1 34 34 GLY H H 34 8.030 8.030 8.112 -0.082 18222
2378 1 6 . 1 1 35 35 VAL N N 35 122.910 122.910 122.607 0.303 18222
2379 1 6 . 1 1 35 35 VAL HA H 35 4.220 4.220 3.372 0.848 18222
2380 1 6 . 1 1 35 35 VAL CA C 35 66.310 66.310 66.321 -0.011 18222
2381 1 6 . 1 1 35 35 VAL CB C 35 30.560 30.560 31.512 -0.952 18222
2382 1 6 . 1 1 35 35 VAL H H 35 8.090 8.090 7.958 0.132 18222
2383 1 6 . 1 1 36 36 PHE N N 36 120.020 120.020 119.480 0.540 18222
2384 1 6 . 1 1 36 36 PHE CA C 36 61.350 61.350 62.748 -1.398 18222
2385 1 6 . 1 1 36 36 PHE CB C 36 38.090 38.090 38.549 -0.459 18222
2386 1 6 . 1 1 36 36 PHE H H 36 8.350 8.350 8.455 -0.105 18222
2387 1 6 . 1 1 37 37 THR N N 37 116.980 116.980 115.941 1.039 18222
2388 1 6 . 1 1 37 37 THR HA H 37 4.050 4.050 3.990 0.060 18222
2389 1 6 . 1 1 37 37 THR CA C 37 66.000 66.000 66.849 -0.849 18222
2390 1 6 . 1 1 37 37 THR CB C 37 68.270 68.270 68.843 -0.573 18222
2391 1 6 . 1 1 37 37 THR H H 37 8.520 8.520 8.243 0.277 18222
2392 1 6 . 1 1 38 38 PHE N N 38 123.090 123.090 120.801 2.289 18222
2393 1 6 . 1 1 38 38 PHE HA H 38 4.360 4.360 4.265 0.095 18222
2394 1 6 . 1 1 38 38 PHE CA C 38 61.140 61.140 60.904 0.235 18222
2395 1 6 . 1 1 38 38 PHE CB C 38 41.200 41.200 39.178 2.022 18222
2396 1 6 . 1 1 38 38 PHE H H 38 8.010 8.010 8.055 -0.045 18222
2397 1 6 . 1 1 39 39 VAL N N 39 117.280 117.280 120.440 -3.160 18222
2398 1 6 . 1 1 39 39 VAL HA H 39 4.210 4.210 3.512 0.698 18222
2399 1 6 . 1 1 39 39 VAL CA C 39 66.000 66.000 66.579 -0.579 18222
2400 1 6 . 1 1 39 39 VAL CB C 39 30.860 30.860 31.693 -0.833 18222
2401 1 6 . 1 1 39 39 VAL H H 39 8.530 8.530 9.008 -0.478 18222
2402 1 6 . 1 1 40 40 THR N N 40 109.470 109.470 115.433 -5.963 18222
2403 1 6 . 1 1 40 40 THR HA H 40 4.060 4.060 4.005 0.055 18222
2404 1 6 . 1 1 40 40 THR CA C 40 63.390 63.390 65.687 -2.297 18222
2405 1 6 . 1 1 40 40 THR CB C 40 68.650 68.650 68.120 0.531 18222
2406 1 6 . 1 1 40 40 THR H H 40 7.700 7.700 8.277 -0.577 18222
2407 1 6 . 1 1 41 41 GLY N N 41 110.770 110.770 107.082 3.688 18222
2408 1 6 . 1 1 41 41 GLY CA C 41 45.580 45.580 45.630 -0.050 18222
2409 1 6 . 1 1 41 41 GLY H H 41 7.700 7.700 7.870 -0.170 18222
2410 1 6 . 1 1 42 42 THR N N 42 114.520 114.520 115.579 -1.059 18222
2411 1 6 . 1 1 42 42 THR CA C 42 63.300 63.300 63.189 0.111 18222
2412 1 6 . 1 1 42 42 THR CB C 42 69.490 69.490 67.059 2.431 18222
2413 1 6 . 1 1 42 42 THR H H 42 7.720 7.720 8.092 -0.372 18222
2414 1 6 . 1 1 43 43 GLY N N 43 109.540 109.540 110.567 -1.027 18222
2415 1 6 . 1 1 43 43 GLY CA C 43 46.250 46.250 45.989 0.261 18222
2416 1 6 . 1 1 43 43 GLY H H 43 8.110 8.110 8.779 -0.669 18222
2417 1 6 . 1 1 44 44 MET N N 44 120.240 120.240 121.075 -0.835 18222
2418 1 6 . 1 1 44 44 MET HA H 44 4.100 4.100 4.008 0.092 18222
2419 1 6 . 1 1 44 44 MET CA C 44 57.700 57.700 58.703 -1.003 18222
2420 1 6 . 1 1 44 44 MET CB C 44 32.030 32.030 32.574 -0.544 18222
2421 1 6 . 1 1 44 44 MET H H 44 7.730 7.730 7.922 -0.192 18222
2422 1 6 . 1 1 45 45 ALA N N 45 121.560 121.560 121.070 0.490 18222
2423 1 6 . 1 1 45 45 ALA CA C 45 54.440 54.440 55.038 -0.598 18222
2424 1 6 . 1 1 45 45 ALA CB C 45 17.400 17.400 17.725 -0.325 18222
2425 1 6 . 1 1 45 45 ALA H H 45 7.950 7.950 7.776 0.174 18222
2426 1 6 . 1 1 46 46 PHE N N 46 118.260 118.260 118.885 -0.625 18222
2427 1 6 . 1 1 46 46 PHE HA H 46 3.930 3.930 4.427 -0.497 18222
2428 1 6 . 1 1 46 46 PHE CA C 46 59.820 59.820 59.748 0.072 18222
2429 1 6 . 1 1 46 46 PHE CB C 46 38.260 38.260 38.459 -0.199 18222
2430 1 6 . 1 1 46 46 PHE H H 46 7.860 7.860 8.061 -0.201 18222
2431 1 6 . 1 1 47 47 GLY N N 47 107.300 107.300 109.024 -1.724 18222
2432 1 6 . 1 1 47 47 GLY CA C 47 46.560 46.560 47.304 -0.744 18222
2433 1 6 . 1 1 47 47 GLY H H 47 8.200 8.200 8.613 -0.413 18222
2434 1 6 . 1 1 48 48 LEU N N 48 121.920 121.920 123.025 -1.105 18222
2435 1 6 . 1 1 48 48 LEU HA H 48 4.040 4.040 4.069 -0.029 18222
2436 1 6 . 1 1 48 48 LEU CA C 48 57.580 57.580 58.367 -0.787 18222
2437 1 6 . 1 1 48 48 LEU CB C 48 40.790 40.790 42.021 -1.231 18222
2438 1 6 . 1 1 48 48 LEU H H 48 8.180 8.180 8.315 -0.135 18222
2439 1 6 . 1 1 49 49 GLN N N 49 118.270 118.270 118.230 0.040 18222
2440 1 6 . 1 1 49 49 GLN HA H 49 3.830 3.830 3.934 -0.104 18222
2441 1 6 . 1 1 49 49 GLN CA C 49 58.880 58.880 59.264 -0.384 18222
2442 1 6 . 1 1 49 49 GLN CB C 49 27.240 27.240 28.660 -1.420 18222
2443 1 6 . 1 1 49 49 GLN H H 49 8.080 8.080 8.171 -0.091 18222
2444 1 6 . 1 1 50 50 MET N N 50 117.630 117.630 120.035 -2.405 18222
2445 1 6 . 1 1 50 50 MET HA H 50 4.010 4.010 4.216 -0.206 18222
2446 1 6 . 1 1 50 50 MET CA C 50 57.730 57.730 58.694 -0.964 18222
2447 1 6 . 1 1 50 50 MET CB C 50 27.160 27.160 32.643 -5.483 18222
2448 1 6 . 1 1 50 50 MET H H 50 7.880 7.880 8.304 -0.424 18222
2449 1 6 . 1 1 51 51 PHE N N 51 119.550 119.550 119.343 0.207 18222
2450 1 6 . 1 1 51 51 PHE CA C 51 60.850 60.850 61.852 -1.002 18222
2451 1 6 . 1 1 51 51 PHE CB C 51 38.720 38.720 39.117 -0.397 18222
2452 1 6 . 1 1 51 51 PHE H H 51 7.890 7.890 8.384 -0.494 18222
2453 1 6 . 1 1 52 52 ILE N N 52 117.950 117.950 113.885 4.065 18222
2454 1 6 . 1 1 52 52 ILE HA H 52 4.050 4.050 4.041 0.009 18222
2455 1 6 . 1 1 52 52 ILE CA C 52 63.560 63.560 64.104 -0.544 18222
2456 1 6 . 1 1 52 52 ILE CB C 52 36.810 36.810 37.871 -1.061 18222
2457 1 6 . 1 1 52 52 ILE H H 52 8.110 8.110 8.159 -0.049 18222
2458 1 6 . 1 1 53 53 GLN N N 53 117.360 117.360 119.991 -2.631 18222
2459 1 6 . 1 1 53 53 GLN CA C 53 57.200 57.200 58.491 -1.291 18222
2460 1 6 . 1 1 53 53 GLN CB C 53 27.870 27.870 28.370 -0.500 18222
2461 1 6 . 1 1 53 53 GLN H H 53 7.930 7.930 8.364 -0.434 18222
2462 1 6 . 1 1 54 54 ARG N N 54 116.840 116.840 118.517 -1.677 18222
2463 1 6 . 1 1 54 54 ARG HA H 54 3.950 3.950 4.189 -0.239 18222
2464 1 6 . 1 1 54 54 ARG CA C 54 56.480 56.480 57.706 -1.226 18222
2465 1 6 . 1 1 54 54 ARG CB C 54 28.970 28.970 29.967 -0.997 18222
2466 1 6 . 1 1 54 54 ARG H H 54 7.540 7.540 7.890 -0.350 18222
2467 1 6 . 1 1 55 55 LYS N N 55 117.900 117.900 117.892 0.008 18222
2468 1 6 . 1 1 55 55 LYS HA H 55 4.080 4.080 4.314 -0.234 18222
2469 1 6 . 1 1 55 55 LYS CA C 55 55.030 55.030 56.915 -1.885 18222
2470 1 6 . 1 1 55 55 LYS CB C 55 32.010 32.010 32.578 -0.568 18222
2471 1 6 . 1 1 55 55 LYS H H 55 7.660 7.660 7.527 0.133 18222
2472 1 6 . 1 1 56 56 PHE N N 56 121.060 121.060 120.559 0.501 18222
2473 1 6 . 1 1 56 56 PHE CA C 56 55.190 55.190 55.173 0.016 18222
2474 1 6 . 1 1 56 56 PHE CB C 56 38.970 38.970 39.815 -0.844 18222
2475 1 6 . 1 1 56 56 PHE H H 56 8.080 8.080 7.814 0.266 18222
2476 1 6 . 1 1 57 57 PRO CA C 57 62.390 62.390 63.556 -1.166 18222
2477 1 6 . 1 1 57 57 PRO CB C 57 30.580 30.580 31.714 -1.134 18222
2478 1 6 . 1 1 58 58 TYR N N 58 120.240 120.240 120.450 -0.210 18222
2479 1 6 . 1 1 58 58 TYR CA C 58 55.770 55.770 55.498 0.272 18222
2480 1 6 . 1 1 58 58 TYR CB C 58 40.220 40.220 38.758 1.462 18222
2481 1 6 . 1 1 58 58 TYR H H 58 7.700 7.700 7.981 -0.281 18222
2482 1 6 . 1 1 59 59 PRO CA C 59 62.130 62.130 63.800 -1.670 18222
2483 1 6 . 1 1 59 59 PRO CB C 59 33.340 33.340 32.130 1.210 18222
2484 1 6 . 1 1 60 60 LEU N N 60 122.210 122.210 120.193 2.017 18222
2485 1 6 . 1 1 60 60 LEU CA C 60 54.250 54.250 54.248 0.002 18222
2486 1 6 . 1 1 60 60 LEU CB C 60 41.470 41.470 42.827 -1.357 18222
2487 1 6 . 1 1 60 60 LEU H H 60 7.880 7.880 7.794 0.086 18222
2488 1 6 . 1 1 61 61 GLN N N 61 122.470 122.470 120.375 2.095 18222
2489 1 6 . 1 1 61 61 GLN CA C 61 54.170 54.170 55.314 -1.144 18222
2490 1 6 . 1 1 61 61 GLN H H 61 7.970 7.970 8.267 -0.297 18222
2491 1 6 . 1 1 62 62 TRP N N 62 124.590 124.590 124.545 0.045 18222
2492 1 6 . 1 1 62 62 TRP CA C 62 59.830 59.830 60.075 -0.245 18222
2493 1 6 . 1 1 62 62 TRP CB C 62 28.800 28.800 29.163 -0.363 18222
2494 1 6 . 1 1 62 62 TRP H H 62 8.240 8.240 8.570 -0.330 18222
2495 1 6 . 1 1 63 63 SER N N 63 113.320 113.320 115.677 -2.357 18222
2496 1 6 . 1 1 63 63 SER CA C 63 61.100 61.100 61.629 -0.529 18222
2497 1 6 . 1 1 63 63 SER H H 63 8.410 8.410 9.329 -0.919 18222
2498 1 6 . 1 1 64 64 LEU N N 64 123.230 123.230 122.803 0.427 18222
2499 1 6 . 1 1 64 64 LEU CA C 64 56.880 56.880 57.630 -0.750 18222
2500 1 6 . 1 1 64 64 LEU CB C 64 40.830 40.830 41.967 -1.137 18222
2501 1 6 . 1 1 64 64 LEU H H 64 7.230 7.230 7.921 -0.691 18222
2502 1 6 . 1 1 65 65 LEU N N 65 119.400 119.400 120.144 -0.744 18222
2503 1 6 . 1 1 65 65 LEU HA H 65 3.890 3.890 4.032 -0.142 18222
2504 1 6 . 1 1 65 65 LEU CA C 65 57.580 57.580 58.345 -0.765 18222
2505 1 6 . 1 1 65 65 LEU CB C 65 40.710 40.710 42.015 -1.305 18222
2506 1 6 . 1 1 65 65 LEU H H 65 7.510 7.510 8.753 -1.243 18222
2507 1 6 . 1 1 66 66 VAL N N 66 116.950 116.950 119.194 -2.244 18222
2508 1 6 . 1 1 66 66 VAL HA H 66 3.960 3.960 3.626 0.334 18222
2509 1 6 . 1 1 66 66 VAL CA C 66 66.260 66.260 66.772 -0.512 18222
2510 1 6 . 1 1 66 66 VAL CB C 66 30.570 30.570 31.322 -0.752 18222
2511 1 6 . 1 1 66 66 VAL H H 66 7.950 7.950 8.257 -0.306 18222
2512 1 6 . 1 1 67 67 ALA N N 67 120.650 120.650 122.599 -1.949 18222
2513 1 6 . 1 1 67 67 ALA HA H 67 4.000 4.000 3.938 0.062 18222
2514 1 6 . 1 1 67 67 ALA CA C 67 54.780 54.780 55.124 -0.344 18222
2515 1 6 . 1 1 67 67 ALA CB C 67 17.440 17.440 18.093 -0.653 18222
2516 1 6 . 1 1 67 67 ALA H H 67 7.450 7.450 7.877 -0.427 18222
2517 1 6 . 1 1 68 68 VAL N N 68 118.440 118.440 118.687 -0.247 18222
2518 1 6 . 1 1 68 68 VAL HA H 68 3.750 3.750 3.625 0.125 18222
2519 1 6 . 1 1 68 68 VAL CA C 68 65.250 65.250 67.127 -1.877 18222
2520 1 6 . 1 1 68 68 VAL CB C 68 30.850 30.850 32.105 -1.255 18222
2521 1 6 . 1 1 68 68 VAL H H 68 7.960 7.960 7.966 -0.006 18222
2522 1 6 . 1 1 69 69 VAL N N 69 120.800 120.800 120.522 0.278 18222
2523 1 6 . 1 1 69 69 VAL HA H 69 4.220 4.220 3.611 0.609 18222
2524 1 6 . 1 1 69 69 VAL CA C 69 66.020 66.020 67.440 -1.420 18222
2525 1 6 . 1 1 69 69 VAL CB C 69 30.850 30.850 31.398 -0.547 18222
2526 1 6 . 1 1 69 69 VAL H H 69 8.080 8.080 8.428 -0.348 18222
2527 1 6 . 1 1 70 70 ALA N N 70 121.740 121.740 120.582 1.158 18222
2528 1 6 . 1 1 70 70 ALA HA H 70 3.920 3.920 4.246 -0.326 18222
2529 1 6 . 1 1 70 70 ALA CA C 70 54.920 54.920 55.297 -0.377 18222
2530 1 6 . 1 1 70 70 ALA CB C 70 17.620 17.620 18.027 -0.407 18222
2531 1 6 . 1 1 70 70 ALA H H 70 8.660 8.660 8.603 0.057 18222
2532 1 6 . 1 1 71 71 GLY N N 71 103.450 103.450 107.160 -3.710 18222
2533 1 6 . 1 1 71 71 GLY CA C 71 46.300 46.300 46.984 -0.684 18222
2534 1 6 . 1 1 71 71 GLY H H 71 8.010 8.010 8.141 -0.131 18222
2535 1 6 . 1 1 72 72 SER N N 72 118.160 118.160 117.780 0.380 18222
2536 1 6 . 1 1 72 72 SER CA C 72 61.260 61.260 61.190 0.070 18222
2537 1 6 . 1 1 72 72 SER CB C 72 62.870 62.870 63.235 -0.365 18222
2538 1 6 . 1 1 72 72 SER H H 72 7.870 7.870 8.170 -0.300 18222
2539 1 6 . 1 1 73 73 VAL N N 73 121.340 121.340 122.190 -0.850 18222
2540 1 6 . 1 1 73 73 VAL CA C 73 65.750 65.750 67.292 -1.542 18222
2541 1 6 . 1 1 73 73 VAL CB C 73 30.740 30.740 31.808 -1.068 18222
2542 1 6 . 1 1 73 73 VAL H H 73 8.050 8.050 8.260 -0.210 18222
2543 1 6 . 1 1 74 74 VAL N N 74 118.680 118.680 118.572 0.108 18222
2544 1 6 . 1 1 74 74 VAL CA C 74 65.770 65.770 67.029 -1.259 18222
2545 1 6 . 1 1 74 74 VAL CB C 74 30.740 30.740 31.069 -0.329 18222
2546 1 6 . 1 1 74 74 VAL H H 74 7.880 7.880 8.549 -0.669 18222
2547 1 6 . 1 1 75 75 SER N N 75 114.750 114.750 115.783 -1.033 18222
2548 1 6 . 1 1 75 75 SER HA H 75 4.100 4.100 4.175 -0.075 18222
2549 1 6 . 1 1 75 75 SER CA C 75 60.870 60.870 61.558 -0.688 18222
2550 1 6 . 1 1 75 75 SER CB C 75 62.340 62.340 63.048 -0.708 18222
2551 1 6 . 1 1 75 75 SER H H 75 7.870 7.870 8.107 -0.237 18222
2552 1 6 . 1 1 76 76 TYR N N 76 121.110 121.110 121.857 -0.747 18222
2553 1 6 . 1 1 76 76 TYR CA C 76 60.050 60.050 61.754 -1.704 18222
2554 1 6 . 1 1 76 76 TYR CB C 76 37.980 37.980 38.565 -0.585 18222
2555 1 6 . 1 1 76 76 TYR H H 76 7.860 7.860 8.552 -0.692 18222
2556 1 6 . 1 1 77 77 GLY N N 77 107.300 107.300 106.741 0.559 18222
2557 1 6 . 1 1 77 77 GLY CA C 77 46.560 46.560 47.309 -0.749 18222
2558 1 6 . 1 1 77 77 GLY H H 77 8.200 8.200 8.547 -0.347 18222
2559 1 6 . 1 1 78 78 VAL N N 78 119.470 119.470 118.694 0.776 18222
2560 1 6 . 1 1 78 78 VAL HA H 78 4.170 4.170 3.903 0.267 18222
2561 1 6 . 1 1 78 78 VAL CA C 78 64.650 64.650 66.359 -1.709 18222
2562 1 6 . 1 1 78 78 VAL H H 78 8.140 8.140 8.658 -0.518 18222
2563 1 6 . 1 1 79 79 THR N N 79 112.100 112.100 117.244 -5.144 18222
2564 1 6 . 1 1 79 79 THR CA C 79 63.460 63.460 66.421 -2.961 18222
2565 1 6 . 1 1 79 79 THR CB C 79 68.650 68.650 68.419 0.231 18222
2566 1 6 . 1 1 79 79 THR H H 79 7.640 7.640 8.075 -0.435 18222
2567 1 6 . 1 1 80 80 ARG N N 80 120.770 120.770 121.810 -1.040 18222
2568 1 6 . 1 1 80 80 ARG HA H 80 4.160 4.160 4.212 -0.052 18222
2569 1 6 . 1 1 80 80 ARG CA C 80 56.790 56.790 58.829 -2.039 18222
2570 1 6 . 1 1 80 80 ARG CB C 80 29.430 29.430 29.966 -0.536 18222
2571 1 6 . 1 1 80 80 ARG H H 80 7.680 7.680 8.174 -0.494 18222
2572 1 6 . 1 1 81 81 VAL N N 81 118.370 118.370 117.602 0.768 18222
2573 1 6 . 1 1 81 81 VAL HA H 81 3.920 3.920 3.870 0.050 18222
2574 1 6 . 1 1 81 81 VAL CA C 81 63.340 63.340 66.794 -3.454 18222
2575 1 6 . 1 1 81 81 VAL CB C 81 31.260 31.260 31.390 -0.130 18222
2576 1 6 . 1 1 81 81 VAL H H 81 7.730 7.730 8.284 -0.553 18222
2577 1 6 . 1 1 82 82 GLU N N 82 120.620 120.620 119.992 0.628 18222
2578 1 6 . 1 1 82 82 GLU CA C 82 56.320 56.320 59.454 -3.134 18222
2579 1 6 . 1 1 82 82 GLU CB C 82 27.930 27.930 29.382 -1.452 18222
2580 1 6 . 1 1 82 82 GLU H H 82 7.920 7.920 8.614 -0.694 18222
2581 1 6 . 1 1 83 83 SER N N 83 116.240 116.240 116.557 -0.317 18222
2582 1 6 . 1 1 83 83 SER CA C 83 59.250 59.250 62.246 -2.996 18222
2583 1 6 . 1 1 83 83 SER CB C 83 63.160 63.160 63.215 -0.055 18222
2584 1 6 . 1 1 83 83 SER H H 83 7.960 7.960 8.069 -0.109 18222
2585 1 6 . 1 1 84 84 GLU N N 84 123.280 123.280 122.075 1.205 18222
2586 1 6 . 1 1 84 84 GLU HA H 84 4.080 4.080 4.026 0.054 18222
2587 1 6 . 1 1 84 84 GLU CA C 84 57.860 57.860 59.843 -1.983 18222
2588 1 6 . 1 1 84 84 GLU CB C 84 28.190 28.190 29.614 -1.424 18222
2589 1 6 . 1 1 84 84 GLU H H 84 8.470 8.470 8.084 0.386 18222
2590 1 6 . 1 1 85 85 LYS N N 85 118.650 118.650 119.296 -0.646 18222
2591 1 6 . 1 1 85 85 LYS HA H 85 4.100 4.100 4.130 -0.030 18222
2592 1 6 . 1 1 85 85 LYS CA C 85 57.780 57.780 59.057 -1.277 18222
2593 1 6 . 1 1 85 85 LYS CB C 85 31.380 31.380 32.207 -0.827 18222
2594 1 6 . 1 1 85 85 LYS H H 85 7.940 7.940 8.170 -0.230 18222
2595 1 6 . 1 1 86 86 CYS N N 86 117.070 117.070 119.126 -2.056 18222
2596 1 6 . 1 1 86 86 CYS CA C 86 60.910 60.910 63.507 -2.597 18222
2597 1 6 . 1 1 86 86 CYS CB C 86 26.740 26.740 26.685 0.055 18222
2598 1 6 . 1 1 86 86 CYS H H 86 7.840 7.840 8.113 -0.273 18222
2599 1 6 . 1 1 87 87 ASN N N 87 119.370 119.370 119.073 0.297 18222
2600 1 6 . 1 1 87 87 ASN HA H 87 4.130 4.130 4.683 -0.553 18222
2601 1 6 . 1 1 87 87 ASN CA C 87 55.750 55.750 56.608 -0.858 18222
2602 1 6 . 1 1 87 87 ASN CB C 87 38.050 38.050 38.308 -0.258 18222
2603 1 6 . 1 1 87 87 ASN H H 87 8.110 8.110 8.705 -0.595 18222
2604 1 6 . 1 1 88 88 ASN N N 88 117.570 117.570 119.571 -2.001 18222
2605 1 6 . 1 1 88 88 ASN HA H 88 4.280 4.280 4.577 -0.297 18222
2606 1 6 . 1 1 88 88 ASN CA C 88 55.190 55.190 56.111 -0.921 18222
2607 1 6 . 1 1 88 88 ASN CB C 88 37.400 37.400 38.319 -0.919 18222
2608 1 6 . 1 1 88 88 ASN H H 88 8.280 8.280 8.266 0.014 18222
2609 1 6 . 1 1 89 89 LEU N N 89 121.940 121.940 121.668 0.272 18222
2610 1 6 . 1 1 89 89 LEU HA H 89 4.070 4.070 4.006 0.064 18222
2611 1 6 . 1 1 89 89 LEU CA C 89 57.580 57.580 58.250 -0.670 18222
2612 1 6 . 1 1 89 89 LEU CB C 89 40.490 40.490 41.004 -0.513 18222
2613 1 6 . 1 1 89 89 LEU H H 89 7.790 7.790 8.288 -0.498 18222
2614 1 6 . 1 1 90 90 TRP N N 90 119.220 119.220 121.496 -2.276 18222
2615 1 6 . 1 1 90 90 TRP CA C 90 59.120 59.120 61.804 -2.684 18222
2616 1 6 . 1 1 90 90 TRP CB C 90 28.800 28.800 29.285 -0.485 18222
2617 1 6 . 1 1 90 90 TRP H H 90 7.850 7.850 8.171 -0.321 18222
2618 1 6 . 1 1 91 91 LEU N N 91 117.870 117.870 120.138 -2.268 18222
2619 1 6 . 1 1 91 91 LEU CA C 91 57.300 57.300 57.888 -0.588 18222
2620 1 6 . 1 1 91 91 LEU CB C 91 40.610 40.610 41.938 -1.328 18222
2621 1 6 . 1 1 91 91 LEU H H 91 7.920 7.920 8.649 -0.729 18222
2622 1 6 . 1 1 92 92 PHE N N 92 121.280 121.280 118.425 2.855 18222
2623 1 6 . 1 1 92 92 PHE CA C 92 60.390 60.390 62.005 -1.615 18222
2624 1 6 . 1 1 92 92 PHE CB C 92 37.980 37.980 38.661 -0.681 18222
2625 1 6 . 1 1 92 92 PHE H H 92 7.860 7.860 8.272 -0.412 18222
2626 1 6 . 1 1 93 93 LEU N N 93 119.860 119.860 119.403 0.457 18222
2627 1 6 . 1 1 93 93 LEU CA C 93 56.860 56.860 58.169 -1.309 18222
2628 1 6 . 1 1 93 93 LEU CB C 93 40.550 40.550 41.891 -1.341 18222
2629 1 6 . 1 1 93 93 LEU H H 93 7.980 7.980 8.705 -0.725 18222
2630 1 6 . 1 1 94 94 GLU N N 94 114.660 114.660 118.768 -4.108 18222
2631 1 6 . 1 1 94 94 GLU HA H 94 3.810 3.810 3.861 -0.051 18222
2632 1 6 . 1 1 94 94 GLU CA C 94 57.210 57.210 58.848 -1.638 18222
2633 1 6 . 1 1 94 94 GLU CB C 94 28.470 28.470 29.241 -0.772 18222
2634 1 6 . 1 1 94 94 GLU H H 94 7.890 7.890 8.002 -0.112 18222
2635 1 6 . 1 1 95 95 THR N N 95 108.260 108.260 111.065 -2.805 18222
2636 1 6 . 1 1 95 95 THR CA C 95 62.150 62.150 62.070 0.080 18222
2637 1 6 . 1 1 95 95 THR CB C 95 70.810 70.810 69.358 1.452 18222
2638 1 6 . 1 1 95 95 THR H H 95 7.690 7.690 7.307 0.383 18222
2639 1 6 . 1 1 96 96 GLY N N 96 112.220 112.220 110.318 1.902 18222
2640 1 6 . 1 1 96 96 GLY CA C 96 45.410 45.410 44.886 0.524 18222
2641 1 6 . 1 1 96 96 GLY H H 96 8.240 8.240 7.681 0.559 18222
2642 1 6 . 1 1 97 97 GLN N N 97 117.950 117.950 121.761 -3.811 18222
2643 1 6 . 1 1 97 97 GLN HA H 97 4.200 4.200 4.323 -0.123 18222
2644 1 6 . 1 1 97 97 GLN CA C 97 54.430 54.430 54.694 -0.264 18222
2645 1 6 . 1 1 97 97 GLN CB C 97 29.910 29.910 27.584 2.326 18222
2646 1 6 . 1 1 97 97 GLN H H 97 7.640 7.640 8.208 -0.568 18222
2647 1 6 . 1 1 98 98 LEU N N 98 123.810 123.810 124.043 -0.233 18222
2648 1 6 . 1 1 98 98 LEU HA H 98 4.360 4.360 4.465 -0.105 18222
2649 1 6 . 1 1 98 98 LEU CA C 98 52.650 52.650 53.922 -1.272 18222
2650 1 6 . 1 1 98 98 LEU CB C 98 40.460 40.460 42.445 -1.985 18222
2651 1 6 . 1 1 98 98 LEU H H 98 8.270 8.270 7.684 0.586 18222
2652 1 6 . 1 1 99 99 PRO CA C 99 63.180 63.180 62.328 0.852 18222
2653 1 6 . 1 1 99 99 PRO CB C 99 30.840 30.840 32.484 -1.644 18222
2654 1 6 . 1 1 100 100 LYS N N 100 120.630 120.630 120.432 0.198 18222
2655 1 6 . 1 1 100 100 LYS CA C 100 55.730 55.730 56.086 -0.355 18222
2656 1 6 . 1 1 100 100 LYS CB C 100 32.280 32.280 33.110 -0.830 18222
2657 1 6 . 1 1 100 100 LYS H H 100 8.090 8.090 8.352 -0.262 18222
2658 1 6 . 1 1 101 101 ASP N N 101 120.920 120.920 121.018 -0.098 18222
2659 1 6 . 1 1 101 101 ASP HA H 101 4.190 4.190 4.814 -0.624 18222
2660 1 6 . 1 1 101 101 ASP CA C 101 54.000 54.000 54.315 -0.315 18222
2661 1 6 . 1 1 101 101 ASP CB C 101 40.330 40.330 42.222 -1.892 18222
2662 1 6 . 1 1 101 101 ASP H H 101 8.190 8.190 8.407 -0.217 18222
2663 1 6 . 1 1 102 102 ARG N N 102 122.210 122.210 122.612 -0.402 18222
2664 1 6 . 1 1 102 102 ARG CA C 102 55.590 55.590 56.691 -1.101 18222
2665 1 6 . 1 1 102 102 ARG CB C 102 29.630 29.630 31.268 -1.638 18222
2666 1 6 . 1 1 102 102 ARG H H 102 8.130 8.130 8.471 -0.341 18222
2667 1 6 . 1 1 103 103 SER N N 103 117.230 117.230 119.880 -2.650 18222
2668 1 6 . 1 1 103 103 SER HA H 103 4.280 4.280 4.275 0.005 18222
2669 1 6 . 1 1 103 103 SER CA C 103 58.470 58.470 59.329 -0.859 18222
2670 1 6 . 1 1 103 103 SER CB C 103 63.080 63.080 63.568 -0.488 18222
2671 1 6 . 1 1 103 103 SER H H 103 8.290 8.290 8.528 -0.238 18222
2672 1 6 . 1 1 104 104 THR N N 104 115.430 115.430 112.613 2.817 18222
2673 1 6 . 1 1 104 104 THR CA C 104 61.570 61.570 62.872 -1.302 18222
2674 1 6 . 1 1 104 104 THR CB C 104 69.030 69.030 68.335 0.694 18222
2675 1 6 . 1 1 104 104 THR H H 104 8.020 8.020 8.016 0.004 18222
2676 1 6 . 1 1 105 105 ASP N N 105 122.780 122.780 121.629 1.151 18222
2677 1 6 . 1 1 105 105 ASP CA C 105 54.210 54.210 54.361 -0.151 18222
2678 1 6 . 1 1 105 105 ASP CB C 105 40.380 40.380 41.219 -0.840 18222
2679 1 6 . 1 1 105 105 ASP H H 105 8.120 8.120 8.162 -0.042 18222
2680 1 6 . 1 1 106 106 GLN N N 106 120.960 120.960 119.354 1.606 18222
2681 1 6 . 1 1 106 106 GLN CA C 106 55.420 55.420 57.055 -1.635 18222
2682 1 6 . 1 1 106 106 GLN CB C 106 28.310 28.310 29.176 -0.866 18222
2683 1 6 . 1 1 106 106 GLN H H 106 8.140 8.140 8.260 -0.120 18222
2684 1 6 . 1 1 107 107 ARG N N 107 123.010 123.010 121.178 1.832 18222
2685 1 6 . 1 1 107 107 ARG HA H 107 4.210 4.210 4.727 -0.517 18222
2686 1 6 . 1 1 107 107 ARG CA C 107 55.560 55.560 56.005 -0.445 18222
2687 1 6 . 1 1 107 107 ARG CB C 107 29.920 29.920 31.448 -1.528 18222
2688 1 6 . 1 1 107 107 ARG H H 107 8.180 8.180 8.639 -0.459 18222
2689 1 7 . 1 1 2 2 VAL N N 2 121.590 121.590 119.922 1.668 18222
2690 1 7 . 1 1 2 2 VAL CA C 2 61.600 61.600 62.017 -0.417 18222
2691 1 7 . 1 1 2 2 VAL CB C 2 31.900 31.900 32.181 -0.281 18222
2692 1 7 . 1 1 2 2 VAL H H 2 8.010 8.010 8.009 0.001 18222
2693 1 7 . 1 1 3 3 ASN N N 3 122.520 122.520 120.998 1.522 18222
2694 1 7 . 1 1 3 3 ASN HA H 3 4.020 4.020 4.335 -0.315 18222
2695 1 7 . 1 1 3 3 ASN CA C 3 52.640 52.640 53.670 -1.030 18222
2696 1 7 . 1 1 3 3 ASN CB C 3 38.330 38.330 38.664 -0.334 18222
2697 1 7 . 1 1 3 3 ASN H H 3 8.360 8.360 8.593 -0.233 18222
2698 1 7 . 1 1 4 4 LEU N N 4 123.830 123.830 121.335 2.495 18222
2699 1 7 . 1 1 4 4 LEU HA H 4 4.220 4.220 3.957 0.263 18222
2700 1 7 . 1 1 4 4 LEU CA C 4 54.620 54.620 56.420 -1.800 18222
2701 1 7 . 1 1 4 4 LEU CB C 4 41.680 41.680 40.427 1.253 18222
2702 1 7 . 1 1 4 4 LEU H H 4 8.220 8.220 8.589 -0.369 18222
2703 1 7 . 1 1 5 5 GLY N N 5 106.810 106.810 109.003 -2.193 18222
2704 1 7 . 1 1 5 5 GLY CA C 5 45.800 45.800 45.053 0.746 18222
2705 1 7 . 1 1 5 5 GLY H H 5 8.030 8.030 7.665 0.365 18222
2706 1 7 . 1 1 6 6 LEU N N 6 120.820 120.820 123.675 -2.855 18222
2707 1 7 . 1 1 6 6 LEU HA H 6 4.050 4.050 3.992 0.058 18222
2708 1 7 . 1 1 6 6 LEU CA C 6 55.990 55.990 58.069 -2.079 18222
2709 1 7 . 1 1 6 6 LEU CB C 6 40.800 40.800 42.012 -1.212 18222
2710 1 7 . 1 1 6 6 LEU H H 6 8.030 8.030 8.654 -0.624 18222
2711 1 7 . 1 1 7 7 SER N N 7 115.540 115.540 113.380 2.160 18222
2712 1 7 . 1 1 7 7 SER HA H 7 4.100 4.100 4.109 -0.009 18222
2713 1 7 . 1 1 7 7 SER CA C 7 60.580 60.580 61.348 -0.768 18222
2714 1 7 . 1 1 7 7 SER CB C 7 62.060 62.060 62.427 -0.367 18222
2715 1 7 . 1 1 7 7 SER H H 7 8.360 8.360 8.358 0.002 18222
2716 1 7 . 1 1 8 8 ARG N N 8 120.690 120.690 121.526 -0.836 18222
2717 1 7 . 1 1 8 8 ARG HA H 8 4.160 4.160 4.185 -0.025 18222
2718 1 7 . 1 1 8 8 ARG CA C 8 57.350 57.350 59.034 -1.684 18222
2719 1 7 . 1 1 8 8 ARG CB C 8 29.230 29.230 29.891 -0.661 18222
2720 1 7 . 1 1 8 8 ARG H H 8 7.830 7.830 8.231 -0.401 18222
2721 1 7 . 1 1 9 9 VAL N N 9 119.330 119.330 120.023 -0.693 18222
2722 1 7 . 1 1 9 9 VAL HA H 9 4.170 4.170 3.709 0.461 18222
2723 1 7 . 1 1 9 9 VAL CA C 9 64.720 64.720 67.163 -2.443 18222
2724 1 7 . 1 1 9 9 VAL CB C 9 30.900 30.900 31.509 -0.609 18222
2725 1 7 . 1 1 9 9 VAL H H 9 7.620 7.620 8.572 -0.952 18222
2726 1 7 . 1 1 10 10 ASP N N 10 119.520 119.520 119.883 -0.363 18222
2727 1 7 . 1 1 10 10 ASP CA C 10 54.960 54.960 57.636 -2.676 18222
2728 1 7 . 1 1 10 10 ASP CB C 10 37.800 37.800 40.439 -2.639 18222
2729 1 7 . 1 1 10 10 ASP H H 10 8.180 8.180 8.221 -0.041 18222
2730 1 7 . 1 1 11 11 ASP N N 11 121.550 121.550 121.200 0.350 18222
2731 1 7 . 1 1 11 11 ASP CA C 11 54.440 54.440 57.280 -2.840 18222
2732 1 7 . 1 1 11 11 ASP CB C 11 37.840 37.840 40.921 -3.081 18222
2733 1 7 . 1 1 11 11 ASP H H 11 7.950 7.950 8.439 -0.489 18222
2734 1 7 . 1 1 12 12 ALA N N 12 120.220 120.220 122.653 -2.433 18222
2735 1 7 . 1 1 12 12 ALA CA C 12 54.370 54.370 55.242 -0.872 18222
2736 1 7 . 1 1 12 12 ALA CB C 12 24.730 24.730 18.498 6.232 18222
2737 1 7 . 1 1 12 12 ALA H H 12 8.090 8.090 8.132 -0.042 18222
2738 1 7 . 1 1 13 13 VAL N N 13 116.910 116.910 115.118 1.792 18222
2739 1 7 . 1 1 13 13 VAL HA H 13 4.140 4.140 3.678 0.462 18222
2740 1 7 . 1 1 13 13 VAL CA C 13 64.900 64.900 65.743 -0.843 18222
2741 1 7 . 1 1 13 13 VAL CB C 13 31.000 31.000 31.436 -0.436 18222
2742 1 7 . 1 1 13 13 VAL H H 13 7.980 7.980 8.327 -0.347 18222
2743 1 7 . 1 1 14 14 ALA N N 14 122.200 122.200 123.457 -1.257 18222
2744 1 7 . 1 1 14 14 ALA HA H 14 4.020 4.020 4.213 -0.193 18222
2745 1 7 . 1 1 14 14 ALA CA C 14 53.800 53.800 55.072 -1.272 18222
2746 1 7 . 1 1 14 14 ALA CB C 14 17.790 17.790 18.366 -0.576 18222
2747 1 7 . 1 1 14 14 ALA H H 14 8.030 8.030 8.335 -0.305 18222
2748 1 7 . 1 1 15 15 ALA N N 15 118.600 118.600 118.770 -0.170 18222
2749 1 7 . 1 1 15 15 ALA CA C 15 53.230 53.230 54.421 -1.191 18222
2750 1 7 . 1 1 15 15 ALA CB C 15 18.010 18.010 18.562 -0.552 18222
2751 1 7 . 1 1 15 15 ALA H H 15 7.530 7.530 8.061 -0.531 18222
2752 1 7 . 1 1 16 16 LYS N N 16 115.820 115.820 117.367 -1.547 18222
2753 1 7 . 1 1 16 16 LYS HA H 16 4.080 4.080 4.240 -0.160 18222
2754 1 7 . 1 1 16 16 LYS CA C 16 55.670 55.670 57.533 -1.863 18222
2755 1 7 . 1 1 16 16 LYS CB C 16 32.640 32.640 33.598 -0.958 18222
2756 1 7 . 1 1 16 16 LYS H H 16 7.490 7.490 7.829 -0.339 18222
2757 1 7 . 1 1 17 17 HIS N N 17 116.790 116.790 119.023 -2.233 18222
2758 1 7 . 1 1 17 17 HIS HA H 17 4.100 4.100 4.939 -0.839 18222
2759 1 7 . 1 1 17 17 HIS CA C 17 52.820 52.820 52.631 0.189 18222
2760 1 7 . 1 1 17 17 HIS CB C 17 28.400 28.400 30.966 -2.566 18222
2761 1 7 . 1 1 17 17 HIS H H 17 8.130 8.130 8.467 -0.337 18222
2762 1 7 . 1 1 18 18 PRO CA C 18 63.800 63.800 62.907 0.893 18222
2763 1 7 . 1 1 18 18 PRO CB C 18 30.800 30.800 32.907 -2.107 18222
2764 1 7 . 1 1 19 19 GLY N N 19 110.260 110.260 108.261 1.999 18222
2765 1 7 . 1 1 19 19 GLY CA C 19 45.490 45.490 45.094 0.396 18222
2766 1 7 . 1 1 19 19 GLY H H 19 8.730 8.730 8.449 0.281 18222
2767 1 7 . 1 1 20 20 LEU N N 20 122.650 122.650 125.881 -3.231 18222
2768 1 7 . 1 1 20 20 LEU HA H 20 4.090 4.090 4.403 -0.313 18222
2769 1 7 . 1 1 20 20 LEU CA C 20 57.060 57.060 57.012 0.048 18222
2770 1 7 . 1 1 20 20 LEU H H 20 7.980 7.980 8.267 -0.287 18222
2771 1 7 . 1 1 21 21 GLY N N 21 107.000 107.000 106.888 0.112 18222
2772 1 7 . 1 1 21 21 GLY CA C 21 46.710 46.710 47.478 -0.769 18222
2773 1 7 . 1 1 21 21 GLY H H 21 8.570 8.570 8.957 -0.387 18222
2774 1 7 . 1 1 22 22 GLU N N 22 121.610 121.610 121.958 -0.348 18222
2775 1 7 . 1 1 22 22 GLU HA H 22 3.990 3.990 4.038 -0.048 18222
2776 1 7 . 1 1 22 22 GLU CA C 22 58.280 58.280 59.590 -1.310 18222
2777 1 7 . 1 1 22 22 GLU CB C 22 28.010 28.010 29.344 -1.334 18222
2778 1 7 . 1 1 22 22 GLU H H 22 8.100 8.100 8.273 -0.173 18222
2779 1 7 . 1 1 23 23 TYR N N 23 120.870 120.870 120.126 0.744 18222
2780 1 7 . 1 1 23 23 TYR CA C 23 60.380 60.380 60.930 -0.550 18222
2781 1 7 . 1 1 23 23 TYR CB C 23 37.750 37.750 37.913 -0.163 18222
2782 1 7 . 1 1 23 23 TYR H H 23 7.910 7.910 7.800 0.110 18222
2783 1 7 . 1 1 24 24 ALA N N 24 121.420 121.420 121.744 -0.324 18222
2784 1 7 . 1 1 24 24 ALA HA H 24 4.140 4.140 4.055 0.085 18222
2785 1 7 . 1 1 24 24 ALA CA C 24 54.260 54.260 54.945 -0.685 18222
2786 1 7 . 1 1 24 24 ALA H H 24 8.410 8.410 8.754 -0.344 18222
2787 1 7 . 1 1 25 25 ALA N N 25 120.220 120.220 122.094 -1.874 18222
2788 1 7 . 1 1 25 25 ALA CA C 25 54.370 54.370 55.094 -0.724 18222
2789 1 7 . 1 1 25 25 ALA H H 25 8.090 8.090 8.551 -0.461 18222
2790 1 7 . 1 1 26 26 CYS N N 26 116.760 116.760 117.190 -0.430 18222
2791 1 7 . 1 1 26 26 CYS CA C 26 61.180 61.180 61.746 -0.566 18222
2792 1 7 . 1 1 26 26 CYS CB C 26 26.390 26.390 26.709 -0.319 18222
2793 1 7 . 1 1 26 26 CYS H H 26 7.950 7.950 8.499 -0.549 18222
2794 1 7 . 1 1 27 27 GLN N N 27 118.690 118.690 121.204 -2.514 18222
2795 1 7 . 1 1 27 27 GLN CA C 27 55.970 55.970 59.807 -3.837 18222
2796 1 7 . 1 1 27 27 GLN H H 27 8.060 8.060 8.304 -0.244 18222
2797 1 7 . 1 1 28 28 SER N N 28 115.490 115.490 115.074 0.416 18222
2798 1 7 . 1 1 28 28 SER HA H 28 3.990 3.990 4.092 -0.102 18222
2799 1 7 . 1 1 28 28 SER CA C 28 61.110 61.110 61.523 -0.413 18222
2800 1 7 . 1 1 28 28 SER H H 28 7.980 7.980 8.642 -0.662 18222
2801 1 7 . 1 1 29 29 HIS N N 29 120.880 120.880 121.774 -0.894 18222
2802 1 7 . 1 1 29 29 HIS CA C 29 58.190 58.190 59.789 -1.599 18222
2803 1 7 . 1 1 29 29 HIS CB C 29 27.460 27.460 29.945 -2.486 18222
2804 1 7 . 1 1 29 29 HIS H H 29 8.180 8.180 8.387 -0.207 18222
2805 1 7 . 1 1 30 30 ALA N N 30 122.920 122.920 122.886 0.034 18222
2806 1 7 . 1 1 30 30 ALA CA C 30 54.560 54.560 55.418 -0.858 18222
2807 1 7 . 1 1 30 30 ALA CB C 30 17.490 17.490 18.276 -0.786 18222
2808 1 7 . 1 1 30 30 ALA H H 30 8.040 8.040 8.006 0.034 18222
2809 1 7 . 1 1 31 31 PHE N N 31 119.340 119.340 119.973 -0.633 18222
2810 1 7 . 1 1 31 31 PHE CA C 31 60.370 60.370 61.731 -1.361 18222
2811 1 7 . 1 1 31 31 PHE CB C 31 38.520 38.520 39.156 -0.636 18222
2812 1 7 . 1 1 31 31 PHE H H 31 8.230 8.230 8.267 -0.037 18222
2813 1 7 . 1 1 32 32 MET N N 32 118.110 118.110 118.765 -0.655 18222
2814 1 7 . 1 1 32 32 MET HA H 32 4.050 4.050 4.108 -0.058 18222
2815 1 7 . 1 1 32 32 MET CA C 32 58.280 58.280 59.372 -1.092 18222
2816 1 7 . 1 1 32 32 MET CB C 32 31.090 31.090 32.639 -1.550 18222
2817 1 7 . 1 1 32 32 MET H H 32 8.120 8.120 8.744 -0.624 18222
2818 1 7 . 1 1 33 33 LYS N N 33 119.040 119.040 119.731 -0.691 18222
2819 1 7 . 1 1 33 33 LYS HA H 33 3.930 3.930 3.851 0.079 18222
2820 1 7 . 1 1 33 33 LYS CA C 33 59.040 59.040 59.892 -0.853 18222
2821 1 7 . 1 1 33 33 LYS CB C 33 30.990 30.990 32.131 -1.141 18222
2822 1 7 . 1 1 33 33 LYS H H 33 7.970 7.970 8.372 -0.402 18222
2823 1 7 . 1 1 34 34 GLY N N 34 108.840 108.840 107.152 1.688 18222
2824 1 7 . 1 1 34 34 GLY CA C 34 46.610 46.610 47.297 -0.687 18222
2825 1 7 . 1 1 34 34 GLY H H 34 8.030 8.030 8.220 -0.190 18222
2826 1 7 . 1 1 35 35 VAL N N 35 122.910 122.910 122.186 0.724 18222
2827 1 7 . 1 1 35 35 VAL HA H 35 4.220 4.220 3.623 0.597 18222
2828 1 7 . 1 1 35 35 VAL CA C 35 66.310 66.310 65.569 0.741 18222
2829 1 7 . 1 1 35 35 VAL CB C 35 30.560 30.560 31.302 -0.742 18222
2830 1 7 . 1 1 35 35 VAL H H 35 8.090 8.090 7.966 0.124 18222
2831 1 7 . 1 1 36 36 PHE N N 36 120.020 120.020 121.154 -1.134 18222
2832 1 7 . 1 1 36 36 PHE CA C 36 61.350 61.350 62.861 -1.512 18222
2833 1 7 . 1 1 36 36 PHE CB C 36 38.090 38.090 39.075 -0.985 18222
2834 1 7 . 1 1 36 36 PHE H H 36 8.350 8.350 8.577 -0.227 18222
2835 1 7 . 1 1 37 37 THR N N 37 116.980 116.980 115.808 1.172 18222
2836 1 7 . 1 1 37 37 THR HA H 37 4.050 4.050 3.997 0.053 18222
2837 1 7 . 1 1 37 37 THR CA C 37 66.000 66.000 66.772 -0.772 18222
2838 1 7 . 1 1 37 37 THR CB C 37 68.270 68.270 68.915 -0.645 18222
2839 1 7 . 1 1 37 37 THR H H 37 8.520 8.520 8.123 0.397 18222
2840 1 7 . 1 1 38 38 PHE N N 38 123.090 123.090 121.596 1.494 18222
2841 1 7 . 1 1 38 38 PHE HA H 38 4.360 4.360 4.266 0.094 18222
2842 1 7 . 1 1 38 38 PHE CA C 38 61.140 61.140 61.919 -0.779 18222
2843 1 7 . 1 1 38 38 PHE CB C 38 41.200 41.200 39.466 1.734 18222
2844 1 7 . 1 1 38 38 PHE H H 38 8.010 8.010 8.232 -0.222 18222
2845 1 7 . 1 1 39 39 VAL N N 39 117.280 117.280 118.999 -1.719 18222
2846 1 7 . 1 1 39 39 VAL HA H 39 4.210 4.210 3.647 0.563 18222
2847 1 7 . 1 1 39 39 VAL CA C 39 66.000 66.000 66.425 -0.425 18222
2848 1 7 . 1 1 39 39 VAL CB C 39 30.860 30.860 31.244 -0.384 18222
2849 1 7 . 1 1 39 39 VAL H H 39 8.530 8.530 8.660 -0.130 18222
2850 1 7 . 1 1 40 40 THR N N 40 109.470 109.470 113.767 -4.297 18222
2851 1 7 . 1 1 40 40 THR HA H 40 4.060 4.060 4.179 -0.119 18222
2852 1 7 . 1 1 40 40 THR CA C 40 63.390 63.390 63.762 -0.372 18222
2853 1 7 . 1 1 40 40 THR CB C 40 68.650 68.650 68.421 0.229 18222
2854 1 7 . 1 1 40 40 THR H H 40 7.700 7.700 8.033 -0.333 18222
2855 1 7 . 1 1 41 41 GLY N N 41 110.770 110.770 108.484 2.286 18222
2856 1 7 . 1 1 41 41 GLY CA C 41 45.580 45.580 44.867 0.713 18222
2857 1 7 . 1 1 41 41 GLY H H 41 7.700 7.700 7.801 -0.101 18222
2858 1 7 . 1 1 42 42 THR N N 42 114.520 114.520 115.840 -1.320 18222
2859 1 7 . 1 1 42 42 THR CA C 42 63.300 63.300 60.734 2.566 18222
2860 1 7 . 1 1 42 42 THR CB C 42 69.490 69.490 68.775 0.715 18222
2861 1 7 . 1 1 42 42 THR H H 42 7.720 7.720 7.270 0.450 18222
2862 1 7 . 1 1 43 43 GLY N N 43 109.540 109.540 111.502 -1.962 18222
2863 1 7 . 1 1 43 43 GLY CA C 43 46.250 46.250 46.671 -0.421 18222
2864 1 7 . 1 1 43 43 GLY H H 43 8.110 8.110 8.781 -0.671 18222
2865 1 7 . 1 1 44 44 MET N N 44 120.240 120.240 119.619 0.621 18222
2866 1 7 . 1 1 44 44 MET HA H 44 4.100 4.100 4.115 -0.015 18222
2867 1 7 . 1 1 44 44 MET CA C 44 57.700 57.700 58.318 -0.618 18222
2868 1 7 . 1 1 44 44 MET CB C 44 32.030 32.030 31.749 0.281 18222
2869 1 7 . 1 1 44 44 MET H H 44 7.730 7.730 7.901 -0.171 18222
2870 1 7 . 1 1 45 45 ALA N N 45 121.560 121.560 122.249 -0.689 18222
2871 1 7 . 1 1 45 45 ALA CA C 45 54.440 54.440 54.733 -0.293 18222
2872 1 7 . 1 1 45 45 ALA CB C 45 17.400 17.400 18.000 -0.600 18222
2873 1 7 . 1 1 45 45 ALA H H 45 7.950 7.950 7.656 0.294 18222
2874 1 7 . 1 1 46 46 PHE N N 46 118.260 118.260 120.176 -1.916 18222
2875 1 7 . 1 1 46 46 PHE HA H 46 3.930 3.930 4.160 -0.230 18222
2876 1 7 . 1 1 46 46 PHE CA C 46 59.820 59.820 60.524 -0.704 18222
2877 1 7 . 1 1 46 46 PHE CB C 46 38.260 38.260 38.986 -0.726 18222
2878 1 7 . 1 1 46 46 PHE H H 46 7.860 7.860 8.169 -0.309 18222
2879 1 7 . 1 1 47 47 GLY N N 47 107.300 107.300 107.371 -0.071 18222
2880 1 7 . 1 1 47 47 GLY CA C 47 46.560 46.560 47.149 -0.589 18222
2881 1 7 . 1 1 47 47 GLY H H 47 8.200 8.200 8.598 -0.398 18222
2882 1 7 . 1 1 48 48 LEU N N 48 121.920 121.920 123.383 -1.463 18222
2883 1 7 . 1 1 48 48 LEU HA H 48 4.040 4.040 3.935 0.105 18222
2884 1 7 . 1 1 48 48 LEU CA C 48 57.580 57.580 58.154 -0.574 18222
2885 1 7 . 1 1 48 48 LEU CB C 48 40.790 40.790 42.067 -1.277 18222
2886 1 7 . 1 1 48 48 LEU H H 48 8.180 8.180 8.084 0.096 18222
2887 1 7 . 1 1 49 49 GLN N N 49 118.270 118.270 117.665 0.605 18222
2888 1 7 . 1 1 49 49 GLN HA H 49 3.830 3.830 3.940 -0.110 18222
2889 1 7 . 1 1 49 49 GLN CA C 49 58.880 58.880 58.520 0.360 18222
2890 1 7 . 1 1 49 49 GLN CB C 49 27.240 27.240 28.223 -0.983 18222
2891 1 7 . 1 1 49 49 GLN H H 49 8.080 8.080 8.328 -0.248 18222
2892 1 7 . 1 1 50 50 MET N N 50 117.630 117.630 121.198 -3.568 18222
2893 1 7 . 1 1 50 50 MET HA H 50 4.010 4.010 4.083 -0.073 18222
2894 1 7 . 1 1 50 50 MET CA C 50 57.730 57.730 59.159 -1.429 18222
2895 1 7 . 1 1 50 50 MET CB C 50 27.160 27.160 32.810 -5.650 18222
2896 1 7 . 1 1 50 50 MET H H 50 7.880 7.880 7.930 -0.050 18222
2897 1 7 . 1 1 51 51 PHE N N 51 119.550 119.550 120.643 -1.093 18222
2898 1 7 . 1 1 51 51 PHE CA C 51 60.850 60.850 61.753 -0.903 18222
2899 1 7 . 1 1 51 51 PHE CB C 51 38.720 38.720 39.373 -0.653 18222
2900 1 7 . 1 1 51 51 PHE H H 51 7.890 7.890 8.496 -0.606 18222
2901 1 7 . 1 1 52 52 ILE N N 52 117.950 117.950 118.095 -0.145 18222
2902 1 7 . 1 1 52 52 ILE HA H 52 4.050 4.050 3.802 0.248 18222
2903 1 7 . 1 1 52 52 ILE CA C 52 63.560 63.560 64.269 -0.709 18222
2904 1 7 . 1 1 52 52 ILE CB C 52 36.810 36.810 38.282 -1.472 18222
2905 1 7 . 1 1 52 52 ILE H H 52 8.110 8.110 8.291 -0.181 18222
2906 1 7 . 1 1 53 53 GLN N N 53 117.360 117.360 120.716 -3.356 18222
2907 1 7 . 1 1 53 53 GLN CA C 53 57.200 57.200 58.788 -1.588 18222
2908 1 7 . 1 1 53 53 GLN CB C 53 27.870 27.870 28.390 -0.520 18222
2909 1 7 . 1 1 53 53 GLN H H 53 7.930 7.930 8.270 -0.340 18222
2910 1 7 . 1 1 54 54 ARG N N 54 116.840 116.840 118.286 -1.446 18222
2911 1 7 . 1 1 54 54 ARG HA H 54 3.950 3.950 4.117 -0.167 18222
2912 1 7 . 1 1 54 54 ARG CA C 54 56.480 56.480 58.387 -1.907 18222
2913 1 7 . 1 1 54 54 ARG CB C 54 28.970 28.970 29.994 -1.024 18222
2914 1 7 . 1 1 54 54 ARG H H 54 7.540 7.540 7.705 -0.165 18222
2915 1 7 . 1 1 55 55 LYS N N 55 117.900 117.900 116.978 0.922 18222
2916 1 7 . 1 1 55 55 LYS HA H 55 4.080 4.080 4.250 -0.170 18222
2917 1 7 . 1 1 55 55 LYS CA C 55 55.030 55.030 57.064 -2.034 18222
2918 1 7 . 1 1 55 55 LYS CB C 55 32.010 32.010 33.193 -1.183 18222
2919 1 7 . 1 1 55 55 LYS H H 55 7.660 7.660 7.353 0.307 18222
2920 1 7 . 1 1 56 56 PHE N N 56 121.060 121.060 120.226 0.834 18222
2921 1 7 . 1 1 56 56 PHE CA C 56 55.190 55.190 54.846 0.343 18222
2922 1 7 . 1 1 56 56 PHE CB C 56 38.970 38.970 39.045 -0.075 18222
2923 1 7 . 1 1 56 56 PHE H H 56 8.080 8.080 8.306 -0.226 18222
2924 1 7 . 1 1 57 57 PRO CA C 57 62.390 62.390 63.740 -1.350 18222
2925 1 7 . 1 1 57 57 PRO CB C 57 30.580 30.580 31.959 -1.379 18222
2926 1 7 . 1 1 58 58 TYR N N 58 120.240 120.240 119.951 0.289 18222
2927 1 7 . 1 1 58 58 TYR CA C 58 55.770 55.770 54.645 1.125 18222
2928 1 7 . 1 1 58 58 TYR CB C 58 40.220 40.220 39.031 1.189 18222
2929 1 7 . 1 1 58 58 TYR H H 58 7.700 7.700 7.976 -0.276 18222
2930 1 7 . 1 1 59 59 PRO CA C 59 62.130 62.130 63.787 -1.657 18222
2931 1 7 . 1 1 59 59 PRO CB C 59 33.340 33.340 32.404 0.936 18222
2932 1 7 . 1 1 60 60 LEU N N 60 122.210 122.210 119.096 3.114 18222
2933 1 7 . 1 1 60 60 LEU CA C 60 54.250 54.250 53.757 0.493 18222
2934 1 7 . 1 1 60 60 LEU CB C 60 41.470 41.470 43.728 -2.258 18222
2935 1 7 . 1 1 60 60 LEU H H 60 7.880 7.880 7.560 0.320 18222
2936 1 7 . 1 1 61 61 GLN N N 61 122.470 122.470 121.966 0.504 18222
2937 1 7 . 1 1 61 61 GLN CA C 61 54.170 54.170 54.871 -0.701 18222
2938 1 7 . 1 1 61 61 GLN H H 61 7.970 7.970 8.493 -0.523 18222
2939 1 7 . 1 1 62 62 TRP N N 62 124.590 124.590 125.639 -1.049 18222
2940 1 7 . 1 1 62 62 TRP CA C 62 59.830 59.830 60.306 -0.476 18222
2941 1 7 . 1 1 62 62 TRP CB C 62 28.800 28.800 29.189 -0.389 18222
2942 1 7 . 1 1 62 62 TRP H H 62 8.240 8.240 8.738 -0.498 18222
2943 1 7 . 1 1 63 63 SER N N 63 113.320 113.320 114.930 -1.610 18222
2944 1 7 . 1 1 63 63 SER CA C 63 61.100 61.100 61.392 -0.292 18222
2945 1 7 . 1 1 63 63 SER H H 63 8.410 8.410 8.279 0.131 18222
2946 1 7 . 1 1 64 64 LEU N N 64 123.230 123.230 122.997 0.233 18222
2947 1 7 . 1 1 64 64 LEU CA C 64 56.880 56.880 56.621 0.259 18222
2948 1 7 . 1 1 64 64 LEU CB C 64 40.830 40.830 41.455 -0.625 18222
2949 1 7 . 1 1 64 64 LEU H H 64 7.230 7.230 7.630 -0.400 18222
2950 1 7 . 1 1 65 65 LEU N N 65 119.400 119.400 120.629 -1.229 18222
2951 1 7 . 1 1 65 65 LEU HA H 65 3.890 3.890 4.081 -0.191 18222
2952 1 7 . 1 1 65 65 LEU CA C 65 57.580 57.580 58.218 -0.638 18222
2953 1 7 . 1 1 65 65 LEU CB C 65 40.710 40.710 41.562 -0.852 18222
2954 1 7 . 1 1 65 65 LEU H H 65 7.510 7.510 8.414 -0.904 18222
2955 1 7 . 1 1 66 66 VAL N N 66 116.950 116.950 119.095 -2.145 18222
2956 1 7 . 1 1 66 66 VAL HA H 66 3.960 3.960 3.516 0.444 18222
2957 1 7 . 1 1 66 66 VAL CA C 66 66.260 66.260 65.645 0.615 18222
2958 1 7 . 1 1 66 66 VAL CB C 66 30.570 30.570 30.851 -0.281 18222
2959 1 7 . 1 1 66 66 VAL H H 66 7.950 7.950 8.002 -0.052 18222
2960 1 7 . 1 1 67 67 ALA N N 67 120.650 120.650 122.568 -1.918 18222
2961 1 7 . 1 1 67 67 ALA HA H 67 4.000 4.000 4.052 -0.052 18222
2962 1 7 . 1 1 67 67 ALA CA C 67 54.780 54.780 55.125 -0.345 18222
2963 1 7 . 1 1 67 67 ALA CB C 67 17.440 17.440 18.375 -0.935 18222
2964 1 7 . 1 1 67 67 ALA H H 67 7.450 7.450 7.822 -0.372 18222
2965 1 7 . 1 1 68 68 VAL N N 68 118.440 118.440 118.755 -0.315 18222
2966 1 7 . 1 1 68 68 VAL HA H 68 3.750 3.750 3.549 0.201 18222
2967 1 7 . 1 1 68 68 VAL CA C 68 65.250 65.250 67.247 -1.997 18222
2968 1 7 . 1 1 68 68 VAL CB C 68 30.850 30.850 32.161 -1.311 18222
2969 1 7 . 1 1 68 68 VAL H H 68 7.960 7.960 7.723 0.237 18222
2970 1 7 . 1 1 69 69 VAL N N 69 120.800 120.800 120.070 0.730 18222
2971 1 7 . 1 1 69 69 VAL HA H 69 4.220 4.220 3.521 0.699 18222
2972 1 7 . 1 1 69 69 VAL CA C 69 66.020 66.020 67.333 -1.313 18222
2973 1 7 . 1 1 69 69 VAL CB C 69 30.850 30.850 31.483 -0.633 18222
2974 1 7 . 1 1 69 69 VAL H H 69 8.080 8.080 8.417 -0.337 18222
2975 1 7 . 1 1 70 70 ALA N N 70 121.740 121.740 120.677 1.063 18222
2976 1 7 . 1 1 70 70 ALA HA H 70 3.920 3.920 4.157 -0.237 18222
2977 1 7 . 1 1 70 70 ALA CA C 70 54.920 54.920 55.352 -0.432 18222
2978 1 7 . 1 1 70 70 ALA CB C 70 17.620 17.620 17.962 -0.342 18222
2979 1 7 . 1 1 70 70 ALA H H 70 8.660 8.660 8.471 0.189 18222
2980 1 7 . 1 1 71 71 GLY N N 71 103.450 103.450 106.937 -3.487 18222
2981 1 7 . 1 1 71 71 GLY CA C 71 46.300 46.300 47.094 -0.794 18222
2982 1 7 . 1 1 71 71 GLY H H 71 8.010 8.010 8.093 -0.083 18222
2983 1 7 . 1 1 72 72 SER N N 72 118.160 118.160 118.267 -0.107 18222
2984 1 7 . 1 1 72 72 SER CA C 72 61.260 61.260 62.263 -1.003 18222
2985 1 7 . 1 1 72 72 SER CB C 72 62.870 62.870 63.084 -0.214 18222
2986 1 7 . 1 1 72 72 SER H H 72 7.870 7.870 8.110 -0.240 18222
2987 1 7 . 1 1 73 73 VAL N N 73 121.340 121.340 121.969 -0.629 18222
2988 1 7 . 1 1 73 73 VAL CA C 73 65.750 65.750 66.957 -1.207 18222
2989 1 7 . 1 1 73 73 VAL CB C 73 30.740 30.740 31.522 -0.782 18222
2990 1 7 . 1 1 73 73 VAL H H 73 8.050 8.050 8.200 -0.150 18222
2991 1 7 . 1 1 74 74 VAL N N 74 118.680 118.680 118.983 -0.303 18222
2992 1 7 . 1 1 74 74 VAL CA C 74 65.770 65.770 66.282 -0.512 18222
2993 1 7 . 1 1 74 74 VAL CB C 74 30.740 30.740 30.494 0.246 18222
2994 1 7 . 1 1 74 74 VAL H H 74 7.880 7.880 8.610 -0.730 18222
2995 1 7 . 1 1 75 75 SER N N 75 114.750 114.750 116.420 -1.670 18222
2996 1 7 . 1 1 75 75 SER HA H 75 4.100 4.100 4.218 -0.118 18222
2997 1 7 . 1 1 75 75 SER CA C 75 60.870 60.870 62.308 -1.438 18222
2998 1 7 . 1 1 75 75 SER CB C 75 62.340 62.340 63.062 -0.722 18222
2999 1 7 . 1 1 75 75 SER H H 75 7.870 7.870 8.008 -0.138 18222
3000 1 7 . 1 1 76 76 TYR N N 76 121.110 121.110 122.790 -1.680 18222
3001 1 7 . 1 1 76 76 TYR CA C 76 60.050 60.050 61.942 -1.892 18222
3002 1 7 . 1 1 76 76 TYR CB C 76 37.980 37.980 38.648 -0.668 18222
3003 1 7 . 1 1 76 76 TYR H H 76 7.860 7.860 8.478 -0.618 18222
3004 1 7 . 1 1 77 77 GLY N N 77 107.300 107.300 106.797 0.503 18222
3005 1 7 . 1 1 77 77 GLY CA C 77 46.560 46.560 47.188 -0.628 18222
3006 1 7 . 1 1 77 77 GLY H H 77 8.200 8.200 8.490 -0.290 18222
3007 1 7 . 1 1 78 78 VAL N N 78 119.470 119.470 121.013 -1.543 18222
3008 1 7 . 1 1 78 78 VAL HA H 78 4.170 4.170 3.725 0.445 18222
3009 1 7 . 1 1 78 78 VAL CA C 78 64.650 64.650 65.692 -1.042 18222
3010 1 7 . 1 1 78 78 VAL H H 78 8.140 8.140 8.663 -0.523 18222
3011 1 7 . 1 1 79 79 THR N N 79 112.100 112.100 116.285 -4.185 18222
3012 1 7 . 1 1 79 79 THR CA C 79 63.460 63.460 67.064 -3.604 18222
3013 1 7 . 1 1 79 79 THR CB C 79 68.650 68.650 68.594 0.057 18222
3014 1 7 . 1 1 79 79 THR H H 79 7.640 7.640 7.991 -0.351 18222
3015 1 7 . 1 1 80 80 ARG N N 80 120.770 120.770 122.075 -1.305 18222
3016 1 7 . 1 1 80 80 ARG HA H 80 4.160 4.160 4.087 0.073 18222
3017 1 7 . 1 1 80 80 ARG CA C 80 56.790 56.790 59.781 -2.991 18222
3018 1 7 . 1 1 80 80 ARG CB C 80 29.430 29.430 30.223 -0.793 18222
3019 1 7 . 1 1 80 80 ARG H H 80 7.680 7.680 8.034 -0.354 18222
3020 1 7 . 1 1 81 81 VAL N N 81 118.370 118.370 120.297 -1.927 18222
3021 1 7 . 1 1 81 81 VAL HA H 81 3.920 3.920 3.760 0.160 18222
3022 1 7 . 1 1 81 81 VAL CA C 81 63.340 63.340 66.151 -2.811 18222
3023 1 7 . 1 1 81 81 VAL CB C 81 31.260 31.260 32.200 -0.940 18222
3024 1 7 . 1 1 81 81 VAL H H 81 7.730 7.730 8.338 -0.608 18222
3025 1 7 . 1 1 82 82 GLU N N 82 120.620 120.620 119.373 1.247 18222
3026 1 7 . 1 1 82 82 GLU CA C 82 56.320 56.320 59.431 -3.111 18222
3027 1 7 . 1 1 82 82 GLU CB C 82 27.930 27.930 29.269 -1.339 18222
3028 1 7 . 1 1 82 82 GLU H H 82 7.920 7.920 8.272 -0.352 18222
3029 1 7 . 1 1 83 83 SER N N 83 116.240 116.240 115.829 0.411 18222
3030 1 7 . 1 1 83 83 SER CA C 83 59.250 59.250 61.852 -2.603 18222
3031 1 7 . 1 1 83 83 SER CB C 83 63.160 63.160 63.019 0.141 18222
3032 1 7 . 1 1 83 83 SER H H 83 7.960 7.960 8.110 -0.150 18222
3033 1 7 . 1 1 84 84 GLU N N 84 123.280 123.280 122.313 0.967 18222
3034 1 7 . 1 1 84 84 GLU HA H 84 4.080 4.080 4.010 0.070 18222
3035 1 7 . 1 1 84 84 GLU CA C 84 57.860 57.860 59.693 -1.833 18222
3036 1 7 . 1 1 84 84 GLU CB C 84 28.190 28.190 29.781 -1.591 18222
3037 1 7 . 1 1 84 84 GLU H H 84 8.470 8.470 8.197 0.273 18222
3038 1 7 . 1 1 85 85 LYS N N 85 118.650 118.650 119.699 -1.049 18222
3039 1 7 . 1 1 85 85 LYS HA H 85 4.100 4.100 4.059 0.041 18222
3040 1 7 . 1 1 85 85 LYS CA C 85 57.780 57.780 59.242 -1.462 18222
3041 1 7 . 1 1 85 85 LYS CB C 85 31.380 31.380 32.122 -0.742 18222
3042 1 7 . 1 1 85 85 LYS H H 85 7.940 7.940 8.148 -0.208 18222
3043 1 7 . 1 1 86 86 CYS N N 86 117.070 117.070 118.171 -1.101 18222
3044 1 7 . 1 1 86 86 CYS CA C 86 60.910 60.910 61.860 -0.950 18222
3045 1 7 . 1 1 86 86 CYS CB C 86 26.740 26.740 26.472 0.268 18222
3046 1 7 . 1 1 86 86 CYS H H 86 7.840 7.840 8.207 -0.367 18222
3047 1 7 . 1 1 87 87 ASN N N 87 119.370 119.370 119.047 0.323 18222
3048 1 7 . 1 1 87 87 ASN HA H 87 4.130 4.130 4.724 -0.594 18222
3049 1 7 . 1 1 87 87 ASN CA C 87 55.750 55.750 56.889 -1.139 18222
3050 1 7 . 1 1 87 87 ASN CB C 87 38.050 38.050 38.157 -0.107 18222
3051 1 7 . 1 1 87 87 ASN H H 87 8.110 8.110 8.585 -0.475 18222
3052 1 7 . 1 1 88 88 ASN N N 88 117.570 117.570 119.445 -1.875 18222
3053 1 7 . 1 1 88 88 ASN HA H 88 4.280 4.280 4.517 -0.237 18222
3054 1 7 . 1 1 88 88 ASN CA C 88 55.190 55.190 55.989 -0.798 18222
3055 1 7 . 1 1 88 88 ASN CB C 88 37.400 37.400 38.188 -0.788 18222
3056 1 7 . 1 1 88 88 ASN H H 88 8.280 8.280 8.336 -0.056 18222
3057 1 7 . 1 1 89 89 LEU N N 89 121.940 121.940 121.758 0.182 18222
3058 1 7 . 1 1 89 89 LEU HA H 89 4.070 4.070 3.872 0.198 18222
3059 1 7 . 1 1 89 89 LEU CA C 89 57.580 57.580 59.143 -1.563 18222
3060 1 7 . 1 1 89 89 LEU CB C 89 40.490 40.490 41.848 -1.358 18222
3061 1 7 . 1 1 89 89 LEU H H 89 7.790 7.790 8.397 -0.607 18222
3062 1 7 . 1 1 90 90 TRP N N 90 119.220 119.220 121.466 -2.246 18222
3063 1 7 . 1 1 90 90 TRP CA C 90 59.120 59.120 61.263 -2.143 18222
3064 1 7 . 1 1 90 90 TRP CB C 90 28.800 28.800 28.874 -0.074 18222
3065 1 7 . 1 1 90 90 TRP H H 90 7.850 7.850 8.441 -0.591 18222
3066 1 7 . 1 1 91 91 LEU N N 91 117.870 117.870 121.162 -3.292 18222
3067 1 7 . 1 1 91 91 LEU CA C 91 57.300 57.300 58.288 -0.987 18222
3068 1 7 . 1 1 91 91 LEU CB C 91 40.610 40.610 41.585 -0.975 18222
3069 1 7 . 1 1 91 91 LEU H H 91 7.920 7.920 7.996 -0.076 18222
3070 1 7 . 1 1 92 92 PHE N N 92 121.280 121.280 117.780 3.500 18222
3071 1 7 . 1 1 92 92 PHE CA C 92 60.390 60.390 61.679 -1.289 18222
3072 1 7 . 1 1 92 92 PHE CB C 92 37.980 37.980 38.353 -0.373 18222
3073 1 7 . 1 1 92 92 PHE H H 92 7.860 7.860 8.272 -0.412 18222
3074 1 7 . 1 1 93 93 LEU N N 93 119.860 119.860 120.431 -0.571 18222
3075 1 7 . 1 1 93 93 LEU CA C 93 56.860 56.860 58.847 -1.987 18222
3076 1 7 . 1 1 93 93 LEU CB C 93 40.550 40.550 41.993 -1.443 18222
3077 1 7 . 1 1 93 93 LEU H H 93 7.980 7.980 8.868 -0.888 18222
3078 1 7 . 1 1 94 94 GLU N N 94 114.660 114.660 118.628 -3.968 18222
3079 1 7 . 1 1 94 94 GLU HA H 94 3.810 3.810 4.101 -0.291 18222
3080 1 7 . 1 1 94 94 GLU CA C 94 57.210 57.210 59.029 -1.819 18222
3081 1 7 . 1 1 94 94 GLU CB C 94 28.470 28.470 29.590 -1.120 18222
3082 1 7 . 1 1 94 94 GLU H H 94 7.890 7.890 8.494 -0.604 18222
3083 1 7 . 1 1 95 95 THR N N 95 108.260 108.260 111.710 -3.450 18222
3084 1 7 . 1 1 95 95 THR CA C 95 62.150 62.150 63.063 -0.913 18222
3085 1 7 . 1 1 95 95 THR CB C 95 70.810 70.810 69.788 1.022 18222
3086 1 7 . 1 1 95 95 THR H H 95 7.690 7.690 7.764 -0.074 18222
3087 1 7 . 1 1 96 96 GLY N N 96 112.220 112.220 109.432 2.788 18222
3088 1 7 . 1 1 96 96 GLY CA C 96 45.410 45.410 44.779 0.631 18222
3089 1 7 . 1 1 96 96 GLY H H 96 8.240 8.240 7.840 0.400 18222
3090 1 7 . 1 1 97 97 GLN N N 97 117.950 117.950 120.764 -2.814 18222
3091 1 7 . 1 1 97 97 GLN HA H 97 4.200 4.200 4.546 -0.346 18222
3092 1 7 . 1 1 97 97 GLN CA C 97 54.430 54.430 54.627 -0.197 18222
3093 1 7 . 1 1 97 97 GLN CB C 97 29.910 29.910 28.133 1.777 18222
3094 1 7 . 1 1 97 97 GLN H H 97 7.640 7.640 8.343 -0.703 18222
3095 1 7 . 1 1 98 98 LEU N N 98 123.810 123.810 121.435 2.375 18222
3096 1 7 . 1 1 98 98 LEU HA H 98 4.360 4.360 4.737 -0.377 18222
3097 1 7 . 1 1 98 98 LEU CA C 98 52.650 52.650 52.949 -0.299 18222
3098 1 7 . 1 1 98 98 LEU CB C 98 40.460 40.460 41.429 -0.969 18222
3099 1 7 . 1 1 98 98 LEU H H 98 8.270 8.270 7.567 0.703 18222
3100 1 7 . 1 1 99 99 PRO CA C 99 63.180 63.180 64.028 -0.848 18222
3101 1 7 . 1 1 99 99 PRO CB C 99 30.840 30.840 32.181 -1.341 18222
3102 1 7 . 1 1 100 100 LYS N N 100 120.630 120.630 115.685 4.945 18222
3103 1 7 . 1 1 100 100 LYS CA C 100 55.730 55.730 56.051 -0.321 18222
3104 1 7 . 1 1 100 100 LYS CB C 100 32.280 32.280 33.462 -1.182 18222
3105 1 7 . 1 1 100 100 LYS H H 100 8.090 8.090 7.658 0.432 18222
3106 1 7 . 1 1 101 101 ASP N N 101 120.920 120.920 120.817 0.103 18222
3107 1 7 . 1 1 101 101 ASP HA H 101 4.190 4.190 4.654 -0.464 18222
3108 1 7 . 1 1 101 101 ASP CA C 101 54.000 54.000 55.377 -1.377 18222
3109 1 7 . 1 1 101 101 ASP CB C 101 40.330 40.330 40.971 -0.641 18222
3110 1 7 . 1 1 101 101 ASP H H 101 8.190 8.190 8.424 -0.234 18222
3111 1 7 . 1 1 102 102 ARG N N 102 122.210 122.210 124.195 -1.985 18222
3112 1 7 . 1 1 102 102 ARG CA C 102 55.590 55.590 55.649 -0.059 18222
3113 1 7 . 1 1 102 102 ARG CB C 102 29.630 29.630 31.387 -1.757 18222
3114 1 7 . 1 1 102 102 ARG H H 102 8.130 8.130 8.526 -0.396 18222
3115 1 7 . 1 1 103 103 SER N N 103 117.230 117.230 120.284 -3.054 18222
3116 1 7 . 1 1 103 103 SER HA H 103 4.280 4.280 4.689 -0.409 18222
3117 1 7 . 1 1 103 103 SER CA C 103 58.470 58.470 58.426 0.044 18222
3118 1 7 . 1 1 103 103 SER CB C 103 63.080 63.080 64.557 -1.477 18222
3119 1 7 . 1 1 103 103 SER H H 103 8.290 8.290 8.255 0.035 18222
3120 1 7 . 1 1 104 104 THR N N 104 115.430 115.430 117.094 -1.664 18222
3121 1 7 . 1 1 104 104 THR CA C 104 61.570 61.570 63.106 -1.536 18222
3122 1 7 . 1 1 104 104 THR CB C 104 69.030 69.030 69.495 -0.465 18222
3123 1 7 . 1 1 104 104 THR H H 104 8.020 8.020 8.349 -0.329 18222
3124 1 7 . 1 1 105 105 ASP N N 105 122.780 122.780 123.898 -1.118 18222
3125 1 7 . 1 1 105 105 ASP CA C 105 54.210 54.210 54.103 0.107 18222
3126 1 7 . 1 1 105 105 ASP CB C 105 40.380 40.380 41.592 -1.212 18222
3127 1 7 . 1 1 105 105 ASP H H 105 8.120 8.120 8.340 -0.220 18222
3128 1 7 . 1 1 106 106 GLN N N 106 120.960 120.960 119.572 1.388 18222
3129 1 7 . 1 1 106 106 GLN CA C 106 55.420 55.420 55.593 -0.173 18222
3130 1 7 . 1 1 106 106 GLN CB C 106 28.310 28.310 30.944 -2.634 18222
3131 1 7 . 1 1 106 106 GLN H H 106 8.140 8.140 8.209 -0.069 18222
3132 1 7 . 1 1 107 107 ARG N N 107 123.010 123.010 123.644 -0.634 18222
3133 1 7 . 1 1 107 107 ARG HA H 107 4.210 4.210 4.851 -0.641 18222
3134 1 7 . 1 1 107 107 ARG CA C 107 55.560 55.560 55.949 -0.389 18222
3135 1 7 . 1 1 107 107 ARG CB C 107 29.920 29.920 32.532 -2.611 18222
3136 1 7 . 1 1 107 107 ARG H H 107 8.180 8.180 8.894 -0.714 18222
3137 1 8 . 1 1 2 2 VAL N N 2 121.590 121.590 122.967 -1.377 18222
3138 1 8 . 1 1 2 2 VAL CA C 2 61.600 61.600 62.058 -0.458 18222
3139 1 8 . 1 1 2 2 VAL CB C 2 31.900 31.900 32.702 -0.802 18222
3140 1 8 . 1 1 2 2 VAL H H 2 8.010 8.010 7.918 0.092 18222
3141 1 8 . 1 1 3 3 ASN N N 3 122.520 122.520 124.217 -1.697 18222
3142 1 8 . 1 1 3 3 ASN HA H 3 4.020 4.020 4.376 -0.356 18222
3143 1 8 . 1 1 3 3 ASN CA C 3 52.640 52.640 53.700 -1.060 18222
3144 1 8 . 1 1 3 3 ASN CB C 3 38.330 38.330 38.812 -0.482 18222
3145 1 8 . 1 1 3 3 ASN H H 3 8.360 8.360 8.672 -0.312 18222
3146 1 8 . 1 1 4 4 LEU N N 4 123.830 123.830 119.669 4.161 18222
3147 1 8 . 1 1 4 4 LEU HA H 4 4.220 4.220 4.145 0.075 18222
3148 1 8 . 1 1 4 4 LEU CA C 4 54.620 54.620 55.132 -0.512 18222
3149 1 8 . 1 1 4 4 LEU CB C 4 41.680 41.680 42.551 -0.871 18222
3150 1 8 . 1 1 4 4 LEU H H 4 8.220 8.220 8.153 0.067 18222
3151 1 8 . 1 1 5 5 GLY N N 5 106.810 106.810 111.185 -4.375 18222
3152 1 8 . 1 1 5 5 GLY CA C 5 45.800 45.800 44.772 1.028 18222
3153 1 8 . 1 1 5 5 GLY H H 5 8.030 8.030 7.995 0.035 18222
3154 1 8 . 1 1 6 6 LEU N N 6 120.820 120.820 121.365 -0.545 18222
3155 1 8 . 1 1 6 6 LEU HA H 6 4.050 4.050 4.389 -0.339 18222
3156 1 8 . 1 1 6 6 LEU CA C 6 55.990 55.990 56.871 -0.881 18222
3157 1 8 . 1 1 6 6 LEU CB C 6 40.800 40.800 41.642 -0.842 18222
3158 1 8 . 1 1 6 6 LEU H H 6 8.030 8.030 8.476 -0.446 18222
3159 1 8 . 1 1 7 7 SER N N 7 115.540 115.540 115.904 -0.364 18222
3160 1 8 . 1 1 7 7 SER HA H 7 4.100 4.100 4.153 -0.053 18222
3161 1 8 . 1 1 7 7 SER CA C 7 60.580 60.580 61.732 -1.152 18222
3162 1 8 . 1 1 7 7 SER CB C 7 62.060 62.060 62.761 -0.701 18222
3163 1 8 . 1 1 7 7 SER H H 7 8.360 8.360 8.457 -0.097 18222
3164 1 8 . 1 1 8 8 ARG N N 8 120.690 120.690 121.174 -0.484 18222
3165 1 8 . 1 1 8 8 ARG HA H 8 4.160 4.160 4.065 0.095 18222
3166 1 8 . 1 1 8 8 ARG CA C 8 57.350 57.350 59.450 -2.100 18222
3167 1 8 . 1 1 8 8 ARG CB C 8 29.230 29.230 30.069 -0.839 18222
3168 1 8 . 1 1 8 8 ARG H H 8 7.830 7.830 8.449 -0.619 18222
3169 1 8 . 1 1 9 9 VAL N N 9 119.330 119.330 120.286 -0.956 18222
3170 1 8 . 1 1 9 9 VAL HA H 9 4.170 4.170 3.663 0.507 18222
3171 1 8 . 1 1 9 9 VAL CA C 9 64.720 64.720 66.919 -2.199 18222
3172 1 8 . 1 1 9 9 VAL CB C 9 30.900 30.900 31.313 -0.413 18222
3173 1 8 . 1 1 9 9 VAL H H 9 7.620 7.620 7.481 0.139 18222
3174 1 8 . 1 1 10 10 ASP N N 10 119.520 119.520 120.249 -0.729 18222
3175 1 8 . 1 1 10 10 ASP CA C 10 54.960 54.960 57.508 -2.548 18222
3176 1 8 . 1 1 10 10 ASP CB C 10 37.800 37.800 40.090 -2.290 18222
3177 1 8 . 1 1 10 10 ASP H H 10 8.180 8.180 8.211 -0.031 18222
3178 1 8 . 1 1 11 11 ASP N N 11 121.550 121.550 120.265 1.285 18222
3179 1 8 . 1 1 11 11 ASP CA C 11 54.440 54.440 57.024 -2.584 18222
3180 1 8 . 1 1 11 11 ASP CB C 11 37.840 37.840 40.740 -2.900 18222
3181 1 8 . 1 1 11 11 ASP H H 11 7.950 7.950 8.259 -0.309 18222
3182 1 8 . 1 1 12 12 ALA N N 12 120.220 120.220 122.569 -2.349 18222
3183 1 8 . 1 1 12 12 ALA CA C 12 54.370 54.370 55.169 -0.799 18222
3184 1 8 . 1 1 12 12 ALA CB C 12 24.730 24.730 18.486 6.244 18222
3185 1 8 . 1 1 12 12 ALA H H 12 8.090 8.090 7.989 0.101 18222
3186 1 8 . 1 1 13 13 VAL N N 13 116.910 116.910 118.148 -1.238 18222
3187 1 8 . 1 1 13 13 VAL HA H 13 4.140 4.140 3.541 0.599 18222
3188 1 8 . 1 1 13 13 VAL CA C 13 64.900 64.900 66.457 -1.558 18222
3189 1 8 . 1 1 13 13 VAL CB C 13 31.000 31.000 31.376 -0.376 18222
3190 1 8 . 1 1 13 13 VAL H H 13 7.980 7.980 8.139 -0.159 18222
3191 1 8 . 1 1 14 14 ALA N N 14 122.200 122.200 122.332 -0.132 18222
3192 1 8 . 1 1 14 14 ALA HA H 14 4.020 4.020 4.050 -0.030 18222
3193 1 8 . 1 1 14 14 ALA CA C 14 53.800 53.800 54.864 -1.065 18222
3194 1 8 . 1 1 14 14 ALA CB C 14 17.790 17.790 18.303 -0.513 18222
3195 1 8 . 1 1 14 14 ALA H H 14 8.030 8.030 8.058 -0.028 18222
3196 1 8 . 1 1 15 15 ALA N N 15 118.600 118.600 119.109 -0.509 18222
3197 1 8 . 1 1 15 15 ALA CA C 15 53.230 53.230 53.955 -0.725 18222
3198 1 8 . 1 1 15 15 ALA CB C 15 18.010 18.010 18.418 -0.408 18222
3199 1 8 . 1 1 15 15 ALA H H 15 7.530 7.530 7.958 -0.428 18222
3200 1 8 . 1 1 16 16 LYS N N 16 115.820 115.820 116.312 -0.492 18222
3201 1 8 . 1 1 16 16 LYS HA H 16 4.080 4.080 4.170 -0.090 18222
3202 1 8 . 1 1 16 16 LYS CA C 16 55.670 55.670 57.391 -1.721 18222
3203 1 8 . 1 1 16 16 LYS CB C 16 32.640 32.640 32.966 -0.326 18222
3204 1 8 . 1 1 16 16 LYS H H 16 7.490 7.490 7.622 -0.132 18222
3205 1 8 . 1 1 17 17 HIS N N 17 116.790 116.790 117.692 -0.902 18222
3206 1 8 . 1 1 17 17 HIS HA H 17 4.100 4.100 4.913 -0.813 18222
3207 1 8 . 1 1 17 17 HIS CA C 17 52.820 52.820 53.098 -0.278 18222
3208 1 8 . 1 1 17 17 HIS CB C 17 28.400 28.400 30.368 -1.968 18222
3209 1 8 . 1 1 17 17 HIS H H 17 8.130 8.130 7.614 0.516 18222
3210 1 8 . 1 1 18 18 PRO CA C 18 63.800 63.800 63.430 0.370 18222
3211 1 8 . 1 1 18 18 PRO CB C 18 30.800 30.800 32.701 -1.901 18222
3212 1 8 . 1 1 19 19 GLY N N 19 110.260 110.260 105.442 4.818 18222
3213 1 8 . 1 1 19 19 GLY CA C 19 45.490 45.490 44.450 1.040 18222
3214 1 8 . 1 1 19 19 GLY H H 19 8.730 8.730 7.456 1.274 18222
3215 1 8 . 1 1 20 20 LEU N N 20 122.650 122.650 125.024 -2.374 18222
3216 1 8 . 1 1 20 20 LEU HA H 20 4.090 4.090 4.113 -0.023 18222
3217 1 8 . 1 1 20 20 LEU CA C 20 57.060 57.060 58.099 -1.039 18222
3218 1 8 . 1 1 20 20 LEU H H 20 7.980 7.980 8.475 -0.495 18222
3219 1 8 . 1 1 21 21 GLY N N 21 107.000 107.000 105.671 1.329 18222
3220 1 8 . 1 1 21 21 GLY CA C 21 46.710 46.710 47.086 -0.376 18222
3221 1 8 . 1 1 21 21 GLY H H 21 8.570 8.570 8.477 0.093 18222
3222 1 8 . 1 1 22 22 GLU N N 22 121.610 121.610 122.505 -0.895 18222
3223 1 8 . 1 1 22 22 GLU HA H 22 3.990 3.990 4.048 -0.058 18222
3224 1 8 . 1 1 22 22 GLU CA C 22 58.280 58.280 59.855 -1.575 18222
3225 1 8 . 1 1 22 22 GLU CB C 22 28.010 28.010 29.349 -1.339 18222
3226 1 8 . 1 1 22 22 GLU H H 22 8.100 8.100 8.311 -0.211 18222
3227 1 8 . 1 1 23 23 TYR N N 23 120.870 120.870 120.973 -0.103 18222
3228 1 8 . 1 1 23 23 TYR CA C 23 60.380 60.380 61.542 -1.162 18222
3229 1 8 . 1 1 23 23 TYR CB C 23 37.750 37.750 38.348 -0.598 18222
3230 1 8 . 1 1 23 23 TYR H H 23 7.910 7.910 8.832 -0.922 18222
3231 1 8 . 1 1 24 24 ALA N N 24 121.420 121.420 120.636 0.784 18222
3232 1 8 . 1 1 24 24 ALA HA H 24 4.140 4.140 3.671 0.469 18222
3233 1 8 . 1 1 24 24 ALA CA C 24 54.260 54.260 54.919 -0.659 18222
3234 1 8 . 1 1 24 24 ALA H H 24 8.410 8.410 8.308 0.102 18222
3235 1 8 . 1 1 25 25 ALA N N 25 120.220 120.220 121.213 -0.993 18222
3236 1 8 . 1 1 25 25 ALA CA C 25 54.370 54.370 54.596 -0.226 18222
3237 1 8 . 1 1 25 25 ALA H H 25 8.090 8.090 7.755 0.335 18222
3238 1 8 . 1 1 26 26 CYS N N 26 116.760 116.760 117.143 -0.383 18222
3239 1 8 . 1 1 26 26 CYS CA C 26 61.180 61.180 62.525 -1.345 18222
3240 1 8 . 1 1 26 26 CYS CB C 26 26.390 26.390 27.148 -0.758 18222
3241 1 8 . 1 1 26 26 CYS H H 26 7.950 7.950 8.052 -0.102 18222
3242 1 8 . 1 1 27 27 GLN N N 27 118.690 118.690 120.568 -1.878 18222
3243 1 8 . 1 1 27 27 GLN CA C 27 55.970 55.970 59.269 -3.299 18222
3244 1 8 . 1 1 27 27 GLN H H 27 8.060 8.060 7.924 0.136 18222
3245 1 8 . 1 1 28 28 SER N N 28 115.490 115.490 114.532 0.958 18222
3246 1 8 . 1 1 28 28 SER HA H 28 3.990 3.990 4.123 -0.133 18222
3247 1 8 . 1 1 28 28 SER CA C 28 61.110 61.110 61.979 -0.869 18222
3248 1 8 . 1 1 28 28 SER H H 28 7.980 7.980 8.194 -0.214 18222
3249 1 8 . 1 1 29 29 HIS N N 29 120.880 120.880 120.658 0.222 18222
3250 1 8 . 1 1 29 29 HIS CA C 29 58.190 58.190 60.117 -1.927 18222
3251 1 8 . 1 1 29 29 HIS CB C 29 27.460 27.460 29.749 -2.289 18222
3252 1 8 . 1 1 29 29 HIS H H 29 8.180 8.180 8.210 -0.030 18222
3253 1 8 . 1 1 30 30 ALA N N 30 122.920 122.920 122.748 0.172 18222
3254 1 8 . 1 1 30 30 ALA CA C 30 54.560 54.560 55.308 -0.748 18222
3255 1 8 . 1 1 30 30 ALA CB C 30 17.490 17.490 18.315 -0.825 18222
3256 1 8 . 1 1 30 30 ALA H H 30 8.040 8.040 8.090 -0.050 18222
3257 1 8 . 1 1 31 31 PHE N N 31 119.340 119.340 119.478 -0.138 18222
3258 1 8 . 1 1 31 31 PHE CA C 31 60.370 60.370 61.106 -0.736 18222
3259 1 8 . 1 1 31 31 PHE CB C 31 38.520 38.520 39.052 -0.532 18222
3260 1 8 . 1 1 31 31 PHE H H 31 8.230 8.230 8.331 -0.101 18222
3261 1 8 . 1 1 32 32 MET N N 32 118.110 118.110 118.161 -0.051 18222
3262 1 8 . 1 1 32 32 MET HA H 32 4.050 4.050 4.039 0.011 18222
3263 1 8 . 1 1 32 32 MET CA C 32 58.280 58.280 58.236 0.044 18222
3264 1 8 . 1 1 32 32 MET CB C 32 31.090 31.090 32.346 -1.256 18222
3265 1 8 . 1 1 32 32 MET H H 32 8.120 8.120 8.547 -0.427 18222
3266 1 8 . 1 1 33 33 LYS N N 33 119.040 119.040 119.941 -0.901 18222
3267 1 8 . 1 1 33 33 LYS HA H 33 3.930 3.930 4.023 -0.093 18222
3268 1 8 . 1 1 33 33 LYS CA C 33 59.040 59.040 59.974 -0.933 18222
3269 1 8 . 1 1 33 33 LYS CB C 33 30.990 30.990 32.392 -1.402 18222
3270 1 8 . 1 1 33 33 LYS H H 33 7.970 7.970 8.346 -0.376 18222
3271 1 8 . 1 1 34 34 GLY N N 34 108.840 108.840 108.053 0.787 18222
3272 1 8 . 1 1 34 34 GLY CA C 34 46.610 46.610 47.237 -0.627 18222
3273 1 8 . 1 1 34 34 GLY H H 34 8.030 8.030 8.266 -0.236 18222
3274 1 8 . 1 1 35 35 VAL N N 35 122.910 122.910 122.316 0.594 18222
3275 1 8 . 1 1 35 35 VAL HA H 35 4.220 4.220 3.665 0.555 18222
3276 1 8 . 1 1 35 35 VAL CA C 35 66.310 66.310 65.717 0.593 18222
3277 1 8 . 1 1 35 35 VAL CB C 35 30.560 30.560 31.731 -1.171 18222
3278 1 8 . 1 1 35 35 VAL H H 35 8.090 8.090 7.968 0.122 18222
3279 1 8 . 1 1 36 36 PHE N N 36 120.020 120.020 119.649 0.371 18222
3280 1 8 . 1 1 36 36 PHE CA C 36 61.350 61.350 62.000 -0.650 18222
3281 1 8 . 1 1 36 36 PHE CB C 36 38.090 38.090 39.011 -0.921 18222
3282 1 8 . 1 1 36 36 PHE H H 36 8.350 8.350 8.199 0.151 18222
3283 1 8 . 1 1 37 37 THR N N 37 116.980 116.980 116.439 0.541 18222
3284 1 8 . 1 1 37 37 THR HA H 37 4.050 4.050 3.987 0.063 18222
3285 1 8 . 1 1 37 37 THR CA C 37 66.000 66.000 66.935 -0.935 18222
3286 1 8 . 1 1 37 37 THR CB C 37 68.270 68.270 68.872 -0.602 18222
3287 1 8 . 1 1 37 37 THR H H 37 8.520 8.520 8.456 0.064 18222
3288 1 8 . 1 1 38 38 PHE N N 38 123.090 123.090 120.646 2.444 18222
3289 1 8 . 1 1 38 38 PHE HA H 38 4.360 4.360 4.233 0.127 18222
3290 1 8 . 1 1 38 38 PHE CA C 38 61.140 61.140 61.432 -0.292 18222
3291 1 8 . 1 1 38 38 PHE CB C 38 41.200 41.200 39.413 1.787 18222
3292 1 8 . 1 1 38 38 PHE H H 38 8.010 8.010 7.999 0.011 18222
3293 1 8 . 1 1 39 39 VAL N N 39 117.280 117.280 120.903 -3.623 18222
3294 1 8 . 1 1 39 39 VAL HA H 39 4.210 4.210 3.703 0.507 18222
3295 1 8 . 1 1 39 39 VAL CA C 39 66.000 66.000 65.458 0.542 18222
3296 1 8 . 1 1 39 39 VAL CB C 39 30.860 30.860 31.993 -1.133 18222
3297 1 8 . 1 1 39 39 VAL H H 39 8.530 8.530 8.965 -0.435 18222
3298 1 8 . 1 1 40 40 THR N N 40 109.470 109.470 114.204 -4.734 18222
3299 1 8 . 1 1 40 40 THR HA H 40 4.060 4.060 3.888 0.172 18222
3300 1 8 . 1 1 40 40 THR CA C 40 63.390 63.390 65.178 -1.788 18222
3301 1 8 . 1 1 40 40 THR CB C 40 68.650 68.650 68.393 0.257 18222
3302 1 8 . 1 1 40 40 THR H H 40 7.700 7.700 7.854 -0.154 18222
3303 1 8 . 1 1 41 41 GLY N N 41 110.770 110.770 107.215 3.555 18222
3304 1 8 . 1 1 41 41 GLY CA C 41 45.580 45.580 44.725 0.855 18222
3305 1 8 . 1 1 41 41 GLY H H 41 7.700 7.700 7.340 0.360 18222
3306 1 8 . 1 1 42 42 THR N N 42 114.520 114.520 120.643 -6.123 18222
3307 1 8 . 1 1 42 42 THR CA C 42 63.300 63.300 62.690 0.610 18222
3308 1 8 . 1 1 42 42 THR CB C 42 69.490 69.490 67.307 2.183 18222
3309 1 8 . 1 1 42 42 THR H H 42 7.720 7.720 8.135 -0.415 18222
3310 1 8 . 1 1 43 43 GLY N N 43 109.540 109.540 112.741 -3.201 18222
3311 1 8 . 1 1 43 43 GLY CA C 43 46.250 46.250 46.257 -0.007 18222
3312 1 8 . 1 1 43 43 GLY H H 43 8.110 8.110 8.194 -0.084 18222
3313 1 8 . 1 1 44 44 MET N N 44 120.240 120.240 121.194 -0.954 18222
3314 1 8 . 1 1 44 44 MET HA H 44 4.100 4.100 4.089 0.011 18222
3315 1 8 . 1 1 44 44 MET CA C 44 57.700 57.700 58.273 -0.572 18222
3316 1 8 . 1 1 44 44 MET CB C 44 32.030 32.030 32.517 -0.487 18222
3317 1 8 . 1 1 44 44 MET H H 44 7.730 7.730 8.022 -0.292 18222
3318 1 8 . 1 1 45 45 ALA N N 45 121.560 121.560 121.814 -0.254 18222
3319 1 8 . 1 1 45 45 ALA CA C 45 54.440 54.440 55.160 -0.720 18222
3320 1 8 . 1 1 45 45 ALA CB C 45 17.400 17.400 17.930 -0.530 18222
3321 1 8 . 1 1 45 45 ALA H H 45 7.950 7.950 7.699 0.251 18222
3322 1 8 . 1 1 46 46 PHE N N 46 118.260 118.260 119.319 -1.059 18222
3323 1 8 . 1 1 46 46 PHE HA H 46 3.930 3.930 4.174 -0.244 18222
3324 1 8 . 1 1 46 46 PHE CA C 46 59.820 59.820 60.252 -0.432 18222
3325 1 8 . 1 1 46 46 PHE CB C 46 38.260 38.260 38.568 -0.308 18222
3326 1 8 . 1 1 46 46 PHE H H 46 7.860 7.860 8.084 -0.224 18222
3327 1 8 . 1 1 47 47 GLY N N 47 107.300 107.300 108.080 -0.780 18222
3328 1 8 . 1 1 47 47 GLY CA C 47 46.560 46.560 47.355 -0.795 18222
3329 1 8 . 1 1 47 47 GLY H H 47 8.200 8.200 8.564 -0.364 18222
3330 1 8 . 1 1 48 48 LEU N N 48 121.920 121.920 122.873 -0.953 18222
3331 1 8 . 1 1 48 48 LEU HA H 48 4.040 4.040 4.117 -0.077 18222
3332 1 8 . 1 1 48 48 LEU CA C 48 57.580 57.580 57.564 0.016 18222
3333 1 8 . 1 1 48 48 LEU CB C 48 40.790 40.790 40.935 -0.145 18222
3334 1 8 . 1 1 48 48 LEU H H 48 8.180 8.180 8.269 -0.089 18222
3335 1 8 . 1 1 49 49 GLN N N 49 118.270 118.270 119.325 -1.055 18222
3336 1 8 . 1 1 49 49 GLN HA H 49 3.830 3.830 3.991 -0.161 18222
3337 1 8 . 1 1 49 49 GLN CA C 49 58.880 58.880 59.206 -0.327 18222
3338 1 8 . 1 1 49 49 GLN CB C 49 27.240 27.240 28.545 -1.305 18222
3339 1 8 . 1 1 49 49 GLN H H 49 8.080 8.080 8.246 -0.166 18222
3340 1 8 . 1 1 50 50 MET N N 50 117.630 117.630 119.410 -1.780 18222
3341 1 8 . 1 1 50 50 MET HA H 50 4.010 4.010 4.205 -0.195 18222
3342 1 8 . 1 1 50 50 MET CA C 50 57.730 57.730 59.333 -1.603 18222
3343 1 8 . 1 1 50 50 MET CB C 50 27.160 27.160 32.854 -5.694 18222
3344 1 8 . 1 1 50 50 MET H H 50 7.880 7.880 8.273 -0.393 18222
3345 1 8 . 1 1 51 51 PHE N N 51 119.550 119.550 119.983 -0.433 18222
3346 1 8 . 1 1 51 51 PHE CA C 51 60.850 60.850 61.535 -0.685 18222
3347 1 8 . 1 1 51 51 PHE CB C 51 38.720 38.720 39.368 -0.648 18222
3348 1 8 . 1 1 51 51 PHE H H 51 7.890 7.890 8.170 -0.280 18222
3349 1 8 . 1 1 52 52 ILE N N 52 117.950 117.950 118.131 -0.181 18222
3350 1 8 . 1 1 52 52 ILE HA H 52 4.050 4.050 3.956 0.094 18222
3351 1 8 . 1 1 52 52 ILE CA C 52 63.560 63.560 64.309 -0.749 18222
3352 1 8 . 1 1 52 52 ILE CB C 52 36.810 36.810 38.576 -1.766 18222
3353 1 8 . 1 1 52 52 ILE H H 52 8.110 8.110 8.588 -0.478 18222
3354 1 8 . 1 1 53 53 GLN N N 53 117.360 117.360 119.522 -2.162 18222
3355 1 8 . 1 1 53 53 GLN CA C 53 57.200 57.200 58.482 -1.282 18222
3356 1 8 . 1 1 53 53 GLN CB C 53 27.870 27.870 28.024 -0.154 18222
3357 1 8 . 1 1 53 53 GLN H H 53 7.930 7.930 8.329 -0.399 18222
3358 1 8 . 1 1 54 54 ARG N N 54 116.840 116.840 120.139 -3.299 18222
3359 1 8 . 1 1 54 54 ARG HA H 54 3.950 3.950 4.122 -0.172 18222
3360 1 8 . 1 1 54 54 ARG CA C 54 56.480 56.480 58.584 -2.104 18222
3361 1 8 . 1 1 54 54 ARG CB C 54 28.970 28.970 29.962 -0.992 18222
3362 1 8 . 1 1 54 54 ARG H H 54 7.540 7.540 8.036 -0.496 18222
3363 1 8 . 1 1 55 55 LYS N N 55 117.900 117.900 116.188 1.712 18222
3364 1 8 . 1 1 55 55 LYS HA H 55 4.080 4.080 4.277 -0.197 18222
3365 1 8 . 1 1 55 55 LYS CA C 55 55.030 55.030 56.327 -1.297 18222
3366 1 8 . 1 1 55 55 LYS CB C 55 32.010 32.010 34.328 -2.317 18222
3367 1 8 . 1 1 55 55 LYS H H 55 7.660 7.660 7.446 0.214 18222
3368 1 8 . 1 1 56 56 PHE N N 56 121.060 121.060 120.605 0.455 18222
3369 1 8 . 1 1 56 56 PHE CA C 56 55.190 55.190 55.208 -0.018 18222
3370 1 8 . 1 1 56 56 PHE CB C 56 38.970 38.970 40.561 -1.591 18222
3371 1 8 . 1 1 56 56 PHE H H 56 8.080 8.080 7.761 0.319 18222
3372 1 8 . 1 1 57 57 PRO CA C 57 62.390 62.390 63.627 -1.237 18222
3373 1 8 . 1 1 57 57 PRO CB C 57 30.580 30.580 31.804 -1.224 18222
3374 1 8 . 1 1 58 58 TYR N N 58 120.240 120.240 118.022 2.218 18222
3375 1 8 . 1 1 58 58 TYR CA C 58 55.770 55.770 54.741 1.029 18222
3376 1 8 . 1 1 58 58 TYR CB C 58 40.220 40.220 40.567 -0.347 18222
3377 1 8 . 1 1 58 58 TYR H H 58 7.700 7.700 7.803 -0.103 18222
3378 1 8 . 1 1 59 59 PRO CA C 59 62.130 62.130 64.019 -1.889 18222
3379 1 8 . 1 1 59 59 PRO CB C 59 33.340 33.340 32.462 0.878 18222
3380 1 8 . 1 1 60 60 LEU N N 60 122.210 122.210 118.847 3.363 18222
3381 1 8 . 1 1 60 60 LEU CA C 60 54.250 54.250 53.412 0.838 18222
3382 1 8 . 1 1 60 60 LEU CB C 60 41.470 41.470 43.529 -2.059 18222
3383 1 8 . 1 1 60 60 LEU H H 60 7.880 7.880 7.571 0.309 18222
3384 1 8 . 1 1 61 61 GLN N N 61 122.470 122.470 120.067 2.403 18222
3385 1 8 . 1 1 61 61 GLN CA C 61 54.170 54.170 54.583 -0.413 18222
3386 1 8 . 1 1 61 61 GLN H H 61 7.970 7.970 8.129 -0.159 18222
3387 1 8 . 1 1 62 62 TRP N N 62 124.590 124.590 125.130 -0.540 18222
3388 1 8 . 1 1 62 62 TRP CA C 62 59.830 59.830 60.918 -1.088 18222
3389 1 8 . 1 1 62 62 TRP CB C 62 28.800 28.800 29.129 -0.329 18222
3390 1 8 . 1 1 62 62 TRP H H 62 8.240 8.240 8.674 -0.434 18222
3391 1 8 . 1 1 63 63 SER N N 63 113.320 113.320 114.533 -1.213 18222
3392 1 8 . 1 1 63 63 SER CA C 63 61.100 61.100 61.676 -0.576 18222
3393 1 8 . 1 1 63 63 SER H H 63 8.410 8.410 8.082 0.328 18222
3394 1 8 . 1 1 64 64 LEU N N 64 123.230 123.230 122.504 0.726 18222
3395 1 8 . 1 1 64 64 LEU CA C 64 56.880 56.880 57.436 -0.556 18222
3396 1 8 . 1 1 64 64 LEU CB C 64 40.830 40.830 41.064 -0.234 18222
3397 1 8 . 1 1 64 64 LEU H H 64 7.230 7.230 8.058 -0.828 18222
3398 1 8 . 1 1 65 65 LEU N N 65 119.400 119.400 121.110 -1.710 18222
3399 1 8 . 1 1 65 65 LEU HA H 65 3.890 3.890 4.060 -0.170 18222
3400 1 8 . 1 1 65 65 LEU CA C 65 57.580 57.580 58.325 -0.745 18222
3401 1 8 . 1 1 65 65 LEU CB C 65 40.710 40.710 40.958 -0.248 18222
3402 1 8 . 1 1 65 65 LEU H H 65 7.510 7.510 8.755 -1.245 18222
3403 1 8 . 1 1 66 66 VAL N N 66 116.950 116.950 119.587 -2.637 18222
3404 1 8 . 1 1 66 66 VAL HA H 66 3.960 3.960 3.580 0.380 18222
3405 1 8 . 1 1 66 66 VAL CA C 66 66.260 66.260 65.740 0.520 18222
3406 1 8 . 1 1 66 66 VAL CB C 66 30.570 30.570 30.958 -0.388 18222
3407 1 8 . 1 1 66 66 VAL H H 66 7.950 7.950 8.143 -0.193 18222
3408 1 8 . 1 1 67 67 ALA N N 67 120.650 120.650 122.789 -2.139 18222
3409 1 8 . 1 1 67 67 ALA HA H 67 4.000 4.000 4.062 -0.062 18222
3410 1 8 . 1 1 67 67 ALA CA C 67 54.780 54.780 55.298 -0.518 18222
3411 1 8 . 1 1 67 67 ALA CB C 67 17.440 17.440 18.307 -0.867 18222
3412 1 8 . 1 1 67 67 ALA H H 67 7.450 7.450 7.961 -0.511 18222
3413 1 8 . 1 1 68 68 VAL N N 68 118.440 118.440 119.022 -0.582 18222
3414 1 8 . 1 1 68 68 VAL HA H 68 3.750 3.750 3.764 -0.014 18222
3415 1 8 . 1 1 68 68 VAL CA C 68 65.250 65.250 65.517 -0.267 18222
3416 1 8 . 1 1 68 68 VAL CB C 68 30.850 30.850 31.431 -0.581 18222
3417 1 8 . 1 1 68 68 VAL H H 68 7.960 7.960 7.856 0.104 18222
3418 1 8 . 1 1 69 69 VAL N N 69 120.800 120.800 120.770 0.030 18222
3419 1 8 . 1 1 69 69 VAL HA H 69 4.220 4.220 3.602 0.618 18222
3420 1 8 . 1 1 69 69 VAL CA C 69 66.020 66.020 67.184 -1.164 18222
3421 1 8 . 1 1 69 69 VAL CB C 69 30.850 30.850 31.037 -0.187 18222
3422 1 8 . 1 1 69 69 VAL H H 69 8.080 8.080 8.504 -0.424 18222
3423 1 8 . 1 1 70 70 ALA N N 70 121.740 121.740 120.598 1.142 18222
3424 1 8 . 1 1 70 70 ALA HA H 70 3.920 3.920 4.197 -0.277 18222
3425 1 8 . 1 1 70 70 ALA CA C 70 54.920 54.920 55.219 -0.299 18222
3426 1 8 . 1 1 70 70 ALA CB C 70 17.620 17.620 17.985 -0.365 18222
3427 1 8 . 1 1 70 70 ALA H H 70 8.660 8.660 8.445 0.215 18222
3428 1 8 . 1 1 71 71 GLY N N 71 103.450 103.450 107.764 -4.314 18222
3429 1 8 . 1 1 71 71 GLY CA C 71 46.300 46.300 47.115 -0.815 18222
3430 1 8 . 1 1 71 71 GLY H H 71 8.010 8.010 7.977 0.033 18222
3431 1 8 . 1 1 72 72 SER N N 72 118.160 118.160 118.068 0.092 18222
3432 1 8 . 1 1 72 72 SER CA C 72 61.260 61.260 61.960 -0.700 18222
3433 1 8 . 1 1 72 72 SER CB C 72 62.870 62.870 63.108 -0.238 18222
3434 1 8 . 1 1 72 72 SER H H 72 7.870 7.870 8.265 -0.395 18222
3435 1 8 . 1 1 73 73 VAL N N 73 121.340 121.340 122.039 -0.699 18222
3436 1 8 . 1 1 73 73 VAL CA C 73 65.750 65.750 67.201 -1.451 18222
3437 1 8 . 1 1 73 73 VAL CB C 73 30.740 30.740 31.843 -1.103 18222
3438 1 8 . 1 1 73 73 VAL H H 73 8.050 8.050 8.065 -0.015 18222
3439 1 8 . 1 1 74 74 VAL N N 74 118.680 118.680 119.162 -0.482 18222
3440 1 8 . 1 1 74 74 VAL CA C 74 65.770 65.770 66.721 -0.951 18222
3441 1 8 . 1 1 74 74 VAL CB C 74 30.740 30.740 31.356 -0.616 18222
3442 1 8 . 1 1 74 74 VAL H H 74 7.880 7.880 8.516 -0.636 18222
3443 1 8 . 1 1 75 75 SER N N 75 114.750 114.750 115.893 -1.143 18222
3444 1 8 . 1 1 75 75 SER HA H 75 4.100 4.100 4.214 -0.114 18222
3445 1 8 . 1 1 75 75 SER CA C 75 60.870 60.870 62.033 -1.163 18222
3446 1 8 . 1 1 75 75 SER CB C 75 62.340 62.340 63.192 -0.852 18222
3447 1 8 . 1 1 75 75 SER H H 75 7.870 7.870 8.029 -0.159 18222
3448 1 8 . 1 1 76 76 TYR N N 76 121.110 121.110 122.235 -1.125 18222
3449 1 8 . 1 1 76 76 TYR CA C 76 60.050 60.050 61.554 -1.504 18222
3450 1 8 . 1 1 76 76 TYR CB C 76 37.980 37.980 38.625 -0.645 18222
3451 1 8 . 1 1 76 76 TYR H H 76 7.860 7.860 8.503 -0.643 18222
3452 1 8 . 1 1 77 77 GLY N N 77 107.300 107.300 106.909 0.391 18222
3453 1 8 . 1 1 77 77 GLY CA C 77 46.560 46.560 47.366 -0.806 18222
3454 1 8 . 1 1 77 77 GLY H H 77 8.200 8.200 8.516 -0.316 18222
3455 1 8 . 1 1 78 78 VAL N N 78 119.470 119.470 121.754 -2.284 18222
3456 1 8 . 1 1 78 78 VAL HA H 78 4.170 4.170 3.828 0.342 18222
3457 1 8 . 1 1 78 78 VAL CA C 78 64.650 64.650 66.041 -1.391 18222
3458 1 8 . 1 1 78 78 VAL H H 78 8.140 8.140 8.713 -0.573 18222
3459 1 8 . 1 1 79 79 THR N N 79 112.100 112.100 116.820 -4.720 18222
3460 1 8 . 1 1 79 79 THR CA C 79 63.460 63.460 66.492 -3.032 18222
3461 1 8 . 1 1 79 79 THR CB C 79 68.650 68.650 68.412 0.238 18222
3462 1 8 . 1 1 79 79 THR H H 79 7.640 7.640 7.988 -0.348 18222
3463 1 8 . 1 1 80 80 ARG N N 80 120.770 120.770 121.831 -1.061 18222
3464 1 8 . 1 1 80 80 ARG HA H 80 4.160 4.160 4.075 0.085 18222
3465 1 8 . 1 1 80 80 ARG CA C 80 56.790 56.790 59.697 -2.906 18222
3466 1 8 . 1 1 80 80 ARG CB C 80 29.430 29.430 30.311 -0.881 18222
3467 1 8 . 1 1 80 80 ARG H H 80 7.680 7.680 7.997 -0.317 18222
3468 1 8 . 1 1 81 81 VAL N N 81 118.370 118.370 116.816 1.554 18222
3469 1 8 . 1 1 81 81 VAL HA H 81 3.920 3.920 3.853 0.067 18222
3470 1 8 . 1 1 81 81 VAL CA C 81 63.340 63.340 65.873 -2.533 18222
3471 1 8 . 1 1 81 81 VAL CB C 81 31.260 31.260 31.874 -0.614 18222
3472 1 8 . 1 1 81 81 VAL H H 81 7.730 7.730 8.268 -0.538 18222
3473 1 8 . 1 1 82 82 GLU N N 82 120.620 120.620 119.899 0.721 18222
3474 1 8 . 1 1 82 82 GLU CA C 82 56.320 56.320 59.582 -3.262 18222
3475 1 8 . 1 1 82 82 GLU CB C 82 27.930 27.930 29.332 -1.402 18222
3476 1 8 . 1 1 82 82 GLU H H 82 7.920 7.920 8.577 -0.657 18222
3477 1 8 . 1 1 83 83 SER N N 83 116.240 116.240 116.573 -0.333 18222
3478 1 8 . 1 1 83 83 SER CA C 83 59.250 59.250 61.480 -2.230 18222
3479 1 8 . 1 1 83 83 SER CB C 83 63.160 63.160 63.107 0.053 18222
3480 1 8 . 1 1 83 83 SER H H 83 7.960 7.960 8.064 -0.104 18222
3481 1 8 . 1 1 84 84 GLU N N 84 123.280 123.280 122.113 1.167 18222
3482 1 8 . 1 1 84 84 GLU HA H 84 4.080 4.080 3.896 0.184 18222
3483 1 8 . 1 1 84 84 GLU CA C 84 57.860 57.860 59.753 -1.893 18222
3484 1 8 . 1 1 84 84 GLU CB C 84 28.190 28.190 29.510 -1.320 18222
3485 1 8 . 1 1 84 84 GLU H H 84 8.470 8.470 8.009 0.461 18222
3486 1 8 . 1 1 85 85 LYS N N 85 118.650 118.650 119.438 -0.788 18222
3487 1 8 . 1 1 85 85 LYS HA H 85 4.100 4.100 4.052 0.048 18222
3488 1 8 . 1 1 85 85 LYS CA C 85 57.780 57.780 59.176 -1.396 18222
3489 1 8 . 1 1 85 85 LYS CB C 85 31.380 31.380 32.488 -1.108 18222
3490 1 8 . 1 1 85 85 LYS H H 85 7.940 7.940 7.967 -0.027 18222
3491 1 8 . 1 1 86 86 CYS N N 86 117.070 117.070 118.548 -1.478 18222
3492 1 8 . 1 1 86 86 CYS CA C 86 60.910 60.910 63.630 -2.720 18222
3493 1 8 . 1 1 86 86 CYS CB C 86 26.740 26.740 26.900 -0.160 18222
3494 1 8 . 1 1 86 86 CYS H H 86 7.840 7.840 8.105 -0.265 18222
3495 1 8 . 1 1 87 87 ASN N N 87 119.370 119.370 117.937 1.433 18222
3496 1 8 . 1 1 87 87 ASN HA H 87 4.130 4.130 3.462 0.668 18222
3497 1 8 . 1 1 87 87 ASN CA C 87 55.750 55.750 56.199 -0.449 18222
3498 1 8 . 1 1 87 87 ASN CB C 87 38.050 38.050 38.218 -0.168 18222
3499 1 8 . 1 1 87 87 ASN H H 87 8.110 8.110 8.156 -0.046 18222
3500 1 8 . 1 1 88 88 ASN N N 88 117.570 117.570 119.102 -1.532 18222
3501 1 8 . 1 1 88 88 ASN HA H 88 4.280 4.280 4.299 -0.019 18222
3502 1 8 . 1 1 88 88 ASN CA C 88 55.190 55.190 55.890 -0.700 18222
3503 1 8 . 1 1 88 88 ASN CB C 88 37.400 37.400 38.319 -0.918 18222
3504 1 8 . 1 1 88 88 ASN H H 88 8.280 8.280 8.012 0.268 18222
3505 1 8 . 1 1 89 89 LEU N N 89 121.940 121.940 121.638 0.302 18222
3506 1 8 . 1 1 89 89 LEU HA H 89 4.070 4.070 4.287 -0.217 18222
3507 1 8 . 1 1 89 89 LEU CA C 89 57.580 57.580 58.606 -1.026 18222
3508 1 8 . 1 1 89 89 LEU CB C 89 40.490 40.490 42.131 -1.641 18222
3509 1 8 . 1 1 89 89 LEU H H 89 7.790 7.790 8.343 -0.553 18222
3510 1 8 . 1 1 90 90 TRP N N 90 119.220 119.220 119.181 0.039 18222
3511 1 8 . 1 1 90 90 TRP CA C 90 59.120 59.120 59.068 0.052 18222
3512 1 8 . 1 1 90 90 TRP CB C 90 28.800 28.800 28.096 0.704 18222
3513 1 8 . 1 1 90 90 TRP H H 90 7.850 7.850 8.017 -0.167 18222
3514 1 8 . 1 1 91 91 LEU N N 91 117.870 117.870 121.542 -3.672 18222
3515 1 8 . 1 1 91 91 LEU CA C 91 57.300 57.300 58.648 -1.349 18222
3516 1 8 . 1 1 91 91 LEU CB C 91 40.610 40.610 41.750 -1.140 18222
3517 1 8 . 1 1 91 91 LEU H H 91 7.920 7.920 8.546 -0.626 18222
3518 1 8 . 1 1 92 92 PHE N N 92 121.280 121.280 118.196 3.084 18222
3519 1 8 . 1 1 92 92 PHE CA C 92 60.390 60.390 62.180 -1.790 18222
3520 1 8 . 1 1 92 92 PHE CB C 92 37.980 37.980 38.523 -0.543 18222
3521 1 8 . 1 1 92 92 PHE H H 92 7.860 7.860 7.981 -0.121 18222
3522 1 8 . 1 1 93 93 LEU N N 93 119.860 119.860 119.516 0.344 18222
3523 1 8 . 1 1 93 93 LEU CA C 93 56.860 56.860 58.501 -1.641 18222
3524 1 8 . 1 1 93 93 LEU CB C 93 40.550 40.550 41.887 -1.337 18222
3525 1 8 . 1 1 93 93 LEU H H 93 7.980 7.980 8.835 -0.855 18222
3526 1 8 . 1 1 94 94 GLU N N 94 114.660 114.660 117.847 -3.187 18222
3527 1 8 . 1 1 94 94 GLU HA H 94 3.810 3.810 4.112 -0.302 18222
3528 1 8 . 1 1 94 94 GLU CA C 94 57.210 57.210 59.160 -1.950 18222
3529 1 8 . 1 1 94 94 GLU CB C 94 28.470 28.470 29.713 -1.243 18222
3530 1 8 . 1 1 94 94 GLU H H 94 7.890 7.890 8.242 -0.352 18222
3531 1 8 . 1 1 95 95 THR N N 95 108.260 108.260 112.338 -4.078 18222
3532 1 8 . 1 1 95 95 THR CA C 95 62.150 62.150 62.999 -0.849 18222
3533 1 8 . 1 1 95 95 THR CB C 95 70.810 70.810 70.211 0.599 18222
3534 1 8 . 1 1 95 95 THR H H 95 7.690 7.690 7.702 -0.011 18222
3535 1 8 . 1 1 96 96 GLY N N 96 112.220 112.220 109.689 2.531 18222
3536 1 8 . 1 1 96 96 GLY CA C 96 45.410 45.410 45.181 0.229 18222
3537 1 8 . 1 1 96 96 GLY H H 96 8.240 8.240 8.049 0.191 18222
3538 1 8 . 1 1 97 97 GLN N N 97 117.950 117.950 120.572 -2.622 18222
3539 1 8 . 1 1 97 97 GLN HA H 97 4.200 4.200 4.570 -0.370 18222
3540 1 8 . 1 1 97 97 GLN CA C 97 54.430 54.430 53.892 0.538 18222
3541 1 8 . 1 1 97 97 GLN CB C 97 29.910 29.910 28.887 1.023 18222
3542 1 8 . 1 1 97 97 GLN H H 97 7.640 7.640 8.054 -0.414 18222
3543 1 8 . 1 1 98 98 LEU N N 98 123.810 123.810 122.198 1.612 18222
3544 1 8 . 1 1 98 98 LEU HA H 98 4.360 4.360 4.400 -0.040 18222
3545 1 8 . 1 1 98 98 LEU CA C 98 52.650 52.650 53.697 -1.046 18222
3546 1 8 . 1 1 98 98 LEU CB C 98 40.460 40.460 41.030 -0.570 18222
3547 1 8 . 1 1 98 98 LEU H H 98 8.270 8.270 7.748 0.522 18222
3548 1 8 . 1 1 99 99 PRO CA C 99 63.180 63.180 61.966 1.214 18222
3549 1 8 . 1 1 99 99 PRO CB C 99 30.840 30.840 32.180 -1.340 18222
3550 1 8 . 1 1 100 100 LYS N N 100 120.630 120.630 119.298 1.332 18222
3551 1 8 . 1 1 100 100 LYS CA C 100 55.730 55.730 56.028 -0.298 18222
3552 1 8 . 1 1 100 100 LYS CB C 100 32.280 32.280 32.890 -0.610 18222
3553 1 8 . 1 1 100 100 LYS H H 100 8.090 8.090 8.181 -0.091 18222
3554 1 8 . 1 1 101 101 ASP N N 101 120.920 120.920 120.615 0.305 18222
3555 1 8 . 1 1 101 101 ASP HA H 101 4.190 4.190 4.818 -0.628 18222
3556 1 8 . 1 1 101 101 ASP CA C 101 54.000 54.000 53.564 0.436 18222
3557 1 8 . 1 1 101 101 ASP CB C 101 40.330 40.330 41.817 -1.487 18222
3558 1 8 . 1 1 101 101 ASP H H 101 8.190 8.190 8.003 0.187 18222
3559 1 8 . 1 1 102 102 ARG N N 102 122.210 122.210 118.946 3.264 18222
3560 1 8 . 1 1 102 102 ARG CA C 102 55.590 55.590 55.235 0.355 18222
3561 1 8 . 1 1 102 102 ARG CB C 102 29.630 29.630 31.592 -1.962 18222
3562 1 8 . 1 1 102 102 ARG H H 102 8.130 8.130 8.288 -0.158 18222
3563 1 8 . 1 1 103 103 SER N N 103 117.230 117.230 115.802 1.428 18222
3564 1 8 . 1 1 103 103 SER HA H 103 4.280 4.280 4.784 -0.504 18222
3565 1 8 . 1 1 103 103 SER CA C 103 58.470 58.470 57.639 0.831 18222
3566 1 8 . 1 1 103 103 SER CB C 103 63.080 63.080 65.275 -2.196 18222
3567 1 8 . 1 1 103 103 SER H H 103 8.290 8.290 8.353 -0.063 18222
3568 1 8 . 1 1 104 104 THR N N 104 115.430 115.430 117.064 -1.634 18222
3569 1 8 . 1 1 104 104 THR CA C 104 61.570 61.570 62.224 -0.654 18222
3570 1 8 . 1 1 104 104 THR CB C 104 69.030 69.030 70.048 -1.018 18222
3571 1 8 . 1 1 104 104 THR H H 104 8.020 8.020 8.221 -0.201 18222
3572 1 8 . 1 1 105 105 ASP N N 105 122.780 122.780 122.019 0.761 18222
3573 1 8 . 1 1 105 105 ASP CA C 105 54.210 54.210 54.065 0.145 18222
3574 1 8 . 1 1 105 105 ASP CB C 105 40.380 40.380 41.745 -1.365 18222
3575 1 8 . 1 1 105 105 ASP H H 105 8.120 8.120 8.366 -0.246 18222
3576 1 8 . 1 1 106 106 GLN N N 106 120.960 120.960 120.042 0.918 18222
3577 1 8 . 1 1 106 106 GLN CA C 106 55.420 55.420 55.740 -0.321 18222
3578 1 8 . 1 1 106 106 GLN CB C 106 28.310 28.310 29.752 -1.442 18222
3579 1 8 . 1 1 106 106 GLN H H 106 8.140 8.140 8.160 -0.020 18222
3580 1 8 . 1 1 107 107 ARG N N 107 123.010 123.010 123.644 -0.634 18222
3581 1 8 . 1 1 107 107 ARG HA H 107 4.210 4.210 4.632 -0.422 18222
3582 1 8 . 1 1 107 107 ARG CA C 107 55.560 55.560 57.467 -1.907 18222
3583 1 8 . 1 1 107 107 ARG CB C 107 29.920 29.920 30.779 -0.859 18222
3584 1 8 . 1 1 107 107 ARG H H 107 8.180 8.180 8.847 -0.667 18222
3585 1 9 . 1 1 2 2 VAL N N 2 121.590 121.590 121.346 0.244 18222
3586 1 9 . 1 1 2 2 VAL CA C 2 61.600 61.600 61.547 0.053 18222
3587 1 9 . 1 1 2 2 VAL CB C 2 31.900 31.900 32.744 -0.844 18222
3588 1 9 . 1 1 2 2 VAL H H 2 8.010 8.010 8.375 -0.365 18222
3589 1 9 . 1 1 3 3 ASN N N 3 122.520 122.520 123.324 -0.804 18222
3590 1 9 . 1 1 3 3 ASN HA H 3 4.020 4.020 4.964 -0.944 18222
3591 1 9 . 1 1 3 3 ASN CA C 3 52.640 52.640 53.229 -0.589 18222
3592 1 9 . 1 1 3 3 ASN CB C 3 38.330 38.330 38.504 -0.174 18222
3593 1 9 . 1 1 3 3 ASN H H 3 8.360 8.360 8.506 -0.146 18222
3594 1 9 . 1 1 4 4 LEU N N 4 123.830 123.830 124.759 -0.929 18222
3595 1 9 . 1 1 4 4 LEU HA H 4 4.220 4.220 4.569 -0.349 18222
3596 1 9 . 1 1 4 4 LEU CA C 4 54.620 54.620 55.761 -1.141 18222
3597 1 9 . 1 1 4 4 LEU CB C 4 41.680 41.680 44.303 -2.623 18222
3598 1 9 . 1 1 4 4 LEU H H 4 8.220 8.220 8.464 -0.244 18222
3599 1 9 . 1 1 5 5 GLY N N 5 106.810 106.810 114.355 -7.545 18222
3600 1 9 . 1 1 5 5 GLY CA C 5 45.800 45.800 44.964 0.836 18222
3601 1 9 . 1 1 5 5 GLY H H 5 8.030 8.030 8.900 -0.870 18222
3602 1 9 . 1 1 6 6 LEU N N 6 120.820 120.820 122.260 -1.440 18222
3603 1 9 . 1 1 6 6 LEU HA H 6 4.050 4.050 4.271 -0.221 18222
3604 1 9 . 1 1 6 6 LEU CA C 6 55.990 55.990 57.001 -1.011 18222
3605 1 9 . 1 1 6 6 LEU CB C 6 40.800 40.800 42.631 -1.831 18222
3606 1 9 . 1 1 6 6 LEU H H 6 8.030 8.030 7.646 0.384 18222
3607 1 9 . 1 1 7 7 SER N N 7 115.540 115.540 113.994 1.546 18222
3608 1 9 . 1 1 7 7 SER HA H 7 4.100 4.100 4.111 -0.011 18222
3609 1 9 . 1 1 7 7 SER CA C 7 60.580 60.580 61.623 -1.043 18222
3610 1 9 . 1 1 7 7 SER CB C 7 62.060 62.060 62.746 -0.686 18222
3611 1 9 . 1 1 7 7 SER H H 7 8.360 8.360 8.472 -0.112 18222
3612 1 9 . 1 1 8 8 ARG N N 8 120.690 120.690 121.138 -0.448 18222
3613 1 9 . 1 1 8 8 ARG HA H 8 4.160 4.160 4.062 0.098 18222
3614 1 9 . 1 1 8 8 ARG CA C 8 57.350 57.350 59.392 -2.042 18222
3615 1 9 . 1 1 8 8 ARG CB C 8 29.230 29.230 30.061 -0.831 18222
3616 1 9 . 1 1 8 8 ARG H H 8 7.830 7.830 8.470 -0.640 18222
3617 1 9 . 1 1 9 9 VAL N N 9 119.330 119.330 119.635 -0.305 18222
3618 1 9 . 1 1 9 9 VAL HA H 9 4.170 4.170 3.631 0.539 18222
3619 1 9 . 1 1 9 9 VAL CA C 9 64.720 64.720 66.339 -1.619 18222
3620 1 9 . 1 1 9 9 VAL CB C 9 30.900 30.900 31.713 -0.813 18222
3621 1 9 . 1 1 9 9 VAL H H 9 7.620 7.620 7.445 0.175 18222
3622 1 9 . 1 1 10 10 ASP N N 10 119.520 119.520 120.555 -1.035 18222
3623 1 9 . 1 1 10 10 ASP CA C 10 54.960 54.960 58.145 -3.185 18222
3624 1 9 . 1 1 10 10 ASP CB C 10 37.800 37.800 40.430 -2.630 18222
3625 1 9 . 1 1 10 10 ASP H H 10 8.180 8.180 8.318 -0.138 18222
3626 1 9 . 1 1 11 11 ASP N N 11 121.550 121.550 120.402 1.148 18222
3627 1 9 . 1 1 11 11 ASP CA C 11 54.440 54.440 56.896 -2.456 18222
3628 1 9 . 1 1 11 11 ASP CB C 11 37.840 37.840 40.610 -2.770 18222
3629 1 9 . 1 1 11 11 ASP H H 11 7.950 7.950 8.213 -0.263 18222
3630 1 9 . 1 1 12 12 ALA N N 12 120.220 120.220 123.377 -3.157 18222
3631 1 9 . 1 1 12 12 ALA CA C 12 54.370 54.370 55.198 -0.828 18222
3632 1 9 . 1 1 12 12 ALA CB C 12 24.730 24.730 18.654 6.077 18222
3633 1 9 . 1 1 12 12 ALA H H 12 8.090 8.090 7.961 0.129 18222
3634 1 9 . 1 1 13 13 VAL N N 13 116.910 116.910 118.141 -1.231 18222
3635 1 9 . 1 1 13 13 VAL HA H 13 4.140 4.140 3.784 0.356 18222
3636 1 9 . 1 1 13 13 VAL CA C 13 64.900 64.900 64.521 0.379 18222
3637 1 9 . 1 1 13 13 VAL CB C 13 31.000 31.000 31.224 -0.224 18222
3638 1 9 . 1 1 13 13 VAL H H 13 7.980 7.980 8.261 -0.281 18222
3639 1 9 . 1 1 14 14 ALA N N 14 122.200 122.200 122.238 -0.038 18222
3640 1 9 . 1 1 14 14 ALA HA H 14 4.020 4.020 4.073 -0.053 18222
3641 1 9 . 1 1 14 14 ALA CA C 14 53.800 53.800 55.007 -1.207 18222
3642 1 9 . 1 1 14 14 ALA CB C 14 17.790 17.790 18.201 -0.411 18222
3643 1 9 . 1 1 14 14 ALA H H 14 8.030 8.030 7.815 0.215 18222
3644 1 9 . 1 1 15 15 ALA N N 15 118.600 118.600 117.854 0.746 18222
3645 1 9 . 1 1 15 15 ALA CA C 15 53.230 53.230 53.580 -0.350 18222
3646 1 9 . 1 1 15 15 ALA CB C 15 18.010 18.010 18.427 -0.417 18222
3647 1 9 . 1 1 15 15 ALA H H 15 7.530 7.530 7.643 -0.113 18222
3648 1 9 . 1 1 16 16 LYS N N 16 115.820 115.820 117.753 -1.933 18222
3649 1 9 . 1 1 16 16 LYS HA H 16 4.080 4.080 4.216 -0.136 18222
3650 1 9 . 1 1 16 16 LYS CA C 16 55.670 55.670 57.138 -1.468 18222
3651 1 9 . 1 1 16 16 LYS CB C 16 32.640 32.640 33.228 -0.588 18222
3652 1 9 . 1 1 16 16 LYS H H 16 7.490 7.490 7.619 -0.129 18222
3653 1 9 . 1 1 17 17 HIS N N 17 116.790 116.790 119.269 -2.479 18222
3654 1 9 . 1 1 17 17 HIS HA H 17 4.100 4.100 4.900 -0.800 18222
3655 1 9 . 1 1 17 17 HIS CA C 17 52.820 52.820 53.213 -0.393 18222
3656 1 9 . 1 1 17 17 HIS CB C 17 28.400 28.400 30.562 -2.162 18222
3657 1 9 . 1 1 17 17 HIS H H 17 8.130 8.130 7.656 0.474 18222
3658 1 9 . 1 1 18 18 PRO CA C 18 63.800 63.800 62.533 1.267 18222
3659 1 9 . 1 1 18 18 PRO CB C 18 30.800 30.800 32.919 -2.119 18222
3660 1 9 . 1 1 19 19 GLY N N 19 110.260 110.260 106.614 3.646 18222
3661 1 9 . 1 1 19 19 GLY CA C 19 45.490 45.490 44.723 0.767 18222
3662 1 9 . 1 1 19 19 GLY H H 19 8.730 8.730 8.257 0.473 18222
3663 1 9 . 1 1 20 20 LEU N N 20 122.650 122.650 122.286 0.364 18222
3664 1 9 . 1 1 20 20 LEU HA H 20 4.090 4.090 4.411 -0.321 18222
3665 1 9 . 1 1 20 20 LEU CA C 20 57.060 57.060 57.328 -0.268 18222
3666 1 9 . 1 1 20 20 LEU H H 20 7.980 7.980 8.594 -0.614 18222
3667 1 9 . 1 1 21 21 GLY N N 21 107.000 107.000 107.614 -0.614 18222
3668 1 9 . 1 1 21 21 GLY CA C 21 46.710 46.710 46.975 -0.265 18222
3669 1 9 . 1 1 21 21 GLY H H 21 8.570 8.570 8.564 0.006 18222
3670 1 9 . 1 1 22 22 GLU N N 22 121.610 121.610 123.061 -1.451 18222
3671 1 9 . 1 1 22 22 GLU HA H 22 3.990 3.990 4.122 -0.132 18222
3672 1 9 . 1 1 22 22 GLU CA C 22 58.280 58.280 59.159 -0.879 18222
3673 1 9 . 1 1 22 22 GLU CB C 22 28.010 28.010 29.717 -1.707 18222
3674 1 9 . 1 1 22 22 GLU H H 22 8.100 8.100 7.866 0.234 18222
3675 1 9 . 1 1 23 23 TYR N N 23 120.870 120.870 120.887 -0.017 18222
3676 1 9 . 1 1 23 23 TYR CA C 23 60.380 60.380 59.975 0.405 18222
3677 1 9 . 1 1 23 23 TYR CB C 23 37.750 37.750 38.095 -0.345 18222
3678 1 9 . 1 1 23 23 TYR H H 23 7.910 7.910 8.046 -0.136 18222
3679 1 9 . 1 1 24 24 ALA N N 24 121.420 121.420 122.223 -0.803 18222
3680 1 9 . 1 1 24 24 ALA HA H 24 4.140 4.140 3.317 0.823 18222
3681 1 9 . 1 1 24 24 ALA CA C 24 54.260 54.260 54.746 -0.486 18222
3682 1 9 . 1 1 24 24 ALA H H 24 8.410 8.410 8.532 -0.122 18222
3683 1 9 . 1 1 25 25 ALA N N 25 120.220 120.220 121.112 -0.892 18222
3684 1 9 . 1 1 25 25 ALA CA C 25 54.370 54.370 55.144 -0.774 18222
3685 1 9 . 1 1 25 25 ALA H H 25 8.090 8.090 8.127 -0.037 18222
3686 1 9 . 1 1 26 26 CYS N N 26 116.760 116.760 117.290 -0.530 18222
3687 1 9 . 1 1 26 26 CYS CA C 26 61.180 61.180 64.064 -2.884 18222
3688 1 9 . 1 1 26 26 CYS CB C 26 26.390 26.390 27.812 -1.422 18222
3689 1 9 . 1 1 26 26 CYS H H 26 7.950 7.950 8.287 -0.337 18222
3690 1 9 . 1 1 27 27 GLN N N 27 118.690 118.690 120.353 -1.663 18222
3691 1 9 . 1 1 27 27 GLN CA C 27 55.970 55.970 59.257 -3.287 18222
3692 1 9 . 1 1 27 27 GLN H H 27 8.060 8.060 8.203 -0.143 18222
3693 1 9 . 1 1 28 28 SER N N 28 115.490 115.490 115.742 -0.252 18222
3694 1 9 . 1 1 28 28 SER HA H 28 3.990 3.990 4.049 -0.059 18222
3695 1 9 . 1 1 28 28 SER CA C 28 61.110 61.110 61.379 -0.269 18222
3696 1 9 . 1 1 28 28 SER H H 28 7.980 7.980 8.148 -0.168 18222
3697 1 9 . 1 1 29 29 HIS N N 29 120.880 120.880 121.177 -0.297 18222
3698 1 9 . 1 1 29 29 HIS CA C 29 58.190 58.190 59.787 -1.597 18222
3699 1 9 . 1 1 29 29 HIS CB C 29 27.460 27.460 29.902 -2.442 18222
3700 1 9 . 1 1 29 29 HIS H H 29 8.180 8.180 8.234 -0.054 18222
3701 1 9 . 1 1 30 30 ALA N N 30 122.920 122.920 122.764 0.156 18222
3702 1 9 . 1 1 30 30 ALA CA C 30 54.560 54.560 55.437 -0.876 18222
3703 1 9 . 1 1 30 30 ALA CB C 30 17.490 17.490 18.544 -1.054 18222
3704 1 9 . 1 1 30 30 ALA H H 30 8.040 8.040 8.386 -0.346 18222
3705 1 9 . 1 1 31 31 PHE N N 31 119.340 119.340 118.195 1.145 18222
3706 1 9 . 1 1 31 31 PHE CA C 31 60.370 60.370 61.931 -1.561 18222
3707 1 9 . 1 1 31 31 PHE CB C 31 38.520 38.520 38.713 -0.193 18222
3708 1 9 . 1 1 31 31 PHE H H 31 8.230 8.230 8.629 -0.399 18222
3709 1 9 . 1 1 32 32 MET N N 32 118.110 118.110 119.333 -1.223 18222
3710 1 9 . 1 1 32 32 MET HA H 32 4.050 4.050 3.952 0.098 18222
3711 1 9 . 1 1 32 32 MET CA C 32 58.280 58.280 59.751 -1.471 18222
3712 1 9 . 1 1 32 32 MET CB C 32 31.090 31.090 32.519 -1.429 18222
3713 1 9 . 1 1 32 32 MET H H 32 8.120 8.120 8.585 -0.465 18222
3714 1 9 . 1 1 33 33 LYS N N 33 119.040 119.040 119.330 -0.290 18222
3715 1 9 . 1 1 33 33 LYS HA H 33 3.930 3.930 3.970 -0.040 18222
3716 1 9 . 1 1 33 33 LYS CA C 33 59.040 59.040 59.895 -0.855 18222
3717 1 9 . 1 1 33 33 LYS CB C 33 30.990 30.990 32.447 -1.457 18222
3718 1 9 . 1 1 33 33 LYS H H 33 7.970 7.970 8.489 -0.519 18222
3719 1 9 . 1 1 34 34 GLY N N 34 108.840 108.840 106.758 2.082 18222
3720 1 9 . 1 1 34 34 GLY CA C 34 46.610 46.610 47.261 -0.651 18222
3721 1 9 . 1 1 34 34 GLY H H 34 8.030 8.030 8.340 -0.310 18222
3722 1 9 . 1 1 35 35 VAL N N 35 122.910 122.910 122.020 0.890 18222
3723 1 9 . 1 1 35 35 VAL HA H 35 4.220 4.220 3.729 0.490 18222
3724 1 9 . 1 1 35 35 VAL CA C 35 66.310 66.310 65.389 0.921 18222
3725 1 9 . 1 1 35 35 VAL CB C 35 30.560 30.560 30.945 -0.385 18222
3726 1 9 . 1 1 35 35 VAL H H 35 8.090 8.090 8.359 -0.269 18222
3727 1 9 . 1 1 36 36 PHE N N 36 120.020 120.020 121.611 -1.591 18222
3728 1 9 . 1 1 36 36 PHE CA C 36 61.350 61.350 62.333 -0.983 18222
3729 1 9 . 1 1 36 36 PHE CB C 36 38.090 38.090 38.777 -0.687 18222
3730 1 9 . 1 1 36 36 PHE H H 36 8.350 8.350 8.861 -0.511 18222
3731 1 9 . 1 1 37 37 THR N N 37 116.980 116.980 116.966 0.014 18222
3732 1 9 . 1 1 37 37 THR HA H 37 4.050 4.050 3.968 0.082 18222
3733 1 9 . 1 1 37 37 THR CA C 37 66.000 66.000 67.088 -1.088 18222
3734 1 9 . 1 1 37 37 THR CB C 37 68.270 68.270 68.910 -0.640 18222
3735 1 9 . 1 1 37 37 THR H H 37 8.520 8.520 8.425 0.095 18222
3736 1 9 . 1 1 38 38 PHE N N 38 123.090 123.090 120.158 2.932 18222
3737 1 9 . 1 1 38 38 PHE HA H 38 4.360 4.360 4.266 0.094 18222
3738 1 9 . 1 1 38 38 PHE CA C 38 61.140 61.140 61.182 -0.042 18222
3739 1 9 . 1 1 38 38 PHE CB C 38 41.200 41.200 38.837 2.363 18222
3740 1 9 . 1 1 38 38 PHE H H 38 8.010 8.010 8.222 -0.212 18222
3741 1 9 . 1 1 39 39 VAL N N 39 117.280 117.280 118.808 -1.528 18222
3742 1 9 . 1 1 39 39 VAL HA H 39 4.210 4.210 3.678 0.532 18222
3743 1 9 . 1 1 39 39 VAL CA C 39 66.000 66.000 65.683 0.317 18222
3744 1 9 . 1 1 39 39 VAL CB C 39 30.860 30.860 31.217 -0.357 18222
3745 1 9 . 1 1 39 39 VAL H H 39 8.530 8.530 8.371 0.159 18222
3746 1 9 . 1 1 40 40 THR N N 40 109.470 109.470 110.950 -1.480 18222
3747 1 9 . 1 1 40 40 THR HA H 40 4.060 4.060 4.014 0.046 18222
3748 1 9 . 1 1 40 40 THR CA C 40 63.390 63.390 64.113 -0.723 18222
3749 1 9 . 1 1 40 40 THR CB C 40 68.650 68.650 69.168 -0.519 18222
3750 1 9 . 1 1 40 40 THR H H 40 7.700 7.700 7.931 -0.231 18222
3751 1 9 . 1 1 41 41 GLY N N 41 110.770 110.770 111.168 -0.398 18222
3752 1 9 . 1 1 41 41 GLY CA C 41 45.580 45.580 45.947 -0.367 18222
3753 1 9 . 1 1 41 41 GLY H H 41 7.700 7.700 8.371 -0.671 18222
3754 1 9 . 1 1 42 42 THR N N 42 114.520 114.520 112.542 1.978 18222
3755 1 9 . 1 1 42 42 THR CA C 42 63.300 63.300 62.528 0.772 18222
3756 1 9 . 1 1 42 42 THR CB C 42 69.490 69.490 67.199 2.291 18222
3757 1 9 . 1 1 42 42 THR H H 42 7.720 7.720 7.819 -0.099 18222
3758 1 9 . 1 1 43 43 GLY N N 43 109.540 109.540 109.507 0.033 18222
3759 1 9 . 1 1 43 43 GLY CA C 43 46.250 46.250 46.702 -0.452 18222
3760 1 9 . 1 1 43 43 GLY H H 43 8.110 8.110 8.603 -0.493 18222
3761 1 9 . 1 1 44 44 MET N N 44 120.240 120.240 121.284 -1.044 18222
3762 1 9 . 1 1 44 44 MET HA H 44 4.100 4.100 3.993 0.107 18222
3763 1 9 . 1 1 44 44 MET CA C 44 57.700 57.700 58.636 -0.936 18222
3764 1 9 . 1 1 44 44 MET CB C 44 32.030 32.030 32.369 -0.339 18222
3765 1 9 . 1 1 44 44 MET H H 44 7.730 7.730 8.096 -0.366 18222
3766 1 9 . 1 1 45 45 ALA N N 45 121.560 121.560 121.535 0.025 18222
3767 1 9 . 1 1 45 45 ALA CA C 45 54.440 54.440 55.346 -0.907 18222
3768 1 9 . 1 1 45 45 ALA CB C 45 17.400 17.400 18.041 -0.641 18222
3769 1 9 . 1 1 45 45 ALA H H 45 7.950 7.950 7.856 0.094 18222
3770 1 9 . 1 1 46 46 PHE N N 46 118.260 118.260 119.052 -0.792 18222
3771 1 9 . 1 1 46 46 PHE HA H 46 3.930 3.930 4.293 -0.363 18222
3772 1 9 . 1 1 46 46 PHE CA C 46 59.820 59.820 60.406 -0.586 18222
3773 1 9 . 1 1 46 46 PHE CB C 46 38.260 38.260 38.479 -0.219 18222
3774 1 9 . 1 1 46 46 PHE H H 46 7.860 7.860 8.090 -0.230 18222
3775 1 9 . 1 1 47 47 GLY N N 47 107.300 107.300 108.710 -1.410 18222
3776 1 9 . 1 1 47 47 GLY CA C 47 46.560 46.560 47.340 -0.780 18222
3777 1 9 . 1 1 47 47 GLY H H 47 8.200 8.200 8.704 -0.504 18222
3778 1 9 . 1 1 48 48 LEU N N 48 121.920 121.920 123.035 -1.115 18222
3779 1 9 . 1 1 48 48 LEU HA H 48 4.040 4.040 3.932 0.108 18222
3780 1 9 . 1 1 48 48 LEU CA C 48 57.580 57.580 58.619 -1.039 18222
3781 1 9 . 1 1 48 48 LEU CB C 48 40.790 40.790 41.998 -1.208 18222
3782 1 9 . 1 1 48 48 LEU H H 48 8.180 8.180 8.263 -0.083 18222
3783 1 9 . 1 1 49 49 GLN N N 49 118.270 118.270 118.372 -0.102 18222
3784 1 9 . 1 1 49 49 GLN HA H 49 3.830 3.830 3.953 -0.123 18222
3785 1 9 . 1 1 49 49 GLN CA C 49 58.880 58.880 59.263 -0.383 18222
3786 1 9 . 1 1 49 49 GLN CB C 49 27.240 27.240 28.599 -1.359 18222
3787 1 9 . 1 1 49 49 GLN H H 49 8.080 8.080 8.215 -0.135 18222
3788 1 9 . 1 1 50 50 MET N N 50 117.630 117.630 119.561 -1.931 18222
3789 1 9 . 1 1 50 50 MET HA H 50 4.010 4.010 4.157 -0.147 18222
3790 1 9 . 1 1 50 50 MET CA C 50 57.730 57.730 59.319 -1.589 18222
3791 1 9 . 1 1 50 50 MET CB C 50 27.160 27.160 32.871 -5.711 18222
3792 1 9 . 1 1 50 50 MET H H 50 7.880 7.880 8.332 -0.452 18222
3793 1 9 . 1 1 51 51 PHE N N 51 119.550 119.550 120.292 -0.742 18222
3794 1 9 . 1 1 51 51 PHE CA C 51 60.850 60.850 61.530 -0.680 18222
3795 1 9 . 1 1 51 51 PHE CB C 51 38.720 38.720 39.160 -0.440 18222
3796 1 9 . 1 1 51 51 PHE H H 51 7.890 7.890 8.369 -0.479 18222
3797 1 9 . 1 1 52 52 ILE N N 52 117.950 117.950 118.605 -0.655 18222
3798 1 9 . 1 1 52 52 ILE HA H 52 4.050 4.050 4.017 0.033 18222
3799 1 9 . 1 1 52 52 ILE CA C 52 63.560 63.560 63.833 -0.273 18222
3800 1 9 . 1 1 52 52 ILE CB C 52 36.810 36.810 38.554 -1.744 18222
3801 1 9 . 1 1 52 52 ILE H H 52 8.110 8.110 8.407 -0.297 18222
3802 1 9 . 1 1 53 53 GLN N N 53 117.360 117.360 119.185 -1.825 18222
3803 1 9 . 1 1 53 53 GLN CA C 53 57.200 57.200 57.961 -0.761 18222
3804 1 9 . 1 1 53 53 GLN CB C 53 27.870 27.870 28.242 -0.372 18222
3805 1 9 . 1 1 53 53 GLN H H 53 7.930 7.930 8.248 -0.318 18222
3806 1 9 . 1 1 54 54 ARG N N 54 116.840 116.840 118.797 -1.957 18222
3807 1 9 . 1 1 54 54 ARG HA H 54 3.950 3.950 4.218 -0.268 18222
3808 1 9 . 1 1 54 54 ARG CA C 54 56.480 56.480 57.629 -1.149 18222
3809 1 9 . 1 1 54 54 ARG CB C 54 28.970 28.970 30.009 -1.040 18222
3810 1 9 . 1 1 54 54 ARG H H 54 7.540 7.540 7.870 -0.330 18222
3811 1 9 . 1 1 55 55 LYS N N 55 117.900 117.900 117.948 -0.048 18222
3812 1 9 . 1 1 55 55 LYS HA H 55 4.080 4.080 4.192 -0.112 18222
3813 1 9 . 1 1 55 55 LYS CA C 55 55.030 55.030 56.930 -1.900 18222
3814 1 9 . 1 1 55 55 LYS CB C 55 32.010 32.010 32.801 -0.791 18222
3815 1 9 . 1 1 55 55 LYS H H 55 7.660 7.660 7.305 0.355 18222
3816 1 9 . 1 1 56 56 PHE N N 56 121.060 121.060 120.940 0.120 18222
3817 1 9 . 1 1 56 56 PHE CA C 56 55.190 55.190 55.714 -0.524 18222
3818 1 9 . 1 1 56 56 PHE CB C 56 38.970 38.970 39.840 -0.870 18222
3819 1 9 . 1 1 56 56 PHE H H 56 8.080 8.080 7.769 0.311 18222
3820 1 9 . 1 1 57 57 PRO CA C 57 62.390 62.390 63.631 -1.241 18222
3821 1 9 . 1 1 57 57 PRO CB C 57 30.580 30.580 31.822 -1.242 18222
3822 1 9 . 1 1 58 58 TYR N N 58 120.240 120.240 120.690 -0.450 18222
3823 1 9 . 1 1 58 58 TYR CA C 58 55.770 55.770 55.167 0.603 18222
3824 1 9 . 1 1 58 58 TYR CB C 58 40.220 40.220 39.159 1.061 18222
3825 1 9 . 1 1 58 58 TYR H H 58 7.700 7.700 8.083 -0.383 18222
3826 1 9 . 1 1 59 59 PRO CA C 59 62.130 62.130 63.789 -1.659 18222
3827 1 9 . 1 1 59 59 PRO CB C 59 33.340 33.340 32.097 1.243 18222
3828 1 9 . 1 1 60 60 LEU N N 60 122.210 122.210 116.985 5.225 18222
3829 1 9 . 1 1 60 60 LEU CA C 60 54.250 54.250 54.712 -0.462 18222
3830 1 9 . 1 1 60 60 LEU CB C 60 41.470 41.470 42.161 -0.691 18222
3831 1 9 . 1 1 60 60 LEU H H 60 7.880 7.880 7.655 0.225 18222
3832 1 9 . 1 1 61 61 GLN N N 61 122.470 122.470 120.260 2.210 18222
3833 1 9 . 1 1 61 61 GLN CA C 61 54.170 54.170 55.721 -1.551 18222
3834 1 9 . 1 1 61 61 GLN H H 61 7.970 7.970 8.171 -0.201 18222
3835 1 9 . 1 1 62 62 TRP N N 62 124.590 124.590 124.437 0.153 18222
3836 1 9 . 1 1 62 62 TRP CA C 62 59.830 59.830 61.505 -1.675 18222
3837 1 9 . 1 1 62 62 TRP CB C 62 28.800 28.800 29.620 -0.820 18222
3838 1 9 . 1 1 62 62 TRP H H 62 8.240 8.240 8.608 -0.368 18222
3839 1 9 . 1 1 63 63 SER N N 63 113.320 113.320 114.924 -1.604 18222
3840 1 9 . 1 1 63 63 SER CA C 63 61.100 61.100 62.763 -1.663 18222
3841 1 9 . 1 1 63 63 SER H H 63 8.410 8.410 8.460 -0.050 18222
3842 1 9 . 1 1 64 64 LEU N N 64 123.230 123.230 121.646 1.584 18222
3843 1 9 . 1 1 64 64 LEU CA C 64 56.880 56.880 57.392 -0.512 18222
3844 1 9 . 1 1 64 64 LEU CB C 64 40.830 40.830 41.267 -0.437 18222
3845 1 9 . 1 1 64 64 LEU H H 64 7.230 7.230 8.206 -0.976 18222
3846 1 9 . 1 1 65 65 LEU N N 65 119.400 119.400 121.389 -1.989 18222
3847 1 9 . 1 1 65 65 LEU HA H 65 3.890 3.890 4.145 -0.255 18222
3848 1 9 . 1 1 65 65 LEU CA C 65 57.580 57.580 58.236 -0.656 18222
3849 1 9 . 1 1 65 65 LEU CB C 65 40.710 40.710 41.516 -0.806 18222
3850 1 9 . 1 1 65 65 LEU H H 65 7.510 7.510 8.341 -0.831 18222
3851 1 9 . 1 1 66 66 VAL N N 66 116.950 116.950 119.629 -2.679 18222
3852 1 9 . 1 1 66 66 VAL HA H 66 3.960 3.960 3.839 0.121 18222
3853 1 9 . 1 1 66 66 VAL CA C 66 66.260 66.260 65.236 1.024 18222
3854 1 9 . 1 1 66 66 VAL CB C 66 30.570 30.570 31.123 -0.553 18222
3855 1 9 . 1 1 66 66 VAL H H 66 7.950 7.950 8.603 -0.653 18222
3856 1 9 . 1 1 67 67 ALA N N 67 120.650 120.650 122.807 -2.157 18222
3857 1 9 . 1 1 67 67 ALA HA H 67 4.000 4.000 4.223 -0.223 18222
3858 1 9 . 1 1 67 67 ALA CA C 67 54.780 54.780 55.362 -0.582 18222
3859 1 9 . 1 1 67 67 ALA CB C 67 17.440 17.440 18.403 -0.963 18222
3860 1 9 . 1 1 67 67 ALA H H 67 7.450 7.450 8.119 -0.669 18222
3861 1 9 . 1 1 68 68 VAL N N 68 118.440 118.440 118.612 -0.172 18222
3862 1 9 . 1 1 68 68 VAL HA H 68 3.750 3.750 3.740 0.010 18222
3863 1 9 . 1 1 68 68 VAL CA C 68 65.250 65.250 66.031 -0.781 18222
3864 1 9 . 1 1 68 68 VAL CB C 68 30.850 30.850 31.503 -0.653 18222
3865 1 9 . 1 1 68 68 VAL H H 68 7.960 7.960 7.791 0.169 18222
3866 1 9 . 1 1 69 69 VAL N N 69 120.800 120.800 120.746 0.054 18222
3867 1 9 . 1 1 69 69 VAL HA H 69 4.220 4.220 3.717 0.503 18222
3868 1 9 . 1 1 69 69 VAL CA C 69 66.020 66.020 66.290 -0.270 18222
3869 1 9 . 1 1 69 69 VAL CB C 69 30.850 30.850 30.290 0.560 18222
3870 1 9 . 1 1 69 69 VAL H H 69 8.080 8.080 8.614 -0.534 18222
3871 1 9 . 1 1 70 70 ALA N N 70 121.740 121.740 120.940 0.800 18222
3872 1 9 . 1 1 70 70 ALA HA H 70 3.920 3.920 4.264 -0.344 18222
3873 1 9 . 1 1 70 70 ALA CA C 70 54.920 54.920 55.400 -0.480 18222
3874 1 9 . 1 1 70 70 ALA CB C 70 17.620 17.620 18.272 -0.652 18222
3875 1 9 . 1 1 70 70 ALA H H 70 8.660 8.660 8.611 0.049 18222
3876 1 9 . 1 1 71 71 GLY N N 71 103.450 103.450 107.149 -3.699 18222
3877 1 9 . 1 1 71 71 GLY CA C 71 46.300 46.300 46.987 -0.687 18222
3878 1 9 . 1 1 71 71 GLY H H 71 8.010 8.010 8.085 -0.075 18222
3879 1 9 . 1 1 72 72 SER N N 72 118.160 118.160 118.271 -0.111 18222
3880 1 9 . 1 1 72 72 SER CA C 72 61.260 61.260 61.707 -0.447 18222
3881 1 9 . 1 1 72 72 SER CB C 72 62.870 62.870 63.348 -0.478 18222
3882 1 9 . 1 1 72 72 SER H H 72 7.870 7.870 8.108 -0.238 18222
3883 1 9 . 1 1 73 73 VAL N N 73 121.340 121.340 122.448 -1.108 18222
3884 1 9 . 1 1 73 73 VAL CA C 73 65.750 65.750 66.674 -0.924 18222
3885 1 9 . 1 1 73 73 VAL CB C 73 30.740 30.740 31.272 -0.532 18222
3886 1 9 . 1 1 73 73 VAL H H 73 8.050 8.050 8.250 -0.200 18222
3887 1 9 . 1 1 74 74 VAL N N 74 118.680 118.680 118.678 0.002 18222
3888 1 9 . 1 1 74 74 VAL CA C 74 65.770 65.770 66.938 -1.168 18222
3889 1 9 . 1 1 74 74 VAL CB C 74 30.740 30.740 31.322 -0.582 18222
3890 1 9 . 1 1 74 74 VAL H H 74 7.880 7.880 8.541 -0.661 18222
3891 1 9 . 1 1 75 75 SER N N 75 114.750 114.750 116.143 -1.393 18222
3892 1 9 . 1 1 75 75 SER HA H 75 4.100 4.100 4.154 -0.054 18222
3893 1 9 . 1 1 75 75 SER CA C 75 60.870 60.870 61.584 -0.714 18222
3894 1 9 . 1 1 75 75 SER CB C 75 62.340 62.340 63.004 -0.664 18222
3895 1 9 . 1 1 75 75 SER H H 75 7.870 7.870 7.966 -0.096 18222
3896 1 9 . 1 1 76 76 TYR N N 76 121.110 121.110 122.002 -0.892 18222
3897 1 9 . 1 1 76 76 TYR CA C 76 60.050 60.050 61.789 -1.739 18222
3898 1 9 . 1 1 76 76 TYR CB C 76 37.980 37.980 38.563 -0.583 18222
3899 1 9 . 1 1 76 76 TYR H H 76 7.860 7.860 8.702 -0.842 18222
3900 1 9 . 1 1 77 77 GLY N N 77 107.300 107.300 107.069 0.231 18222
3901 1 9 . 1 1 77 77 GLY CA C 77 46.560 46.560 47.348 -0.788 18222
3902 1 9 . 1 1 77 77 GLY H H 77 8.200 8.200 8.579 -0.379 18222
3903 1 9 . 1 1 78 78 VAL N N 78 119.470 119.470 121.888 -2.418 18222
3904 1 9 . 1 1 78 78 VAL HA H 78 4.170 4.170 3.761 0.409 18222
3905 1 9 . 1 1 78 78 VAL CA C 78 64.650 64.650 66.246 -1.596 18222
3906 1 9 . 1 1 78 78 VAL H H 78 8.140 8.140 8.681 -0.541 18222
3907 1 9 . 1 1 79 79 THR N N 79 112.100 112.100 116.822 -4.722 18222
3908 1 9 . 1 1 79 79 THR CA C 79 63.460 63.460 67.411 -3.951 18222
3909 1 9 . 1 1 79 79 THR CB C 79 68.650 68.650 68.606 0.045 18222
3910 1 9 . 1 1 79 79 THR H H 79 7.640 7.640 8.213 -0.573 18222
3911 1 9 . 1 1 80 80 ARG N N 80 120.770 120.770 121.949 -1.179 18222
3912 1 9 . 1 1 80 80 ARG HA H 80 4.160 4.160 4.073 0.087 18222
3913 1 9 . 1 1 80 80 ARG CA C 80 56.790 56.790 59.999 -3.209 18222
3914 1 9 . 1 1 80 80 ARG CB C 80 29.430 29.430 30.215 -0.785 18222
3915 1 9 . 1 1 80 80 ARG H H 80 7.680 7.680 8.087 -0.407 18222
3916 1 9 . 1 1 81 81 VAL N N 81 118.370 118.370 120.572 -2.202 18222
3917 1 9 . 1 1 81 81 VAL HA H 81 3.920 3.920 3.644 0.276 18222
3918 1 9 . 1 1 81 81 VAL CA C 81 63.340 63.340 66.799 -3.459 18222
3919 1 9 . 1 1 81 81 VAL CB C 81 31.260 31.260 31.654 -0.394 18222
3920 1 9 . 1 1 81 81 VAL H H 81 7.730 7.730 8.329 -0.599 18222
3921 1 9 . 1 1 82 82 GLU N N 82 120.620 120.620 119.348 1.272 18222
3922 1 9 . 1 1 82 82 GLU CA C 82 56.320 56.320 59.712 -3.392 18222
3923 1 9 . 1 1 82 82 GLU CB C 82 27.930 27.930 29.328 -1.399 18222
3924 1 9 . 1 1 82 82 GLU H H 82 7.920 7.920 8.648 -0.728 18222
3925 1 9 . 1 1 83 83 SER N N 83 116.240 116.240 116.335 -0.095 18222
3926 1 9 . 1 1 83 83 SER CA C 83 59.250 59.250 62.108 -2.858 18222
3927 1 9 . 1 1 83 83 SER CB C 83 63.160 63.160 62.868 0.292 18222
3928 1 9 . 1 1 83 83 SER H H 83 7.960 7.960 8.312 -0.352 18222
3929 1 9 . 1 1 84 84 GLU N N 84 123.280 123.280 122.160 1.120 18222
3930 1 9 . 1 1 84 84 GLU HA H 84 4.080 4.080 3.991 0.089 18222
3931 1 9 . 1 1 84 84 GLU CA C 84 57.860 57.860 60.054 -2.194 18222
3932 1 9 . 1 1 84 84 GLU CB C 84 28.190 28.190 29.563 -1.373 18222
3933 1 9 . 1 1 84 84 GLU H H 84 8.470 8.470 8.278 0.192 18222
3934 1 9 . 1 1 85 85 LYS N N 85 118.650 118.650 119.684 -1.034 18222
3935 1 9 . 1 1 85 85 LYS HA H 85 4.100 4.100 4.151 -0.051 18222
3936 1 9 . 1 1 85 85 LYS CA C 85 57.780 57.780 59.393 -1.613 18222
3937 1 9 . 1 1 85 85 LYS CB C 85 31.380 31.380 32.533 -1.153 18222
3938 1 9 . 1 1 85 85 LYS H H 85 7.940 7.940 8.011 -0.071 18222
3939 1 9 . 1 1 86 86 CYS N N 86 117.070 117.070 118.681 -1.611 18222
3940 1 9 . 1 1 86 86 CYS CA C 86 60.910 60.910 62.469 -1.559 18222
3941 1 9 . 1 1 86 86 CYS CB C 86 26.740 26.740 26.422 0.318 18222
3942 1 9 . 1 1 86 86 CYS H H 86 7.840 7.840 8.474 -0.634 18222
3943 1 9 . 1 1 87 87 ASN N N 87 119.370 119.370 119.407 -0.037 18222
3944 1 9 . 1 1 87 87 ASN HA H 87 4.130 4.130 4.766 -0.636 18222
3945 1 9 . 1 1 87 87 ASN CA C 87 55.750 55.750 56.743 -0.993 18222
3946 1 9 . 1 1 87 87 ASN CB C 87 38.050 38.050 38.356 -0.306 18222
3947 1 9 . 1 1 87 87 ASN H H 87 8.110 8.110 8.706 -0.596 18222
3948 1 9 . 1 1 88 88 ASN N N 88 117.570 117.570 119.262 -1.692 18222
3949 1 9 . 1 1 88 88 ASN HA H 88 4.280 4.280 4.547 -0.267 18222
3950 1 9 . 1 1 88 88 ASN CA C 88 55.190 55.190 56.458 -1.268 18222
3951 1 9 . 1 1 88 88 ASN CB C 88 37.400 37.400 38.650 -1.250 18222
3952 1 9 . 1 1 88 88 ASN H H 88 8.280 8.280 8.419 -0.139 18222
3953 1 9 . 1 1 89 89 LEU N N 89 121.940 121.940 122.349 -0.409 18222
3954 1 9 . 1 1 89 89 LEU HA H 89 4.070 4.070 4.231 -0.161 18222
3955 1 9 . 1 1 89 89 LEU CA C 89 57.580 57.580 59.016 -1.436 18222
3956 1 9 . 1 1 89 89 LEU CB C 89 40.490 40.490 42.103 -1.613 18222
3957 1 9 . 1 1 89 89 LEU H H 89 7.790 7.790 8.394 -0.604 18222
3958 1 9 . 1 1 90 90 TRP N N 90 119.220 119.220 121.385 -2.165 18222
3959 1 9 . 1 1 90 90 TRP CA C 90 59.120 59.120 61.187 -2.067 18222
3960 1 9 . 1 1 90 90 TRP CB C 90 28.800 28.800 29.013 -0.213 18222
3961 1 9 . 1 1 90 90 TRP H H 90 7.850 7.850 8.577 -0.727 18222
3962 1 9 . 1 1 91 91 LEU N N 91 117.870 117.870 119.337 -1.467 18222
3963 1 9 . 1 1 91 91 LEU CA C 91 57.300 57.300 57.645 -0.345 18222
3964 1 9 . 1 1 91 91 LEU CB C 91 40.610 40.610 41.321 -0.711 18222
3965 1 9 . 1 1 91 91 LEU H H 91 7.920 7.920 8.033 -0.113 18222
3966 1 9 . 1 1 92 92 PHE N N 92 121.280 121.280 118.261 3.019 18222
3967 1 9 . 1 1 92 92 PHE CA C 92 60.390 60.390 61.826 -1.436 18222
3968 1 9 . 1 1 92 92 PHE CB C 92 37.980 37.980 38.838 -0.858 18222
3969 1 9 . 1 1 92 92 PHE H H 92 7.860 7.860 8.179 -0.319 18222
3970 1 9 . 1 1 93 93 LEU N N 93 119.860 119.860 121.022 -1.162 18222
3971 1 9 . 1 1 93 93 LEU CA C 93 56.860 56.860 57.962 -1.103 18222
3972 1 9 . 1 1 93 93 LEU CB C 93 40.550 40.550 40.521 0.029 18222
3973 1 9 . 1 1 93 93 LEU H H 93 7.980 7.980 8.367 -0.387 18222
3974 1 9 . 1 1 94 94 GLU N N 94 114.660 114.660 119.157 -4.497 18222
3975 1 9 . 1 1 94 94 GLU HA H 94 3.810 3.810 4.105 -0.295 18222
3976 1 9 . 1 1 94 94 GLU CA C 94 57.210 57.210 58.830 -1.620 18222
3977 1 9 . 1 1 94 94 GLU CB C 94 28.470 28.470 28.845 -0.375 18222
3978 1 9 . 1 1 94 94 GLU H H 94 7.890 7.890 8.267 -0.377 18222
3979 1 9 . 1 1 95 95 THR N N 95 108.260 108.260 112.450 -4.190 18222
3980 1 9 . 1 1 95 95 THR CA C 95 62.150 62.150 62.424 -0.274 18222
3981 1 9 . 1 1 95 95 THR CB C 95 70.810 70.810 69.148 1.662 18222
3982 1 9 . 1 1 95 95 THR H H 95 7.690 7.690 7.154 0.536 18222
3983 1 9 . 1 1 96 96 GLY N N 96 112.220 112.220 109.717 2.503 18222
3984 1 9 . 1 1 96 96 GLY CA C 96 45.410 45.410 45.279 0.132 18222
3985 1 9 . 1 1 96 96 GLY H H 96 8.240 8.240 8.081 0.159 18222
3986 1 9 . 1 1 97 97 GLN N N 97 117.950 117.950 121.091 -3.141 18222
3987 1 9 . 1 1 97 97 GLN HA H 97 4.200 4.200 4.489 -0.289 18222
3988 1 9 . 1 1 97 97 GLN CA C 97 54.430 54.430 54.915 -0.485 18222
3989 1 9 . 1 1 97 97 GLN CB C 97 29.910 29.910 28.972 0.938 18222
3990 1 9 . 1 1 97 97 GLN H H 97 7.640 7.640 8.332 -0.692 18222
3991 1 9 . 1 1 98 98 LEU N N 98 123.810 123.810 125.414 -1.604 18222
3992 1 9 . 1 1 98 98 LEU HA H 98 4.360 4.360 4.645 -0.285 18222
3993 1 9 . 1 1 98 98 LEU CA C 98 52.650 52.650 53.105 -0.455 18222
3994 1 9 . 1 1 98 98 LEU CB C 98 40.460 40.460 41.127 -0.667 18222
3995 1 9 . 1 1 98 98 LEU H H 98 8.270 8.270 7.845 0.425 18222
3996 1 9 . 1 1 99 99 PRO CA C 99 63.180 63.180 63.633 -0.453 18222
3997 1 9 . 1 1 99 99 PRO CB C 99 30.840 30.840 32.397 -1.557 18222
3998 1 9 . 1 1 100 100 LYS N N 100 120.630 120.630 118.470 2.160 18222
3999 1 9 . 1 1 100 100 LYS CA C 100 55.730 55.730 55.880 -0.151 18222
4000 1 9 . 1 1 100 100 LYS CB C 100 32.280 32.280 34.322 -2.042 18222
4001 1 9 . 1 1 100 100 LYS H H 100 8.090 8.090 7.751 0.339 18222
4002 1 9 . 1 1 101 101 ASP N N 101 120.920 120.920 122.695 -1.775 18222
4003 1 9 . 1 1 101 101 ASP HA H 101 4.190 4.190 4.901 -0.711 18222
4004 1 9 . 1 1 101 101 ASP CA C 101 54.000 54.000 53.964 0.036 18222
4005 1 9 . 1 1 101 101 ASP CB C 101 40.330 40.330 40.808 -0.478 18222
4006 1 9 . 1 1 101 101 ASP H H 101 8.190 8.190 8.710 -0.520 18222
4007 1 9 . 1 1 102 102 ARG N N 102 122.210 122.210 122.948 -0.738 18222
4008 1 9 . 1 1 102 102 ARG CA C 102 55.590 55.590 56.121 -0.531 18222
4009 1 9 . 1 1 102 102 ARG CB C 102 29.630 29.630 31.450 -1.820 18222
4010 1 9 . 1 1 102 102 ARG H H 102 8.130 8.130 8.211 -0.081 18222
4011 1 9 . 1 1 103 103 SER N N 103 117.230 117.230 115.545 1.685 18222
4012 1 9 . 1 1 103 103 SER HA H 103 4.280 4.280 4.240 0.040 18222
4013 1 9 . 1 1 103 103 SER CA C 103 58.470 58.470 59.155 -0.685 18222
4014 1 9 . 1 1 103 103 SER CB C 103 63.080 63.080 63.492 -0.412 18222
4015 1 9 . 1 1 103 103 SER H H 103 8.290 8.290 8.528 -0.238 18222
4016 1 9 . 1 1 104 104 THR N N 104 115.430 115.430 117.105 -1.675 18222
4017 1 9 . 1 1 104 104 THR CA C 104 61.570 61.570 62.166 -0.597 18222
4018 1 9 . 1 1 104 104 THR CB C 104 69.030 69.030 69.608 -0.578 18222
4019 1 9 . 1 1 104 104 THR H H 104 8.020 8.020 8.182 -0.162 18222
4020 1 9 . 1 1 105 105 ASP N N 105 122.780 122.780 123.681 -0.901 18222
4021 1 9 . 1 1 105 105 ASP CA C 105 54.210 54.210 53.899 0.311 18222
4022 1 9 . 1 1 105 105 ASP CB C 105 40.380 40.380 43.336 -2.956 18222
4023 1 9 . 1 1 105 105 ASP H H 105 8.120 8.120 8.417 -0.297 18222
4024 1 9 . 1 1 106 106 GLN N N 106 120.960 120.960 120.207 0.753 18222
4025 1 9 . 1 1 106 106 GLN CA C 106 55.420 55.420 55.280 0.140 18222
4026 1 9 . 1 1 106 106 GLN CB C 106 28.310 28.310 30.086 -1.776 18222
4027 1 9 . 1 1 106 106 GLN H H 106 8.140 8.140 8.174 -0.034 18222
4028 1 9 . 1 1 107 107 ARG N N 107 123.010 123.010 121.226 1.784 18222
4029 1 9 . 1 1 107 107 ARG HA H 107 4.210 4.210 4.388 -0.178 18222
4030 1 9 . 1 1 107 107 ARG CA C 107 55.560 55.560 56.913 -1.353 18222
4031 1 9 . 1 1 107 107 ARG CB C 107 29.920 29.920 30.446 -0.526 18222
4032 1 9 . 1 1 107 107 ARG H H 107 8.180 8.180 8.607 -0.427 18222
4033 1 10 . 1 1 2 2 VAL N N 2 121.590 121.590 122.189 -0.599 18222
4034 1 10 . 1 1 2 2 VAL CA C 2 61.600 61.600 62.313 -0.714 18222
4035 1 10 . 1 1 2 2 VAL CB C 2 31.900 31.900 33.547 -1.647 18222
4036 1 10 . 1 1 2 2 VAL H H 2 8.010 8.010 8.375 -0.365 18222
4037 1 10 . 1 1 3 3 ASN N N 3 122.520 122.520 123.773 -1.253 18222
4038 1 10 . 1 1 3 3 ASN HA H 3 4.020 4.020 5.119 -1.099 18222
4039 1 10 . 1 1 3 3 ASN CA C 3 52.640 52.640 52.570 0.070 18222
4040 1 10 . 1 1 3 3 ASN CB C 3 38.330 38.330 39.659 -1.329 18222
4041 1 10 . 1 1 3 3 ASN H H 3 8.360 8.360 8.533 -0.173 18222
4042 1 10 . 1 1 4 4 LEU N N 4 123.830 123.830 117.845 5.985 18222
4043 1 10 . 1 1 4 4 LEU HA H 4 4.220 4.220 4.563 -0.343 18222
4044 1 10 . 1 1 4 4 LEU CA C 4 54.620 54.620 54.438 0.182 18222
4045 1 10 . 1 1 4 4 LEU CB C 4 41.680 41.680 43.589 -1.909 18222
4046 1 10 . 1 1 4 4 LEU H H 4 8.220 8.220 8.365 -0.145 18222
4047 1 10 . 1 1 5 5 GLY N N 5 106.810 106.810 110.814 -4.004 18222
4048 1 10 . 1 1 5 5 GLY CA C 5 45.800 45.800 45.015 0.785 18222
4049 1 10 . 1 1 5 5 GLY H H 5 8.030 8.030 8.741 -0.711 18222
4050 1 10 . 1 1 6 6 LEU N N 6 120.820 120.820 123.641 -2.821 18222
4051 1 10 . 1 1 6 6 LEU HA H 6 4.050 4.050 4.404 -0.354 18222
4052 1 10 . 1 1 6 6 LEU CA C 6 55.990 55.990 54.979 1.011 18222
4053 1 10 . 1 1 6 6 LEU CB C 6 40.800 40.800 42.317 -1.517 18222
4054 1 10 . 1 1 6 6 LEU H H 6 8.030 8.030 7.885 0.145 18222
4055 1 10 . 1 1 7 7 SER N N 7 115.540 115.540 116.618 -1.078 18222
4056 1 10 . 1 1 7 7 SER HA H 7 4.100 4.100 4.170 -0.070 18222
4057 1 10 . 1 1 7 7 SER CA C 7 60.580 60.580 61.389 -0.809 18222
4058 1 10 . 1 1 7 7 SER CB C 7 62.060 62.060 63.041 -0.981 18222
4059 1 10 . 1 1 7 7 SER H H 7 8.360 8.360 8.541 -0.181 18222
4060 1 10 . 1 1 8 8 ARG N N 8 120.690 120.690 120.838 -0.148 18222
4061 1 10 . 1 1 8 8 ARG HA H 8 4.160 4.160 4.071 0.089 18222
4062 1 10 . 1 1 8 8 ARG CA C 8 57.350 57.350 59.224 -1.874 18222
4063 1 10 . 1 1 8 8 ARG CB C 8 29.230 29.230 29.942 -0.712 18222
4064 1 10 . 1 1 8 8 ARG H H 8 7.830 7.830 8.067 -0.237 18222
4065 1 10 . 1 1 9 9 VAL N N 9 119.330 119.330 120.009 -0.679 18222
4066 1 10 . 1 1 9 9 VAL HA H 9 4.170 4.170 3.657 0.513 18222
4067 1 10 . 1 1 9 9 VAL CA C 9 64.720 64.720 66.431 -1.711 18222
4068 1 10 . 1 1 9 9 VAL CB C 9 30.900 30.900 31.389 -0.489 18222
4069 1 10 . 1 1 9 9 VAL H H 9 7.620 7.620 7.763 -0.143 18222
4070 1 10 . 1 1 10 10 ASP N N 10 119.520 119.520 120.589 -1.069 18222
4071 1 10 . 1 1 10 10 ASP CA C 10 54.960 54.960 58.244 -3.284 18222
4072 1 10 . 1 1 10 10 ASP CB C 10 37.800 37.800 40.835 -3.035 18222
4073 1 10 . 1 1 10 10 ASP H H 10 8.180 8.180 8.225 -0.045 18222
4074 1 10 . 1 1 11 11 ASP N N 11 121.550 121.550 120.572 0.978 18222
4075 1 10 . 1 1 11 11 ASP CA C 11 54.440 54.440 57.286 -2.846 18222
4076 1 10 . 1 1 11 11 ASP CB C 11 37.840 37.840 40.804 -2.964 18222
4077 1 10 . 1 1 11 11 ASP H H 11 7.950 7.950 8.301 -0.351 18222
4078 1 10 . 1 1 12 12 ALA N N 12 120.220 120.220 122.156 -1.936 18222
4079 1 10 . 1 1 12 12 ALA CA C 12 54.370 54.370 55.155 -0.785 18222
4080 1 10 . 1 1 12 12 ALA CB C 12 24.730 24.730 18.463 6.267 18222
4081 1 10 . 1 1 12 12 ALA H H 12 8.090 8.090 8.032 0.058 18222
4082 1 10 . 1 1 13 13 VAL N N 13 116.910 116.910 117.717 -0.807 18222
4083 1 10 . 1 1 13 13 VAL HA H 13 4.140 4.140 3.613 0.527 18222
4084 1 10 . 1 1 13 13 VAL CA C 13 64.900 64.900 66.275 -1.375 18222
4085 1 10 . 1 1 13 13 VAL CB C 13 31.000 31.000 31.438 -0.438 18222
4086 1 10 . 1 1 13 13 VAL H H 13 7.980 7.980 8.141 -0.161 18222
4087 1 10 . 1 1 14 14 ALA N N 14 122.200 122.200 121.828 0.372 18222
4088 1 10 . 1 1 14 14 ALA HA H 14 4.020 4.020 3.968 0.052 18222
4089 1 10 . 1 1 14 14 ALA CA C 14 53.800 53.800 54.375 -0.575 18222
4090 1 10 . 1 1 14 14 ALA CB C 14 17.790 17.790 18.606 -0.816 18222
4091 1 10 . 1 1 14 14 ALA H H 14 8.030 8.030 7.994 0.036 18222
4092 1 10 . 1 1 15 15 ALA N N 15 118.600 118.600 118.592 0.008 18222
4093 1 10 . 1 1 15 15 ALA CA C 15 53.230 53.230 53.892 -0.662 18222
4094 1 10 . 1 1 15 15 ALA CB C 15 18.010 18.010 18.896 -0.886 18222
4095 1 10 . 1 1 15 15 ALA H H 15 7.530 7.530 7.692 -0.162 18222
4096 1 10 . 1 1 16 16 LYS N N 16 115.820 115.820 117.408 -1.588 18222
4097 1 10 . 1 1 16 16 LYS HA H 16 4.080 4.080 4.212 -0.132 18222
4098 1 10 . 1 1 16 16 LYS CA C 16 55.670 55.670 56.873 -1.204 18222
4099 1 10 . 1 1 16 16 LYS CB C 16 32.640 32.640 32.634 0.006 18222
4100 1 10 . 1 1 16 16 LYS H H 16 7.490 7.490 7.507 -0.017 18222
4101 1 10 . 1 1 17 17 HIS N N 17 116.790 116.790 118.016 -1.226 18222
4102 1 10 . 1 1 17 17 HIS HA H 17 4.100 4.100 4.752 -0.652 18222
4103 1 10 . 1 1 17 17 HIS CA C 17 52.820 52.820 52.797 0.023 18222
4104 1 10 . 1 1 17 17 HIS CB C 17 28.400 28.400 30.761 -2.361 18222
4105 1 10 . 1 1 17 17 HIS H H 17 8.130 8.130 7.153 0.977 18222
4106 1 10 . 1 1 18 18 PRO CA C 18 63.800 63.800 63.224 0.576 18222
4107 1 10 . 1 1 18 18 PRO CB C 18 30.800 30.800 31.941 -1.141 18222
4108 1 10 . 1 1 19 19 GLY N N 19 110.260 110.260 112.140 -1.880 18222
4109 1 10 . 1 1 19 19 GLY CA C 19 45.490 45.490 44.841 0.649 18222
4110 1 10 . 1 1 19 19 GLY H H 19 8.730 8.730 8.460 0.270 18222
4111 1 10 . 1 1 20 20 LEU N N 20 122.650 122.650 122.241 0.409 18222
4112 1 10 . 1 1 20 20 LEU HA H 20 4.090 4.090 4.065 0.025 18222
4113 1 10 . 1 1 20 20 LEU CA C 20 57.060 57.060 57.918 -0.858 18222
4114 1 10 . 1 1 20 20 LEU H H 20 7.980 7.980 8.072 -0.092 18222
4115 1 10 . 1 1 21 21 GLY N N 21 107.000 107.000 106.109 0.891 18222
4116 1 10 . 1 1 21 21 GLY CA C 21 46.710 46.710 47.163 -0.453 18222
4117 1 10 . 1 1 21 21 GLY H H 21 8.570 8.570 8.653 -0.083 18222
4118 1 10 . 1 1 22 22 GLU N N 22 121.610 121.610 122.811 -1.201 18222
4119 1 10 . 1 1 22 22 GLU HA H 22 3.990 3.990 4.034 -0.044 18222
4120 1 10 . 1 1 22 22 GLU CA C 22 58.280 58.280 59.620 -1.340 18222
4121 1 10 . 1 1 22 22 GLU CB C 22 28.010 28.010 29.669 -1.659 18222
4122 1 10 . 1 1 22 22 GLU H H 22 8.100 8.100 8.278 -0.178 18222
4123 1 10 . 1 1 23 23 TYR N N 23 120.870 120.870 120.200 0.670 18222
4124 1 10 . 1 1 23 23 TYR CA C 23 60.380 60.380 61.368 -0.988 18222
4125 1 10 . 1 1 23 23 TYR CB C 23 37.750 37.750 38.054 -0.304 18222
4126 1 10 . 1 1 23 23 TYR H H 23 7.910 7.910 8.367 -0.457 18222
4127 1 10 . 1 1 24 24 ALA N N 24 121.420 121.420 121.533 -0.113 18222
4128 1 10 . 1 1 24 24 ALA HA H 24 4.140 4.140 3.885 0.255 18222
4129 1 10 . 1 1 24 24 ALA CA C 24 54.260 54.260 55.189 -0.929 18222
4130 1 10 . 1 1 24 24 ALA H H 24 8.410 8.410 8.891 -0.481 18222
4131 1 10 . 1 1 25 25 ALA N N 25 120.220 120.220 121.109 -0.889 18222
4132 1 10 . 1 1 25 25 ALA CA C 25 54.370 54.370 55.007 -0.637 18222
4133 1 10 . 1 1 25 25 ALA H H 25 8.090 8.090 8.339 -0.249 18222
4134 1 10 . 1 1 26 26 CYS N N 26 116.760 116.760 117.046 -0.286 18222
4135 1 10 . 1 1 26 26 CYS CA C 26 61.180 61.180 63.743 -2.563 18222
4136 1 10 . 1 1 26 26 CYS CB C 26 26.390 26.390 27.528 -1.138 18222
4137 1 10 . 1 1 26 26 CYS H H 26 7.950 7.950 8.455 -0.505 18222
4138 1 10 . 1 1 27 27 GLN N N 27 118.690 118.690 120.663 -1.973 18222
4139 1 10 . 1 1 27 27 GLN CA C 27 55.970 55.970 59.636 -3.666 18222
4140 1 10 . 1 1 27 27 GLN H H 27 8.060 8.060 8.205 -0.145 18222
4141 1 10 . 1 1 28 28 SER N N 28 115.490 115.490 114.091 1.399 18222
4142 1 10 . 1 1 28 28 SER HA H 28 3.990 3.990 4.166 -0.176 18222
4143 1 10 . 1 1 28 28 SER CA C 28 61.110 61.110 61.296 -0.186 18222
4144 1 10 . 1 1 28 28 SER H H 28 7.980 7.980 8.369 -0.389 18222
4145 1 10 . 1 1 29 29 HIS N N 29 120.880 120.880 121.939 -1.059 18222
4146 1 10 . 1 1 29 29 HIS CA C 29 58.190 58.190 59.445 -1.255 18222
4147 1 10 . 1 1 29 29 HIS CB C 29 27.460 27.460 29.886 -2.426 18222
4148 1 10 . 1 1 29 29 HIS H H 29 8.180 8.180 8.195 -0.015 18222
4149 1 10 . 1 1 30 30 ALA N N 30 122.920 122.920 122.405 0.515 18222
4150 1 10 . 1 1 30 30 ALA CA C 30 54.560 54.560 55.304 -0.744 18222
4151 1 10 . 1 1 30 30 ALA CB C 30 17.490 17.490 18.351 -0.861 18222
4152 1 10 . 1 1 30 30 ALA H H 30 8.040 8.040 8.038 0.002 18222
4153 1 10 . 1 1 31 31 PHE N N 31 119.340 119.340 119.039 0.301 18222
4154 1 10 . 1 1 31 31 PHE CA C 31 60.370 60.370 62.364 -1.994 18222
4155 1 10 . 1 1 31 31 PHE CB C 31 38.520 38.520 39.323 -0.803 18222
4156 1 10 . 1 1 31 31 PHE H H 31 8.230 8.230 8.368 -0.138 18222
4157 1 10 . 1 1 32 32 MET N N 32 118.110 118.110 118.416 -0.306 18222
4158 1 10 . 1 1 32 32 MET HA H 32 4.050 4.050 4.160 -0.110 18222
4159 1 10 . 1 1 32 32 MET CA C 32 58.280 58.280 58.805 -0.525 18222
4160 1 10 . 1 1 32 32 MET CB C 32 31.090 31.090 32.331 -1.241 18222
4161 1 10 . 1 1 32 32 MET H H 32 8.120 8.120 8.375 -0.255 18222
4162 1 10 . 1 1 33 33 LYS N N 33 119.040 119.040 119.961 -0.921 18222
4163 1 10 . 1 1 33 33 LYS HA H 33 3.930 3.930 4.136 -0.206 18222
4164 1 10 . 1 1 33 33 LYS CA C 33 59.040 59.040 59.813 -0.773 18222
4165 1 10 . 1 1 33 33 LYS CB C 33 30.990 30.990 32.200 -1.210 18222
4166 1 10 . 1 1 33 33 LYS H H 33 7.970 7.970 8.243 -0.273 18222
4167 1 10 . 1 1 34 34 GLY N N 34 108.840 108.840 107.631 1.209 18222
4168 1 10 . 1 1 34 34 GLY CA C 34 46.610 46.610 47.349 -0.739 18222
4169 1 10 . 1 1 34 34 GLY H H 34 8.030 8.030 8.282 -0.252 18222
4170 1 10 . 1 1 35 35 VAL N N 35 122.910 122.910 121.907 1.003 18222
4171 1 10 . 1 1 35 35 VAL HA H 35 4.220 4.220 3.805 0.415 18222
4172 1 10 . 1 1 35 35 VAL CA C 35 66.310 66.310 64.670 1.640 18222
4173 1 10 . 1 1 35 35 VAL CB C 35 30.560 30.560 31.018 -0.459 18222
4174 1 10 . 1 1 35 35 VAL H H 35 8.090 8.090 8.141 -0.051 18222
4175 1 10 . 1 1 36 36 PHE N N 36 120.020 120.020 122.105 -2.085 18222
4176 1 10 . 1 1 36 36 PHE CA C 36 61.350 61.350 61.005 0.345 18222
4177 1 10 . 1 1 36 36 PHE CB C 36 38.090 38.090 38.398 -0.308 18222
4178 1 10 . 1 1 36 36 PHE H H 36 8.350 8.350 8.408 -0.058 18222
4179 1 10 . 1 1 37 37 THR N N 37 116.980 116.980 114.896 2.084 18222
4180 1 10 . 1 1 37 37 THR HA H 37 4.050 4.050 3.317 0.734 18222
4181 1 10 . 1 1 37 37 THR CA C 37 66.000 66.000 66.269 -0.269 18222
4182 1 10 . 1 1 37 37 THR CB C 37 68.270 68.270 68.718 -0.448 18222
4183 1 10 . 1 1 37 37 THR H H 37 8.520 8.520 8.166 0.354 18222
4184 1 10 . 1 1 38 38 PHE N N 38 123.090 123.090 118.548 4.542 18222
4185 1 10 . 1 1 38 38 PHE HA H 38 4.360 4.360 4.236 0.124 18222
4186 1 10 . 1 1 38 38 PHE CA C 38 61.140 61.140 61.088 0.052 18222
4187 1 10 . 1 1 38 38 PHE CB C 38 41.200 41.200 39.517 1.683 18222
4188 1 10 . 1 1 38 38 PHE H H 38 8.010 8.010 7.992 0.018 18222
4189 1 10 . 1 1 39 39 VAL N N 39 117.280 117.280 119.551 -2.271 18222
4190 1 10 . 1 1 39 39 VAL HA H 39 4.210 4.210 3.696 0.514 18222
4191 1 10 . 1 1 39 39 VAL CA C 39 66.000 66.000 65.895 0.105 18222
4192 1 10 . 1 1 39 39 VAL CB C 39 30.860 30.860 31.201 -0.341 18222
4193 1 10 . 1 1 39 39 VAL H H 39 8.530 8.530 8.631 -0.101 18222
4194 1 10 . 1 1 40 40 THR N N 40 109.470 109.470 115.913 -6.443 18222
4195 1 10 . 1 1 40 40 THR HA H 40 4.060 4.060 4.039 0.021 18222
4196 1 10 . 1 1 40 40 THR CA C 40 63.390 63.390 65.427 -2.037 18222
4197 1 10 . 1 1 40 40 THR CB C 40 68.650 68.650 67.792 0.858 18222
4198 1 10 . 1 1 40 40 THR H H 40 7.700 7.700 7.844 -0.144 18222
4199 1 10 . 1 1 41 41 GLY N N 41 110.770 110.770 107.999 2.771 18222
4200 1 10 . 1 1 41 41 GLY CA C 41 45.580 45.580 45.589 -0.009 18222
4201 1 10 . 1 1 41 41 GLY H H 41 7.700 7.700 7.925 -0.225 18222
4202 1 10 . 1 1 42 42 THR N N 42 114.520 114.520 116.628 -2.108 18222
4203 1 10 . 1 1 42 42 THR CA C 42 63.300 63.300 60.981 2.318 18222
4204 1 10 . 1 1 42 42 THR CB C 42 69.490 69.490 68.726 0.764 18222
4205 1 10 . 1 1 42 42 THR H H 42 7.720 7.720 7.386 0.334 18222
4206 1 10 . 1 1 43 43 GLY N N 43 109.540 109.540 109.812 -0.272 18222
4207 1 10 . 1 1 43 43 GLY CA C 43 46.250 46.250 46.652 -0.402 18222
4208 1 10 . 1 1 43 43 GLY H H 43 8.110 8.110 7.592 0.518 18222
4209 1 10 . 1 1 44 44 MET N N 44 120.240 120.240 121.072 -0.832 18222
4210 1 10 . 1 1 44 44 MET HA H 44 4.100 4.100 4.091 0.009 18222
4211 1 10 . 1 1 44 44 MET CA C 44 57.700 57.700 58.643 -0.943 18222
4212 1 10 . 1 1 44 44 MET CB C 44 32.030 32.030 32.580 -0.550 18222
4213 1 10 . 1 1 44 44 MET H H 44 7.730 7.730 7.833 -0.103 18222
4214 1 10 . 1 1 45 45 ALA N N 45 121.560 121.560 121.043 0.517 18222
4215 1 10 . 1 1 45 45 ALA CA C 45 54.440 54.440 55.096 -0.656 18222
4216 1 10 . 1 1 45 45 ALA CB C 45 17.400 17.400 17.757 -0.357 18222
4217 1 10 . 1 1 45 45 ALA H H 45 7.950 7.950 7.879 0.071 18222
4218 1 10 . 1 1 46 46 PHE N N 46 118.260 118.260 119.588 -1.328 18222
4219 1 10 . 1 1 46 46 PHE HA H 46 3.930 3.930 4.132 -0.202 18222
4220 1 10 . 1 1 46 46 PHE CA C 46 59.820 59.820 61.228 -1.408 18222
4221 1 10 . 1 1 46 46 PHE CB C 46 38.260 38.260 38.971 -0.711 18222
4222 1 10 . 1 1 46 46 PHE H H 46 7.860 7.860 7.659 0.201 18222
4223 1 10 . 1 1 47 47 GLY N N 47 107.300 107.300 107.752 -0.452 18222
4224 1 10 . 1 1 47 47 GLY CA C 47 46.560 46.560 47.432 -0.872 18222
4225 1 10 . 1 1 47 47 GLY H H 47 8.200 8.200 8.461 -0.261 18222
4226 1 10 . 1 1 48 48 LEU N N 48 121.920 121.920 122.697 -0.777 18222
4227 1 10 . 1 1 48 48 LEU HA H 48 4.040 4.040 4.061 -0.021 18222
4228 1 10 . 1 1 48 48 LEU CA C 48 57.580 57.580 57.901 -0.321 18222
4229 1 10 . 1 1 48 48 LEU CB C 48 40.790 40.790 41.851 -1.061 18222
4230 1 10 . 1 1 48 48 LEU H H 48 8.180 8.180 8.331 -0.151 18222
4231 1 10 . 1 1 49 49 GLN N N 49 118.270 118.270 118.437 -0.167 18222
4232 1 10 . 1 1 49 49 GLN HA H 49 3.830 3.830 3.867 -0.037 18222
4233 1 10 . 1 1 49 49 GLN CA C 49 58.880 58.880 59.113 -0.233 18222
4234 1 10 . 1 1 49 49 GLN CB C 49 27.240 27.240 28.252 -1.012 18222
4235 1 10 . 1 1 49 49 GLN H H 49 8.080 8.080 8.091 -0.011 18222
4236 1 10 . 1 1 50 50 MET N N 50 117.630 117.630 119.603 -1.973 18222
4237 1 10 . 1 1 50 50 MET HA H 50 4.010 4.010 4.008 0.002 18222
4238 1 10 . 1 1 50 50 MET CA C 50 57.730 57.730 59.607 -1.877 18222
4239 1 10 . 1 1 50 50 MET CB C 50 27.160 27.160 32.715 -5.555 18222
4240 1 10 . 1 1 50 50 MET H H 50 7.880 7.880 8.362 -0.482 18222
4241 1 10 . 1 1 51 51 PHE N N 51 119.550 119.550 120.708 -1.158 18222
4242 1 10 . 1 1 51 51 PHE CA C 51 60.850 60.850 61.436 -0.586 18222
4243 1 10 . 1 1 51 51 PHE CB C 51 38.720 38.720 39.077 -0.357 18222
4244 1 10 . 1 1 51 51 PHE H H 51 7.890 7.890 8.136 -0.246 18222
4245 1 10 . 1 1 52 52 ILE N N 52 117.950 117.950 117.551 0.399 18222
4246 1 10 . 1 1 52 52 ILE HA H 52 4.050 4.050 3.549 0.501 18222
4247 1 10 . 1 1 52 52 ILE CA C 52 63.560 63.560 64.782 -1.222 18222
4248 1 10 . 1 1 52 52 ILE CB C 52 36.810 36.810 37.925 -1.115 18222
4249 1 10 . 1 1 52 52 ILE H H 52 8.110 8.110 8.123 -0.013 18222
4250 1 10 . 1 1 53 53 GLN N N 53 117.360 117.360 119.465 -2.105 18222
4251 1 10 . 1 1 53 53 GLN CA C 53 57.200 57.200 58.806 -1.606 18222
4252 1 10 . 1 1 53 53 GLN CB C 53 27.870 27.870 28.287 -0.417 18222
4253 1 10 . 1 1 53 53 GLN H H 53 7.930 7.930 8.363 -0.433 18222
4254 1 10 . 1 1 54 54 ARG N N 54 116.840 116.840 117.300 -0.460 18222
4255 1 10 . 1 1 54 54 ARG HA H 54 3.950 3.950 4.179 -0.229 18222
4256 1 10 . 1 1 54 54 ARG CA C 54 56.480 56.480 57.851 -1.371 18222
4257 1 10 . 1 1 54 54 ARG CB C 54 28.970 28.970 30.031 -1.061 18222
4258 1 10 . 1 1 54 54 ARG H H 54 7.540 7.540 7.850 -0.310 18222
4259 1 10 . 1 1 55 55 LYS N N 55 117.900 117.900 116.691 1.209 18222
4260 1 10 . 1 1 55 55 LYS HA H 55 4.080 4.080 4.257 -0.177 18222
4261 1 10 . 1 1 55 55 LYS CA C 55 55.030 55.030 56.627 -1.597 18222
4262 1 10 . 1 1 55 55 LYS CB C 55 32.010 32.010 33.426 -1.416 18222
4263 1 10 . 1 1 55 55 LYS H H 55 7.660 7.660 7.550 0.110 18222
4264 1 10 . 1 1 56 56 PHE N N 56 121.060 121.060 121.389 -0.329 18222
4265 1 10 . 1 1 56 56 PHE CA C 56 55.190 55.190 55.272 -0.082 18222
4266 1 10 . 1 1 56 56 PHE CB C 56 38.970 38.970 40.108 -1.137 18222
4267 1 10 . 1 1 56 56 PHE H H 56 8.080 8.080 7.816 0.265 18222
4268 1 10 . 1 1 57 57 PRO CA C 57 62.390 62.390 63.270 -0.880 18222
4269 1 10 . 1 1 57 57 PRO CB C 57 30.580 30.580 30.155 0.425 18222
4270 1 10 . 1 1 58 58 TYR N N 58 120.240 120.240 123.943 -3.703 18222
4271 1 10 . 1 1 58 58 TYR CA C 58 55.770 55.770 55.839 -0.069 18222
4272 1 10 . 1 1 58 58 TYR CB C 58 40.220 40.220 39.250 0.970 18222
4273 1 10 . 1 1 58 58 TYR H H 58 7.700 7.700 8.239 -0.539 18222
4274 1 10 . 1 1 59 59 PRO CA C 59 62.130 62.130 63.867 -1.737 18222
4275 1 10 . 1 1 59 59 PRO CB C 59 33.340 33.340 31.945 1.395 18222
4276 1 10 . 1 1 60 60 LEU N N 60 122.210 122.210 121.142 1.068 18222
4277 1 10 . 1 1 60 60 LEU CA C 60 54.250 54.250 54.635 -0.385 18222
4278 1 10 . 1 1 60 60 LEU CB C 60 41.470 41.470 42.481 -1.011 18222
4279 1 10 . 1 1 60 60 LEU H H 60 7.880 7.880 7.717 0.163 18222
4280 1 10 . 1 1 61 61 GLN N N 61 122.470 122.470 120.467 2.003 18222
4281 1 10 . 1 1 61 61 GLN CA C 61 54.170 54.170 55.347 -1.177 18222
4282 1 10 . 1 1 61 61 GLN H H 61 7.970 7.970 8.199 -0.229 18222
4283 1 10 . 1 1 62 62 TRP N N 62 124.590 124.590 124.810 -0.220 18222
4284 1 10 . 1 1 62 62 TRP CA C 62 59.830 59.830 60.234 -0.404 18222
4285 1 10 . 1 1 62 62 TRP CB C 62 28.800 28.800 28.568 0.232 18222
4286 1 10 . 1 1 62 62 TRP H H 62 8.240 8.240 8.921 -0.681 18222
4287 1 10 . 1 1 63 63 SER N N 63 113.320 113.320 115.253 -1.933 18222
4288 1 10 . 1 1 63 63 SER CA C 63 61.100 61.100 61.751 -0.651 18222
4289 1 10 . 1 1 63 63 SER H H 63 8.410 8.410 7.470 0.940 18222
4290 1 10 . 1 1 64 64 LEU N N 64 123.230 123.230 122.805 0.425 18222
4291 1 10 . 1 1 64 64 LEU CA C 64 56.880 56.880 57.754 -0.874 18222
4292 1 10 . 1 1 64 64 LEU CB C 64 40.830 40.830 41.340 -0.510 18222
4293 1 10 . 1 1 64 64 LEU H H 64 7.230 7.230 7.955 -0.725 18222
4294 1 10 . 1 1 65 65 LEU N N 65 119.400 119.400 120.148 -0.748 18222
4295 1 10 . 1 1 65 65 LEU HA H 65 3.890 3.890 4.100 -0.210 18222
4296 1 10 . 1 1 65 65 LEU CA C 65 57.580 57.580 58.392 -0.812 18222
4297 1 10 . 1 1 65 65 LEU CB C 65 40.710 40.710 41.639 -0.929 18222
4298 1 10 . 1 1 65 65 LEU H H 65 7.510 7.510 8.293 -0.783 18222
4299 1 10 . 1 1 66 66 VAL N N 66 116.950 116.950 119.543 -2.593 18222
4300 1 10 . 1 1 66 66 VAL HA H 66 3.960 3.960 3.868 0.092 18222
4301 1 10 . 1 1 66 66 VAL CA C 66 66.260 66.260 65.005 1.255 18222
4302 1 10 . 1 1 66 66 VAL CB C 66 30.570 30.570 30.833 -0.263 18222
4303 1 10 . 1 1 66 66 VAL H H 66 7.950 7.950 8.324 -0.374 18222
4304 1 10 . 1 1 67 67 ALA N N 67 120.650 120.650 122.786 -2.136 18222
4305 1 10 . 1 1 67 67 ALA HA H 67 4.000 4.000 4.170 -0.170 18222
4306 1 10 . 1 1 67 67 ALA CA C 67 54.780 54.780 55.257 -0.477 18222
4307 1 10 . 1 1 67 67 ALA CB C 67 17.440 17.440 18.285 -0.845 18222
4308 1 10 . 1 1 67 67 ALA H H 67 7.450 7.450 8.197 -0.747 18222
4309 1 10 . 1 1 68 68 VAL N N 68 118.440 118.440 118.283 0.157 18222
4310 1 10 . 1 1 68 68 VAL HA H 68 3.750 3.750 3.679 0.071 18222
4311 1 10 . 1 1 68 68 VAL CA C 68 65.250 65.250 67.020 -1.770 18222
4312 1 10 . 1 1 68 68 VAL CB C 68 30.850 30.850 32.019 -1.169 18222
4313 1 10 . 1 1 68 68 VAL H H 68 7.960 7.960 8.062 -0.102 18222
4314 1 10 . 1 1 69 69 VAL N N 69 120.800 120.800 120.516 0.284 18222
4315 1 10 . 1 1 69 69 VAL HA H 69 4.220 4.220 3.586 0.634 18222
4316 1 10 . 1 1 69 69 VAL CA C 69 66.020 66.020 66.342 -0.322 18222
4317 1 10 . 1 1 69 69 VAL CB C 69 30.850 30.850 31.747 -0.897 18222
4318 1 10 . 1 1 69 69 VAL H H 69 8.080 8.080 8.395 -0.315 18222
4319 1 10 . 1 1 70 70 ALA N N 70 121.740 121.740 120.641 1.099 18222
4320 1 10 . 1 1 70 70 ALA HA H 70 3.920 3.920 4.154 -0.234 18222
4321 1 10 . 1 1 70 70 ALA CA C 70 54.920 54.920 55.542 -0.623 18222
4322 1 10 . 1 1 70 70 ALA CB C 70 17.620 17.620 18.015 -0.395 18222
4323 1 10 . 1 1 70 70 ALA H H 70 8.660 8.660 8.640 0.020 18222
4324 1 10 . 1 1 71 71 GLY N N 71 103.450 103.450 106.497 -3.047 18222
4325 1 10 . 1 1 71 71 GLY CA C 71 46.300 46.300 46.868 -0.568 18222
4326 1 10 . 1 1 71 71 GLY H H 71 8.010 8.010 8.188 -0.178 18222
4327 1 10 . 1 1 72 72 SER N N 72 118.160 118.160 117.790 0.370 18222
4328 1 10 . 1 1 72 72 SER CA C 72 61.260 61.260 61.530 -0.270 18222
4329 1 10 . 1 1 72 72 SER CB C 72 62.870 62.870 63.041 -0.171 18222
4330 1 10 . 1 1 72 72 SER H H 72 7.870 7.870 7.872 -0.002 18222
4331 1 10 . 1 1 73 73 VAL N N 73 121.340 121.340 121.944 -0.604 18222
4332 1 10 . 1 1 73 73 VAL CA C 73 65.750 65.750 65.928 -0.178 18222
4333 1 10 . 1 1 73 73 VAL CB C 73 30.740 30.740 31.114 -0.374 18222
4334 1 10 . 1 1 73 73 VAL H H 73 8.050 8.050 8.232 -0.182 18222
4335 1 10 . 1 1 74 74 VAL N N 74 118.680 118.680 119.259 -0.579 18222
4336 1 10 . 1 1 74 74 VAL CA C 74 65.770 65.770 66.995 -1.225 18222
4337 1 10 . 1 1 74 74 VAL CB C 74 30.740 30.740 31.116 -0.376 18222
4338 1 10 . 1 1 74 74 VAL H H 74 7.880 7.880 8.507 -0.627 18222
4339 1 10 . 1 1 75 75 SER N N 75 114.750 114.750 116.466 -1.716 18222
4340 1 10 . 1 1 75 75 SER HA H 75 4.100 4.100 4.057 0.043 18222
4341 1 10 . 1 1 75 75 SER CA C 75 60.870 60.870 62.074 -1.204 18222
4342 1 10 . 1 1 75 75 SER CB C 75 62.340 62.340 62.949 -0.609 18222
4343 1 10 . 1 1 75 75 SER H H 75 7.870 7.870 7.943 -0.073 18222
4344 1 10 . 1 1 76 76 TYR N N 76 121.110 121.110 121.748 -0.638 18222
4345 1 10 . 1 1 76 76 TYR CA C 76 60.050 60.050 61.670 -1.620 18222
4346 1 10 . 1 1 76 76 TYR CB C 76 37.980 37.980 37.959 0.021 18222
4347 1 10 . 1 1 76 76 TYR H H 76 7.860 7.860 8.423 -0.563 18222
4348 1 10 . 1 1 77 77 GLY N N 77 107.300 107.300 107.402 -0.102 18222
4349 1 10 . 1 1 77 77 GLY CA C 77 46.560 46.560 47.215 -0.655 18222
4350 1 10 . 1 1 77 77 GLY H H 77 8.200 8.200 8.609 -0.409 18222
4351 1 10 . 1 1 78 78 VAL N N 78 119.470 119.470 121.377 -1.907 18222
4352 1 10 . 1 1 78 78 VAL HA H 78 4.170 4.170 3.894 0.276 18222
4353 1 10 . 1 1 78 78 VAL CA C 78 64.650 64.650 65.668 -1.018 18222
4354 1 10 . 1 1 78 78 VAL H H 78 8.140 8.140 8.737 -0.597 18222
4355 1 10 . 1 1 79 79 THR N N 79 112.100 112.100 116.756 -4.656 18222
4356 1 10 . 1 1 79 79 THR CA C 79 63.460 63.460 67.118 -3.658 18222
4357 1 10 . 1 1 79 79 THR CB C 79 68.650 68.650 68.573 0.077 18222
4358 1 10 . 1 1 79 79 THR H H 79 7.640 7.640 8.113 -0.473 18222
4359 1 10 . 1 1 80 80 ARG N N 80 120.770 120.770 122.187 -1.417 18222
4360 1 10 . 1 1 80 80 ARG HA H 80 4.160 4.160 4.234 -0.074 18222
4361 1 10 . 1 1 80 80 ARG CA C 80 56.790 56.790 59.304 -2.514 18222
4362 1 10 . 1 1 80 80 ARG CB C 80 29.430 29.430 30.064 -0.634 18222
4363 1 10 . 1 1 80 80 ARG H H 80 7.680 7.680 8.342 -0.662 18222
4364 1 10 . 1 1 81 81 VAL N N 81 118.370 118.370 120.017 -1.647 18222
4365 1 10 . 1 1 81 81 VAL HA H 81 3.920 3.920 3.801 0.119 18222
4366 1 10 . 1 1 81 81 VAL CA C 81 63.340 63.340 66.333 -2.993 18222
4367 1 10 . 1 1 81 81 VAL CB C 81 31.260 31.260 31.780 -0.520 18222
4368 1 10 . 1 1 81 81 VAL H H 81 7.730 7.730 8.270 -0.540 18222
4369 1 10 . 1 1 82 82 GLU N N 82 120.620 120.620 119.463 1.157 18222
4370 1 10 . 1 1 82 82 GLU CA C 82 56.320 56.320 59.228 -2.908 18222
4371 1 10 . 1 1 82 82 GLU CB C 82 27.930 27.930 29.420 -1.490 18222
4372 1 10 . 1 1 82 82 GLU H H 82 7.920 7.920 8.514 -0.594 18222
4373 1 10 . 1 1 83 83 SER N N 83 116.240 116.240 115.944 0.296 18222
4374 1 10 . 1 1 83 83 SER CA C 83 59.250 59.250 61.550 -2.300 18222
4375 1 10 . 1 1 83 83 SER CB C 83 63.160 63.160 62.985 0.175 18222
4376 1 10 . 1 1 83 83 SER H H 83 7.960 7.960 8.033 -0.073 18222
4377 1 10 . 1 1 84 84 GLU N N 84 123.280 123.280 122.703 0.577 18222
4378 1 10 . 1 1 84 84 GLU HA H 84 4.080 4.080 3.910 0.170 18222
4379 1 10 . 1 1 84 84 GLU CA C 84 57.860 57.860 59.407 -1.547 18222
4380 1 10 . 1 1 84 84 GLU CB C 84 28.190 28.190 29.615 -1.425 18222
4381 1 10 . 1 1 84 84 GLU H H 84 8.470 8.470 8.195 0.275 18222
4382 1 10 . 1 1 85 85 LYS N N 85 118.650 118.650 119.691 -1.041 18222
4383 1 10 . 1 1 85 85 LYS HA H 85 4.100 4.100 4.060 0.040 18222
4384 1 10 . 1 1 85 85 LYS CA C 85 57.780 57.780 59.444 -1.664 18222
4385 1 10 . 1 1 85 85 LYS CB C 85 31.380 31.380 32.564 -1.184 18222
4386 1 10 . 1 1 85 85 LYS H H 85 7.940 7.940 8.071 -0.131 18222
4387 1 10 . 1 1 86 86 CYS N N 86 117.070 117.070 118.062 -0.992 18222
4388 1 10 . 1 1 86 86 CYS CA C 86 60.910 60.910 62.502 -1.592 18222
4389 1 10 . 1 1 86 86 CYS CB C 86 26.740 26.740 26.886 -0.146 18222
4390 1 10 . 1 1 86 86 CYS H H 86 7.840 7.840 8.426 -0.586 18222
4391 1 10 . 1 1 87 87 ASN N N 87 119.370 119.370 119.488 -0.118 18222
4392 1 10 . 1 1 87 87 ASN HA H 87 4.130 4.130 4.457 -0.327 18222
4393 1 10 . 1 1 87 87 ASN CA C 87 55.750 55.750 56.536 -0.786 18222
4394 1 10 . 1 1 87 87 ASN CB C 87 38.050 38.050 37.739 0.311 18222
4395 1 10 . 1 1 87 87 ASN H H 87 8.110 8.110 8.342 -0.232 18222
4396 1 10 . 1 1 88 88 ASN N N 88 117.570 117.570 119.506 -1.936 18222
4397 1 10 . 1 1 88 88 ASN HA H 88 4.280 4.280 4.609 -0.329 18222
4398 1 10 . 1 1 88 88 ASN CA C 88 55.190 55.190 55.980 -0.790 18222
4399 1 10 . 1 1 88 88 ASN CB C 88 37.400 37.400 38.410 -1.010 18222
4400 1 10 . 1 1 88 88 ASN H H 88 8.280 8.280 8.118 0.162 18222
4401 1 10 . 1 1 89 89 LEU N N 89 121.940 121.940 121.571 0.369 18222
4402 1 10 . 1 1 89 89 LEU HA H 89 4.070 4.070 3.882 0.188 18222
4403 1 10 . 1 1 89 89 LEU CA C 89 57.580 57.580 59.214 -1.634 18222
4404 1 10 . 1 1 89 89 LEU CB C 89 40.490 40.490 41.876 -1.386 18222
4405 1 10 . 1 1 89 89 LEU H H 89 7.790 7.790 8.138 -0.348 18222
4406 1 10 . 1 1 90 90 TRP N N 90 119.220 119.220 120.384 -1.164 18222
4407 1 10 . 1 1 90 90 TRP CA C 90 59.120 59.120 61.089 -1.969 18222
4408 1 10 . 1 1 90 90 TRP CB C 90 28.800 28.800 29.570 -0.770 18222
4409 1 10 . 1 1 90 90 TRP H H 90 7.850 7.850 8.476 -0.626 18222
4410 1 10 . 1 1 91 91 LEU N N 91 117.870 117.870 120.187 -2.317 18222
4411 1 10 . 1 1 91 91 LEU CA C 91 57.300 57.300 58.443 -1.143 18222
4412 1 10 . 1 1 91 91 LEU CB C 91 40.610 40.610 41.908 -1.298 18222
4413 1 10 . 1 1 91 91 LEU H H 91 7.920 7.920 8.386 -0.466 18222
4414 1 10 . 1 1 92 92 PHE N N 92 121.280 121.280 116.477 4.803 18222
4415 1 10 . 1 1 92 92 PHE CA C 92 60.390 60.390 61.282 -0.892 18222
4416 1 10 . 1 1 92 92 PHE CB C 92 37.980 37.980 39.090 -1.111 18222
4417 1 10 . 1 1 92 92 PHE H H 92 7.860 7.860 8.033 -0.173 18222
4418 1 10 . 1 1 93 93 LEU N N 93 119.860 119.860 122.315 -2.455 18222
4419 1 10 . 1 1 93 93 LEU CA C 93 56.860 56.860 58.199 -1.339 18222
4420 1 10 . 1 1 93 93 LEU CB C 93 40.550 40.550 41.834 -1.284 18222
4421 1 10 . 1 1 93 93 LEU H H 93 7.980 7.980 8.547 -0.567 18222
4422 1 10 . 1 1 94 94 GLU N N 94 114.660 114.660 117.491 -2.831 18222
4423 1 10 . 1 1 94 94 GLU HA H 94 3.810 3.810 4.109 -0.299 18222
4424 1 10 . 1 1 94 94 GLU CA C 94 57.210 57.210 58.759 -1.549 18222
4425 1 10 . 1 1 94 94 GLU CB C 94 28.470 28.470 29.055 -0.585 18222
4426 1 10 . 1 1 94 94 GLU H H 94 7.890 7.890 8.480 -0.590 18222
4427 1 10 . 1 1 95 95 THR N N 95 108.260 108.260 112.895 -4.635 18222
4428 1 10 . 1 1 95 95 THR CA C 95 62.150 62.150 62.365 -0.215 18222
4429 1 10 . 1 1 95 95 THR CB C 95 70.810 70.810 69.219 1.591 18222
4430 1 10 . 1 1 95 95 THR H H 95 7.690 7.690 7.781 -0.091 18222
4431 1 10 . 1 1 96 96 GLY N N 96 112.220 112.220 109.664 2.556 18222
4432 1 10 . 1 1 96 96 GLY CA C 96 45.410 45.410 44.782 0.628 18222
4433 1 10 . 1 1 96 96 GLY H H 96 8.240 8.240 7.943 0.297 18222
4434 1 10 . 1 1 97 97 GLN N N 97 117.950 117.950 119.277 -1.327 18222
4435 1 10 . 1 1 97 97 GLN HA H 97 4.200 4.200 4.516 -0.316 18222
4436 1 10 . 1 1 97 97 GLN CA C 97 54.430 54.430 55.724 -1.294 18222
4437 1 10 . 1 1 97 97 GLN CB C 97 29.910 29.910 30.499 -0.589 18222
4438 1 10 . 1 1 97 97 GLN H H 97 7.640 7.640 7.902 -0.262 18222
4439 1 10 . 1 1 98 98 LEU N N 98 123.810 123.810 119.244 4.566 18222
4440 1 10 . 1 1 98 98 LEU HA H 98 4.360 4.360 4.396 -0.036 18222
4441 1 10 . 1 1 98 98 LEU CA C 98 52.650 52.650 54.557 -1.907 18222
4442 1 10 . 1 1 98 98 LEU CB C 98 40.460 40.460 40.275 0.185 18222
4443 1 10 . 1 1 98 98 LEU H H 98 8.270 8.270 8.500 -0.230 18222
4444 1 10 . 1 1 99 99 PRO CA C 99 63.180 63.180 62.533 0.647 18222
4445 1 10 . 1 1 99 99 PRO CB C 99 30.840 30.840 32.303 -1.463 18222
4446 1 10 . 1 1 100 100 LYS N N 100 120.630 120.630 117.809 2.821 18222
4447 1 10 . 1 1 100 100 LYS CA C 100 55.730 55.730 55.731 -0.001 18222
4448 1 10 . 1 1 100 100 LYS CB C 100 32.280 32.280 33.890 -1.610 18222
4449 1 10 . 1 1 100 100 LYS H H 100 8.090 8.090 8.396 -0.306 18222
4450 1 10 . 1 1 101 101 ASP N N 101 120.920 120.920 121.905 -0.985 18222
4451 1 10 . 1 1 101 101 ASP HA H 101 4.190 4.190 4.820 -0.630 18222
4452 1 10 . 1 1 101 101 ASP CA C 101 54.000 54.000 53.485 0.515 18222
4453 1 10 . 1 1 101 101 ASP CB C 101 40.330 40.330 41.882 -1.552 18222
4454 1 10 . 1 1 101 101 ASP H H 101 8.190 8.190 8.405 -0.215 18222
4455 1 10 . 1 1 102 102 ARG N N 102 122.210 122.210 119.261 2.949 18222
4456 1 10 . 1 1 102 102 ARG CA C 102 55.590 55.590 56.669 -1.079 18222
4457 1 10 . 1 1 102 102 ARG CB C 102 29.630 29.630 30.375 -0.746 18222
4458 1 10 . 1 1 102 102 ARG H H 102 8.130 8.130 8.593 -0.463 18222
4459 1 10 . 1 1 103 103 SER N N 103 117.230 117.230 115.844 1.386 18222
4460 1 10 . 1 1 103 103 SER HA H 103 4.280 4.280 4.400 -0.120 18222
4461 1 10 . 1 1 103 103 SER CA C 103 58.470 58.470 58.844 -0.374 18222
4462 1 10 . 1 1 103 103 SER CB C 103 63.080 63.080 63.819 -0.738 18222
4463 1 10 . 1 1 103 103 SER H H 103 8.290 8.290 8.490 -0.200 18222
4464 1 10 . 1 1 104 104 THR N N 104 115.430 115.430 119.724 -4.294 18222
4465 1 10 . 1 1 104 104 THR CA C 104 61.570 61.570 63.431 -1.861 18222
4466 1 10 . 1 1 104 104 THR CB C 104 69.030 69.030 68.599 0.431 18222
4467 1 10 . 1 1 104 104 THR H H 104 8.020 8.020 8.253 -0.233 18222
4468 1 10 . 1 1 105 105 ASP N N 105 122.780 122.780 123.436 -0.656 18222
4469 1 10 . 1 1 105 105 ASP CA C 105 54.210 54.210 53.376 0.834 18222
4470 1 10 . 1 1 105 105 ASP CB C 105 40.380 40.380 41.464 -1.084 18222
4471 1 10 . 1 1 105 105 ASP H H 105 8.120 8.120 8.251 -0.131 18222
4472 1 10 . 1 1 106 106 GLN N N 106 120.960 120.960 122.012 -1.052 18222
4473 1 10 . 1 1 106 106 GLN CA C 106 55.420 55.420 56.577 -1.157 18222
4474 1 10 . 1 1 106 106 GLN CB C 106 28.310 28.310 29.573 -1.263 18222
4475 1 10 . 1 1 106 106 GLN H H 106 8.140 8.140 8.610 -0.470 18222
4476 1 10 . 1 1 107 107 ARG N N 107 123.010 123.010 122.576 0.434 18222
4477 1 10 . 1 1 107 107 ARG HA H 107 4.210 4.210 4.494 -0.284 18222
4478 1 10 . 1 1 107 107 ARG CA C 107 55.560 55.560 55.703 -0.143 18222
4479 1 10 . 1 1 107 107 ARG CB C 107 29.920 29.920 31.586 -1.666 18222
4480 1 10 . 1 1 107 107 ARG H H 107 8.180 8.180 8.504 -0.324 18222
4481 1 11 . 1 1 2 2 VAL N N 2 121.590 121.590 125.041 -3.451 18222
4482 1 11 . 1 1 2 2 VAL CA C 2 61.600 61.600 62.512 -0.912 18222
4483 1 11 . 1 1 2 2 VAL CB C 2 31.900 31.900 33.935 -2.035 18222
4484 1 11 . 1 1 2 2 VAL H H 2 8.010 8.010 8.854 -0.844 18222
4485 1 11 . 1 1 3 3 ASN N N 3 122.520 122.520 125.479 -2.959 18222
4486 1 11 . 1 1 3 3 ASN HA H 3 4.020 4.020 4.525 -0.505 18222
4487 1 11 . 1 1 3 3 ASN CA C 3 52.640 52.640 53.596 -0.956 18222
4488 1 11 . 1 1 3 3 ASN CB C 3 38.330 38.330 38.734 -0.404 18222
4489 1 11 . 1 1 3 3 ASN H H 3 8.360 8.360 8.633 -0.273 18222
4490 1 11 . 1 1 4 4 LEU N N 4 123.830 123.830 120.562 3.268 18222
4491 1 11 . 1 1 4 4 LEU HA H 4 4.220 4.220 4.422 -0.202 18222
4492 1 11 . 1 1 4 4 LEU CA C 4 54.620 54.620 56.382 -1.762 18222
4493 1 11 . 1 1 4 4 LEU CB C 4 41.680 41.680 42.023 -0.343 18222
4494 1 11 . 1 1 4 4 LEU H H 4 8.220 8.220 8.074 0.146 18222
4495 1 11 . 1 1 5 5 GLY N N 5 106.810 106.810 109.140 -2.330 18222
4496 1 11 . 1 1 5 5 GLY CA C 5 45.800 45.800 47.294 -1.494 18222
4497 1 11 . 1 1 5 5 GLY H H 5 8.030 8.030 8.366 -0.336 18222
4498 1 11 . 1 1 6 6 LEU N N 6 120.820 120.820 121.147 -0.327 18222
4499 1 11 . 1 1 6 6 LEU HA H 6 4.050 4.050 4.083 -0.033 18222
4500 1 11 . 1 1 6 6 LEU CA C 6 55.990 55.990 57.810 -1.821 18222
4501 1 11 . 1 1 6 6 LEU CB C 6 40.800 40.800 41.954 -1.154 18222
4502 1 11 . 1 1 6 6 LEU H H 6 8.030 8.030 8.204 -0.174 18222
4503 1 11 . 1 1 7 7 SER N N 7 115.540 115.540 113.538 2.002 18222
4504 1 11 . 1 1 7 7 SER HA H 7 4.100 4.100 4.054 0.046 18222
4505 1 11 . 1 1 7 7 SER CA C 7 60.580 60.580 61.664 -1.085 18222
4506 1 11 . 1 1 7 7 SER CB C 7 62.060 62.060 62.804 -0.744 18222
4507 1 11 . 1 1 7 7 SER H H 7 8.360 8.360 8.328 0.032 18222
4508 1 11 . 1 1 8 8 ARG N N 8 120.690 120.690 121.577 -0.887 18222
4509 1 11 . 1 1 8 8 ARG HA H 8 4.160 4.160 4.040 0.120 18222
4510 1 11 . 1 1 8 8 ARG CA C 8 57.350 57.350 59.360 -2.010 18222
4511 1 11 . 1 1 8 8 ARG CB C 8 29.230 29.230 30.183 -0.953 18222
4512 1 11 . 1 1 8 8 ARG H H 8 7.830 7.830 8.151 -0.321 18222
4513 1 11 . 1 1 9 9 VAL N N 9 119.330 119.330 120.343 -1.013 18222
4514 1 11 . 1 1 9 9 VAL HA H 9 4.170 4.170 3.668 0.502 18222
4515 1 11 . 1 1 9 9 VAL CA C 9 64.720 64.720 66.496 -1.776 18222
4516 1 11 . 1 1 9 9 VAL CB C 9 30.900 30.900 31.541 -0.641 18222
4517 1 11 . 1 1 9 9 VAL H H 9 7.620 7.620 8.451 -0.831 18222
4518 1 11 . 1 1 10 10 ASP N N 10 119.520 119.520 120.596 -1.076 18222
4519 1 11 . 1 1 10 10 ASP CA C 10 54.960 54.960 57.655 -2.695 18222
4520 1 11 . 1 1 10 10 ASP CB C 10 37.800 37.800 40.357 -2.557 18222
4521 1 11 . 1 1 10 10 ASP H H 10 8.180 8.180 8.210 -0.030 18222
4522 1 11 . 1 1 11 11 ASP N N 11 121.550 121.550 120.240 1.310 18222
4523 1 11 . 1 1 11 11 ASP CA C 11 54.440 54.440 57.098 -2.658 18222
4524 1 11 . 1 1 11 11 ASP CB C 11 37.840 37.840 40.866 -3.026 18222
4525 1 11 . 1 1 11 11 ASP H H 11 7.950 7.950 8.205 -0.255 18222
4526 1 11 . 1 1 12 12 ALA N N 12 120.220 120.220 123.066 -2.846 18222
4527 1 11 . 1 1 12 12 ALA CA C 12 54.370 54.370 55.206 -0.836 18222
4528 1 11 . 1 1 12 12 ALA CB C 12 24.730 24.730 18.511 6.220 18222
4529 1 11 . 1 1 12 12 ALA H H 12 8.090 8.090 7.905 0.185 18222
4530 1 11 . 1 1 13 13 VAL N N 13 116.910 116.910 118.024 -1.114 18222
4531 1 11 . 1 1 13 13 VAL HA H 13 4.140 4.140 3.739 0.401 18222
4532 1 11 . 1 1 13 13 VAL CA C 13 64.900 64.900 65.209 -0.309 18222
4533 1 11 . 1 1 13 13 VAL CB C 13 31.000 31.000 31.824 -0.824 18222
4534 1 11 . 1 1 13 13 VAL H H 13 7.980 7.980 8.314 -0.334 18222
4535 1 11 . 1 1 14 14 ALA N N 14 122.200 122.200 122.558 -0.358 18222
4536 1 11 . 1 1 14 14 ALA HA H 14 4.020 4.020 3.967 0.053 18222
4537 1 11 . 1 1 14 14 ALA CA C 14 53.800 53.800 55.134 -1.334 18222
4538 1 11 . 1 1 14 14 ALA CB C 14 17.790 17.790 18.308 -0.518 18222
4539 1 11 . 1 1 14 14 ALA H H 14 8.030 8.030 7.948 0.082 18222
4540 1 11 . 1 1 15 15 ALA N N 15 118.600 118.600 117.225 1.375 18222
4541 1 11 . 1 1 15 15 ALA CA C 15 53.230 53.230 54.085 -0.855 18222
4542 1 11 . 1 1 15 15 ALA CB C 15 18.010 18.010 18.575 -0.565 18222
4543 1 11 . 1 1 15 15 ALA H H 15 7.530 7.530 7.941 -0.411 18222
4544 1 11 . 1 1 16 16 LYS N N 16 115.820 115.820 118.097 -2.277 18222
4545 1 11 . 1 1 16 16 LYS HA H 16 4.080 4.080 4.263 -0.183 18222
4546 1 11 . 1 1 16 16 LYS CA C 16 55.670 55.670 57.677 -2.007 18222
4547 1 11 . 1 1 16 16 LYS CB C 16 32.640 32.640 33.020 -0.380 18222
4548 1 11 . 1 1 16 16 LYS H H 16 7.490 7.490 7.764 -0.274 18222
4549 1 11 . 1 1 17 17 HIS N N 17 116.790 116.790 118.871 -2.081 18222
4550 1 11 . 1 1 17 17 HIS HA H 17 4.100 4.100 4.815 -0.715 18222
4551 1 11 . 1 1 17 17 HIS CA C 17 52.820 52.820 54.390 -1.570 18222
4552 1 11 . 1 1 17 17 HIS CB C 17 28.400 28.400 30.329 -1.929 18222
4553 1 11 . 1 1 17 17 HIS H H 17 8.130 8.130 7.969 0.161 18222
4554 1 11 . 1 1 18 18 PRO CA C 18 63.800 63.800 63.570 0.230 18222
4555 1 11 . 1 1 18 18 PRO CB C 18 30.800 30.800 31.818 -1.018 18222
4556 1 11 . 1 1 19 19 GLY N N 19 110.260 110.260 112.251 -1.991 18222
4557 1 11 . 1 1 19 19 GLY CA C 19 45.490 45.490 45.247 0.243 18222
4558 1 11 . 1 1 19 19 GLY H H 19 8.730 8.730 8.348 0.382 18222
4559 1 11 . 1 1 20 20 LEU N N 20 122.650 122.650 125.580 -2.930 18222
4560 1 11 . 1 1 20 20 LEU HA H 20 4.090 4.090 4.210 -0.120 18222
4561 1 11 . 1 1 20 20 LEU CA C 20 57.060 57.060 57.150 -0.090 18222
4562 1 11 . 1 1 20 20 LEU H H 20 7.980 7.980 8.171 -0.191 18222
4563 1 11 . 1 1 21 21 GLY N N 21 107.000 107.000 106.166 0.834 18222
4564 1 11 . 1 1 21 21 GLY CA C 21 46.710 46.710 47.408 -0.698 18222
4565 1 11 . 1 1 21 21 GLY H H 21 8.570 8.570 8.104 0.466 18222
4566 1 11 . 1 1 22 22 GLU N N 22 121.610 121.610 121.951 -0.341 18222
4567 1 11 . 1 1 22 22 GLU HA H 22 3.990 3.990 4.218 -0.228 18222
4568 1 11 . 1 1 22 22 GLU CA C 22 58.280 58.280 59.726 -1.446 18222
4569 1 11 . 1 1 22 22 GLU CB C 22 28.010 28.010 29.587 -1.577 18222
4570 1 11 . 1 1 22 22 GLU H H 22 8.100 8.100 7.800 0.300 18222
4571 1 11 . 1 1 23 23 TYR N N 23 120.870 120.870 120.916 -0.046 18222
4572 1 11 . 1 1 23 23 TYR CA C 23 60.380 60.380 60.619 -0.239 18222
4573 1 11 . 1 1 23 23 TYR CB C 23 37.750 37.750 38.309 -0.559 18222
4574 1 11 . 1 1 23 23 TYR H H 23 7.910 7.910 7.670 0.240 18222
4575 1 11 . 1 1 24 24 ALA N N 24 121.420 121.420 120.742 0.678 18222
4576 1 11 . 1 1 24 24 ALA HA H 24 4.140 4.140 4.017 0.123 18222
4577 1 11 . 1 1 24 24 ALA CA C 24 54.260 54.260 54.845 -0.585 18222
4578 1 11 . 1 1 24 24 ALA H H 24 8.410 8.410 8.931 -0.521 18222
4579 1 11 . 1 1 25 25 ALA N N 25 120.220 120.220 122.242 -2.022 18222
4580 1 11 . 1 1 25 25 ALA CA C 25 54.370 54.370 55.261 -0.891 18222
4581 1 11 . 1 1 25 25 ALA H H 25 8.090 8.090 8.127 -0.037 18222
4582 1 11 . 1 1 26 26 CYS N N 26 116.760 116.760 118.173 -1.413 18222
4583 1 11 . 1 1 26 26 CYS CA C 26 61.180 61.180 62.837 -1.657 18222
4584 1 11 . 1 1 26 26 CYS CB C 26 26.390 26.390 26.746 -0.356 18222
4585 1 11 . 1 1 26 26 CYS H H 26 7.950 7.950 8.282 -0.332 18222
4586 1 11 . 1 1 27 27 GLN N N 27 118.690 118.690 120.492 -1.802 18222
4587 1 11 . 1 1 27 27 GLN CA C 27 55.970 55.970 59.639 -3.668 18222
4588 1 11 . 1 1 27 27 GLN H H 27 8.060 8.060 8.359 -0.299 18222
4589 1 11 . 1 1 28 28 SER N N 28 115.490 115.490 114.619 0.871 18222
4590 1 11 . 1 1 28 28 SER HA H 28 3.990 3.990 4.150 -0.160 18222
4591 1 11 . 1 1 28 28 SER CA C 28 61.110 61.110 61.488 -0.378 18222
4592 1 11 . 1 1 28 28 SER H H 28 7.980 7.980 8.272 -0.292 18222
4593 1 11 . 1 1 29 29 HIS N N 29 120.880 120.880 122.071 -1.191 18222
4594 1 11 . 1 1 29 29 HIS CA C 29 58.190 58.190 59.855 -1.665 18222
4595 1 11 . 1 1 29 29 HIS CB C 29 27.460 27.460 29.882 -2.422 18222
4596 1 11 . 1 1 29 29 HIS H H 29 8.180 8.180 8.693 -0.513 18222
4597 1 11 . 1 1 30 30 ALA N N 30 122.920 122.920 122.716 0.204 18222
4598 1 11 . 1 1 30 30 ALA CA C 30 54.560 54.560 55.322 -0.761 18222
4599 1 11 . 1 1 30 30 ALA CB C 30 17.490 17.490 18.431 -0.941 18222
4600 1 11 . 1 1 30 30 ALA H H 30 8.040 8.040 8.147 -0.107 18222
4601 1 11 . 1 1 31 31 PHE N N 31 119.340 119.340 117.956 1.384 18222
4602 1 11 . 1 1 31 31 PHE CA C 31 60.370 60.370 61.704 -1.334 18222
4603 1 11 . 1 1 31 31 PHE CB C 31 38.520 38.520 38.727 -0.207 18222
4604 1 11 . 1 1 31 31 PHE H H 31 8.230 8.230 8.530 -0.300 18222
4605 1 11 . 1 1 32 32 MET N N 32 118.110 118.110 119.374 -1.264 18222
4606 1 11 . 1 1 32 32 MET HA H 32 4.050 4.050 4.038 0.012 18222
4607 1 11 . 1 1 32 32 MET CA C 32 58.280 58.280 59.360 -1.080 18222
4608 1 11 . 1 1 32 32 MET CB C 32 31.090 31.090 32.390 -1.300 18222
4609 1 11 . 1 1 32 32 MET H H 32 8.120 8.120 8.509 -0.389 18222
4610 1 11 . 1 1 33 33 LYS N N 33 119.040 119.040 119.280 -0.240 18222
4611 1 11 . 1 1 33 33 LYS HA H 33 3.930 3.930 3.907 0.023 18222
4612 1 11 . 1 1 33 33 LYS CA C 33 59.040 59.040 59.783 -0.743 18222
4613 1 11 . 1 1 33 33 LYS CB C 33 30.990 30.990 32.262 -1.272 18222
4614 1 11 . 1 1 33 33 LYS H H 33 7.970 7.970 8.141 -0.171 18222
4615 1 11 . 1 1 34 34 GLY N N 34 108.840 108.840 107.963 0.877 18222
4616 1 11 . 1 1 34 34 GLY CA C 34 46.610 46.610 47.163 -0.554 18222
4617 1 11 . 1 1 34 34 GLY H H 34 8.030 8.030 8.127 -0.097 18222
4618 1 11 . 1 1 35 35 VAL N N 35 122.910 122.910 122.260 0.650 18222
4619 1 11 . 1 1 35 35 VAL HA H 35 4.220 4.220 3.752 0.468 18222
4620 1 11 . 1 1 35 35 VAL CA C 35 66.310 66.310 65.073 1.237 18222
4621 1 11 . 1 1 35 35 VAL CB C 35 30.560 30.560 31.822 -1.262 18222
4622 1 11 . 1 1 35 35 VAL H H 35 8.090 8.090 8.304 -0.214 18222
4623 1 11 . 1 1 36 36 PHE N N 36 120.020 120.020 120.218 -0.198 18222
4624 1 11 . 1 1 36 36 PHE CA C 36 61.350 61.350 62.154 -0.804 18222
4625 1 11 . 1 1 36 36 PHE CB C 36 38.090 38.090 39.238 -1.148 18222
4626 1 11 . 1 1 36 36 PHE H H 36 8.350 8.350 8.355 -0.005 18222
4627 1 11 . 1 1 37 37 THR N N 37 116.980 116.980 115.825 1.155 18222
4628 1 11 . 1 1 37 37 THR HA H 37 4.050 4.050 4.099 -0.049 18222
4629 1 11 . 1 1 37 37 THR CA C 37 66.000 66.000 67.035 -1.035 18222
4630 1 11 . 1 1 37 37 THR CB C 37 68.270 68.270 69.002 -0.732 18222
4631 1 11 . 1 1 37 37 THR H H 37 8.520 8.520 8.605 -0.085 18222
4632 1 11 . 1 1 38 38 PHE N N 38 123.090 123.090 118.509 4.581 18222
4633 1 11 . 1 1 38 38 PHE HA H 38 4.360 4.360 4.325 0.035 18222
4634 1 11 . 1 1 38 38 PHE CA C 38 61.140 61.140 59.993 1.147 18222
4635 1 11 . 1 1 38 38 PHE CB C 38 41.200 41.200 39.147 2.053 18222
4636 1 11 . 1 1 38 38 PHE H H 38 8.010 8.010 8.166 -0.156 18222
4637 1 11 . 1 1 39 39 VAL N N 39 117.280 117.280 120.090 -2.810 18222
4638 1 11 . 1 1 39 39 VAL HA H 39 4.210 4.210 3.733 0.477 18222
4639 1 11 . 1 1 39 39 VAL CA C 39 66.000 66.000 66.670 -0.670 18222
4640 1 11 . 1 1 39 39 VAL CB C 39 30.860 30.860 31.386 -0.526 18222
4641 1 11 . 1 1 39 39 VAL H H 39 8.530 8.530 8.573 -0.043 18222
4642 1 11 . 1 1 40 40 THR N N 40 109.470 109.470 113.005 -3.535 18222
4643 1 11 . 1 1 40 40 THR HA H 40 4.060 4.060 4.226 -0.166 18222
4644 1 11 . 1 1 40 40 THR CA C 40 63.390 63.390 62.758 0.632 18222
4645 1 11 . 1 1 40 40 THR CB C 40 68.650 68.650 67.951 0.699 18222
4646 1 11 . 1 1 40 40 THR H H 40 7.700 7.700 8.116 -0.416 18222
4647 1 11 . 1 1 41 41 GLY N N 41 110.770 110.770 109.718 1.052 18222
4648 1 11 . 1 1 41 41 GLY CA C 41 45.580 45.580 45.543 0.037 18222
4649 1 11 . 1 1 41 41 GLY H H 41 7.700 7.700 7.511 0.189 18222
4650 1 11 . 1 1 42 42 THR N N 42 114.520 114.520 117.312 -2.792 18222
4651 1 11 . 1 1 42 42 THR CA C 42 63.300 63.300 61.374 1.926 18222
4652 1 11 . 1 1 42 42 THR CB C 42 69.490 69.490 68.942 0.548 18222
4653 1 11 . 1 1 42 42 THR H H 42 7.720 7.720 7.375 0.345 18222
4654 1 11 . 1 1 43 43 GLY N N 43 109.540 109.540 110.648 -1.108 18222
4655 1 11 . 1 1 43 43 GLY CA C 43 46.250 46.250 46.633 -0.383 18222
4656 1 11 . 1 1 43 43 GLY H H 43 8.110 8.110 7.771 0.339 18222
4657 1 11 . 1 1 44 44 MET N N 44 120.240 120.240 120.942 -0.702 18222
4658 1 11 . 1 1 44 44 MET HA H 44 4.100 4.100 4.099 0.001 18222
4659 1 11 . 1 1 44 44 MET CA C 44 57.700 57.700 58.515 -0.815 18222
4660 1 11 . 1 1 44 44 MET CB C 44 32.030 32.030 32.557 -0.527 18222
4661 1 11 . 1 1 44 44 MET H H 44 7.730 7.730 7.866 -0.136 18222
4662 1 11 . 1 1 45 45 ALA N N 45 121.560 121.560 121.940 -0.380 18222
4663 1 11 . 1 1 45 45 ALA CA C 45 54.440 54.440 55.287 -0.847 18222
4664 1 11 . 1 1 45 45 ALA CB C 45 17.400 17.400 17.430 -0.030 18222
4665 1 11 . 1 1 45 45 ALA H H 45 7.950 7.950 7.788 0.162 18222
4666 1 11 . 1 1 46 46 PHE N N 46 118.260 118.260 118.449 -0.189 18222
4667 1 11 . 1 1 46 46 PHE HA H 46 3.930 3.930 4.195 -0.265 18222
4668 1 11 . 1 1 46 46 PHE CA C 46 59.820 59.820 61.181 -1.361 18222
4669 1 11 . 1 1 46 46 PHE CB C 46 38.260 38.260 38.542 -0.282 18222
4670 1 11 . 1 1 46 46 PHE H H 46 7.860 7.860 7.579 0.281 18222
4671 1 11 . 1 1 47 47 GLY N N 47 107.300 107.300 108.133 -0.833 18222
4672 1 11 . 1 1 47 47 GLY CA C 47 46.560 46.560 47.229 -0.669 18222
4673 1 11 . 1 1 47 47 GLY H H 47 8.200 8.200 8.511 -0.311 18222
4674 1 11 . 1 1 48 48 LEU N N 48 121.920 121.920 122.907 -0.987 18222
4675 1 11 . 1 1 48 48 LEU HA H 48 4.040 4.040 3.961 0.079 18222
4676 1 11 . 1 1 48 48 LEU CA C 48 57.580 57.580 58.096 -0.516 18222
4677 1 11 . 1 1 48 48 LEU CB C 48 40.790 40.790 41.955 -1.165 18222
4678 1 11 . 1 1 48 48 LEU H H 48 8.180 8.180 8.381 -0.201 18222
4679 1 11 . 1 1 49 49 GLN N N 49 118.270 118.270 118.747 -0.477 18222
4680 1 11 . 1 1 49 49 GLN HA H 49 3.830 3.830 3.879 -0.049 18222
4681 1 11 . 1 1 49 49 GLN CA C 49 58.880 58.880 59.249 -0.369 18222
4682 1 11 . 1 1 49 49 GLN CB C 49 27.240 27.240 28.764 -1.524 18222
4683 1 11 . 1 1 49 49 GLN H H 49 8.080 8.080 8.095 -0.015 18222
4684 1 11 . 1 1 50 50 MET N N 50 117.630 117.630 119.812 -2.182 18222
4685 1 11 . 1 1 50 50 MET HA H 50 4.010 4.010 4.211 -0.201 18222
4686 1 11 . 1 1 50 50 MET CA C 50 57.730 57.730 58.244 -0.514 18222
4687 1 11 . 1 1 50 50 MET CB C 50 27.160 27.160 32.434 -5.274 18222
4688 1 11 . 1 1 50 50 MET H H 50 7.880 7.880 8.510 -0.630 18222
4689 1 11 . 1 1 51 51 PHE N N 51 119.550 119.550 118.517 1.033 18222
4690 1 11 . 1 1 51 51 PHE CA C 51 60.850 60.850 61.944 -1.094 18222
4691 1 11 . 1 1 51 51 PHE CB C 51 38.720 38.720 38.735 -0.015 18222
4692 1 11 . 1 1 51 51 PHE H H 51 7.890 7.890 8.195 -0.305 18222
4693 1 11 . 1 1 52 52 ILE N N 52 117.950 117.950 117.087 0.863 18222
4694 1 11 . 1 1 52 52 ILE HA H 52 4.050 4.050 3.816 0.234 18222
4695 1 11 . 1 1 52 52 ILE CA C 52 63.560 63.560 64.813 -1.253 18222
4696 1 11 . 1 1 52 52 ILE CB C 52 36.810 36.810 37.990 -1.180 18222
4697 1 11 . 1 1 52 52 ILE H H 52 8.110 8.110 8.102 0.008 18222
4698 1 11 . 1 1 53 53 GLN N N 53 117.360 117.360 118.808 -1.448 18222
4699 1 11 . 1 1 53 53 GLN CA C 53 57.200 57.200 58.220 -1.020 18222
4700 1 11 . 1 1 53 53 GLN CB C 53 27.870 27.870 28.004 -0.134 18222
4701 1 11 . 1 1 53 53 GLN H H 53 7.930 7.930 8.189 -0.259 18222
4702 1 11 . 1 1 54 54 ARG N N 54 116.840 116.840 118.843 -2.003 18222
4703 1 11 . 1 1 54 54 ARG HA H 54 3.950 3.950 4.169 -0.219 18222
4704 1 11 . 1 1 54 54 ARG CA C 54 56.480 56.480 58.059 -1.579 18222
4705 1 11 . 1 1 54 54 ARG CB C 54 28.970 28.970 29.913 -0.943 18222
4706 1 11 . 1 1 54 54 ARG H H 54 7.540 7.540 7.842 -0.302 18222
4707 1 11 . 1 1 55 55 LYS N N 55 117.900 117.900 117.907 -0.007 18222
4708 1 11 . 1 1 55 55 LYS HA H 55 4.080 4.080 4.270 -0.190 18222
4709 1 11 . 1 1 55 55 LYS CA C 55 55.030 55.030 56.922 -1.892 18222
4710 1 11 . 1 1 55 55 LYS CB C 55 32.010 32.010 33.256 -1.246 18222
4711 1 11 . 1 1 55 55 LYS H H 55 7.660 7.660 7.450 0.210 18222
4712 1 11 . 1 1 56 56 PHE N N 56 121.060 121.060 121.075 -0.015 18222
4713 1 11 . 1 1 56 56 PHE CA C 56 55.190 55.190 54.674 0.516 18222
4714 1 11 . 1 1 56 56 PHE CB C 56 38.970 38.970 38.666 0.304 18222
4715 1 11 . 1 1 56 56 PHE H H 56 8.080 8.080 8.028 0.052 18222
4716 1 11 . 1 1 57 57 PRO CA C 57 62.390 62.390 63.162 -0.772 18222
4717 1 11 . 1 1 57 57 PRO CB C 57 30.580 30.580 29.894 0.686 18222
4718 1 11 . 1 1 58 58 TYR N N 58 120.240 120.240 124.042 -3.802 18222
4719 1 11 . 1 1 58 58 TYR CA C 58 55.770 55.770 55.364 0.406 18222
4720 1 11 . 1 1 58 58 TYR CB C 58 40.220 40.220 39.857 0.363 18222
4721 1 11 . 1 1 58 58 TYR H H 58 7.700 7.700 8.176 -0.476 18222
4722 1 11 . 1 1 59 59 PRO CA C 59 62.130 62.130 63.870 -1.740 18222
4723 1 11 . 1 1 59 59 PRO CB C 59 33.340 33.340 31.952 1.388 18222
4724 1 11 . 1 1 60 60 LEU N N 60 122.210 122.210 120.556 1.654 18222
4725 1 11 . 1 1 60 60 LEU CA C 60 54.250 54.250 54.541 -0.291 18222
4726 1 11 . 1 1 60 60 LEU CB C 60 41.470 41.470 42.747 -1.277 18222
4727 1 11 . 1 1 60 60 LEU H H 60 7.880 7.880 7.686 0.194 18222
4728 1 11 . 1 1 61 61 GLN N N 61 122.470 122.470 121.091 1.379 18222
4729 1 11 . 1 1 61 61 GLN CA C 61 54.170 54.170 55.029 -0.859 18222
4730 1 11 . 1 1 61 61 GLN H H 61 7.970 7.970 8.369 -0.399 18222
4731 1 11 . 1 1 62 62 TRP N N 62 124.590 124.590 125.426 -0.836 18222
4732 1 11 . 1 1 62 62 TRP CA C 62 59.830 59.830 59.756 0.074 18222
4733 1 11 . 1 1 62 62 TRP CB C 62 28.800 28.800 28.675 0.125 18222
4734 1 11 . 1 1 62 62 TRP H H 62 8.240 8.240 9.118 -0.878 18222
4735 1 11 . 1 1 63 63 SER N N 63 113.320 113.320 115.509 -2.189 18222
4736 1 11 . 1 1 63 63 SER CA C 63 61.100 61.100 60.413 0.687 18222
4737 1 11 . 1 1 63 63 SER H H 63 8.410 8.410 7.719 0.691 18222
4738 1 11 . 1 1 64 64 LEU N N 64 123.230 123.230 122.459 0.771 18222
4739 1 11 . 1 1 64 64 LEU CA C 64 56.880 56.880 57.150 -0.270 18222
4740 1 11 . 1 1 64 64 LEU CB C 64 40.830 40.830 41.194 -0.364 18222
4741 1 11 . 1 1 64 64 LEU H H 64 7.230 7.230 7.277 -0.047 18222
4742 1 11 . 1 1 65 65 LEU N N 65 119.400 119.400 121.186 -1.786 18222
4743 1 11 . 1 1 65 65 LEU HA H 65 3.890 3.890 4.074 -0.184 18222
4744 1 11 . 1 1 65 65 LEU CA C 65 57.580 57.580 58.786 -1.206 18222
4745 1 11 . 1 1 65 65 LEU CB C 65 40.710 40.710 42.082 -1.372 18222
4746 1 11 . 1 1 65 65 LEU H H 65 7.510 7.510 8.709 -1.199 18222
4747 1 11 . 1 1 66 66 VAL N N 66 116.950 116.950 118.823 -1.873 18222
4748 1 11 . 1 1 66 66 VAL HA H 66 3.960 3.960 3.790 0.170 18222
4749 1 11 . 1 1 66 66 VAL CA C 66 66.260 66.260 64.772 1.488 18222
4750 1 11 . 1 1 66 66 VAL CB C 66 30.570 30.570 30.988 -0.418 18222
4751 1 11 . 1 1 66 66 VAL H H 66 7.950 7.950 8.198 -0.248 18222
4752 1 11 . 1 1 67 67 ALA N N 67 120.650 120.650 122.785 -2.135 18222
4753 1 11 . 1 1 67 67 ALA HA H 67 4.000 4.000 4.093 -0.093 18222
4754 1 11 . 1 1 67 67 ALA CA C 67 54.780 54.780 55.239 -0.459 18222
4755 1 11 . 1 1 67 67 ALA CB C 67 17.440 17.440 18.327 -0.887 18222
4756 1 11 . 1 1 67 67 ALA H H 67 7.450 7.450 7.948 -0.498 18222
4757 1 11 . 1 1 68 68 VAL N N 68 118.440 118.440 119.292 -0.852 18222
4758 1 11 . 1 1 68 68 VAL HA H 68 3.750 3.750 3.808 -0.058 18222
4759 1 11 . 1 1 68 68 VAL CA C 68 65.250 65.250 66.370 -1.120 18222
4760 1 11 . 1 1 68 68 VAL CB C 68 30.850 30.850 31.475 -0.625 18222
4761 1 11 . 1 1 68 68 VAL H H 68 7.960 7.960 7.828 0.132 18222
4762 1 11 . 1 1 69 69 VAL N N 69 120.800 120.800 120.896 -0.096 18222
4763 1 11 . 1 1 69 69 VAL HA H 69 4.220 4.220 3.678 0.542 18222
4764 1 11 . 1 1 69 69 VAL CA C 69 66.020 66.020 66.391 -0.371 18222
4765 1 11 . 1 1 69 69 VAL CB C 69 30.850 30.850 31.144 -0.294 18222
4766 1 11 . 1 1 69 69 VAL H H 69 8.080 8.080 8.469 -0.389 18222
4767 1 11 . 1 1 70 70 ALA N N 70 121.740 121.740 120.350 1.390 18222
4768 1 11 . 1 1 70 70 ALA HA H 70 3.920 3.920 4.061 -0.141 18222
4769 1 11 . 1 1 70 70 ALA CA C 70 54.920 54.920 55.282 -0.362 18222
4770 1 11 . 1 1 70 70 ALA CB C 70 17.620 17.620 18.184 -0.564 18222
4771 1 11 . 1 1 70 70 ALA H H 70 8.660 8.660 8.520 0.140 18222
4772 1 11 . 1 1 71 71 GLY N N 71 103.450 103.450 106.978 -3.528 18222
4773 1 11 . 1 1 71 71 GLY CA C 71 46.300 46.300 46.923 -0.623 18222
4774 1 11 . 1 1 71 71 GLY H H 71 8.010 8.010 8.054 -0.044 18222
4775 1 11 . 1 1 72 72 SER N N 72 118.160 118.160 117.773 0.387 18222
4776 1 11 . 1 1 72 72 SER CA C 72 61.260 61.260 62.277 -1.017 18222
4777 1 11 . 1 1 72 72 SER CB C 72 62.870 62.870 63.307 -0.437 18222
4778 1 11 . 1 1 72 72 SER H H 72 7.870 7.870 8.068 -0.198 18222
4779 1 11 . 1 1 73 73 VAL N N 73 121.340 121.340 122.046 -0.706 18222
4780 1 11 . 1 1 73 73 VAL CA C 73 65.750 65.750 66.797 -1.047 18222
4781 1 11 . 1 1 73 73 VAL CB C 73 30.740 30.740 31.259 -0.518 18222
4782 1 11 . 1 1 73 73 VAL H H 73 8.050 8.050 8.202 -0.152 18222
4783 1 11 . 1 1 74 74 VAL N N 74 118.680 118.680 118.816 -0.136 18222
4784 1 11 . 1 1 74 74 VAL CA C 74 65.770 65.770 65.951 -0.181 18222
4785 1 11 . 1 1 74 74 VAL CB C 74 30.740 30.740 30.627 0.114 18222
4786 1 11 . 1 1 74 74 VAL H H 74 7.880 7.880 8.452 -0.572 18222
4787 1 11 . 1 1 75 75 SER N N 75 114.750 114.750 116.405 -1.655 18222
4788 1 11 . 1 1 75 75 SER HA H 75 4.100 4.100 4.166 -0.066 18222
4789 1 11 . 1 1 75 75 SER CA C 75 60.870 60.870 61.646 -0.776 18222
4790 1 11 . 1 1 75 75 SER CB C 75 62.340 62.340 63.016 -0.676 18222
4791 1 11 . 1 1 75 75 SER H H 75 7.870 7.870 8.028 -0.158 18222
4792 1 11 . 1 1 76 76 TYR N N 76 121.110 121.110 122.215 -1.105 18222
4793 1 11 . 1 1 76 76 TYR CA C 76 60.050 60.050 61.800 -1.750 18222
4794 1 11 . 1 1 76 76 TYR CB C 76 37.980 37.980 38.597 -0.617 18222
4795 1 11 . 1 1 76 76 TYR H H 76 7.860 7.860 8.622 -0.762 18222
4796 1 11 . 1 1 77 77 GLY N N 77 107.300 107.300 106.930 0.370 18222
4797 1 11 . 1 1 77 77 GLY CA C 77 46.560 46.560 47.376 -0.816 18222
4798 1 11 . 1 1 77 77 GLY H H 77 8.200 8.200 8.503 -0.303 18222
4799 1 11 . 1 1 78 78 VAL N N 78 119.470 119.470 121.705 -2.235 18222
4800 1 11 . 1 1 78 78 VAL HA H 78 4.170 4.170 3.616 0.554 18222
4801 1 11 . 1 1 78 78 VAL CA C 78 64.650 64.650 66.549 -1.899 18222
4802 1 11 . 1 1 78 78 VAL H H 78 8.140 8.140 8.721 -0.581 18222
4803 1 11 . 1 1 79 79 THR N N 79 112.100 112.100 117.094 -4.994 18222
4804 1 11 . 1 1 79 79 THR CA C 79 63.460 63.460 66.002 -2.542 18222
4805 1 11 . 1 1 79 79 THR CB C 79 68.650 68.650 68.405 0.245 18222
4806 1 11 . 1 1 79 79 THR H H 79 7.640 7.640 8.034 -0.394 18222
4807 1 11 . 1 1 80 80 ARG N N 80 120.770 120.770 122.416 -1.646 18222
4808 1 11 . 1 1 80 80 ARG HA H 80 4.160 4.160 4.151 0.009 18222
4809 1 11 . 1 1 80 80 ARG CA C 80 56.790 56.790 59.868 -3.078 18222
4810 1 11 . 1 1 80 80 ARG CB C 80 29.430 29.430 30.277 -0.847 18222
4811 1 11 . 1 1 80 80 ARG H H 80 7.680 7.680 8.057 -0.377 18222
4812 1 11 . 1 1 81 81 VAL N N 81 118.370 118.370 119.570 -1.200 18222
4813 1 11 . 1 1 81 81 VAL HA H 81 3.920 3.920 3.885 0.035 18222
4814 1 11 . 1 1 81 81 VAL CA C 81 63.340 63.340 64.858 -1.518 18222
4815 1 11 . 1 1 81 81 VAL CB C 81 31.260 31.260 31.862 -0.602 18222
4816 1 11 . 1 1 81 81 VAL H H 81 7.730 7.730 8.292 -0.562 18222
4817 1 11 . 1 1 82 82 GLU N N 82 120.620 120.620 119.885 0.735 18222
4818 1 11 . 1 1 82 82 GLU CA C 82 56.320 56.320 59.806 -3.486 18222
4819 1 11 . 1 1 82 82 GLU CB C 82 27.930 27.930 29.372 -1.442 18222
4820 1 11 . 1 1 82 82 GLU H H 82 7.920 7.920 8.336 -0.416 18222
4821 1 11 . 1 1 83 83 SER N N 83 116.240 116.240 115.941 0.299 18222
4822 1 11 . 1 1 83 83 SER CA C 83 59.250 59.250 61.375 -2.125 18222
4823 1 11 . 1 1 83 83 SER CB C 83 63.160 63.160 62.978 0.182 18222
4824 1 11 . 1 1 83 83 SER H H 83 7.960 7.960 8.171 -0.211 18222
4825 1 11 . 1 1 84 84 GLU N N 84 123.280 123.280 121.615 1.665 18222
4826 1 11 . 1 1 84 84 GLU HA H 84 4.080 4.080 4.015 0.065 18222
4827 1 11 . 1 1 84 84 GLU CA C 84 57.860 57.860 59.882 -2.022 18222
4828 1 11 . 1 1 84 84 GLU CB C 84 28.190 28.190 29.687 -1.497 18222
4829 1 11 . 1 1 84 84 GLU H H 84 8.470 8.470 8.072 0.398 18222
4830 1 11 . 1 1 85 85 LYS N N 85 118.650 118.650 119.131 -0.481 18222
4831 1 11 . 1 1 85 85 LYS HA H 85 4.100 4.100 3.978 0.122 18222
4832 1 11 . 1 1 85 85 LYS CA C 85 57.780 57.780 59.400 -1.620 18222
4833 1 11 . 1 1 85 85 LYS CB C 85 31.380 31.380 32.209 -0.829 18222
4834 1 11 . 1 1 85 85 LYS H H 85 7.940 7.940 8.099 -0.159 18222
4835 1 11 . 1 1 86 86 CYS N N 86 117.070 117.070 118.053 -0.983 18222
4836 1 11 . 1 1 86 86 CYS CA C 86 60.910 60.910 64.038 -3.128 18222
4837 1 11 . 1 1 86 86 CYS CB C 86 26.740 26.740 26.928 -0.188 18222
4838 1 11 . 1 1 86 86 CYS H H 86 7.840 7.840 8.066 -0.226 18222
4839 1 11 . 1 1 87 87 ASN N N 87 119.370 119.370 118.450 0.920 18222
4840 1 11 . 1 1 87 87 ASN HA H 87 4.130 4.130 4.448 -0.318 18222
4841 1 11 . 1 1 87 87 ASN CA C 87 55.750 55.750 56.872 -1.122 18222
4842 1 11 . 1 1 87 87 ASN CB C 87 38.050 38.050 38.610 -0.560 18222
4843 1 11 . 1 1 87 87 ASN H H 87 8.110 8.110 8.509 -0.399 18222
4844 1 11 . 1 1 88 88 ASN N N 88 117.570 117.570 118.801 -1.231 18222
4845 1 11 . 1 1 88 88 ASN HA H 88 4.280 4.280 4.518 -0.238 18222
4846 1 11 . 1 1 88 88 ASN CA C 88 55.190 55.190 55.794 -0.604 18222
4847 1 11 . 1 1 88 88 ASN CB C 88 37.400 37.400 38.347 -0.947 18222
4848 1 11 . 1 1 88 88 ASN H H 88 8.280 8.280 8.233 0.047 18222
4849 1 11 . 1 1 89 89 LEU N N 89 121.940 121.940 121.533 0.407 18222
4850 1 11 . 1 1 89 89 LEU HA H 89 4.070 4.070 3.944 0.126 18222
4851 1 11 . 1 1 89 89 LEU CA C 89 57.580 57.580 58.886 -1.306 18222
4852 1 11 . 1 1 89 89 LEU CB C 89 40.490 40.490 41.884 -1.394 18222
4853 1 11 . 1 1 89 89 LEU H H 89 7.790 7.790 8.100 -0.310 18222
4854 1 11 . 1 1 90 90 TRP N N 90 119.220 119.220 120.871 -1.651 18222
4855 1 11 . 1 1 90 90 TRP CA C 90 59.120 59.120 61.541 -2.421 18222
4856 1 11 . 1 1 90 90 TRP CB C 90 28.800 28.800 29.153 -0.353 18222
4857 1 11 . 1 1 90 90 TRP H H 90 7.850 7.850 8.391 -0.541 18222
4858 1 11 . 1 1 91 91 LEU N N 91 117.870 117.870 120.929 -3.059 18222
4859 1 11 . 1 1 91 91 LEU CA C 91 57.300 57.300 58.328 -1.028 18222
4860 1 11 . 1 1 91 91 LEU CB C 91 40.610 40.610 41.861 -1.251 18222
4861 1 11 . 1 1 91 91 LEU H H 91 7.920 7.920 8.232 -0.312 18222
4862 1 11 . 1 1 92 92 PHE N N 92 121.280 121.280 118.450 2.830 18222
4863 1 11 . 1 1 92 92 PHE CA C 92 60.390 60.390 61.413 -1.023 18222
4864 1 11 . 1 1 92 92 PHE CB C 92 37.980 37.980 38.585 -0.605 18222
4865 1 11 . 1 1 92 92 PHE H H 92 7.860 7.860 8.277 -0.417 18222
4866 1 11 . 1 1 93 93 LEU N N 93 119.860 119.860 121.116 -1.256 18222
4867 1 11 . 1 1 93 93 LEU CA C 93 56.860 56.860 57.759 -0.899 18222
4868 1 11 . 1 1 93 93 LEU CB C 93 40.550 40.550 42.063 -1.513 18222
4869 1 11 . 1 1 93 93 LEU H H 93 7.980 7.980 8.815 -0.835 18222
4870 1 11 . 1 1 94 94 GLU N N 94 114.660 114.660 118.422 -3.762 18222
4871 1 11 . 1 1 94 94 GLU HA H 94 3.810 3.810 4.037 -0.227 18222
4872 1 11 . 1 1 94 94 GLU CA C 94 57.210 57.210 58.613 -1.403 18222
4873 1 11 . 1 1 94 94 GLU CB C 94 28.470 28.470 29.421 -0.951 18222
4874 1 11 . 1 1 94 94 GLU H H 94 7.890 7.890 8.093 -0.203 18222
4875 1 11 . 1 1 95 95 THR N N 95 108.260 108.260 113.083 -4.823 18222
4876 1 11 . 1 1 95 95 THR CA C 95 62.150 62.150 62.376 -0.226 18222
4877 1 11 . 1 1 95 95 THR CB C 95 70.810 70.810 69.117 1.693 18222
4878 1 11 . 1 1 95 95 THR H H 95 7.690 7.690 7.506 0.184 18222
4879 1 11 . 1 1 96 96 GLY N N 96 112.220 112.220 109.008 3.212 18222
4880 1 11 . 1 1 96 96 GLY CA C 96 45.410 45.410 44.974 0.436 18222
4881 1 11 . 1 1 96 96 GLY H H 96 8.240 8.240 7.507 0.733 18222
4882 1 11 . 1 1 97 97 GLN N N 97 117.950 117.950 120.585 -2.635 18222
4883 1 11 . 1 1 97 97 GLN HA H 97 4.200 4.200 4.533 -0.333 18222
4884 1 11 . 1 1 97 97 GLN CA C 97 54.430 54.430 54.269 0.161 18222
4885 1 11 . 1 1 97 97 GLN CB C 97 29.910 29.910 29.442 0.468 18222
4886 1 11 . 1 1 97 97 GLN H H 97 7.640 7.640 8.024 -0.384 18222
4887 1 11 . 1 1 98 98 LEU N N 98 123.810 123.810 123.552 0.258 18222
4888 1 11 . 1 1 98 98 LEU HA H 98 4.360 4.360 4.541 -0.181 18222
4889 1 11 . 1 1 98 98 LEU CA C 98 52.650 52.650 53.689 -1.039 18222
4890 1 11 . 1 1 98 98 LEU CB C 98 40.460 40.460 40.822 -0.362 18222
4891 1 11 . 1 1 98 98 LEU H H 98 8.270 8.270 8.367 -0.097 18222
4892 1 11 . 1 1 99 99 PRO CA C 99 63.180 63.180 62.570 0.610 18222
4893 1 11 . 1 1 99 99 PRO CB C 99 30.840 30.840 32.615 -1.775 18222
4894 1 11 . 1 1 100 100 LYS N N 100 120.630 120.630 119.762 0.868 18222
4895 1 11 . 1 1 100 100 LYS CA C 100 55.730 55.730 56.186 -0.456 18222
4896 1 11 . 1 1 100 100 LYS CB C 100 32.280 32.280 33.156 -0.876 18222
4897 1 11 . 1 1 100 100 LYS H H 100 8.090 8.090 8.562 -0.472 18222
4898 1 11 . 1 1 101 101 ASP N N 101 120.920 120.920 121.052 -0.132 18222
4899 1 11 . 1 1 101 101 ASP HA H 101 4.190 4.190 5.131 -0.941 18222
4900 1 11 . 1 1 101 101 ASP CA C 101 54.000 54.000 53.616 0.384 18222
4901 1 11 . 1 1 101 101 ASP CB C 101 40.330 40.330 43.178 -2.848 18222
4902 1 11 . 1 1 101 101 ASP H H 101 8.190 8.190 8.353 -0.163 18222
4903 1 11 . 1 1 102 102 ARG N N 102 122.210 122.210 120.525 1.685 18222
4904 1 11 . 1 1 102 102 ARG CA C 102 55.590 55.590 55.602 -0.012 18222
4905 1 11 . 1 1 102 102 ARG CB C 102 29.630 29.630 32.016 -2.385 18222
4906 1 11 . 1 1 102 102 ARG H H 102 8.130 8.130 8.292 -0.162 18222
4907 1 11 . 1 1 103 103 SER N N 103 117.230 117.230 115.780 1.450 18222
4908 1 11 . 1 1 103 103 SER HA H 103 4.280 4.280 4.303 -0.023 18222
4909 1 11 . 1 1 103 103 SER CA C 103 58.470 58.470 58.390 0.080 18222
4910 1 11 . 1 1 103 103 SER CB C 103 63.080 63.080 63.653 -0.573 18222
4911 1 11 . 1 1 103 103 SER H H 103 8.290 8.290 8.472 -0.182 18222
4912 1 11 . 1 1 104 104 THR N N 104 115.430 115.430 120.691 -5.261 18222
4913 1 11 . 1 1 104 104 THR CA C 104 61.570 61.570 62.219 -0.649 18222
4914 1 11 . 1 1 104 104 THR CB C 104 69.030 69.030 68.980 0.050 18222
4915 1 11 . 1 1 104 104 THR H H 104 8.020 8.020 8.428 -0.408 18222
4916 1 11 . 1 1 105 105 ASP N N 105 122.780 122.780 126.228 -3.448 18222
4917 1 11 . 1 1 105 105 ASP CA C 105 54.210 54.210 53.775 0.435 18222
4918 1 11 . 1 1 105 105 ASP CB C 105 40.380 40.380 42.452 -2.072 18222
4919 1 11 . 1 1 105 105 ASP H H 105 8.120 8.120 8.610 -0.490 18222
4920 1 11 . 1 1 106 106 GLN N N 106 120.960 120.960 120.316 0.644 18222
4921 1 11 . 1 1 106 106 GLN CA C 106 55.420 55.420 55.457 -0.037 18222
4922 1 11 . 1 1 106 106 GLN CB C 106 28.310 28.310 30.436 -2.126 18222
4923 1 11 . 1 1 106 106 GLN H H 106 8.140 8.140 8.510 -0.370 18222
4924 1 11 . 1 1 107 107 ARG N N 107 123.010 123.010 122.414 0.596 18222
4925 1 11 . 1 1 107 107 ARG HA H 107 4.210 4.210 4.461 -0.251 18222
4926 1 11 . 1 1 107 107 ARG CA C 107 55.560 55.560 56.183 -0.623 18222
4927 1 11 . 1 1 107 107 ARG CB C 107 29.920 29.920 31.103 -1.183 18222
4928 1 11 . 1 1 107 107 ARG H H 107 8.180 8.180 8.735 -0.555 18222
4929 1 12 . 1 1 2 2 VAL N N 2 121.590 121.590 124.300 -2.710 18222
4930 1 12 . 1 1 2 2 VAL CA C 2 61.600 61.600 62.247 -0.647 18222
4931 1 12 . 1 1 2 2 VAL CB C 2 31.900 31.900 33.010 -1.110 18222
4932 1 12 . 1 1 2 2 VAL H H 2 8.010 8.010 8.340 -0.330 18222
4933 1 12 . 1 1 3 3 ASN N N 3 122.520 122.520 124.300 -1.780 18222
4934 1 12 . 1 1 3 3 ASN HA H 3 4.020 4.020 4.590 -0.570 18222
4935 1 12 . 1 1 3 3 ASN CA C 3 52.640 52.640 55.057 -2.417 18222
4936 1 12 . 1 1 3 3 ASN CB C 3 38.330 38.330 38.936 -0.606 18222
4937 1 12 . 1 1 3 3 ASN H H 3 8.360 8.360 8.697 -0.337 18222
4938 1 12 . 1 1 4 4 LEU N N 4 123.830 123.830 117.704 6.126 18222
4939 1 12 . 1 1 4 4 LEU HA H 4 4.220 4.220 4.513 -0.293 18222
4940 1 12 . 1 1 4 4 LEU CA C 4 54.620 54.620 55.339 -0.719 18222
4941 1 12 . 1 1 4 4 LEU CB C 4 41.680 41.680 43.099 -1.419 18222
4942 1 12 . 1 1 4 4 LEU H H 4 8.220 8.220 7.762 0.458 18222
4943 1 12 . 1 1 5 5 GLY N N 5 106.810 106.810 106.534 0.276 18222
4944 1 12 . 1 1 5 5 GLY CA C 5 45.800 45.800 45.799 0.001 18222
4945 1 12 . 1 1 5 5 GLY H H 5 8.030 8.030 8.116 -0.086 18222
4946 1 12 . 1 1 6 6 LEU N N 6 120.820 120.820 119.511 1.309 18222
4947 1 12 . 1 1 6 6 LEU HA H 6 4.050 4.050 4.297 -0.247 18222
4948 1 12 . 1 1 6 6 LEU CA C 6 55.990 55.990 57.828 -1.839 18222
4949 1 12 . 1 1 6 6 LEU CB C 6 40.800 40.800 41.876 -1.076 18222
4950 1 12 . 1 1 6 6 LEU H H 6 8.030 8.030 8.058 -0.028 18222
4951 1 12 . 1 1 7 7 SER N N 7 115.540 115.540 115.845 -0.305 18222
4952 1 12 . 1 1 7 7 SER HA H 7 4.100 4.100 4.179 -0.079 18222
4953 1 12 . 1 1 7 7 SER CA C 7 60.580 60.580 61.894 -1.313 18222
4954 1 12 . 1 1 7 7 SER CB C 7 62.060 62.060 62.492 -0.432 18222
4955 1 12 . 1 1 7 7 SER H H 7 8.360 8.360 8.451 -0.091 18222
4956 1 12 . 1 1 8 8 ARG N N 8 120.690 120.690 121.532 -0.842 18222
4957 1 12 . 1 1 8 8 ARG HA H 8 4.160 4.160 4.095 0.065 18222
4958 1 12 . 1 1 8 8 ARG CA C 8 57.350 57.350 58.972 -1.622 18222
4959 1 12 . 1 1 8 8 ARG CB C 8 29.230 29.230 29.929 -0.699 18222
4960 1 12 . 1 1 8 8 ARG H H 8 7.830 7.830 8.254 -0.424 18222
4961 1 12 . 1 1 9 9 VAL N N 9 119.330 119.330 120.093 -0.763 18222
4962 1 12 . 1 1 9 9 VAL HA H 9 4.170 4.170 3.593 0.577 18222
4963 1 12 . 1 1 9 9 VAL CA C 9 64.720 64.720 67.454 -2.734 18222
4964 1 12 . 1 1 9 9 VAL CB C 9 30.900 30.900 31.604 -0.704 18222
4965 1 12 . 1 1 9 9 VAL H H 9 7.620 7.620 8.466 -0.846 18222
4966 1 12 . 1 1 10 10 ASP N N 10 119.520 119.520 119.500 0.020 18222
4967 1 12 . 1 1 10 10 ASP CA C 10 54.960 54.960 57.434 -2.474 18222
4968 1 12 . 1 1 10 10 ASP CB C 10 37.800 37.800 40.400 -2.600 18222
4969 1 12 . 1 1 10 10 ASP H H 10 8.180 8.180 7.970 0.210 18222
4970 1 12 . 1 1 11 11 ASP N N 11 121.550 121.550 120.157 1.393 18222
4971 1 12 . 1 1 11 11 ASP CA C 11 54.440 54.440 57.459 -3.019 18222
4972 1 12 . 1 1 11 11 ASP CB C 11 37.840 37.840 41.139 -3.299 18222
4973 1 12 . 1 1 11 11 ASP H H 11 7.950 7.950 8.230 -0.280 18222
4974 1 12 . 1 1 12 12 ALA N N 12 120.220 120.220 122.679 -2.459 18222
4975 1 12 . 1 1 12 12 ALA CA C 12 54.370 54.370 55.225 -0.855 18222
4976 1 12 . 1 1 12 12 ALA CB C 12 24.730 24.730 18.450 6.280 18222
4977 1 12 . 1 1 12 12 ALA H H 12 8.090 8.090 8.184 -0.094 18222
4978 1 12 . 1 1 13 13 VAL N N 13 116.910 116.910 119.143 -2.233 18222
4979 1 12 . 1 1 13 13 VAL HA H 13 4.140 4.140 3.538 0.602 18222
4980 1 12 . 1 1 13 13 VAL CA C 13 64.900 64.900 67.200 -2.300 18222
4981 1 12 . 1 1 13 13 VAL CB C 13 31.000 31.000 31.523 -0.523 18222
4982 1 12 . 1 1 13 13 VAL H H 13 7.980 7.980 8.056 -0.076 18222
4983 1 12 . 1 1 14 14 ALA N N 14 122.200 122.200 122.007 0.193 18222
4984 1 12 . 1 1 14 14 ALA HA H 14 4.020 4.020 4.263 -0.243 18222
4985 1 12 . 1 1 14 14 ALA CA C 14 53.800 53.800 54.786 -0.986 18222
4986 1 12 . 1 1 14 14 ALA CB C 14 17.790 17.790 18.578 -0.788 18222
4987 1 12 . 1 1 14 14 ALA H H 14 8.030 8.030 8.195 -0.165 18222
4988 1 12 . 1 1 15 15 ALA N N 15 118.600 118.600 119.391 -0.791 18222
4989 1 12 . 1 1 15 15 ALA CA C 15 53.230 53.230 54.208 -0.978 18222
4990 1 12 . 1 1 15 15 ALA CB C 15 18.010 18.010 18.691 -0.681 18222
4991 1 12 . 1 1 15 15 ALA H H 15 7.530 7.530 7.904 -0.374 18222
4992 1 12 . 1 1 16 16 LYS N N 16 115.820 115.820 116.460 -0.640 18222
4993 1 12 . 1 1 16 16 LYS HA H 16 4.080 4.080 4.139 -0.059 18222
4994 1 12 . 1 1 16 16 LYS CA C 16 55.670 55.670 57.529 -1.859 18222
4995 1 12 . 1 1 16 16 LYS CB C 16 32.640 32.640 33.708 -1.068 18222
4996 1 12 . 1 1 16 16 LYS H H 16 7.490 7.490 7.719 -0.229 18222
4997 1 12 . 1 1 17 17 HIS N N 17 116.790 116.790 116.845 -0.055 18222
4998 1 12 . 1 1 17 17 HIS HA H 17 4.100 4.100 4.949 -0.849 18222
4999 1 12 . 1 1 17 17 HIS CA C 17 52.820 52.820 53.261 -0.441 18222
5000 1 12 . 1 1 17 17 HIS CB C 17 28.400 28.400 30.780 -2.380 18222
5001 1 12 . 1 1 17 17 HIS H H 17 8.130 8.130 8.424 -0.294 18222
5002 1 12 . 1 1 18 18 PRO CA C 18 63.800 63.800 63.670 0.130 18222
5003 1 12 . 1 1 18 18 PRO CB C 18 30.800 30.800 32.339 -1.539 18222
5004 1 12 . 1 1 19 19 GLY N N 19 110.260 110.260 106.083 4.177 18222
5005 1 12 . 1 1 19 19 GLY CA C 19 45.490 45.490 45.417 0.073 18222
5006 1 12 . 1 1 19 19 GLY H H 19 8.730 8.730 8.256 0.474 18222
5007 1 12 . 1 1 20 20 LEU N N 20 122.650 122.650 125.455 -2.805 18222
5008 1 12 . 1 1 20 20 LEU HA H 20 4.090 4.090 4.211 -0.121 18222
5009 1 12 . 1 1 20 20 LEU CA C 20 57.060 57.060 57.502 -0.441 18222
5010 1 12 . 1 1 20 20 LEU H H 20 7.980 7.980 8.211 -0.231 18222
5011 1 12 . 1 1 21 21 GLY N N 21 107.000 107.000 106.974 0.026 18222
5012 1 12 . 1 1 21 21 GLY CA C 21 46.710 46.710 47.278 -0.568 18222
5013 1 12 . 1 1 21 21 GLY H H 21 8.570 8.570 8.605 -0.035 18222
5014 1 12 . 1 1 22 22 GLU N N 22 121.610 121.610 122.033 -0.423 18222
5015 1 12 . 1 1 22 22 GLU HA H 22 3.990 3.990 3.872 0.118 18222
5016 1 12 . 1 1 22 22 GLU CA C 22 58.280 58.280 59.243 -0.963 18222
5017 1 12 . 1 1 22 22 GLU CB C 22 28.010 28.010 29.052 -1.042 18222
5018 1 12 . 1 1 22 22 GLU H H 22 8.100 8.100 8.146 -0.046 18222
5019 1 12 . 1 1 23 23 TYR N N 23 120.870 120.870 121.352 -0.482 18222
5020 1 12 . 1 1 23 23 TYR CA C 23 60.380 60.380 61.364 -0.984 18222
5021 1 12 . 1 1 23 23 TYR CB C 23 37.750 37.750 38.350 -0.600 18222
5022 1 12 . 1 1 23 23 TYR H H 23 7.910 7.910 7.862 0.048 18222
5023 1 12 . 1 1 24 24 ALA N N 24 121.420 121.420 121.554 -0.134 18222
5024 1 12 . 1 1 24 24 ALA HA H 24 4.140 4.140 3.949 0.191 18222
5025 1 12 . 1 1 24 24 ALA CA C 24 54.260 54.260 55.157 -0.897 18222
5026 1 12 . 1 1 24 24 ALA H H 24 8.410 8.410 8.801 -0.391 18222
5027 1 12 . 1 1 25 25 ALA N N 25 120.220 120.220 121.711 -1.491 18222
5028 1 12 . 1 1 25 25 ALA CA C 25 54.370 54.370 55.266 -0.896 18222
5029 1 12 . 1 1 25 25 ALA H H 25 8.090 8.090 8.509 -0.419 18222
5030 1 12 . 1 1 26 26 CYS N N 26 116.760 116.760 117.038 -0.278 18222
5031 1 12 . 1 1 26 26 CYS CA C 26 61.180 61.180 62.613 -1.433 18222
5032 1 12 . 1 1 26 26 CYS CB C 26 26.390 26.390 26.529 -0.139 18222
5033 1 12 . 1 1 26 26 CYS H H 26 7.950 7.950 8.442 -0.492 18222
5034 1 12 . 1 1 27 27 GLN N N 27 118.690 118.690 120.492 -1.802 18222
5035 1 12 . 1 1 27 27 GLN CA C 27 55.970 55.970 59.026 -3.056 18222
5036 1 12 . 1 1 27 27 GLN H H 27 8.060 8.060 7.912 0.148 18222
5037 1 12 . 1 1 28 28 SER N N 28 115.490 115.490 115.607 -0.117 18222
5038 1 12 . 1 1 28 28 SER HA H 28 3.990 3.990 4.183 -0.193 18222
5039 1 12 . 1 1 28 28 SER CA C 28 61.110 61.110 61.702 -0.592 18222
5040 1 12 . 1 1 28 28 SER H H 28 7.980 7.980 8.457 -0.477 18222
5041 1 12 . 1 1 29 29 HIS N N 29 120.880 120.880 120.646 0.234 18222
5042 1 12 . 1 1 29 29 HIS CA C 29 58.190 58.190 59.057 -0.867 18222
5043 1 12 . 1 1 29 29 HIS CB C 29 27.460 27.460 30.048 -2.588 18222
5044 1 12 . 1 1 29 29 HIS H H 29 8.180 8.180 8.595 -0.415 18222
5045 1 12 . 1 1 30 30 ALA N N 30 122.920 122.920 122.194 0.726 18222
5046 1 12 . 1 1 30 30 ALA CA C 30 54.560 54.560 55.209 -0.649 18222
5047 1 12 . 1 1 30 30 ALA CB C 30 17.490 17.490 18.024 -0.534 18222
5048 1 12 . 1 1 30 30 ALA H H 30 8.040 8.040 7.978 0.062 18222
5049 1 12 . 1 1 31 31 PHE N N 31 119.340 119.340 119.713 -0.373 18222
5050 1 12 . 1 1 31 31 PHE CA C 31 60.370 60.370 61.883 -1.513 18222
5051 1 12 . 1 1 31 31 PHE CB C 31 38.520 38.520 39.228 -0.708 18222
5052 1 12 . 1 1 31 31 PHE H H 31 8.230 8.230 8.504 -0.274 18222
5053 1 12 . 1 1 32 32 MET N N 32 118.110 118.110 119.745 -1.635 18222
5054 1 12 . 1 1 32 32 MET HA H 32 4.050 4.050 3.942 0.108 18222
5055 1 12 . 1 1 32 32 MET CA C 32 58.280 58.280 59.327 -1.047 18222
5056 1 12 . 1 1 32 32 MET CB C 32 31.090 31.090 32.295 -1.206 18222
5057 1 12 . 1 1 32 32 MET H H 32 8.120 8.120 8.762 -0.642 18222
5058 1 12 . 1 1 33 33 LYS N N 33 119.040 119.040 119.257 -0.217 18222
5059 1 12 . 1 1 33 33 LYS HA H 33 3.930 3.930 3.883 0.047 18222
5060 1 12 . 1 1 33 33 LYS CA C 33 59.040 59.040 59.846 -0.806 18222
5061 1 12 . 1 1 33 33 LYS CB C 33 30.990 30.990 32.195 -1.205 18222
5062 1 12 . 1 1 33 33 LYS H H 33 7.970 7.970 8.507 -0.537 18222
5063 1 12 . 1 1 34 34 GLY N N 34 108.840 108.840 107.238 1.602 18222
5064 1 12 . 1 1 34 34 GLY CA C 34 46.610 46.610 47.350 -0.740 18222
5065 1 12 . 1 1 34 34 GLY H H 34 8.030 8.030 8.195 -0.165 18222
5066 1 12 . 1 1 35 35 VAL N N 35 122.910 122.910 122.148 0.762 18222
5067 1 12 . 1 1 35 35 VAL HA H 35 4.220 4.220 3.598 0.622 18222
5068 1 12 . 1 1 35 35 VAL CA C 35 66.310 66.310 65.298 1.012 18222
5069 1 12 . 1 1 35 35 VAL CB C 35 30.560 30.560 31.204 -0.644 18222
5070 1 12 . 1 1 35 35 VAL H H 35 8.090 8.090 7.945 0.145 18222
5071 1 12 . 1 1 36 36 PHE N N 36 120.020 120.020 121.249 -1.229 18222
5072 1 12 . 1 1 36 36 PHE CA C 36 61.350 61.350 62.072 -0.722 18222
5073 1 12 . 1 1 36 36 PHE CB C 36 38.090 38.090 39.109 -1.019 18222
5074 1 12 . 1 1 36 36 PHE H H 36 8.350 8.350 8.632 -0.282 18222
5075 1 12 . 1 1 37 37 THR N N 37 116.980 116.980 114.400 2.580 18222
5076 1 12 . 1 1 37 37 THR HA H 37 4.050 4.050 3.985 0.065 18222
5077 1 12 . 1 1 37 37 THR CA C 37 66.000 66.000 65.964 0.036 18222
5078 1 12 . 1 1 37 37 THR CB C 37 68.270 68.270 68.923 -0.653 18222
5079 1 12 . 1 1 37 37 THR H H 37 8.520 8.520 8.227 0.293 18222
5080 1 12 . 1 1 38 38 PHE N N 38 123.090 123.090 118.308 4.782 18222
5081 1 12 . 1 1 38 38 PHE HA H 38 4.360 4.360 4.312 0.048 18222
5082 1 12 . 1 1 38 38 PHE CA C 38 61.140 61.140 61.349 -0.209 18222
5083 1 12 . 1 1 38 38 PHE CB C 38 41.200 41.200 39.397 1.803 18222
5084 1 12 . 1 1 38 38 PHE H H 38 8.010 8.010 8.060 -0.050 18222
5085 1 12 . 1 1 39 39 VAL N N 39 117.280 117.280 119.323 -2.043 18222
5086 1 12 . 1 1 39 39 VAL HA H 39 4.210 4.210 3.700 0.510 18222
5087 1 12 . 1 1 39 39 VAL CA C 39 66.000 66.000 65.375 0.625 18222
5088 1 12 . 1 1 39 39 VAL CB C 39 30.860 30.860 31.679 -0.819 18222
5089 1 12 . 1 1 39 39 VAL H H 39 8.530 8.530 8.631 -0.101 18222
5090 1 12 . 1 1 40 40 THR N N 40 109.470 109.470 115.348 -5.878 18222
5091 1 12 . 1 1 40 40 THR HA H 40 4.060 4.060 4.136 -0.076 18222
5092 1 12 . 1 1 40 40 THR CA C 40 63.390 63.390 63.965 -0.575 18222
5093 1 12 . 1 1 40 40 THR CB C 40 68.650 68.650 68.063 0.587 18222
5094 1 12 . 1 1 40 40 THR H H 40 7.700 7.700 7.749 -0.049 18222
5095 1 12 . 1 1 41 41 GLY N N 41 110.770 110.770 109.191 1.579 18222
5096 1 12 . 1 1 41 41 GLY CA C 41 45.580 45.580 45.108 0.471 18222
5097 1 12 . 1 1 41 41 GLY H H 41 7.700 7.700 7.566 0.134 18222
5098 1 12 . 1 1 42 42 THR N N 42 114.520 114.520 116.418 -1.898 18222
5099 1 12 . 1 1 42 42 THR CA C 42 63.300 63.300 61.287 2.013 18222
5100 1 12 . 1 1 42 42 THR CB C 42 69.490 69.490 69.216 0.274 18222
5101 1 12 . 1 1 42 42 THR H H 42 7.720 7.720 7.322 0.398 18222
5102 1 12 . 1 1 43 43 GLY N N 43 109.540 109.540 110.380 -0.840 18222
5103 1 12 . 1 1 43 43 GLY CA C 43 46.250 46.250 46.581 -0.331 18222
5104 1 12 . 1 1 43 43 GLY H H 43 8.110 8.110 8.003 0.107 18222
5105 1 12 . 1 1 44 44 MET N N 44 120.240 120.240 121.149 -0.909 18222
5106 1 12 . 1 1 44 44 MET HA H 44 4.100 4.100 4.008 0.092 18222
5107 1 12 . 1 1 44 44 MET CA C 44 57.700 57.700 58.923 -1.223 18222
5108 1 12 . 1 1 44 44 MET CB C 44 32.030 32.030 32.471 -0.441 18222
5109 1 12 . 1 1 44 44 MET H H 44 7.730 7.730 8.020 -0.290 18222
5110 1 12 . 1 1 45 45 ALA N N 45 121.560 121.560 121.273 0.287 18222
5111 1 12 . 1 1 45 45 ALA CA C 45 54.440 54.440 55.004 -0.564 18222
5112 1 12 . 1 1 45 45 ALA CB C 45 17.400 17.400 17.770 -0.370 18222
5113 1 12 . 1 1 45 45 ALA H H 45 7.950 7.950 7.813 0.137 18222
5114 1 12 . 1 1 46 46 PHE N N 46 118.260 118.260 119.100 -0.840 18222
5115 1 12 . 1 1 46 46 PHE HA H 46 3.930 3.930 4.300 -0.370 18222
5116 1 12 . 1 1 46 46 PHE CA C 46 59.820 59.820 60.766 -0.946 18222
5117 1 12 . 1 1 46 46 PHE CB C 46 38.260 38.260 38.583 -0.323 18222
5118 1 12 . 1 1 46 46 PHE H H 46 7.860 7.860 8.163 -0.303 18222
5119 1 12 . 1 1 47 47 GLY N N 47 107.300 107.300 108.268 -0.968 18222
5120 1 12 . 1 1 47 47 GLY CA C 47 46.560 46.560 47.272 -0.712 18222
5121 1 12 . 1 1 47 47 GLY H H 47 8.200 8.200 8.713 -0.513 18222
5122 1 12 . 1 1 48 48 LEU N N 48 121.920 121.920 122.655 -0.735 18222
5123 1 12 . 1 1 48 48 LEU HA H 48 4.040 4.040 4.003 0.037 18222
5124 1 12 . 1 1 48 48 LEU CA C 48 57.580 57.580 58.122 -0.542 18222
5125 1 12 . 1 1 48 48 LEU CB C 48 40.790 40.790 41.952 -1.162 18222
5126 1 12 . 1 1 48 48 LEU H H 48 8.180 8.180 8.339 -0.159 18222
5127 1 12 . 1 1 49 49 GLN N N 49 118.270 118.270 118.742 -0.472 18222
5128 1 12 . 1 1 49 49 GLN HA H 49 3.830 3.830 3.892 -0.062 18222
5129 1 12 . 1 1 49 49 GLN CA C 49 58.880 58.880 59.254 -0.374 18222
5130 1 12 . 1 1 49 49 GLN CB C 49 27.240 27.240 28.677 -1.437 18222
5131 1 12 . 1 1 49 49 GLN H H 49 8.080 8.080 8.070 0.010 18222
5132 1 12 . 1 1 50 50 MET N N 50 117.630 117.630 119.091 -1.461 18222
5133 1 12 . 1 1 50 50 MET HA H 50 4.010 4.010 4.107 -0.097 18222
5134 1 12 . 1 1 50 50 MET CA C 50 57.730 57.730 59.792 -2.062 18222
5135 1 12 . 1 1 50 50 MET CB C 50 27.160 27.160 32.806 -5.646 18222
5136 1 12 . 1 1 50 50 MET H H 50 7.880 7.880 8.471 -0.591 18222
5137 1 12 . 1 1 51 51 PHE N N 51 119.550 119.550 119.151 0.399 18222
5138 1 12 . 1 1 51 51 PHE CA C 51 60.850 60.850 61.786 -0.936 18222
5139 1 12 . 1 1 51 51 PHE CB C 51 38.720 38.720 39.014 -0.294 18222
5140 1 12 . 1 1 51 51 PHE H H 51 7.890 7.890 8.209 -0.319 18222
5141 1 12 . 1 1 52 52 ILE N N 52 117.950 117.950 116.625 1.325 18222
5142 1 12 . 1 1 52 52 ILE HA H 52 4.050 4.050 3.910 0.140 18222
5143 1 12 . 1 1 52 52 ILE CA C 52 63.560 63.560 63.989 -0.429 18222
5144 1 12 . 1 1 52 52 ILE CB C 52 36.810 36.810 38.176 -1.366 18222
5145 1 12 . 1 1 52 52 ILE H H 52 8.110 8.110 8.076 0.034 18222
5146 1 12 . 1 1 53 53 GLN N N 53 117.360 117.360 119.329 -1.969 18222
5147 1 12 . 1 1 53 53 GLN CA C 53 57.200 57.200 58.542 -1.342 18222
5148 1 12 . 1 1 53 53 GLN CB C 53 27.870 27.870 28.429 -0.559 18222
5149 1 12 . 1 1 53 53 GLN H H 53 7.930 7.930 8.446 -0.516 18222
5150 1 12 . 1 1 54 54 ARG N N 54 116.840 116.840 118.445 -1.605 18222
5151 1 12 . 1 1 54 54 ARG HA H 54 3.950 3.950 4.169 -0.219 18222
5152 1 12 . 1 1 54 54 ARG CA C 54 56.480 56.480 57.457 -0.977 18222
5153 1 12 . 1 1 54 54 ARG CB C 54 28.970 28.970 30.075 -1.105 18222
5154 1 12 . 1 1 54 54 ARG H H 54 7.540 7.540 7.900 -0.360 18222
5155 1 12 . 1 1 55 55 LYS N N 55 117.900 117.900 116.859 1.041 18222
5156 1 12 . 1 1 55 55 LYS HA H 55 4.080 4.080 4.236 -0.156 18222
5157 1 12 . 1 1 55 55 LYS CA C 55 55.030 55.030 57.138 -2.108 18222
5158 1 12 . 1 1 55 55 LYS CB C 55 32.010 32.010 32.295 -0.285 18222
5159 1 12 . 1 1 55 55 LYS H H 55 7.660 7.660 7.435 0.225 18222
5160 1 12 . 1 1 56 56 PHE N N 56 121.060 121.060 122.806 -1.746 18222
5161 1 12 . 1 1 56 56 PHE CA C 56 55.190 55.190 55.357 -0.167 18222
5162 1 12 . 1 1 56 56 PHE CB C 56 38.970 38.970 39.905 -0.935 18222
5163 1 12 . 1 1 56 56 PHE H H 56 8.080 8.080 7.809 0.271 18222
5164 1 12 . 1 1 57 57 PRO CA C 57 62.390 62.390 63.603 -1.214 18222
5165 1 12 . 1 1 57 57 PRO CB C 57 30.580 30.580 31.791 -1.211 18222
5166 1 12 . 1 1 58 58 TYR N N 58 120.240 120.240 120.472 -0.232 18222
5167 1 12 . 1 1 58 58 TYR CA C 58 55.770 55.770 55.668 0.102 18222
5168 1 12 . 1 1 58 58 TYR CB C 58 40.220 40.220 39.612 0.608 18222
5169 1 12 . 1 1 58 58 TYR H H 58 7.700 7.700 7.998 -0.298 18222
5170 1 12 . 1 1 59 59 PRO CA C 59 62.130 62.130 63.699 -1.569 18222
5171 1 12 . 1 1 59 59 PRO CB C 59 33.340 33.340 32.230 1.110 18222
5172 1 12 . 1 1 60 60 LEU N N 60 122.210 122.210 120.228 1.982 18222
5173 1 12 . 1 1 60 60 LEU CA C 60 54.250 54.250 55.107 -0.857 18222
5174 1 12 . 1 1 60 60 LEU CB C 60 41.470 41.470 42.509 -1.039 18222
5175 1 12 . 1 1 60 60 LEU H H 60 7.880 7.880 7.946 -0.066 18222
5176 1 12 . 1 1 61 61 GLN N N 61 122.470 122.470 120.311 2.159 18222
5177 1 12 . 1 1 61 61 GLN CA C 61 54.170 54.170 55.341 -1.171 18222
5178 1 12 . 1 1 61 61 GLN H H 61 7.970 7.970 8.220 -0.250 18222
5179 1 12 . 1 1 62 62 TRP N N 62 124.590 124.590 124.952 -0.362 18222
5180 1 12 . 1 1 62 62 TRP CA C 62 59.830 59.830 60.417 -0.587 18222
5181 1 12 . 1 1 62 62 TRP CB C 62 28.800 28.800 29.322 -0.522 18222
5182 1 12 . 1 1 62 62 TRP H H 62 8.240 8.240 8.657 -0.417 18222
5183 1 12 . 1 1 63 63 SER N N 63 113.320 113.320 115.146 -1.826 18222
5184 1 12 . 1 1 63 63 SER CA C 63 61.100 61.100 61.489 -0.389 18222
5185 1 12 . 1 1 63 63 SER H H 63 8.410 8.410 7.932 0.478 18222
5186 1 12 . 1 1 64 64 LEU N N 64 123.230 123.230 121.968 1.262 18222
5187 1 12 . 1 1 64 64 LEU CA C 64 56.880 56.880 57.064 -0.184 18222
5188 1 12 . 1 1 64 64 LEU CB C 64 40.830 40.830 40.978 -0.148 18222
5189 1 12 . 1 1 64 64 LEU H H 64 7.230 7.230 8.126 -0.896 18222
5190 1 12 . 1 1 65 65 LEU N N 65 119.400 119.400 121.078 -1.678 18222
5191 1 12 . 1 1 65 65 LEU HA H 65 3.890 3.890 4.089 -0.199 18222
5192 1 12 . 1 1 65 65 LEU CA C 65 57.580 57.580 58.401 -0.821 18222
5193 1 12 . 1 1 65 65 LEU CB C 65 40.710 40.710 42.021 -1.311 18222
5194 1 12 . 1 1 65 65 LEU H H 65 7.510 7.510 8.295 -0.785 18222
5195 1 12 . 1 1 66 66 VAL N N 66 116.950 116.950 119.148 -2.198 18222
5196 1 12 . 1 1 66 66 VAL HA H 66 3.960 3.960 3.728 0.232 18222
5197 1 12 . 1 1 66 66 VAL CA C 66 66.260 66.260 65.532 0.728 18222
5198 1 12 . 1 1 66 66 VAL CB C 66 30.570 30.570 31.127 -0.557 18222
5199 1 12 . 1 1 66 66 VAL H H 66 7.950 7.950 8.424 -0.474 18222
5200 1 12 . 1 1 67 67 ALA N N 67 120.650 120.650 122.699 -2.049 18222
5201 1 12 . 1 1 67 67 ALA HA H 67 4.000 4.000 4.129 -0.129 18222
5202 1 12 . 1 1 67 67 ALA CA C 67 54.780 54.780 55.188 -0.408 18222
5203 1 12 . 1 1 67 67 ALA CB C 67 17.440 17.440 18.485 -1.044 18222
5204 1 12 . 1 1 67 67 ALA H H 67 7.450 7.450 7.901 -0.451 18222
5205 1 12 . 1 1 68 68 VAL N N 68 118.440 118.440 118.444 -0.004 18222
5206 1 12 . 1 1 68 68 VAL HA H 68 3.750 3.750 3.578 0.172 18222
5207 1 12 . 1 1 68 68 VAL CA C 68 65.250 65.250 66.803 -1.553 18222
5208 1 12 . 1 1 68 68 VAL CB C 68 30.850 30.850 32.097 -1.247 18222
5209 1 12 . 1 1 68 68 VAL H H 68 7.960 7.960 7.858 0.102 18222
5210 1 12 . 1 1 69 69 VAL N N 69 120.800 120.800 120.200 0.600 18222
5211 1 12 . 1 1 69 69 VAL HA H 69 4.220 4.220 3.681 0.539 18222
5212 1 12 . 1 1 69 69 VAL CA C 69 66.020 66.020 65.711 0.309 18222
5213 1 12 . 1 1 69 69 VAL CB C 69 30.850 30.850 30.469 0.381 18222
5214 1 12 . 1 1 69 69 VAL H H 69 8.080 8.080 8.463 -0.383 18222
5215 1 12 . 1 1 70 70 ALA N N 70 121.740 121.740 121.057 0.683 18222
5216 1 12 . 1 1 70 70 ALA HA H 70 3.920 3.920 4.207 -0.287 18222
5217 1 12 . 1 1 70 70 ALA CA C 70 54.920 54.920 55.437 -0.517 18222
5218 1 12 . 1 1 70 70 ALA CB C 70 17.620 17.620 18.225 -0.605 18222
5219 1 12 . 1 1 70 70 ALA H H 70 8.660 8.660 8.612 0.048 18222
5220 1 12 . 1 1 71 71 GLY N N 71 103.450 103.450 106.599 -3.149 18222
5221 1 12 . 1 1 71 71 GLY CA C 71 46.300 46.300 47.002 -0.702 18222
5222 1 12 . 1 1 71 71 GLY H H 71 8.010 8.010 8.160 -0.150 18222
5223 1 12 . 1 1 72 72 SER N N 72 118.160 118.160 118.534 -0.374 18222
5224 1 12 . 1 1 72 72 SER CA C 72 61.260 61.260 61.980 -0.720 18222
5225 1 12 . 1 1 72 72 SER CB C 72 62.870 62.870 63.141 -0.271 18222
5226 1 12 . 1 1 72 72 SER H H 72 7.870 7.870 8.039 -0.169 18222
5227 1 12 . 1 1 73 73 VAL N N 73 121.340 121.340 122.164 -0.824 18222
5228 1 12 . 1 1 73 73 VAL CA C 73 65.750 65.750 67.259 -1.509 18222
5229 1 12 . 1 1 73 73 VAL CB C 73 30.740 30.740 31.774 -1.034 18222
5230 1 12 . 1 1 73 73 VAL H H 73 8.050 8.050 8.093 -0.043 18222
5231 1 12 . 1 1 74 74 VAL N N 74 118.680 118.680 118.950 -0.270 18222
5232 1 12 . 1 1 74 74 VAL CA C 74 65.770 65.770 66.819 -1.049 18222
5233 1 12 . 1 1 74 74 VAL CB C 74 30.740 30.740 31.307 -0.567 18222
5234 1 12 . 1 1 74 74 VAL H H 74 7.880 7.880 8.515 -0.635 18222
5235 1 12 . 1 1 75 75 SER N N 75 114.750 114.750 116.699 -1.949 18222
5236 1 12 . 1 1 75 75 SER HA H 75 4.100 4.100 4.165 -0.065 18222
5237 1 12 . 1 1 75 75 SER CA C 75 60.870 60.870 62.101 -1.231 18222
5238 1 12 . 1 1 75 75 SER CB C 75 62.340 62.340 63.083 -0.743 18222
5239 1 12 . 1 1 75 75 SER H H 75 7.870 7.870 7.887 -0.017 18222
5240 1 12 . 1 1 76 76 TYR N N 76 121.110 121.110 121.670 -0.560 18222
5241 1 12 . 1 1 76 76 TYR CA C 76 60.050 60.050 61.916 -1.866 18222
5242 1 12 . 1 1 76 76 TYR CB C 76 37.980 37.980 38.417 -0.438 18222
5243 1 12 . 1 1 76 76 TYR H H 76 7.860 7.860 8.702 -0.842 18222
5244 1 12 . 1 1 77 77 GLY N N 77 107.300 107.300 106.502 0.798 18222
5245 1 12 . 1 1 77 77 GLY CA C 77 46.560 46.560 47.279 -0.719 18222
5246 1 12 . 1 1 77 77 GLY H H 77 8.200 8.200 8.459 -0.259 18222
5247 1 12 . 1 1 78 78 VAL N N 78 119.470 119.470 121.996 -2.526 18222
5248 1 12 . 1 1 78 78 VAL HA H 78 4.170 4.170 3.755 0.415 18222
5249 1 12 . 1 1 78 78 VAL CA C 78 64.650 64.650 66.066 -1.416 18222
5250 1 12 . 1 1 78 78 VAL H H 78 8.140 8.140 8.468 -0.328 18222
5251 1 12 . 1 1 79 79 THR N N 79 112.100 112.100 115.886 -3.786 18222
5252 1 12 . 1 1 79 79 THR CA C 79 63.460 63.460 66.801 -3.341 18222
5253 1 12 . 1 1 79 79 THR CB C 79 68.650 68.650 68.727 -0.077 18222
5254 1 12 . 1 1 79 79 THR H H 79 7.640 7.640 8.198 -0.558 18222
5255 1 12 . 1 1 80 80 ARG N N 80 120.770 120.770 121.130 -0.360 18222
5256 1 12 . 1 1 80 80 ARG HA H 80 4.160 4.160 4.102 0.058 18222
5257 1 12 . 1 1 80 80 ARG CA C 80 56.790 56.790 60.092 -3.302 18222
5258 1 12 . 1 1 80 80 ARG CB C 80 29.430 29.430 30.295 -0.865 18222
5259 1 12 . 1 1 80 80 ARG H H 80 7.680 7.680 8.024 -0.344 18222
5260 1 12 . 1 1 81 81 VAL N N 81 118.370 118.370 119.485 -1.115 18222
5261 1 12 . 1 1 81 81 VAL HA H 81 3.920 3.920 3.754 0.166 18222
5262 1 12 . 1 1 81 81 VAL CA C 81 63.340 63.340 66.775 -3.435 18222
5263 1 12 . 1 1 81 81 VAL CB C 81 31.260 31.260 31.883 -0.623 18222
5264 1 12 . 1 1 81 81 VAL H H 81 7.730 7.730 8.261 -0.531 18222
5265 1 12 . 1 1 82 82 GLU N N 82 120.620 120.620 119.427 1.193 18222
5266 1 12 . 1 1 82 82 GLU CA C 82 56.320 56.320 59.616 -3.296 18222
5267 1 12 . 1 1 82 82 GLU CB C 82 27.930 27.930 29.349 -1.419 18222
5268 1 12 . 1 1 82 82 GLU H H 82 7.920 7.920 8.554 -0.634 18222
5269 1 12 . 1 1 83 83 SER N N 83 116.240 116.240 116.249 -0.009 18222
5270 1 12 . 1 1 83 83 SER CA C 83 59.250 59.250 62.218 -2.968 18222
5271 1 12 . 1 1 83 83 SER CB C 83 63.160 63.160 62.949 0.211 18222
5272 1 12 . 1 1 83 83 SER H H 83 7.960 7.960 8.005 -0.045 18222
5273 1 12 . 1 1 84 84 GLU N N 84 123.280 123.280 121.345 1.935 18222
5274 1 12 . 1 1 84 84 GLU HA H 84 4.080 4.080 4.029 0.051 18222
5275 1 12 . 1 1 84 84 GLU CA C 84 57.860 57.860 59.893 -2.033 18222
5276 1 12 . 1 1 84 84 GLU CB C 84 28.190 28.190 29.627 -1.437 18222
5277 1 12 . 1 1 84 84 GLU H H 84 8.470 8.470 8.068 0.402 18222
5278 1 12 . 1 1 85 85 LYS N N 85 118.650 118.650 119.509 -0.859 18222
5279 1 12 . 1 1 85 85 LYS HA H 85 4.100 4.100 4.160 -0.060 18222
5280 1 12 . 1 1 85 85 LYS CA C 85 57.780 57.780 59.389 -1.609 18222
5281 1 12 . 1 1 85 85 LYS CB C 85 31.380 31.380 32.483 -1.103 18222
5282 1 12 . 1 1 85 85 LYS H H 85 7.940 7.940 8.194 -0.254 18222
5283 1 12 . 1 1 86 86 CYS N N 86 117.070 117.070 118.435 -1.365 18222
5284 1 12 . 1 1 86 86 CYS CA C 86 60.910 60.910 62.999 -2.090 18222
5285 1 12 . 1 1 86 86 CYS CB C 86 26.740 26.740 26.493 0.247 18222
5286 1 12 . 1 1 86 86 CYS H H 86 7.840 7.840 8.388 -0.548 18222
5287 1 12 . 1 1 87 87 ASN N N 87 119.370 119.370 119.671 -0.301 18222
5288 1 12 . 1 1 87 87 ASN HA H 87 4.130 4.130 4.775 -0.645 18222
5289 1 12 . 1 1 87 87 ASN CA C 87 55.750 55.750 56.988 -1.238 18222
5290 1 12 . 1 1 87 87 ASN CB C 87 38.050 38.050 38.123 -0.073 18222
5291 1 12 . 1 1 87 87 ASN H H 87 8.110 8.110 8.618 -0.508 18222
5292 1 12 . 1 1 88 88 ASN N N 88 117.570 117.570 119.696 -2.126 18222
5293 1 12 . 1 1 88 88 ASN HA H 88 4.280 4.280 4.359 -0.079 18222
5294 1 12 . 1 1 88 88 ASN CA C 88 55.190 55.190 56.545 -1.355 18222
5295 1 12 . 1 1 88 88 ASN CB C 88 37.400 37.400 38.645 -1.245 18222
5296 1 12 . 1 1 88 88 ASN H H 88 8.280 8.280 8.258 0.022 18222
5297 1 12 . 1 1 89 89 LEU N N 89 121.940 121.940 121.894 0.046 18222
5298 1 12 . 1 1 89 89 LEU HA H 89 4.070 4.070 4.370 -0.300 18222
5299 1 12 . 1 1 89 89 LEU CA C 89 57.580 57.580 59.409 -1.829 18222
5300 1 12 . 1 1 89 89 LEU CB C 89 40.490 40.490 42.129 -1.639 18222
5301 1 12 . 1 1 89 89 LEU H H 89 7.790 7.790 8.484 -0.694 18222
5302 1 12 . 1 1 90 90 TRP N N 90 119.220 119.220 121.211 -1.991 18222
5303 1 12 . 1 1 90 90 TRP CA C 90 59.120 59.120 61.080 -1.960 18222
5304 1 12 . 1 1 90 90 TRP CB C 90 28.800 28.800 28.691 0.109 18222
5305 1 12 . 1 1 90 90 TRP H H 90 7.850 7.850 8.695 -0.845 18222
5306 1 12 . 1 1 91 91 LEU N N 91 117.870 117.870 120.485 -2.615 18222
5307 1 12 . 1 1 91 91 LEU CA C 91 57.300 57.300 58.693 -1.393 18222
5308 1 12 . 1 1 91 91 LEU CB C 91 40.610 40.610 41.252 -0.641 18222
5309 1 12 . 1 1 91 91 LEU H H 91 7.920 7.920 7.937 -0.017 18222
5310 1 12 . 1 1 92 92 PHE N N 92 121.280 121.280 118.412 2.868 18222
5311 1 12 . 1 1 92 92 PHE CA C 92 60.390 60.390 62.085 -1.695 18222
5312 1 12 . 1 1 92 92 PHE CB C 92 37.980 37.980 38.315 -0.334 18222
5313 1 12 . 1 1 92 92 PHE H H 92 7.860 7.860 7.915 -0.055 18222
5314 1 12 . 1 1 93 93 LEU N N 93 119.860 119.860 120.040 -0.180 18222
5315 1 12 . 1 1 93 93 LEU CA C 93 56.860 56.860 58.638 -1.778 18222
5316 1 12 . 1 1 93 93 LEU CB C 93 40.550 40.550 41.885 -1.335 18222
5317 1 12 . 1 1 93 93 LEU H H 93 7.980 7.980 8.829 -0.849 18222
5318 1 12 . 1 1 94 94 GLU N N 94 114.660 114.660 117.875 -3.215 18222
5319 1 12 . 1 1 94 94 GLU HA H 94 3.810 3.810 4.101 -0.291 18222
5320 1 12 . 1 1 94 94 GLU CA C 94 57.210 57.210 59.219 -2.009 18222
5321 1 12 . 1 1 94 94 GLU CB C 94 28.470 28.470 29.596 -1.127 18222
5322 1 12 . 1 1 94 94 GLU H H 94 7.890 7.890 8.199 -0.309 18222
5323 1 12 . 1 1 95 95 THR N N 95 108.260 108.260 111.424 -3.164 18222
5324 1 12 . 1 1 95 95 THR CA C 95 62.150 62.150 62.655 -0.505 18222
5325 1 12 . 1 1 95 95 THR CB C 95 70.810 70.810 69.758 1.052 18222
5326 1 12 . 1 1 95 95 THR H H 95 7.690 7.690 7.512 0.178 18222
5327 1 12 . 1 1 96 96 GLY N N 96 112.220 112.220 110.025 2.195 18222
5328 1 12 . 1 1 96 96 GLY CA C 96 45.410 45.410 44.823 0.587 18222
5329 1 12 . 1 1 96 96 GLY H H 96 8.240 8.240 7.989 0.251 18222
5330 1 12 . 1 1 97 97 GLN N N 97 117.950 117.950 121.124 -3.174 18222
5331 1 12 . 1 1 97 97 GLN HA H 97 4.200 4.200 4.432 -0.232 18222
5332 1 12 . 1 1 97 97 GLN CA C 97 54.430 54.430 54.804 -0.374 18222
5333 1 12 . 1 1 97 97 GLN CB C 97 29.910 29.910 28.185 1.725 18222
5334 1 12 . 1 1 97 97 GLN H H 97 7.640 7.640 8.689 -1.049 18222
5335 1 12 . 1 1 98 98 LEU N N 98 123.810 123.810 120.916 2.894 18222
5336 1 12 . 1 1 98 98 LEU HA H 98 4.360 4.360 4.532 -0.172 18222
5337 1 12 . 1 1 98 98 LEU CA C 98 52.650 52.650 54.129 -1.479 18222
5338 1 12 . 1 1 98 98 LEU CB C 98 40.460 40.460 40.891 -0.431 18222
5339 1 12 . 1 1 98 98 LEU H H 98 8.270 8.270 7.569 0.701 18222
5340 1 12 . 1 1 99 99 PRO CA C 99 63.180 63.180 63.443 -0.263 18222
5341 1 12 . 1 1 99 99 PRO CB C 99 30.840 30.840 32.160 -1.321 18222
5342 1 12 . 1 1 100 100 LYS N N 100 120.630 120.630 117.909 2.721 18222
5343 1 12 . 1 1 100 100 LYS CA C 100 55.730 55.730 56.763 -1.033 18222
5344 1 12 . 1 1 100 100 LYS CB C 100 32.280 32.280 31.954 0.326 18222
5345 1 12 . 1 1 100 100 LYS H H 100 8.090 8.090 8.129 -0.039 18222
5346 1 12 . 1 1 101 101 ASP N N 101 120.920 120.920 121.475 -0.555 18222
5347 1 12 . 1 1 101 101 ASP HA H 101 4.190 4.190 4.747 -0.557 18222
5348 1 12 . 1 1 101 101 ASP CA C 101 54.000 54.000 53.362 0.638 18222
5349 1 12 . 1 1 101 101 ASP CB C 101 40.330 40.330 41.953 -1.623 18222
5350 1 12 . 1 1 101 101 ASP H H 101 8.190 8.190 8.101 0.089 18222
5351 1 12 . 1 1 102 102 ARG N N 102 122.210 122.210 122.695 -0.485 18222
5352 1 12 . 1 1 102 102 ARG CA C 102 55.590 55.590 56.438 -0.848 18222
5353 1 12 . 1 1 102 102 ARG CB C 102 29.630 29.630 29.798 -0.168 18222
5354 1 12 . 1 1 102 102 ARG H H 102 8.130 8.130 8.648 -0.518 18222
5355 1 12 . 1 1 103 103 SER N N 103 117.230 117.230 116.146 1.084 18222
5356 1 12 . 1 1 103 103 SER HA H 103 4.280 4.280 4.396 -0.116 18222
5357 1 12 . 1 1 103 103 SER CA C 103 58.470 58.470 59.772 -1.302 18222
5358 1 12 . 1 1 103 103 SER CB C 103 63.080 63.080 63.622 -0.542 18222
5359 1 12 . 1 1 103 103 SER H H 103 8.290 8.290 8.567 -0.277 18222
5360 1 12 . 1 1 104 104 THR N N 104 115.430 115.430 113.439 1.991 18222
5361 1 12 . 1 1 104 104 THR CA C 104 61.570 61.570 61.950 -0.381 18222
5362 1 12 . 1 1 104 104 THR CB C 104 69.030 69.030 69.514 -0.484 18222
5363 1 12 . 1 1 104 104 THR H H 104 8.020 8.020 7.706 0.314 18222
5364 1 12 . 1 1 105 105 ASP N N 105 122.780 122.780 121.860 0.920 18222
5365 1 12 . 1 1 105 105 ASP CA C 105 54.210 54.210 54.173 0.037 18222
5366 1 12 . 1 1 105 105 ASP CB C 105 40.380 40.380 42.514 -2.134 18222
5367 1 12 . 1 1 105 105 ASP H H 105 8.120 8.120 8.213 -0.093 18222
5368 1 12 . 1 1 106 106 GLN N N 106 120.960 120.960 119.960 1.000 18222
5369 1 12 . 1 1 106 106 GLN CA C 106 55.420 55.420 54.682 0.738 18222
5370 1 12 . 1 1 106 106 GLN CB C 106 28.310 28.310 32.143 -3.833 18222
5371 1 12 . 1 1 106 106 GLN H H 106 8.140 8.140 8.611 -0.471 18222
5372 1 12 . 1 1 107 107 ARG N N 107 123.010 123.010 120.788 2.222 18222
5373 1 12 . 1 1 107 107 ARG HA H 107 4.210 4.210 4.625 -0.415 18222
5374 1 12 . 1 1 107 107 ARG CA C 107 55.560 55.560 55.752 -0.192 18222
5375 1 12 . 1 1 107 107 ARG CB C 107 29.920 29.920 31.513 -1.593 18222
5376 1 12 . 1 1 107 107 ARG H H 107 8.180 8.180 8.621 -0.441 18222
5377 1 13 . 1 1 2 2 VAL N N 2 121.590 121.590 122.005 -0.415 18222
5378 1 13 . 1 1 2 2 VAL CA C 2 61.600 61.600 62.477 -0.877 18222
5379 1 13 . 1 1 2 2 VAL CB C 2 31.900 31.900 32.703 -0.802 18222
5380 1 13 . 1 1 2 2 VAL H H 2 8.010 8.010 8.246 -0.236 18222
5381 1 13 . 1 1 3 3 ASN N N 3 122.520 122.520 123.030 -0.510 18222
5382 1 13 . 1 1 3 3 ASN HA H 3 4.020 4.020 4.671 -0.651 18222
5383 1 13 . 1 1 3 3 ASN CA C 3 52.640 52.640 53.514 -0.874 18222
5384 1 13 . 1 1 3 3 ASN CB C 3 38.330 38.330 38.716 -0.386 18222
5385 1 13 . 1 1 3 3 ASN H H 3 8.360 8.360 8.680 -0.320 18222
5386 1 13 . 1 1 4 4 LEU N N 4 123.830 123.830 121.655 2.175 18222
5387 1 13 . 1 1 4 4 LEU HA H 4 4.220 4.220 4.257 -0.037 18222
5388 1 13 . 1 1 4 4 LEU CA C 4 54.620 54.620 56.336 -1.716 18222
5389 1 13 . 1 1 4 4 LEU CB C 4 41.680 41.680 42.479 -0.799 18222
5390 1 13 . 1 1 4 4 LEU H H 4 8.220 8.220 8.181 0.039 18222
5391 1 13 . 1 1 5 5 GLY N N 5 106.810 106.810 105.735 1.075 18222
5392 1 13 . 1 1 5 5 GLY CA C 5 45.800 45.800 44.376 1.424 18222
5393 1 13 . 1 1 5 5 GLY H H 5 8.030 8.030 7.974 0.056 18222
5394 1 13 . 1 1 6 6 LEU N N 6 120.820 120.820 121.423 -0.603 18222
5395 1 13 . 1 1 6 6 LEU HA H 6 4.050 4.050 4.535 -0.485 18222
5396 1 13 . 1 1 6 6 LEU CA C 6 55.990 55.990 56.532 -0.541 18222
5397 1 13 . 1 1 6 6 LEU CB C 6 40.800 40.800 42.519 -1.719 18222
5398 1 13 . 1 1 6 6 LEU H H 6 8.030 8.030 8.185 -0.155 18222
5399 1 13 . 1 1 7 7 SER N N 7 115.540 115.540 115.529 0.011 18222
5400 1 13 . 1 1 7 7 SER HA H 7 4.100 4.100 4.208 -0.108 18222
5401 1 13 . 1 1 7 7 SER CA C 7 60.580 60.580 61.478 -0.898 18222
5402 1 13 . 1 1 7 7 SER CB C 7 62.060 62.060 62.844 -0.784 18222
5403 1 13 . 1 1 7 7 SER H H 7 8.360 8.360 8.261 0.099 18222
5404 1 13 . 1 1 8 8 ARG N N 8 120.690 120.690 120.853 -0.163 18222
5405 1 13 . 1 1 8 8 ARG HA H 8 4.160 4.160 4.104 0.056 18222
5406 1 13 . 1 1 8 8 ARG CA C 8 57.350 57.350 59.292 -1.942 18222
5407 1 13 . 1 1 8 8 ARG CB C 8 29.230 29.230 30.178 -0.948 18222
5408 1 13 . 1 1 8 8 ARG H H 8 7.830 7.830 8.427 -0.597 18222
5409 1 13 . 1 1 9 9 VAL N N 9 119.330 119.330 120.180 -0.850 18222
5410 1 13 . 1 1 9 9 VAL HA H 9 4.170 4.170 3.574 0.596 18222
5411 1 13 . 1 1 9 9 VAL CA C 9 64.720 64.720 66.718 -1.998 18222
5412 1 13 . 1 1 9 9 VAL CB C 9 30.900 30.900 31.573 -0.673 18222
5413 1 13 . 1 1 9 9 VAL H H 9 7.620 7.620 7.509 0.111 18222
5414 1 13 . 1 1 10 10 ASP N N 10 119.520 119.520 119.931 -0.411 18222
5415 1 13 . 1 1 10 10 ASP CA C 10 54.960 54.960 57.798 -2.838 18222
5416 1 13 . 1 1 10 10 ASP CB C 10 37.800 37.800 40.618 -2.818 18222
5417 1 13 . 1 1 10 10 ASP H H 10 8.180 8.180 8.369 -0.189 18222
5418 1 13 . 1 1 11 11 ASP N N 11 121.550 121.550 120.827 0.723 18222
5419 1 13 . 1 1 11 11 ASP CA C 11 54.440 54.440 57.663 -3.224 18222
5420 1 13 . 1 1 11 11 ASP CB C 11 37.840 37.840 40.813 -2.973 18222
5421 1 13 . 1 1 11 11 ASP H H 11 7.950 7.950 8.027 -0.077 18222
5422 1 13 . 1 1 12 12 ALA N N 12 120.220 120.220 122.904 -2.684 18222
5423 1 13 . 1 1 12 12 ALA CA C 12 54.370 54.370 55.197 -0.827 18222
5424 1 13 . 1 1 12 12 ALA CB C 12 24.730 24.730 18.574 6.156 18222
5425 1 13 . 1 1 12 12 ALA H H 12 8.090 8.090 8.054 0.036 18222
5426 1 13 . 1 1 13 13 VAL N N 13 116.910 116.910 118.572 -1.662 18222
5427 1 13 . 1 1 13 13 VAL HA H 13 4.140 4.140 3.720 0.420 18222
5428 1 13 . 1 1 13 13 VAL CA C 13 64.900 64.900 64.952 -0.052 18222
5429 1 13 . 1 1 13 13 VAL CB C 13 31.000 31.000 31.620 -0.621 18222
5430 1 13 . 1 1 13 13 VAL H H 13 7.980 7.980 8.111 -0.131 18222
5431 1 13 . 1 1 14 14 ALA N N 14 122.200 122.200 122.802 -0.602 18222
5432 1 13 . 1 1 14 14 ALA HA H 14 4.020 4.020 4.044 -0.024 18222
5433 1 13 . 1 1 14 14 ALA CA C 14 53.800 53.800 55.168 -1.368 18222
5434 1 13 . 1 1 14 14 ALA CB C 14 17.790 17.790 18.183 -0.393 18222
5435 1 13 . 1 1 14 14 ALA H H 14 8.030 8.030 7.775 0.255 18222
5436 1 13 . 1 1 15 15 ALA N N 15 118.600 118.600 119.081 -0.481 18222
5437 1 13 . 1 1 15 15 ALA CA C 15 53.230 53.230 54.107 -0.877 18222
5438 1 13 . 1 1 15 15 ALA CB C 15 18.010 18.010 18.626 -0.616 18222
5439 1 13 . 1 1 15 15 ALA H H 15 7.530 7.530 7.924 -0.394 18222
5440 1 13 . 1 1 16 16 LYS N N 16 115.820 115.820 118.354 -2.534 18222
5441 1 13 . 1 1 16 16 LYS HA H 16 4.080 4.080 4.191 -0.111 18222
5442 1 13 . 1 1 16 16 LYS CA C 16 55.670 55.670 56.969 -1.299 18222
5443 1 13 . 1 1 16 16 LYS CB C 16 32.640 32.640 33.324 -0.684 18222
5444 1 13 . 1 1 16 16 LYS H H 16 7.490 7.490 7.759 -0.269 18222
5445 1 13 . 1 1 17 17 HIS N N 17 116.790 116.790 120.579 -3.789 18222
5446 1 13 . 1 1 17 17 HIS HA H 17 4.100 4.100 4.795 -0.695 18222
5447 1 13 . 1 1 17 17 HIS CA C 17 52.820 52.820 53.598 -0.778 18222
5448 1 13 . 1 1 17 17 HIS CB C 17 28.400 28.400 30.594 -2.194 18222
5449 1 13 . 1 1 17 17 HIS H H 17 8.130 8.130 8.196 -0.066 18222
5450 1 13 . 1 1 18 18 PRO CA C 18 63.800 63.800 62.941 0.859 18222
5451 1 13 . 1 1 18 18 PRO CB C 18 30.800 30.800 31.153 -0.353 18222
5452 1 13 . 1 1 19 19 GLY N N 19 110.260 110.260 109.945 0.315 18222
5453 1 13 . 1 1 19 19 GLY CA C 19 45.490 45.490 46.084 -0.594 18222
5454 1 13 . 1 1 19 19 GLY H H 19 8.730 8.730 8.020 0.710 18222
5455 1 13 . 1 1 20 20 LEU N N 20 122.650 122.650 124.223 -1.573 18222
5456 1 13 . 1 1 20 20 LEU HA H 20 4.090 4.090 4.335 -0.245 18222
5457 1 13 . 1 1 20 20 LEU CA C 20 57.060 57.060 57.272 -0.212 18222
5458 1 13 . 1 1 20 20 LEU H H 20 7.980 7.980 8.231 -0.251 18222
5459 1 13 . 1 1 21 21 GLY N N 21 107.000 107.000 106.368 0.632 18222
5460 1 13 . 1 1 21 21 GLY CA C 21 46.710 46.710 47.170 -0.460 18222
5461 1 13 . 1 1 21 21 GLY H H 21 8.570 8.570 8.720 -0.150 18222
5462 1 13 . 1 1 22 22 GLU N N 22 121.610 121.610 121.156 0.454 18222
5463 1 13 . 1 1 22 22 GLU HA H 22 3.990 3.990 3.878 0.112 18222
5464 1 13 . 1 1 22 22 GLU CA C 22 58.280 58.280 59.257 -0.977 18222
5465 1 13 . 1 1 22 22 GLU CB C 22 28.010 28.010 29.470 -1.460 18222
5466 1 13 . 1 1 22 22 GLU H H 22 8.100 8.100 8.511 -0.411 18222
5467 1 13 . 1 1 23 23 TYR N N 23 120.870 120.870 120.117 0.753 18222
5468 1 13 . 1 1 23 23 TYR CA C 23 60.380 60.380 61.098 -0.718 18222
5469 1 13 . 1 1 23 23 TYR CB C 23 37.750 37.750 38.425 -0.674 18222
5470 1 13 . 1 1 23 23 TYR H H 23 7.910 7.910 7.441 0.469 18222
5471 1 13 . 1 1 24 24 ALA N N 24 121.420 121.420 121.352 0.068 18222
5472 1 13 . 1 1 24 24 ALA HA H 24 4.140 4.140 4.036 0.104 18222
5473 1 13 . 1 1 24 24 ALA CA C 24 54.260 54.260 55.254 -0.994 18222
5474 1 13 . 1 1 24 24 ALA H H 24 8.410 8.410 8.695 -0.285 18222
5475 1 13 . 1 1 25 25 ALA N N 25 120.220 120.220 120.844 -0.624 18222
5476 1 13 . 1 1 25 25 ALA CA C 25 54.370 54.370 54.842 -0.472 18222
5477 1 13 . 1 1 25 25 ALA H H 25 8.090 8.090 8.247 -0.157 18222
5478 1 13 . 1 1 26 26 CYS N N 26 116.760 116.760 117.207 -0.447 18222
5479 1 13 . 1 1 26 26 CYS CA C 26 61.180 61.180 62.461 -1.281 18222
5480 1 13 . 1 1 26 26 CYS CB C 26 26.390 26.390 27.406 -1.016 18222
5481 1 13 . 1 1 26 26 CYS H H 26 7.950 7.950 8.004 -0.054 18222
5482 1 13 . 1 1 27 27 GLN N N 27 118.690 118.690 120.410 -1.720 18222
5483 1 13 . 1 1 27 27 GLN CA C 27 55.970 55.970 59.121 -3.151 18222
5484 1 13 . 1 1 27 27 GLN H H 27 8.060 8.060 8.264 -0.204 18222
5485 1 13 . 1 1 28 28 SER N N 28 115.490 115.490 115.351 0.139 18222
5486 1 13 . 1 1 28 28 SER HA H 28 3.990 3.990 4.270 -0.280 18222
5487 1 13 . 1 1 28 28 SER CA C 28 61.110 61.110 61.778 -0.668 18222
5488 1 13 . 1 1 28 28 SER H H 28 7.980 7.980 8.519 -0.539 18222
5489 1 13 . 1 1 29 29 HIS N N 29 120.880 120.880 120.811 0.069 18222
5490 1 13 . 1 1 29 29 HIS CA C 29 58.190 58.190 60.109 -1.919 18222
5491 1 13 . 1 1 29 29 HIS CB C 29 27.460 27.460 30.323 -2.863 18222
5492 1 13 . 1 1 29 29 HIS H H 29 8.180 8.180 8.550 -0.370 18222
5493 1 13 . 1 1 30 30 ALA N N 30 122.920 122.920 122.578 0.342 18222
5494 1 13 . 1 1 30 30 ALA CA C 30 54.560 54.560 55.346 -0.786 18222
5495 1 13 . 1 1 30 30 ALA CB C 30 17.490 17.490 18.224 -0.734 18222
5496 1 13 . 1 1 30 30 ALA H H 30 8.040 8.040 8.163 -0.123 18222
5497 1 13 . 1 1 31 31 PHE N N 31 119.340 119.340 119.520 -0.180 18222
5498 1 13 . 1 1 31 31 PHE CA C 31 60.370 60.370 62.384 -2.014 18222
5499 1 13 . 1 1 31 31 PHE CB C 31 38.520 38.520 39.408 -0.888 18222
5500 1 13 . 1 1 31 31 PHE H H 31 8.230 8.230 8.379 -0.149 18222
5501 1 13 . 1 1 32 32 MET N N 32 118.110 118.110 118.431 -0.321 18222
5502 1 13 . 1 1 32 32 MET HA H 32 4.050 4.050 4.141 -0.091 18222
5503 1 13 . 1 1 32 32 MET CA C 32 58.280 58.280 58.723 -0.443 18222
5504 1 13 . 1 1 32 32 MET CB C 32 31.090 31.090 32.175 -1.085 18222
5505 1 13 . 1 1 32 32 MET H H 32 8.120 8.120 8.544 -0.424 18222
5506 1 13 . 1 1 33 33 LYS N N 33 119.040 119.040 120.003 -0.963 18222
5507 1 13 . 1 1 33 33 LYS HA H 33 3.930 3.930 4.082 -0.152 18222
5508 1 13 . 1 1 33 33 LYS CA C 33 59.040 59.040 59.790 -0.750 18222
5509 1 13 . 1 1 33 33 LYS CB C 33 30.990 30.990 32.429 -1.439 18222
5510 1 13 . 1 1 33 33 LYS H H 33 7.970 7.970 8.452 -0.482 18222
5511 1 13 . 1 1 34 34 GLY N N 34 108.840 108.840 107.380 1.460 18222
5512 1 13 . 1 1 34 34 GLY CA C 34 46.610 46.610 47.123 -0.513 18222
5513 1 13 . 1 1 34 34 GLY H H 34 8.030 8.030 8.151 -0.121 18222
5514 1 13 . 1 1 35 35 VAL N N 35 122.910 122.910 122.239 0.671 18222
5515 1 13 . 1 1 35 35 VAL HA H 35 4.220 4.220 3.582 0.638 18222
5516 1 13 . 1 1 35 35 VAL CA C 35 66.310 66.310 66.596 -0.286 18222
5517 1 13 . 1 1 35 35 VAL CB C 35 30.560 30.560 31.867 -1.307 18222
5518 1 13 . 1 1 35 35 VAL H H 35 8.090 8.090 8.355 -0.265 18222
5519 1 13 . 1 1 36 36 PHE N N 36 120.020 120.020 121.319 -1.299 18222
5520 1 13 . 1 1 36 36 PHE CA C 36 61.350 61.350 61.908 -0.558 18222
5521 1 13 . 1 1 36 36 PHE CB C 36 38.090 38.090 39.016 -0.926 18222
5522 1 13 . 1 1 36 36 PHE H H 36 8.350 8.350 8.111 0.239 18222
5523 1 13 . 1 1 37 37 THR N N 37 116.980 116.980 115.584 1.396 18222
5524 1 13 . 1 1 37 37 THR HA H 37 4.050 4.050 3.952 0.098 18222
5525 1 13 . 1 1 37 37 THR CA C 37 66.000 66.000 66.052 -0.052 18222
5526 1 13 . 1 1 37 37 THR CB C 37 68.270 68.270 68.951 -0.682 18222
5527 1 13 . 1 1 37 37 THR H H 37 8.520 8.520 8.562 -0.042 18222
5528 1 13 . 1 1 38 38 PHE N N 38 123.090 123.090 119.978 3.112 18222
5529 1 13 . 1 1 38 38 PHE HA H 38 4.360 4.360 4.279 0.081 18222
5530 1 13 . 1 1 38 38 PHE CA C 38 61.140 61.140 60.749 0.391 18222
5531 1 13 . 1 1 38 38 PHE CB C 38 41.200 41.200 38.739 2.461 18222
5532 1 13 . 1 1 38 38 PHE H H 38 8.010 8.010 8.251 -0.241 18222
5533 1 13 . 1 1 39 39 VAL N N 39 117.280 117.280 119.420 -2.140 18222
5534 1 13 . 1 1 39 39 VAL HA H 39 4.210 4.210 3.774 0.436 18222
5535 1 13 . 1 1 39 39 VAL CA C 39 66.000 66.000 65.628 0.372 18222
5536 1 13 . 1 1 39 39 VAL CB C 39 30.860 30.860 30.669 0.191 18222
5537 1 13 . 1 1 39 39 VAL H H 39 8.530 8.530 8.555 -0.025 18222
5538 1 13 . 1 1 40 40 THR N N 40 109.470 109.470 115.144 -5.674 18222
5539 1 13 . 1 1 40 40 THR HA H 40 4.060 4.060 3.956 0.104 18222
5540 1 13 . 1 1 40 40 THR CA C 40 63.390 63.390 66.253 -2.863 18222
5541 1 13 . 1 1 40 40 THR CB C 40 68.650 68.650 68.177 0.473 18222
5542 1 13 . 1 1 40 40 THR H H 40 7.700 7.700 7.851 -0.151 18222
5543 1 13 . 1 1 41 41 GLY N N 41 110.770 110.770 106.446 4.324 18222
5544 1 13 . 1 1 41 41 GLY CA C 41 45.580 45.580 44.998 0.583 18222
5545 1 13 . 1 1 41 41 GLY H H 41 7.700 7.700 7.315 0.385 18222
5546 1 13 . 1 1 42 42 THR N N 42 114.520 114.520 118.218 -3.698 18222
5547 1 13 . 1 1 42 42 THR CA C 42 63.300 63.300 60.512 2.788 18222
5548 1 13 . 1 1 42 42 THR CB C 42 69.490 69.490 66.968 2.522 18222
5549 1 13 . 1 1 42 42 THR H H 42 7.720 7.720 8.121 -0.401 18222
5550 1 13 . 1 1 43 43 GLY N N 43 109.540 109.540 109.735 -0.195 18222
5551 1 13 . 1 1 43 43 GLY CA C 43 46.250 46.250 46.577 -0.327 18222
5552 1 13 . 1 1 43 43 GLY H H 43 8.110 8.110 7.821 0.289 18222
5553 1 13 . 1 1 44 44 MET N N 44 120.240 120.240 120.944 -0.704 18222
5554 1 13 . 1 1 44 44 MET HA H 44 4.100 4.100 4.001 0.099 18222
5555 1 13 . 1 1 44 44 MET CA C 44 57.700 57.700 59.017 -1.317 18222
5556 1 13 . 1 1 44 44 MET CB C 44 32.030 32.030 32.410 -0.380 18222
5557 1 13 . 1 1 44 44 MET H H 44 7.730 7.730 8.298 -0.568 18222
5558 1 13 . 1 1 45 45 ALA N N 45 121.560 121.560 121.555 0.005 18222
5559 1 13 . 1 1 45 45 ALA CA C 45 54.440 54.440 55.004 -0.564 18222
5560 1 13 . 1 1 45 45 ALA CB C 45 17.400 17.400 17.752 -0.352 18222
5561 1 13 . 1 1 45 45 ALA H H 45 7.950 7.950 7.656 0.294 18222
5562 1 13 . 1 1 46 46 PHE N N 46 118.260 118.260 119.102 -0.842 18222
5563 1 13 . 1 1 46 46 PHE HA H 46 3.930 3.930 4.161 -0.231 18222
5564 1 13 . 1 1 46 46 PHE CA C 46 59.820 59.820 61.177 -1.357 18222
5565 1 13 . 1 1 46 46 PHE CB C 46 38.260 38.260 38.480 -0.220 18222
5566 1 13 . 1 1 46 46 PHE H H 46 7.860 7.860 8.188 -0.328 18222
5567 1 13 . 1 1 47 47 GLY N N 47 107.300 107.300 108.320 -1.020 18222
5568 1 13 . 1 1 47 47 GLY CA C 47 46.560 46.560 47.185 -0.625 18222
5569 1 13 . 1 1 47 47 GLY H H 47 8.200 8.200 8.400 -0.200 18222
5570 1 13 . 1 1 48 48 LEU N N 48 121.920 121.920 122.877 -0.957 18222
5571 1 13 . 1 1 48 48 LEU HA H 48 4.040 4.040 4.048 -0.008 18222
5572 1 13 . 1 1 48 48 LEU CA C 48 57.580 57.580 58.060 -0.480 18222
5573 1 13 . 1 1 48 48 LEU CB C 48 40.790 40.790 41.965 -1.175 18222
5574 1 13 . 1 1 48 48 LEU H H 48 8.180 8.180 8.291 -0.111 18222
5575 1 13 . 1 1 49 49 GLN N N 49 118.270 118.270 117.686 0.584 18222
5576 1 13 . 1 1 49 49 GLN HA H 49 3.830 3.830 4.034 -0.204 18222
5577 1 13 . 1 1 49 49 GLN CA C 49 58.880 58.880 59.161 -0.281 18222
5578 1 13 . 1 1 49 49 GLN CB C 49 27.240 27.240 28.308 -1.068 18222
5579 1 13 . 1 1 49 49 GLN H H 49 8.080 8.080 8.389 -0.309 18222
5580 1 13 . 1 1 50 50 MET N N 50 117.630 117.630 120.267 -2.637 18222
5581 1 13 . 1 1 50 50 MET HA H 50 4.010 4.010 4.300 -0.290 18222
5582 1 13 . 1 1 50 50 MET CA C 50 57.730 57.730 58.685 -0.955 18222
5583 1 13 . 1 1 50 50 MET CB C 50 27.160 27.160 32.564 -5.404 18222
5584 1 13 . 1 1 50 50 MET H H 50 7.880 7.880 8.289 -0.409 18222
5585 1 13 . 1 1 51 51 PHE N N 51 119.550 119.550 119.927 -0.377 18222
5586 1 13 . 1 1 51 51 PHE CA C 51 60.850 60.850 61.537 -0.687 18222
5587 1 13 . 1 1 51 51 PHE CB C 51 38.720 38.720 39.499 -0.779 18222
5588 1 13 . 1 1 51 51 PHE H H 51 7.890 7.890 8.147 -0.257 18222
5589 1 13 . 1 1 52 52 ILE N N 52 117.950 117.950 117.407 0.543 18222
5590 1 13 . 1 1 52 52 ILE HA H 52 4.050 4.050 3.924 0.126 18222
5591 1 13 . 1 1 52 52 ILE CA C 52 63.560 63.560 64.569 -1.009 18222
5592 1 13 . 1 1 52 52 ILE CB C 52 36.810 36.810 37.920 -1.110 18222
5593 1 13 . 1 1 52 52 ILE H H 52 8.110 8.110 8.493 -0.383 18222
5594 1 13 . 1 1 53 53 GLN N N 53 117.360 117.360 119.996 -2.636 18222
5595 1 13 . 1 1 53 53 GLN CA C 53 57.200 57.200 58.397 -1.197 18222
5596 1 13 . 1 1 53 53 GLN CB C 53 27.870 27.870 28.114 -0.244 18222
5597 1 13 . 1 1 53 53 GLN H H 53 7.930 7.930 8.645 -0.715 18222
5598 1 13 . 1 1 54 54 ARG N N 54 116.840 116.840 119.174 -2.334 18222
5599 1 13 . 1 1 54 54 ARG HA H 54 3.950 3.950 4.138 -0.188 18222
5600 1 13 . 1 1 54 54 ARG CA C 54 56.480 56.480 58.216 -1.736 18222
5601 1 13 . 1 1 54 54 ARG CB C 54 28.970 28.970 29.764 -0.794 18222
5602 1 13 . 1 1 54 54 ARG H H 54 7.540 7.540 7.934 -0.394 18222
5603 1 13 . 1 1 55 55 LYS N N 55 117.900 117.900 117.451 0.449 18222
5604 1 13 . 1 1 55 55 LYS HA H 55 4.080 4.080 4.186 -0.106 18222
5605 1 13 . 1 1 55 55 LYS CA C 55 55.030 55.030 57.118 -2.088 18222
5606 1 13 . 1 1 55 55 LYS CB C 55 32.010 32.010 33.240 -1.230 18222
5607 1 13 . 1 1 55 55 LYS H H 55 7.660 7.660 7.392 0.268 18222
5608 1 13 . 1 1 56 56 PHE N N 56 121.060 121.060 120.394 0.666 18222
5609 1 13 . 1 1 56 56 PHE CA C 56 55.190 55.190 55.355 -0.165 18222
5610 1 13 . 1 1 56 56 PHE CB C 56 38.970 38.970 39.816 -0.846 18222
5611 1 13 . 1 1 56 56 PHE H H 56 8.080 8.080 8.169 -0.089 18222
5612 1 13 . 1 1 57 57 PRO CA C 57 62.390 62.390 63.700 -1.310 18222
5613 1 13 . 1 1 57 57 PRO CB C 57 30.580 30.580 31.948 -1.368 18222
5614 1 13 . 1 1 58 58 TYR N N 58 120.240 120.240 120.117 0.123 18222
5615 1 13 . 1 1 58 58 TYR CA C 58 55.770 55.770 54.979 0.791 18222
5616 1 13 . 1 1 58 58 TYR CB C 58 40.220 40.220 39.128 1.092 18222
5617 1 13 . 1 1 58 58 TYR H H 58 7.700 7.700 7.944 -0.244 18222
5618 1 13 . 1 1 59 59 PRO CA C 59 62.130 62.130 63.751 -1.621 18222
5619 1 13 . 1 1 59 59 PRO CB C 59 33.340 33.340 32.263 1.077 18222
5620 1 13 . 1 1 60 60 LEU N N 60 122.210 122.210 119.238 2.972 18222
5621 1 13 . 1 1 60 60 LEU CA C 60 54.250 54.250 53.534 0.716 18222
5622 1 13 . 1 1 60 60 LEU CB C 60 41.470 41.470 44.196 -2.726 18222
5623 1 13 . 1 1 60 60 LEU H H 60 7.880 7.880 7.589 0.291 18222
5624 1 13 . 1 1 61 61 GLN N N 61 122.470 122.470 121.359 1.111 18222
5625 1 13 . 1 1 61 61 GLN CA C 61 54.170 54.170 54.909 -0.739 18222
5626 1 13 . 1 1 61 61 GLN H H 61 7.970 7.970 8.359 -0.389 18222
5627 1 13 . 1 1 62 62 TRP N N 62 124.590 124.590 126.140 -1.550 18222
5628 1 13 . 1 1 62 62 TRP CA C 62 59.830 59.830 60.983 -1.153 18222
5629 1 13 . 1 1 62 62 TRP CB C 62 28.800 28.800 28.769 0.031 18222
5630 1 13 . 1 1 62 62 TRP H H 62 8.240 8.240 8.623 -0.383 18222
5631 1 13 . 1 1 63 63 SER N N 63 113.320 113.320 113.845 -0.525 18222
5632 1 13 . 1 1 63 63 SER CA C 63 61.100 61.100 62.236 -1.135 18222
5633 1 13 . 1 1 63 63 SER H H 63 8.410 8.410 8.327 0.083 18222
5634 1 13 . 1 1 64 64 LEU N N 64 123.230 123.230 122.273 0.957 18222
5635 1 13 . 1 1 64 64 LEU CA C 64 56.880 56.880 57.990 -1.110 18222
5636 1 13 . 1 1 64 64 LEU CB C 64 40.830 40.830 42.061 -1.231 18222
5637 1 13 . 1 1 64 64 LEU H H 64 7.230 7.230 7.816 -0.586 18222
5638 1 13 . 1 1 65 65 LEU N N 65 119.400 119.400 120.120 -0.720 18222
5639 1 13 . 1 1 65 65 LEU HA H 65 3.890 3.890 4.027 -0.137 18222
5640 1 13 . 1 1 65 65 LEU CA C 65 57.580 57.580 58.400 -0.820 18222
5641 1 13 . 1 1 65 65 LEU CB C 65 40.710 40.710 41.968 -1.258 18222
5642 1 13 . 1 1 65 65 LEU H H 65 7.510 7.510 8.860 -1.349 18222
5643 1 13 . 1 1 66 66 VAL N N 66 116.950 116.950 119.464 -2.514 18222
5644 1 13 . 1 1 66 66 VAL HA H 66 3.960 3.960 3.729 0.231 18222
5645 1 13 . 1 1 66 66 VAL CA C 66 66.260 66.260 65.985 0.275 18222
5646 1 13 . 1 1 66 66 VAL CB C 66 30.570 30.570 30.917 -0.347 18222
5647 1 13 . 1 1 66 66 VAL H H 66 7.950 7.950 8.182 -0.232 18222
5648 1 13 . 1 1 67 67 ALA N N 67 120.650 120.650 122.925 -2.275 18222
5649 1 13 . 1 1 67 67 ALA HA H 67 4.000 4.000 4.121 -0.121 18222
5650 1 13 . 1 1 67 67 ALA CA C 67 54.780 54.780 55.374 -0.594 18222
5651 1 13 . 1 1 67 67 ALA CB C 67 17.440 17.440 18.319 -0.879 18222
5652 1 13 . 1 1 67 67 ALA H H 67 7.450 7.450 8.270 -0.820 18222
5653 1 13 . 1 1 68 68 VAL N N 68 118.440 118.440 118.567 -0.127 18222
5654 1 13 . 1 1 68 68 VAL HA H 68 3.750 3.750 3.751 -0.001 18222
5655 1 13 . 1 1 68 68 VAL CA C 68 65.250 65.250 66.226 -0.976 18222
5656 1 13 . 1 1 68 68 VAL CB C 68 30.850 30.850 31.638 -0.788 18222
5657 1 13 . 1 1 68 68 VAL H H 68 7.960 7.960 8.036 -0.076 18222
5658 1 13 . 1 1 69 69 VAL N N 69 120.800 120.800 120.887 -0.087 18222
5659 1 13 . 1 1 69 69 VAL HA H 69 4.220 4.220 3.709 0.511 18222
5660 1 13 . 1 1 69 69 VAL CA C 69 66.020 66.020 66.318 -0.298 18222
5661 1 13 . 1 1 69 69 VAL CB C 69 30.850 30.850 30.635 0.215 18222
5662 1 13 . 1 1 69 69 VAL H H 69 8.080 8.080 8.578 -0.498 18222
5663 1 13 . 1 1 70 70 ALA N N 70 121.740 121.740 120.821 0.919 18222
5664 1 13 . 1 1 70 70 ALA HA H 70 3.920 3.920 4.217 -0.297 18222
5665 1 13 . 1 1 70 70 ALA CA C 70 54.920 54.920 55.368 -0.448 18222
5666 1 13 . 1 1 70 70 ALA CB C 70 17.620 17.620 18.144 -0.524 18222
5667 1 13 . 1 1 70 70 ALA H H 70 8.660 8.660 8.601 0.059 18222
5668 1 13 . 1 1 71 71 GLY N N 71 103.450 103.450 106.953 -3.503 18222
5669 1 13 . 1 1 71 71 GLY CA C 71 46.300 46.300 47.020 -0.720 18222
5670 1 13 . 1 1 71 71 GLY H H 71 8.010 8.010 8.147 -0.137 18222
5671 1 13 . 1 1 72 72 SER N N 72 118.160 118.160 118.302 -0.142 18222
5672 1 13 . 1 1 72 72 SER CA C 72 61.260 61.260 61.547 -0.288 18222
5673 1 13 . 1 1 72 72 SER CB C 72 62.870 62.870 63.003 -0.133 18222
5674 1 13 . 1 1 72 72 SER H H 72 7.870 7.870 8.115 -0.245 18222
5675 1 13 . 1 1 73 73 VAL N N 73 121.340 121.340 121.854 -0.514 18222
5676 1 13 . 1 1 73 73 VAL CA C 73 65.750 65.750 66.185 -0.435 18222
5677 1 13 . 1 1 73 73 VAL CB C 73 30.740 30.740 31.140 -0.400 18222
5678 1 13 . 1 1 73 73 VAL H H 73 8.050 8.050 8.260 -0.210 18222
5679 1 13 . 1 1 74 74 VAL N N 74 118.680 118.680 119.350 -0.670 18222
5680 1 13 . 1 1 74 74 VAL CA C 74 65.770 65.770 66.014 -0.244 18222
5681 1 13 . 1 1 74 74 VAL CB C 74 30.740 30.740 30.857 -0.117 18222
5682 1 13 . 1 1 74 74 VAL H H 74 7.880 7.880 8.477 -0.597 18222
5683 1 13 . 1 1 75 75 SER N N 75 114.750 114.750 116.357 -1.607 18222
5684 1 13 . 1 1 75 75 SER HA H 75 4.100 4.100 4.202 -0.102 18222
5685 1 13 . 1 1 75 75 SER CA C 75 60.870 60.870 61.836 -0.966 18222
5686 1 13 . 1 1 75 75 SER CB C 75 62.340 62.340 63.006 -0.666 18222
5687 1 13 . 1 1 75 75 SER H H 75 7.870 7.870 7.983 -0.113 18222
5688 1 13 . 1 1 76 76 TYR N N 76 121.110 121.110 122.600 -1.490 18222
5689 1 13 . 1 1 76 76 TYR CA C 76 60.050 60.050 61.593 -1.543 18222
5690 1 13 . 1 1 76 76 TYR CB C 76 37.980 37.980 38.582 -0.602 18222
5691 1 13 . 1 1 76 76 TYR H H 76 7.860 7.860 8.501 -0.641 18222
5692 1 13 . 1 1 77 77 GLY N N 77 107.300 107.300 106.367 0.933 18222
5693 1 13 . 1 1 77 77 GLY CA C 77 46.560 46.560 47.404 -0.844 18222
5694 1 13 . 1 1 77 77 GLY H H 77 8.200 8.200 8.454 -0.254 18222
5695 1 13 . 1 1 78 78 VAL N N 78 119.470 119.470 117.631 1.839 18222
5696 1 13 . 1 1 78 78 VAL HA H 78 4.170 4.170 3.874 0.296 18222
5697 1 13 . 1 1 78 78 VAL CA C 78 64.650 64.650 66.109 -1.459 18222
5698 1 13 . 1 1 78 78 VAL H H 78 8.140 8.140 8.479 -0.339 18222
5699 1 13 . 1 1 79 79 THR N N 79 112.100 112.100 117.763 -5.663 18222
5700 1 13 . 1 1 79 79 THR CA C 79 63.460 63.460 66.901 -3.442 18222
5701 1 13 . 1 1 79 79 THR CB C 79 68.650 68.650 68.367 0.283 18222
5702 1 13 . 1 1 79 79 THR H H 79 7.640 7.640 7.966 -0.326 18222
5703 1 13 . 1 1 80 80 ARG N N 80 120.770 120.770 122.770 -2.000 18222
5704 1 13 . 1 1 80 80 ARG HA H 80 4.160 4.160 4.079 0.081 18222
5705 1 13 . 1 1 80 80 ARG CA C 80 56.790 56.790 59.771 -2.981 18222
5706 1 13 . 1 1 80 80 ARG CB C 80 29.430 29.430 30.307 -0.877 18222
5707 1 13 . 1 1 80 80 ARG H H 80 7.680 7.680 8.126 -0.446 18222
5708 1 13 . 1 1 81 81 VAL N N 81 118.370 118.370 119.490 -1.120 18222
5709 1 13 . 1 1 81 81 VAL HA H 81 3.920 3.920 3.712 0.208 18222
5710 1 13 . 1 1 81 81 VAL CA C 81 63.340 63.340 66.517 -3.177 18222
5711 1 13 . 1 1 81 81 VAL CB C 81 31.260 31.260 31.285 -0.025 18222
5712 1 13 . 1 1 81 81 VAL H H 81 7.730 7.730 8.273 -0.543 18222
5713 1 13 . 1 1 82 82 GLU N N 82 120.620 120.620 119.646 0.974 18222
5714 1 13 . 1 1 82 82 GLU CA C 82 56.320 56.320 59.602 -3.282 18222
5715 1 13 . 1 1 82 82 GLU CB C 82 27.930 27.930 29.359 -1.429 18222
5716 1 13 . 1 1 82 82 GLU H H 82 7.920 7.920 8.492 -0.572 18222
5717 1 13 . 1 1 83 83 SER N N 83 116.240 116.240 115.903 0.337 18222
5718 1 13 . 1 1 83 83 SER CA C 83 59.250 59.250 61.315 -2.065 18222
5719 1 13 . 1 1 83 83 SER CB C 83 63.160 63.160 62.598 0.562 18222
5720 1 13 . 1 1 83 83 SER H H 83 7.960 7.960 7.915 0.045 18222
5721 1 13 . 1 1 84 84 GLU N N 84 123.280 123.280 122.082 1.198 18222
5722 1 13 . 1 1 84 84 GLU HA H 84 4.080 4.080 3.942 0.138 18222
5723 1 13 . 1 1 84 84 GLU CA C 84 57.860 57.860 60.059 -2.199 18222
5724 1 13 . 1 1 84 84 GLU CB C 84 28.190 28.190 29.559 -1.369 18222
5725 1 13 . 1 1 84 84 GLU H H 84 8.470 8.470 8.036 0.434 18222
5726 1 13 . 1 1 85 85 LYS N N 85 118.650 118.650 119.879 -1.229 18222
5727 1 13 . 1 1 85 85 LYS HA H 85 4.100 4.100 3.933 0.167 18222
5728 1 13 . 1 1 85 85 LYS CA C 85 57.780 57.780 59.283 -1.503 18222
5729 1 13 . 1 1 85 85 LYS CB C 85 31.380 31.380 32.356 -0.976 18222
5730 1 13 . 1 1 85 85 LYS H H 85 7.940 7.940 7.939 0.001 18222
5731 1 13 . 1 1 86 86 CYS N N 86 117.070 117.070 117.576 -0.506 18222
5732 1 13 . 1 1 86 86 CYS CA C 86 60.910 60.910 63.953 -3.043 18222
5733 1 13 . 1 1 86 86 CYS CB C 86 26.740 26.740 26.526 0.214 18222
5734 1 13 . 1 1 86 86 CYS H H 86 7.840 7.840 8.173 -0.333 18222
5735 1 13 . 1 1 87 87 ASN N N 87 119.370 119.370 117.901 1.469 18222
5736 1 13 . 1 1 87 87 ASN HA H 87 4.130 4.130 4.378 -0.248 18222
5737 1 13 . 1 1 87 87 ASN CA C 87 55.750 55.750 56.415 -0.665 18222
5738 1 13 . 1 1 87 87 ASN CB C 87 38.050 38.050 38.323 -0.273 18222
5739 1 13 . 1 1 87 87 ASN H H 87 8.110 8.110 8.210 -0.100 18222
5740 1 13 . 1 1 88 88 ASN N N 88 117.570 117.570 119.074 -1.504 18222
5741 1 13 . 1 1 88 88 ASN HA H 88 4.280 4.280 4.538 -0.258 18222
5742 1 13 . 1 1 88 88 ASN CA C 88 55.190 55.190 55.989 -0.799 18222
5743 1 13 . 1 1 88 88 ASN CB C 88 37.400 37.400 38.376 -0.975 18222
5744 1 13 . 1 1 88 88 ASN H H 88 8.280 8.280 8.090 0.190 18222
5745 1 13 . 1 1 89 89 LEU N N 89 121.940 121.940 121.678 0.262 18222
5746 1 13 . 1 1 89 89 LEU HA H 89 4.070 4.070 3.908 0.162 18222
5747 1 13 . 1 1 89 89 LEU CA C 89 57.580 57.580 59.072 -1.492 18222
5748 1 13 . 1 1 89 89 LEU CB C 89 40.490 40.490 41.558 -1.068 18222
5749 1 13 . 1 1 89 89 LEU H H 89 7.790 7.790 8.242 -0.452 18222
5750 1 13 . 1 1 90 90 TRP N N 90 119.220 119.220 119.387 -0.167 18222
5751 1 13 . 1 1 90 90 TRP CA C 90 59.120 59.120 60.274 -1.154 18222
5752 1 13 . 1 1 90 90 TRP CB C 90 28.800 28.800 28.594 0.206 18222
5753 1 13 . 1 1 90 90 TRP H H 90 7.850 7.850 8.180 -0.330 18222
5754 1 13 . 1 1 91 91 LEU N N 91 117.870 117.870 121.028 -3.158 18222
5755 1 13 . 1 1 91 91 LEU CA C 91 57.300 57.300 58.458 -1.158 18222
5756 1 13 . 1 1 91 91 LEU CB C 91 40.610 40.610 41.853 -1.243 18222
5757 1 13 . 1 1 91 91 LEU H H 91 7.920 7.920 8.378 -0.458 18222
5758 1 13 . 1 1 92 92 PHE N N 92 121.280 121.280 118.916 2.364 18222
5759 1 13 . 1 1 92 92 PHE CA C 92 60.390 60.390 62.593 -2.203 18222
5760 1 13 . 1 1 92 92 PHE CB C 92 37.980 37.980 38.778 -0.798 18222
5761 1 13 . 1 1 92 92 PHE H H 92 7.860 7.860 8.400 -0.540 18222
5762 1 13 . 1 1 93 93 LEU N N 93 119.860 119.860 119.772 0.088 18222
5763 1 13 . 1 1 93 93 LEU CA C 93 56.860 56.860 57.525 -0.665 18222
5764 1 13 . 1 1 93 93 LEU CB C 93 40.550 40.550 42.360 -1.810 18222
5765 1 13 . 1 1 93 93 LEU H H 93 7.980 7.980 8.832 -0.852 18222
5766 1 13 . 1 1 94 94 GLU N N 94 114.660 114.660 118.958 -4.298 18222
5767 1 13 . 1 1 94 94 GLU HA H 94 3.810 3.810 4.140 -0.330 18222
5768 1 13 . 1 1 94 94 GLU CA C 94 57.210 57.210 59.132 -1.922 18222
5769 1 13 . 1 1 94 94 GLU CB C 94 28.470 28.470 29.826 -1.356 18222
5770 1 13 . 1 1 94 94 GLU H H 94 7.890 7.890 8.040 -0.149 18222
5771 1 13 . 1 1 95 95 THR N N 95 108.260 108.260 111.215 -2.955 18222
5772 1 13 . 1 1 95 95 THR CA C 95 62.150 62.150 61.557 0.593 18222
5773 1 13 . 1 1 95 95 THR CB C 95 70.810 70.810 69.240 1.570 18222
5774 1 13 . 1 1 95 95 THR H H 95 7.690 7.690 7.592 0.098 18222
5775 1 13 . 1 1 96 96 GLY N N 96 112.220 112.220 108.894 3.326 18222
5776 1 13 . 1 1 96 96 GLY CA C 96 45.410 45.410 45.122 0.288 18222
5777 1 13 . 1 1 96 96 GLY H H 96 8.240 8.240 7.423 0.817 18222
5778 1 13 . 1 1 97 97 GLN N N 97 117.950 117.950 120.267 -2.317 18222
5779 1 13 . 1 1 97 97 GLN HA H 97 4.200 4.200 4.332 -0.132 18222
5780 1 13 . 1 1 97 97 GLN CA C 97 54.430 54.430 55.659 -1.229 18222
5781 1 13 . 1 1 97 97 GLN CB C 97 29.910 29.910 29.780 0.130 18222
5782 1 13 . 1 1 97 97 GLN H H 97 7.640 7.640 8.377 -0.737 18222
5783 1 13 . 1 1 98 98 LEU N N 98 123.810 123.810 123.147 0.663 18222
5784 1 13 . 1 1 98 98 LEU HA H 98 4.360 4.360 4.470 -0.110 18222
5785 1 13 . 1 1 98 98 LEU CA C 98 52.650 52.650 53.915 -1.265 18222
5786 1 13 . 1 1 98 98 LEU CB C 98 40.460 40.460 40.911 -0.451 18222
5787 1 13 . 1 1 98 98 LEU H H 98 8.270 8.270 8.293 -0.023 18222
5788 1 13 . 1 1 99 99 PRO CA C 99 63.180 63.180 62.460 0.720 18222
5789 1 13 . 1 1 99 99 PRO CB C 99 30.840 30.840 32.331 -1.491 18222
5790 1 13 . 1 1 100 100 LYS N N 100 120.630 120.630 120.115 0.515 18222
5791 1 13 . 1 1 100 100 LYS CA C 100 55.730 55.730 56.164 -0.434 18222
5792 1 13 . 1 1 100 100 LYS CB C 100 32.280 32.280 33.983 -1.703 18222
5793 1 13 . 1 1 100 100 LYS H H 100 8.090 8.090 8.541 -0.451 18222
5794 1 13 . 1 1 101 101 ASP N N 101 120.920 120.920 123.673 -2.753 18222
5795 1 13 . 1 1 101 101 ASP HA H 101 4.190 4.190 4.825 -0.635 18222
5796 1 13 . 1 1 101 101 ASP CA C 101 54.000 54.000 53.841 0.159 18222
5797 1 13 . 1 1 101 101 ASP CB C 101 40.330 40.330 42.779 -2.449 18222
5798 1 13 . 1 1 101 101 ASP H H 101 8.190 8.190 8.495 -0.305 18222
5799 1 13 . 1 1 102 102 ARG N N 102 122.210 122.210 122.607 -0.397 18222
5800 1 13 . 1 1 102 102 ARG CA C 102 55.590 55.590 55.898 -0.308 18222
5801 1 13 . 1 1 102 102 ARG CB C 102 29.630 29.630 31.755 -2.125 18222
5802 1 13 . 1 1 102 102 ARG H H 102 8.130 8.130 8.587 -0.457 18222
5803 1 13 . 1 1 103 103 SER N N 103 117.230 117.230 117.280 -0.050 18222
5804 1 13 . 1 1 103 103 SER HA H 103 4.280 4.280 4.803 -0.523 18222
5805 1 13 . 1 1 103 103 SER CA C 103 58.470 58.470 58.170 0.300 18222
5806 1 13 . 1 1 103 103 SER CB C 103 63.080 63.080 64.541 -1.461 18222
5807 1 13 . 1 1 103 103 SER H H 103 8.290 8.290 8.202 0.088 18222
5808 1 13 . 1 1 104 104 THR N N 104 115.430 115.430 115.256 0.174 18222
5809 1 13 . 1 1 104 104 THR CA C 104 61.570 61.570 61.808 -0.238 18222
5810 1 13 . 1 1 104 104 THR CB C 104 69.030 69.030 71.936 -2.906 18222
5811 1 13 . 1 1 104 104 THR H H 104 8.020 8.020 8.188 -0.168 18222
5812 1 13 . 1 1 105 105 ASP N N 105 122.780 122.780 120.069 2.711 18222
5813 1 13 . 1 1 105 105 ASP CA C 105 54.210 54.210 54.579 -0.369 18222
5814 1 13 . 1 1 105 105 ASP CB C 105 40.380 40.380 41.383 -1.004 18222
5815 1 13 . 1 1 105 105 ASP H H 105 8.120 8.120 8.606 -0.486 18222
5816 1 13 . 1 1 106 106 GLN N N 106 120.960 120.960 120.421 0.539 18222
5817 1 13 . 1 1 106 106 GLN CA C 106 55.420 55.420 56.213 -0.793 18222
5818 1 13 . 1 1 106 106 GLN CB C 106 28.310 28.310 29.780 -1.470 18222
5819 1 13 . 1 1 106 106 GLN H H 106 8.140 8.140 7.932 0.208 18222
5820 1 13 . 1 1 107 107 ARG N N 107 123.010 123.010 120.804 2.206 18222
5821 1 13 . 1 1 107 107 ARG HA H 107 4.210 4.210 4.330 -0.120 18222
5822 1 13 . 1 1 107 107 ARG CA C 107 55.560 55.560 56.212 -0.652 18222
5823 1 13 . 1 1 107 107 ARG CB C 107 29.920 29.920 30.549 -0.629 18222
5824 1 13 . 1 1 107 107 ARG H H 107 8.180 8.180 8.759 -0.579 18222
5825 1 14 . 1 1 2 2 VAL N N 2 121.590 121.590 123.035 -1.445 18222
5826 1 14 . 1 1 2 2 VAL CA C 2 61.600 61.600 61.716 -0.116 18222
5827 1 14 . 1 1 2 2 VAL CB C 2 31.900 31.900 33.402 -1.502 18222
5828 1 14 . 1 1 2 2 VAL H H 2 8.010 8.010 7.917 0.093 18222
5829 1 14 . 1 1 3 3 ASN N N 3 122.520 122.520 123.116 -0.596 18222
5830 1 14 . 1 1 3 3 ASN HA H 3 4.020 4.020 4.721 -0.701 18222
5831 1 14 . 1 1 3 3 ASN CA C 3 52.640 52.640 54.667 -2.027 18222
5832 1 14 . 1 1 3 3 ASN CB C 3 38.330 38.330 39.119 -0.789 18222
5833 1 14 . 1 1 3 3 ASN H H 3 8.360 8.360 8.651 -0.291 18222
5834 1 14 . 1 1 4 4 LEU N N 4 123.830 123.830 120.265 3.565 18222
5835 1 14 . 1 1 4 4 LEU HA H 4 4.220 4.220 4.499 -0.279 18222
5836 1 14 . 1 1 4 4 LEU CA C 4 54.620 54.620 55.245 -0.625 18222
5837 1 14 . 1 1 4 4 LEU CB C 4 41.680 41.680 42.701 -1.021 18222
5838 1 14 . 1 1 4 4 LEU H H 4 8.220 8.220 7.585 0.635 18222
5839 1 14 . 1 1 5 5 GLY N N 5 106.810 106.810 109.133 -2.323 18222
5840 1 14 . 1 1 5 5 GLY CA C 5 45.800 45.800 43.871 1.929 18222
5841 1 14 . 1 1 5 5 GLY H H 5 8.030 8.030 7.740 0.290 18222
5842 1 14 . 1 1 6 6 LEU N N 6 120.820 120.820 121.272 -0.452 18222
5843 1 14 . 1 1 6 6 LEU HA H 6 4.050 4.050 4.118 -0.068 18222
5844 1 14 . 1 1 6 6 LEU CA C 6 55.990 55.990 58.123 -2.133 18222
5845 1 14 . 1 1 6 6 LEU CB C 6 40.800 40.800 41.847 -1.047 18222
5846 1 14 . 1 1 6 6 LEU H H 6 8.030 8.030 8.617 -0.587 18222
5847 1 14 . 1 1 7 7 SER N N 7 115.540 115.540 114.474 1.066 18222
5848 1 14 . 1 1 7 7 SER HA H 7 4.100 4.100 4.174 -0.074 18222
5849 1 14 . 1 1 7 7 SER CA C 7 60.580 60.580 61.389 -0.809 18222
5850 1 14 . 1 1 7 7 SER CB C 7 62.060 62.060 61.822 0.238 18222
5851 1 14 . 1 1 7 7 SER H H 7 8.360 8.360 8.309 0.051 18222
5852 1 14 . 1 1 8 8 ARG N N 8 120.690 120.690 122.591 -1.901 18222
5853 1 14 . 1 1 8 8 ARG HA H 8 4.160 4.160 4.287 -0.127 18222
5854 1 14 . 1 1 8 8 ARG CA C 8 57.350 57.350 58.792 -1.442 18222
5855 1 14 . 1 1 8 8 ARG CB C 8 29.230 29.230 29.843 -0.613 18222
5856 1 14 . 1 1 8 8 ARG H H 8 7.830 7.830 8.115 -0.285 18222
5857 1 14 . 1 1 9 9 VAL N N 9 119.330 119.330 119.505 -0.175 18222
5858 1 14 . 1 1 9 9 VAL HA H 9 4.170 4.170 3.711 0.459 18222
5859 1 14 . 1 1 9 9 VAL CA C 9 64.720 64.720 66.650 -1.930 18222
5860 1 14 . 1 1 9 9 VAL CB C 9 30.900 30.900 31.038 -0.138 18222
5861 1 14 . 1 1 9 9 VAL H H 9 7.620 7.620 8.678 -1.058 18222
5862 1 14 . 1 1 10 10 ASP N N 10 119.520 119.520 120.640 -1.120 18222
5863 1 14 . 1 1 10 10 ASP CA C 10 54.960 54.960 57.605 -2.645 18222
5864 1 14 . 1 1 10 10 ASP CB C 10 37.800 37.800 40.274 -2.474 18222
5865 1 14 . 1 1 10 10 ASP H H 10 8.180 8.180 8.435 -0.255 18222
5866 1 14 . 1 1 11 11 ASP N N 11 121.550 121.550 120.550 1.000 18222
5867 1 14 . 1 1 11 11 ASP CA C 11 54.440 54.440 57.009 -2.569 18222
5868 1 14 . 1 1 11 11 ASP CB C 11 37.840 37.840 40.392 -2.552 18222
5869 1 14 . 1 1 11 11 ASP H H 11 7.950 7.950 8.046 -0.096 18222
5870 1 14 . 1 1 12 12 ALA N N 12 120.220 120.220 123.367 -3.147 18222
5871 1 14 . 1 1 12 12 ALA CA C 12 54.370 54.370 55.153 -0.783 18222
5872 1 14 . 1 1 12 12 ALA CB C 12 24.730 24.730 18.530 6.200 18222
5873 1 14 . 1 1 12 12 ALA H H 12 8.090 8.090 8.098 -0.008 18222
5874 1 14 . 1 1 13 13 VAL N N 13 116.910 116.910 117.870 -0.960 18222
5875 1 14 . 1 1 13 13 VAL HA H 13 4.140 4.140 3.700 0.440 18222
5876 1 14 . 1 1 13 13 VAL CA C 13 64.900 64.900 64.906 -0.006 18222
5877 1 14 . 1 1 13 13 VAL CB C 13 31.000 31.000 31.873 -0.873 18222
5878 1 14 . 1 1 13 13 VAL H H 13 7.980 7.980 8.078 -0.098 18222
5879 1 14 . 1 1 14 14 ALA N N 14 122.200 122.200 122.537 -0.337 18222
5880 1 14 . 1 1 14 14 ALA HA H 14 4.020 4.020 4.042 -0.022 18222
5881 1 14 . 1 1 14 14 ALA CA C 14 53.800 53.800 55.069 -1.269 18222
5882 1 14 . 1 1 14 14 ALA CB C 14 17.790 17.790 18.099 -0.309 18222
5883 1 14 . 1 1 14 14 ALA H H 14 8.030 8.030 7.877 0.153 18222
5884 1 14 . 1 1 15 15 ALA N N 15 118.600 118.600 119.947 -1.347 18222
5885 1 14 . 1 1 15 15 ALA CA C 15 53.230 53.230 53.959 -0.729 18222
5886 1 14 . 1 1 15 15 ALA CB C 15 18.010 18.010 18.542 -0.532 18222
5887 1 14 . 1 1 15 15 ALA H H 15 7.530 7.530 8.105 -0.576 18222
5888 1 14 . 1 1 16 16 LYS N N 16 115.820 115.820 116.116 -0.296 18222
5889 1 14 . 1 1 16 16 LYS HA H 16 4.080 4.080 4.251 -0.171 18222
5890 1 14 . 1 1 16 16 LYS CA C 16 55.670 55.670 56.677 -1.007 18222
5891 1 14 . 1 1 16 16 LYS CB C 16 32.640 32.640 32.826 -0.186 18222
5892 1 14 . 1 1 16 16 LYS H H 16 7.490 7.490 7.392 0.098 18222
5893 1 14 . 1 1 17 17 HIS N N 17 116.790 116.790 119.365 -2.575 18222
5894 1 14 . 1 1 17 17 HIS HA H 17 4.100 4.100 4.853 -0.753 18222
5895 1 14 . 1 1 17 17 HIS CA C 17 52.820 52.820 52.851 -0.031 18222
5896 1 14 . 1 1 17 17 HIS CB C 17 28.400 28.400 30.541 -2.141 18222
5897 1 14 . 1 1 17 17 HIS H H 17 8.130 8.130 7.585 0.545 18222
5898 1 14 . 1 1 18 18 PRO CA C 18 63.800 63.800 62.218 1.583 18222
5899 1 14 . 1 1 18 18 PRO CB C 18 30.800 30.800 32.736 -1.936 18222
5900 1 14 . 1 1 19 19 GLY N N 19 110.260 110.260 107.800 2.460 18222
5901 1 14 . 1 1 19 19 GLY CA C 19 45.490 45.490 44.930 0.560 18222
5902 1 14 . 1 1 19 19 GLY H H 19 8.730 8.730 8.299 0.431 18222
5903 1 14 . 1 1 20 20 LEU N N 20 122.650 122.650 125.313 -2.663 18222
5904 1 14 . 1 1 20 20 LEU HA H 20 4.090 4.090 4.112 -0.022 18222
5905 1 14 . 1 1 20 20 LEU CA C 20 57.060 57.060 58.075 -1.015 18222
5906 1 14 . 1 1 20 20 LEU H H 20 7.980 7.980 8.631 -0.651 18222
5907 1 14 . 1 1 21 21 GLY N N 21 107.000 107.000 105.577 1.423 18222
5908 1 14 . 1 1 21 21 GLY CA C 21 46.710 46.710 47.396 -0.686 18222
5909 1 14 . 1 1 21 21 GLY H H 21 8.570 8.570 8.322 0.248 18222
5910 1 14 . 1 1 22 22 GLU N N 22 121.610 121.610 121.987 -0.377 18222
5911 1 14 . 1 1 22 22 GLU HA H 22 3.990 3.990 4.147 -0.157 18222
5912 1 14 . 1 1 22 22 GLU CA C 22 58.280 58.280 59.028 -0.748 18222
5913 1 14 . 1 1 22 22 GLU CB C 22 28.010 28.010 29.414 -1.404 18222
5914 1 14 . 1 1 22 22 GLU H H 22 8.100 8.100 8.628 -0.528 18222
5915 1 14 . 1 1 23 23 TYR N N 23 120.870 120.870 121.277 -0.407 18222
5916 1 14 . 1 1 23 23 TYR CA C 23 60.380 60.380 61.166 -0.785 18222
5917 1 14 . 1 1 23 23 TYR CB C 23 37.750 37.750 38.209 -0.459 18222
5918 1 14 . 1 1 23 23 TYR H H 23 7.910 7.910 8.986 -1.076 18222
5919 1 14 . 1 1 24 24 ALA N N 24 121.420 121.420 121.657 -0.237 18222
5920 1 14 . 1 1 24 24 ALA HA H 24 4.140 4.140 3.546 0.594 18222
5921 1 14 . 1 1 24 24 ALA CA C 24 54.260 54.260 54.857 -0.597 18222
5922 1 14 . 1 1 24 24 ALA H H 24 8.410 8.410 8.251 0.159 18222
5923 1 14 . 1 1 25 25 ALA N N 25 120.220 120.220 121.426 -1.206 18222
5924 1 14 . 1 1 25 25 ALA CA C 25 54.370 54.370 55.301 -0.931 18222
5925 1 14 . 1 1 25 25 ALA H H 25 8.090 8.090 8.160 -0.070 18222
5926 1 14 . 1 1 26 26 CYS N N 26 116.760 116.760 116.476 0.284 18222
5927 1 14 . 1 1 26 26 CYS CA C 26 61.180 61.180 64.197 -3.017 18222
5928 1 14 . 1 1 26 26 CYS CB C 26 26.390 26.390 26.927 -0.537 18222
5929 1 14 . 1 1 26 26 CYS H H 26 7.950 7.950 8.566 -0.616 18222
5930 1 14 . 1 1 27 27 GLN N N 27 118.690 118.690 121.180 -2.490 18222
5931 1 14 . 1 1 27 27 GLN CA C 27 55.970 55.970 59.737 -3.767 18222
5932 1 14 . 1 1 27 27 GLN H H 27 8.060 8.060 8.226 -0.166 18222
5933 1 14 . 1 1 28 28 SER N N 28 115.490 115.490 115.842 -0.352 18222
5934 1 14 . 1 1 28 28 SER HA H 28 3.990 3.990 4.133 -0.143 18222
5935 1 14 . 1 1 28 28 SER CA C 28 61.110 61.110 62.187 -1.077 18222
5936 1 14 . 1 1 28 28 SER H H 28 7.980 7.980 8.419 -0.439 18222
5937 1 14 . 1 1 29 29 HIS N N 29 120.880 120.880 121.002 -0.122 18222
5938 1 14 . 1 1 29 29 HIS CA C 29 58.190 58.190 59.910 -1.720 18222
5939 1 14 . 1 1 29 29 HIS CB C 29 27.460 27.460 30.047 -2.587 18222
5940 1 14 . 1 1 29 29 HIS H H 29 8.180 8.180 8.320 -0.140 18222
5941 1 14 . 1 1 30 30 ALA N N 30 122.920 122.920 121.718 1.202 18222
5942 1 14 . 1 1 30 30 ALA CA C 30 54.560 54.560 55.161 -0.601 18222
5943 1 14 . 1 1 30 30 ALA CB C 30 17.490 17.490 18.330 -0.840 18222
5944 1 14 . 1 1 30 30 ALA H H 30 8.040 8.040 8.411 -0.371 18222
5945 1 14 . 1 1 31 31 PHE N N 31 119.340 119.340 119.930 -0.590 18222
5946 1 14 . 1 1 31 31 PHE CA C 31 60.370 60.370 61.549 -1.179 18222
5947 1 14 . 1 1 31 31 PHE CB C 31 38.520 38.520 39.413 -0.893 18222
5948 1 14 . 1 1 31 31 PHE H H 31 8.230 8.230 8.712 -0.482 18222
5949 1 14 . 1 1 32 32 MET N N 32 118.110 118.110 120.394 -2.284 18222
5950 1 14 . 1 1 32 32 MET HA H 32 4.050 4.050 4.120 -0.070 18222
5951 1 14 . 1 1 32 32 MET CA C 32 58.280 58.280 59.505 -1.225 18222
5952 1 14 . 1 1 32 32 MET CB C 32 31.090 31.090 32.348 -1.258 18222
5953 1 14 . 1 1 32 32 MET H H 32 8.120 8.120 8.584 -0.464 18222
5954 1 14 . 1 1 33 33 LYS N N 33 119.040 119.040 119.505 -0.465 18222
5955 1 14 . 1 1 33 33 LYS HA H 33 3.930 3.930 4.123 -0.193 18222
5956 1 14 . 1 1 33 33 LYS CA C 33 59.040 59.040 59.719 -0.679 18222
5957 1 14 . 1 1 33 33 LYS CB C 33 30.990 30.990 32.640 -1.650 18222
5958 1 14 . 1 1 33 33 LYS H H 33 7.970 7.970 8.369 -0.399 18222
5959 1 14 . 1 1 34 34 GLY N N 34 108.840 108.840 107.932 0.908 18222
5960 1 14 . 1 1 34 34 GLY CA C 34 46.610 46.610 47.197 -0.587 18222
5961 1 14 . 1 1 34 34 GLY H H 34 8.030 8.030 8.597 -0.567 18222
5962 1 14 . 1 1 35 35 VAL N N 35 122.910 122.910 122.749 0.161 18222
5963 1 14 . 1 1 35 35 VAL HA H 35 4.220 4.220 3.772 0.448 18222
5964 1 14 . 1 1 35 35 VAL CA C 35 66.310 66.310 64.935 1.375 18222
5965 1 14 . 1 1 35 35 VAL CB C 35 30.560 30.560 31.268 -0.709 18222
5966 1 14 . 1 1 35 35 VAL H H 35 8.090 8.090 8.203 -0.113 18222
5967 1 14 . 1 1 36 36 PHE N N 36 120.020 120.020 121.075 -1.055 18222
5968 1 14 . 1 1 36 36 PHE CA C 36 61.350 61.350 61.748 -0.398 18222
5969 1 14 . 1 1 36 36 PHE CB C 36 38.090 38.090 38.799 -0.709 18222
5970 1 14 . 1 1 36 36 PHE H H 36 8.350 8.350 8.344 0.006 18222
5971 1 14 . 1 1 37 37 THR N N 37 116.980 116.980 115.890 1.090 18222
5972 1 14 . 1 1 37 37 THR HA H 37 4.050 4.050 3.667 0.383 18222
5973 1 14 . 1 1 37 37 THR CA C 37 66.000 66.000 66.555 -0.555 18222
5974 1 14 . 1 1 37 37 THR CB C 37 68.270 68.270 68.857 -0.587 18222
5975 1 14 . 1 1 37 37 THR H H 37 8.520 8.520 8.139 0.381 18222
5976 1 14 . 1 1 38 38 PHE N N 38 123.090 123.090 119.293 3.797 18222
5977 1 14 . 1 1 38 38 PHE HA H 38 4.360 4.360 4.217 0.143 18222
5978 1 14 . 1 1 38 38 PHE CA C 38 61.140 61.140 60.557 0.583 18222
5979 1 14 . 1 1 38 38 PHE CB C 38 41.200 41.200 39.315 1.885 18222
5980 1 14 . 1 1 38 38 PHE H H 38 8.010 8.010 7.881 0.129 18222
5981 1 14 . 1 1 39 39 VAL N N 39 117.280 117.280 118.811 -1.531 18222
5982 1 14 . 1 1 39 39 VAL HA H 39 4.210 4.210 3.645 0.565 18222
5983 1 14 . 1 1 39 39 VAL CA C 39 66.000 66.000 66.311 -0.311 18222
5984 1 14 . 1 1 39 39 VAL CB C 39 30.860 30.860 31.428 -0.568 18222
5985 1 14 . 1 1 39 39 VAL H H 39 8.530 8.530 8.573 -0.043 18222
5986 1 14 . 1 1 40 40 THR N N 40 109.470 109.470 113.839 -4.369 18222
5987 1 14 . 1 1 40 40 THR HA H 40 4.060 4.060 4.134 -0.074 18222
5988 1 14 . 1 1 40 40 THR CA C 40 63.390 63.390 63.563 -0.173 18222
5989 1 14 . 1 1 40 40 THR CB C 40 68.650 68.650 68.074 0.576 18222
5990 1 14 . 1 1 40 40 THR H H 40 7.700 7.700 7.813 -0.113 18222
5991 1 14 . 1 1 41 41 GLY N N 41 110.770 110.770 108.814 1.956 18222
5992 1 14 . 1 1 41 41 GLY CA C 41 45.580 45.580 44.778 0.802 18222
5993 1 14 . 1 1 41 41 GLY H H 41 7.700 7.700 7.644 0.056 18222
5994 1 14 . 1 1 42 42 THR N N 42 114.520 114.520 114.779 -0.259 18222
5995 1 14 . 1 1 42 42 THR CA C 42 63.300 63.300 63.191 0.109 18222
5996 1 14 . 1 1 42 42 THR CB C 42 69.490 69.490 67.470 2.020 18222
5997 1 14 . 1 1 42 42 THR H H 42 7.720 7.720 7.370 0.350 18222
5998 1 14 . 1 1 43 43 GLY N N 43 109.540 109.540 108.922 0.618 18222
5999 1 14 . 1 1 43 43 GLY CA C 43 46.250 46.250 45.996 0.254 18222
6000 1 14 . 1 1 43 43 GLY H H 43 8.110 8.110 8.494 -0.384 18222
6001 1 14 . 1 1 44 44 MET N N 44 120.240 120.240 121.107 -0.867 18222
6002 1 14 . 1 1 44 44 MET HA H 44 4.100 4.100 4.008 0.092 18222
6003 1 14 . 1 1 44 44 MET CA C 44 57.700 57.700 58.563 -0.863 18222
6004 1 14 . 1 1 44 44 MET CB C 44 32.030 32.030 32.621 -0.591 18222
6005 1 14 . 1 1 44 44 MET H H 44 7.730 7.730 7.971 -0.241 18222
6006 1 14 . 1 1 45 45 ALA N N 45 121.560 121.560 121.330 0.230 18222
6007 1 14 . 1 1 45 45 ALA CA C 45 54.440 54.440 55.100 -0.660 18222
6008 1 14 . 1 1 45 45 ALA CB C 45 17.400 17.400 17.792 -0.392 18222
6009 1 14 . 1 1 45 45 ALA H H 45 7.950 7.950 7.723 0.227 18222
6010 1 14 . 1 1 46 46 PHE N N 46 118.260 118.260 119.001 -0.741 18222
6011 1 14 . 1 1 46 46 PHE HA H 46 3.930 3.930 4.175 -0.245 18222
6012 1 14 . 1 1 46 46 PHE CA C 46 59.820 59.820 61.412 -1.592 18222
6013 1 14 . 1 1 46 46 PHE CB C 46 38.260 38.260 38.739 -0.479 18222
6014 1 14 . 1 1 46 46 PHE H H 46 7.860 7.860 8.366 -0.506 18222
6015 1 14 . 1 1 47 47 GLY N N 47 107.300 107.300 107.993 -0.693 18222
6016 1 14 . 1 1 47 47 GLY CA C 47 46.560 46.560 47.150 -0.590 18222
6017 1 14 . 1 1 47 47 GLY H H 47 8.200 8.200 8.486 -0.286 18222
6018 1 14 . 1 1 48 48 LEU N N 48 121.920 121.920 123.795 -1.875 18222
6019 1 14 . 1 1 48 48 LEU HA H 48 4.040 4.040 4.020 0.020 18222
6020 1 14 . 1 1 48 48 LEU CA C 48 57.580 57.580 58.316 -0.736 18222
6021 1 14 . 1 1 48 48 LEU CB C 48 40.790 40.790 41.891 -1.101 18222
6022 1 14 . 1 1 48 48 LEU H H 48 8.180 8.180 8.439 -0.259 18222
6023 1 14 . 1 1 49 49 GLN N N 49 118.270 118.270 118.176 0.094 18222
6024 1 14 . 1 1 49 49 GLN HA H 49 3.830 3.830 3.965 -0.135 18222
6025 1 14 . 1 1 49 49 GLN CA C 49 58.880 58.880 58.535 0.345 18222
6026 1 14 . 1 1 49 49 GLN CB C 49 27.240 27.240 28.308 -1.067 18222
6027 1 14 . 1 1 49 49 GLN H H 49 8.080 8.080 8.276 -0.196 18222
6028 1 14 . 1 1 50 50 MET N N 50 117.630 117.630 121.543 -3.913 18222
6029 1 14 . 1 1 50 50 MET HA H 50 4.010 4.010 4.324 -0.314 18222
6030 1 14 . 1 1 50 50 MET CA C 50 57.730 57.730 59.002 -1.272 18222
6031 1 14 . 1 1 50 50 MET CB C 50 27.160 27.160 32.836 -5.676 18222
6032 1 14 . 1 1 50 50 MET H H 50 7.880 7.880 8.092 -0.212 18222
6033 1 14 . 1 1 51 51 PHE N N 51 119.550 119.550 119.476 0.074 18222
6034 1 14 . 1 1 51 51 PHE CA C 51 60.850 60.850 61.952 -1.102 18222
6035 1 14 . 1 1 51 51 PHE CB C 51 38.720 38.720 39.373 -0.653 18222
6036 1 14 . 1 1 51 51 PHE H H 51 7.890 7.890 8.498 -0.608 18222
6037 1 14 . 1 1 52 52 ILE N N 52 117.950 117.950 118.563 -0.613 18222
6038 1 14 . 1 1 52 52 ILE HA H 52 4.050 4.050 3.773 0.277 18222
6039 1 14 . 1 1 52 52 ILE CA C 52 63.560 63.560 65.037 -1.477 18222
6040 1 14 . 1 1 52 52 ILE CB C 52 36.810 36.810 38.068 -1.258 18222
6041 1 14 . 1 1 52 52 ILE H H 52 8.110 8.110 8.127 -0.017 18222
6042 1 14 . 1 1 53 53 GLN N N 53 117.360 117.360 118.346 -0.986 18222
6043 1 14 . 1 1 53 53 GLN CA C 53 57.200 57.200 58.201 -1.001 18222
6044 1 14 . 1 1 53 53 GLN CB C 53 27.870 27.870 28.360 -0.490 18222
6045 1 14 . 1 1 53 53 GLN H H 53 7.930 7.930 8.350 -0.420 18222
6046 1 14 . 1 1 54 54 ARG N N 54 116.840 116.840 118.378 -1.538 18222
6047 1 14 . 1 1 54 54 ARG HA H 54 3.950 3.950 4.184 -0.234 18222
6048 1 14 . 1 1 54 54 ARG CA C 54 56.480 56.480 57.606 -1.126 18222
6049 1 14 . 1 1 54 54 ARG CB C 54 28.970 28.970 29.859 -0.889 18222
6050 1 14 . 1 1 54 54 ARG H H 54 7.540 7.540 7.828 -0.288 18222
6051 1 14 . 1 1 55 55 LYS N N 55 117.900 117.900 117.957 -0.057 18222
6052 1 14 . 1 1 55 55 LYS HA H 55 4.080 4.080 4.240 -0.160 18222
6053 1 14 . 1 1 55 55 LYS CA C 55 55.030 55.030 56.618 -1.588 18222
6054 1 14 . 1 1 55 55 LYS CB C 55 32.010 32.010 32.706 -0.696 18222
6055 1 14 . 1 1 55 55 LYS H H 55 7.660 7.660 7.216 0.444 18222
6056 1 14 . 1 1 56 56 PHE N N 56 121.060 121.060 121.334 -0.274 18222
6057 1 14 . 1 1 56 56 PHE CA C 56 55.190 55.190 55.144 0.046 18222
6058 1 14 . 1 1 56 56 PHE CB C 56 38.970 38.970 39.568 -0.598 18222
6059 1 14 . 1 1 56 56 PHE H H 56 8.080 8.080 7.807 0.273 18222
6060 1 14 . 1 1 57 57 PRO CA C 57 62.390 62.390 63.415 -1.025 18222
6061 1 14 . 1 1 57 57 PRO CB C 57 30.580 30.580 31.555 -0.975 18222
6062 1 14 . 1 1 58 58 TYR N N 58 120.240 120.240 119.943 0.297 18222
6063 1 14 . 1 1 58 58 TYR CA C 58 55.770 55.770 55.650 0.120 18222
6064 1 14 . 1 1 58 58 TYR CB C 58 40.220 40.220 38.790 1.430 18222
6065 1 14 . 1 1 58 58 TYR H H 58 7.700 7.700 7.896 -0.196 18222
6066 1 14 . 1 1 59 59 PRO CA C 59 62.130 62.130 63.938 -1.808 18222
6067 1 14 . 1 1 59 59 PRO CB C 59 33.340 33.340 32.223 1.117 18222
6068 1 14 . 1 1 60 60 LEU N N 60 122.210 122.210 120.178 2.032 18222
6069 1 14 . 1 1 60 60 LEU CA C 60 54.250 54.250 54.184 0.065 18222
6070 1 14 . 1 1 60 60 LEU CB C 60 41.470 41.470 43.374 -1.904 18222
6071 1 14 . 1 1 60 60 LEU H H 60 7.880 7.880 7.861 0.019 18222
6072 1 14 . 1 1 61 61 GLN N N 61 122.470 122.470 120.280 2.190 18222
6073 1 14 . 1 1 61 61 GLN CA C 61 54.170 54.170 54.946 -0.776 18222
6074 1 14 . 1 1 61 61 GLN H H 61 7.970 7.970 8.346 -0.376 18222
6075 1 14 . 1 1 62 62 TRP N N 62 124.590 124.590 125.335 -0.745 18222
6076 1 14 . 1 1 62 62 TRP CA C 62 59.830 59.830 61.572 -1.742 18222
6077 1 14 . 1 1 62 62 TRP CB C 62 28.800 28.800 29.323 -0.523 18222
6078 1 14 . 1 1 62 62 TRP H H 62 8.240 8.240 8.744 -0.504 18222
6079 1 14 . 1 1 63 63 SER N N 63 113.320 113.320 115.122 -1.802 18222
6080 1 14 . 1 1 63 63 SER CA C 63 61.100 61.100 61.174 -0.074 18222
6081 1 14 . 1 1 63 63 SER H H 63 8.410 8.410 8.359 0.051 18222
6082 1 14 . 1 1 64 64 LEU N N 64 123.230 123.230 121.974 1.256 18222
6083 1 14 . 1 1 64 64 LEU CA C 64 56.880 56.880 57.682 -0.802 18222
6084 1 14 . 1 1 64 64 LEU CB C 64 40.830 40.830 41.927 -1.097 18222
6085 1 14 . 1 1 64 64 LEU H H 64 7.230 7.230 7.883 -0.653 18222
6086 1 14 . 1 1 65 65 LEU N N 65 119.400 119.400 120.405 -1.005 18222
6087 1 14 . 1 1 65 65 LEU HA H 65 3.890 3.890 4.047 -0.157 18222
6088 1 14 . 1 1 65 65 LEU CA C 65 57.580 57.580 58.233 -0.653 18222
6089 1 14 . 1 1 65 65 LEU CB C 65 40.710 40.710 41.618 -0.908 18222
6090 1 14 . 1 1 65 65 LEU H H 65 7.510 7.510 8.554 -1.044 18222
6091 1 14 . 1 1 66 66 VAL N N 66 116.950 116.950 119.065 -2.115 18222
6092 1 14 . 1 1 66 66 VAL HA H 66 3.960 3.960 3.688 0.272 18222
6093 1 14 . 1 1 66 66 VAL CA C 66 66.260 66.260 65.515 0.745 18222
6094 1 14 . 1 1 66 66 VAL CB C 66 30.570 30.570 31.074 -0.504 18222
6095 1 14 . 1 1 66 66 VAL H H 66 7.950 7.950 8.361 -0.411 18222
6096 1 14 . 1 1 67 67 ALA N N 67 120.650 120.650 122.546 -1.896 18222
6097 1 14 . 1 1 67 67 ALA HA H 67 4.000 4.000 4.073 -0.073 18222
6098 1 14 . 1 1 67 67 ALA CA C 67 54.780 54.780 55.096 -0.316 18222
6099 1 14 . 1 1 67 67 ALA CB C 67 17.440 17.440 18.427 -0.987 18222
6100 1 14 . 1 1 67 67 ALA H H 67 7.450 7.450 8.151 -0.701 18222
6101 1 14 . 1 1 68 68 VAL N N 68 118.440 118.440 119.009 -0.569 18222
6102 1 14 . 1 1 68 68 VAL HA H 68 3.750 3.750 3.750 0.000 18222
6103 1 14 . 1 1 68 68 VAL CA C 68 65.250 65.250 65.481 -0.231 18222
6104 1 14 . 1 1 68 68 VAL CB C 68 30.850 30.850 31.420 -0.570 18222
6105 1 14 . 1 1 68 68 VAL H H 68 7.960 7.960 7.907 0.053 18222
6106 1 14 . 1 1 69 69 VAL N N 69 120.800 120.800 120.732 0.068 18222
6107 1 14 . 1 1 69 69 VAL HA H 69 4.220 4.220 3.596 0.624 18222
6108 1 14 . 1 1 69 69 VAL CA C 69 66.020 66.020 66.992 -0.972 18222
6109 1 14 . 1 1 69 69 VAL CB C 69 30.850 30.850 30.865 -0.015 18222
6110 1 14 . 1 1 69 69 VAL H H 69 8.080 8.080 8.537 -0.458 18222
6111 1 14 . 1 1 70 70 ALA N N 70 121.740 121.740 120.639 1.101 18222
6112 1 14 . 1 1 70 70 ALA HA H 70 3.920 3.920 4.240 -0.320 18222
6113 1 14 . 1 1 70 70 ALA CA C 70 54.920 54.920 55.281 -0.361 18222
6114 1 14 . 1 1 70 70 ALA CB C 70 17.620 17.620 18.070 -0.449 18222
6115 1 14 . 1 1 70 70 ALA H H 70 8.660 8.660 8.501 0.159 18222
6116 1 14 . 1 1 71 71 GLY N N 71 103.450 103.450 107.430 -3.980 18222
6117 1 14 . 1 1 71 71 GLY CA C 71 46.300 46.300 47.057 -0.757 18222
6118 1 14 . 1 1 71 71 GLY H H 71 8.010 8.010 8.041 -0.031 18222
6119 1 14 . 1 1 72 72 SER N N 72 118.160 118.160 117.043 1.117 18222
6120 1 14 . 1 1 72 72 SER CA C 72 61.260 61.260 61.823 -0.563 18222
6121 1 14 . 1 1 72 72 SER CB C 72 62.870 62.870 63.143 -0.273 18222
6122 1 14 . 1 1 72 72 SER H H 72 7.870 7.870 8.206 -0.336 18222
6123 1 14 . 1 1 73 73 VAL N N 73 121.340 121.340 121.812 -0.472 18222
6124 1 14 . 1 1 73 73 VAL CA C 73 65.750 65.750 66.318 -0.568 18222
6125 1 14 . 1 1 73 73 VAL CB C 73 30.740 30.740 30.942 -0.202 18222
6126 1 14 . 1 1 73 73 VAL H H 73 8.050 8.050 8.230 -0.180 18222
6127 1 14 . 1 1 74 74 VAL N N 74 118.680 118.680 119.166 -0.486 18222
6128 1 14 . 1 1 74 74 VAL CA C 74 65.770 65.770 66.820 -1.050 18222
6129 1 14 . 1 1 74 74 VAL CB C 74 30.740 30.740 30.641 0.099 18222
6130 1 14 . 1 1 74 74 VAL H H 74 7.880 7.880 8.658 -0.778 18222
6131 1 14 . 1 1 75 75 SER N N 75 114.750 114.750 116.664 -1.914 18222
6132 1 14 . 1 1 75 75 SER HA H 75 4.100 4.100 4.233 -0.133 18222
6133 1 14 . 1 1 75 75 SER CA C 75 60.870 60.870 62.414 -1.544 18222
6134 1 14 . 1 1 75 75 SER CB C 75 62.340 62.340 63.108 -0.768 18222
6135 1 14 . 1 1 75 75 SER H H 75 7.870 7.870 8.046 -0.176 18222
6136 1 14 . 1 1 76 76 TYR N N 76 121.110 121.110 122.659 -1.549 18222
6137 1 14 . 1 1 76 76 TYR CA C 76 60.050 60.050 61.836 -1.786 18222
6138 1 14 . 1 1 76 76 TYR CB C 76 37.980 37.980 38.690 -0.710 18222
6139 1 14 . 1 1 76 76 TYR H H 76 7.860 7.860 8.683 -0.823 18222
6140 1 14 . 1 1 77 77 GLY N N 77 107.300 107.300 106.737 0.563 18222
6141 1 14 . 1 1 77 77 GLY CA C 77 46.560 46.560 47.350 -0.790 18222
6142 1 14 . 1 1 77 77 GLY H H 77 8.200 8.200 8.614 -0.414 18222
6143 1 14 . 1 1 78 78 VAL N N 78 119.470 119.470 121.665 -2.195 18222
6144 1 14 . 1 1 78 78 VAL HA H 78 4.170 4.170 3.638 0.532 18222
6145 1 14 . 1 1 78 78 VAL CA C 78 64.650 64.650 66.284 -1.634 18222
6146 1 14 . 1 1 78 78 VAL H H 78 8.140 8.140 8.620 -0.480 18222
6147 1 14 . 1 1 79 79 THR N N 79 112.100 112.100 116.713 -4.613 18222
6148 1 14 . 1 1 79 79 THR CA C 79 63.460 63.460 66.924 -3.465 18222
6149 1 14 . 1 1 79 79 THR CB C 79 68.650 68.650 68.438 0.212 18222
6150 1 14 . 1 1 79 79 THR H H 79 7.640 7.640 7.995 -0.355 18222
6151 1 14 . 1 1 80 80 ARG N N 80 120.770 120.770 121.925 -1.155 18222
6152 1 14 . 1 1 80 80 ARG HA H 80 4.160 4.160 4.048 0.112 18222
6153 1 14 . 1 1 80 80 ARG CA C 80 56.790 56.790 59.834 -3.044 18222
6154 1 14 . 1 1 80 80 ARG CB C 80 29.430 29.430 30.198 -0.768 18222
6155 1 14 . 1 1 80 80 ARG H H 80 7.680 7.680 7.978 -0.298 18222
6156 1 14 . 1 1 81 81 VAL N N 81 118.370 118.370 119.383 -1.013 18222
6157 1 14 . 1 1 81 81 VAL HA H 81 3.920 3.920 3.717 0.203 18222
6158 1 14 . 1 1 81 81 VAL CA C 81 63.340 63.340 65.974 -2.634 18222
6159 1 14 . 1 1 81 81 VAL CB C 81 31.260 31.260 31.362 -0.102 18222
6160 1 14 . 1 1 81 81 VAL H H 81 7.730 7.730 8.244 -0.514 18222
6161 1 14 . 1 1 82 82 GLU N N 82 120.620 120.620 119.627 0.993 18222
6162 1 14 . 1 1 82 82 GLU CA C 82 56.320 56.320 59.282 -2.962 18222
6163 1 14 . 1 1 82 82 GLU CB C 82 27.930 27.930 29.387 -1.456 18222
6164 1 14 . 1 1 82 82 GLU H H 82 7.920 7.920 8.505 -0.585 18222
6165 1 14 . 1 1 83 83 SER N N 83 116.240 116.240 115.656 0.584 18222
6166 1 14 . 1 1 83 83 SER CA C 83 59.250 59.250 61.754 -2.504 18222
6167 1 14 . 1 1 83 83 SER CB C 83 63.160 63.160 62.849 0.311 18222
6168 1 14 . 1 1 83 83 SER H H 83 7.960 7.960 7.968 -0.008 18222
6169 1 14 . 1 1 84 84 GLU N N 84 123.280 123.280 122.333 0.947 18222
6170 1 14 . 1 1 84 84 GLU HA H 84 4.080 4.080 3.953 0.127 18222
6171 1 14 . 1 1 84 84 GLU CA C 84 57.860 57.860 59.965 -2.105 18222
6172 1 14 . 1 1 84 84 GLU CB C 84 28.190 28.190 29.678 -1.488 18222
6173 1 14 . 1 1 84 84 GLU H H 84 8.470 8.470 8.181 0.289 18222
6174 1 14 . 1 1 85 85 LYS N N 85 118.650 118.650 119.862 -1.212 18222
6175 1 14 . 1 1 85 85 LYS HA H 85 4.100 4.100 4.076 0.024 18222
6176 1 14 . 1 1 85 85 LYS CA C 85 57.780 57.780 59.390 -1.610 18222
6177 1 14 . 1 1 85 85 LYS CB C 85 31.380 31.380 32.476 -1.096 18222
6178 1 14 . 1 1 85 85 LYS H H 85 7.940 7.940 8.104 -0.164 18222
6179 1 14 . 1 1 86 86 CYS N N 86 117.070 117.070 118.279 -1.209 18222
6180 1 14 . 1 1 86 86 CYS CA C 86 60.910 60.910 61.721 -0.811 18222
6181 1 14 . 1 1 86 86 CYS CB C 86 26.740 26.740 26.199 0.541 18222
6182 1 14 . 1 1 86 86 CYS H H 86 7.840 7.840 8.123 -0.283 18222
6183 1 14 . 1 1 87 87 ASN N N 87 119.370 119.370 119.763 -0.393 18222
6184 1 14 . 1 1 87 87 ASN HA H 87 4.130 4.130 4.403 -0.273 18222
6185 1 14 . 1 1 87 87 ASN CA C 87 55.750 55.750 56.694 -0.944 18222
6186 1 14 . 1 1 87 87 ASN CB C 87 38.050 38.050 38.257 -0.207 18222
6187 1 14 . 1 1 87 87 ASN H H 87 8.110 8.110 8.276 -0.166 18222
6188 1 14 . 1 1 88 88 ASN N N 88 117.570 117.570 119.719 -2.149 18222
6189 1 14 . 1 1 88 88 ASN HA H 88 4.280 4.280 4.618 -0.338 18222
6190 1 14 . 1 1 88 88 ASN CA C 88 55.190 55.190 56.499 -1.309 18222
6191 1 14 . 1 1 88 88 ASN CB C 88 37.400 37.400 38.447 -1.047 18222
6192 1 14 . 1 1 88 88 ASN H H 88 8.280 8.280 8.289 -0.009 18222
6193 1 14 . 1 1 89 89 LEU N N 89 121.940 121.940 121.539 0.401 18222
6194 1 14 . 1 1 89 89 LEU HA H 89 4.070 4.070 3.904 0.166 18222
6195 1 14 . 1 1 89 89 LEU CA C 89 57.580 57.580 58.683 -1.103 18222
6196 1 14 . 1 1 89 89 LEU CB C 89 40.490 40.490 41.151 -0.661 18222
6197 1 14 . 1 1 89 89 LEU H H 89 7.790 7.790 8.448 -0.658 18222
6198 1 14 . 1 1 90 90 TRP N N 90 119.220 119.220 120.089 -0.869 18222
6199 1 14 . 1 1 90 90 TRP CA C 90 59.120 59.120 59.941 -0.822 18222
6200 1 14 . 1 1 90 90 TRP CB C 90 28.800 28.800 29.691 -0.891 18222
6201 1 14 . 1 1 90 90 TRP H H 90 7.850 7.850 8.487 -0.637 18222
6202 1 14 . 1 1 91 91 LEU N N 91 117.870 117.870 121.257 -3.387 18222
6203 1 14 . 1 1 91 91 LEU CA C 91 57.300 57.300 58.087 -0.788 18222
6204 1 14 . 1 1 91 91 LEU CB C 91 40.610 40.610 41.112 -0.502 18222
6205 1 14 . 1 1 91 91 LEU H H 91 7.920 7.920 8.436 -0.516 18222
6206 1 14 . 1 1 92 92 PHE N N 92 121.280 121.280 118.357 2.923 18222
6207 1 14 . 1 1 92 92 PHE CA C 92 60.390 60.390 62.001 -1.611 18222
6208 1 14 . 1 1 92 92 PHE CB C 92 37.980 37.980 38.216 -0.236 18222
6209 1 14 . 1 1 92 92 PHE H H 92 7.860 7.860 8.664 -0.804 18222
6210 1 14 . 1 1 93 93 LEU N N 93 119.860 119.860 121.126 -1.266 18222
6211 1 14 . 1 1 93 93 LEU CA C 93 56.860 56.860 57.925 -1.065 18222
6212 1 14 . 1 1 93 93 LEU CB C 93 40.550 40.550 41.467 -0.917 18222
6213 1 14 . 1 1 93 93 LEU H H 93 7.980 7.980 8.561 -0.581 18222
6214 1 14 . 1 1 94 94 GLU N N 94 114.660 114.660 116.444 -1.784 18222
6215 1 14 . 1 1 94 94 GLU HA H 94 3.810 3.810 4.016 -0.206 18222
6216 1 14 . 1 1 94 94 GLU CA C 94 57.210 57.210 59.039 -1.829 18222
6217 1 14 . 1 1 94 94 GLU CB C 94 28.470 28.470 29.558 -1.088 18222
6218 1 14 . 1 1 94 94 GLU H H 94 7.890 7.890 8.495 -0.605 18222
6219 1 14 . 1 1 95 95 THR N N 95 108.260 108.260 111.472 -3.212 18222
6220 1 14 . 1 1 95 95 THR CA C 95 62.150 62.150 62.943 -0.792 18222
6221 1 14 . 1 1 95 95 THR CB C 95 70.810 70.810 68.909 1.901 18222
6222 1 14 . 1 1 95 95 THR H H 95 7.690 7.690 7.576 0.114 18222
6223 1 14 . 1 1 96 96 GLY N N 96 112.220 112.220 110.138 2.082 18222
6224 1 14 . 1 1 96 96 GLY CA C 96 45.410 45.410 45.914 -0.504 18222
6225 1 14 . 1 1 96 96 GLY H H 96 8.240 8.240 8.178 0.062 18222
6226 1 14 . 1 1 97 97 GLN N N 97 117.950 117.950 119.655 -1.705 18222
6227 1 14 . 1 1 97 97 GLN HA H 97 4.200 4.200 4.312 -0.112 18222
6228 1 14 . 1 1 97 97 GLN CA C 97 54.430 54.430 55.677 -1.247 18222
6229 1 14 . 1 1 97 97 GLN CB C 97 29.910 29.910 29.624 0.286 18222
6230 1 14 . 1 1 97 97 GLN H H 97 7.640 7.640 7.948 -0.308 18222
6231 1 14 . 1 1 98 98 LEU N N 98 123.810 123.810 125.292 -1.482 18222
6232 1 14 . 1 1 98 98 LEU HA H 98 4.360 4.360 4.552 -0.192 18222
6233 1 14 . 1 1 98 98 LEU CA C 98 52.650 52.650 53.210 -0.560 18222
6234 1 14 . 1 1 98 98 LEU CB C 98 40.460 40.460 41.144 -0.684 18222
6235 1 14 . 1 1 98 98 LEU H H 98 8.270 8.270 8.396 -0.126 18222
6236 1 14 . 1 1 99 99 PRO CA C 99 63.180 63.180 61.939 1.241 18222
6237 1 14 . 1 1 99 99 PRO CB C 99 30.840 30.840 32.532 -1.692 18222
6238 1 14 . 1 1 100 100 LYS N N 100 120.630 120.630 118.792 1.838 18222
6239 1 14 . 1 1 100 100 LYS CA C 100 55.730 55.730 58.251 -2.521 18222
6240 1 14 . 1 1 100 100 LYS CB C 100 32.280 32.280 32.555 -0.275 18222
6241 1 14 . 1 1 100 100 LYS H H 100 8.090 8.090 8.304 -0.214 18222
6242 1 14 . 1 1 101 101 ASP N N 101 120.920 120.920 117.181 3.739 18222
6243 1 14 . 1 1 101 101 ASP HA H 101 4.190 4.190 4.853 -0.663 18222
6244 1 14 . 1 1 101 101 ASP CA C 101 54.000 54.000 53.366 0.634 18222
6245 1 14 . 1 1 101 101 ASP CB C 101 40.330 40.330 42.589 -2.259 18222
6246 1 14 . 1 1 101 101 ASP H H 101 8.190 8.190 8.091 0.099 18222
6247 1 14 . 1 1 102 102 ARG N N 102 122.210 122.210 121.221 0.989 18222
6248 1 14 . 1 1 102 102 ARG CA C 102 55.590 55.590 55.367 0.223 18222
6249 1 14 . 1 1 102 102 ARG CB C 102 29.630 29.630 31.778 -2.148 18222
6250 1 14 . 1 1 102 102 ARG H H 102 8.130 8.130 8.483 -0.353 18222
6251 1 14 . 1 1 103 103 SER N N 103 117.230 117.230 116.626 0.604 18222
6252 1 14 . 1 1 103 103 SER HA H 103 4.280 4.280 4.600 -0.320 18222
6253 1 14 . 1 1 103 103 SER CA C 103 58.470 58.470 58.381 0.089 18222
6254 1 14 . 1 1 103 103 SER CB C 103 63.080 63.080 64.471 -1.391 18222
6255 1 14 . 1 1 103 103 SER H H 103 8.290 8.290 8.584 -0.294 18222
6256 1 14 . 1 1 104 104 THR N N 104 115.430 115.430 116.906 -1.476 18222
6257 1 14 . 1 1 104 104 THR CA C 104 61.570 61.570 62.028 -0.458 18222
6258 1 14 . 1 1 104 104 THR CB C 104 69.030 69.030 70.022 -0.992 18222
6259 1 14 . 1 1 104 104 THR H H 104 8.020 8.020 8.022 -0.002 18222
6260 1 14 . 1 1 105 105 ASP N N 105 122.780 122.780 122.981 -0.201 18222
6261 1 14 . 1 1 105 105 ASP CA C 105 54.210 54.210 53.575 0.634 18222
6262 1 14 . 1 1 105 105 ASP CB C 105 40.380 40.380 43.237 -2.857 18222
6263 1 14 . 1 1 105 105 ASP H H 105 8.120 8.120 8.512 -0.392 18222
6264 1 14 . 1 1 106 106 GLN N N 106 120.960 120.960 119.187 1.773 18222
6265 1 14 . 1 1 106 106 GLN CA C 106 55.420 55.420 56.225 -0.805 18222
6266 1 14 . 1 1 106 106 GLN CB C 106 28.310 28.310 30.715 -2.405 18222
6267 1 14 . 1 1 106 106 GLN H H 106 8.140 8.140 8.604 -0.464 18222
6268 1 14 . 1 1 107 107 ARG N N 107 123.010 123.010 122.736 0.274 18222
6269 1 14 . 1 1 107 107 ARG HA H 107 4.210 4.210 4.628 -0.418 18222
6270 1 14 . 1 1 107 107 ARG CA C 107 55.560 55.560 55.985 -0.425 18222
6271 1 14 . 1 1 107 107 ARG CB C 107 29.920 29.920 31.687 -1.767 18222
6272 1 14 . 1 1 107 107 ARG H H 107 8.180 8.180 8.495 -0.315 18222
6273 1 15 . 1 1 2 2 VAL N N 2 121.590 121.590 123.154 -1.564 18222
6274 1 15 . 1 1 2 2 VAL CA C 2 61.600 61.600 61.561 0.039 18222
6275 1 15 . 1 1 2 2 VAL CB C 2 31.900 31.900 33.520 -1.619 18222
6276 1 15 . 1 1 2 2 VAL H H 2 8.010 8.010 8.208 -0.198 18222
6277 1 15 . 1 1 3 3 ASN N N 3 122.520 122.520 123.473 -0.953 18222
6278 1 15 . 1 1 3 3 ASN HA H 3 4.020 4.020 5.055 -1.035 18222
6279 1 15 . 1 1 3 3 ASN CA C 3 52.640 52.640 53.488 -0.848 18222
6280 1 15 . 1 1 3 3 ASN CB C 3 38.330 38.330 39.826 -1.496 18222
6281 1 15 . 1 1 3 3 ASN H H 3 8.360 8.360 8.255 0.105 18222
6282 1 15 . 1 1 4 4 LEU N N 4 123.830 123.830 123.142 0.688 18222
6283 1 15 . 1 1 4 4 LEU HA H 4 4.220 4.220 4.780 -0.560 18222
6284 1 15 . 1 1 4 4 LEU CA C 4 54.620 54.620 54.587 0.033 18222
6285 1 15 . 1 1 4 4 LEU CB C 4 41.680 41.680 44.020 -2.340 18222
6286 1 15 . 1 1 4 4 LEU H H 4 8.220 8.220 8.693 -0.473 18222
6287 1 15 . 1 1 5 5 GLY N N 5 106.810 106.810 111.612 -4.802 18222
6288 1 15 . 1 1 5 5 GLY CA C 5 45.800 45.800 44.749 1.051 18222
6289 1 15 . 1 1 5 5 GLY H H 5 8.030 8.030 8.267 -0.237 18222
6290 1 15 . 1 1 6 6 LEU N N 6 120.820 120.820 121.524 -0.704 18222
6291 1 15 . 1 1 6 6 LEU HA H 6 4.050 4.050 4.585 -0.535 18222
6292 1 15 . 1 1 6 6 LEU CA C 6 55.990 55.990 56.876 -0.886 18222
6293 1 15 . 1 1 6 6 LEU CB C 6 40.800 40.800 42.718 -1.918 18222
6294 1 15 . 1 1 6 6 LEU H H 6 8.030 8.030 8.382 -0.352 18222
6295 1 15 . 1 1 7 7 SER N N 7 115.540 115.540 116.682 -1.142 18222
6296 1 15 . 1 1 7 7 SER HA H 7 4.100 4.100 4.258 -0.158 18222
6297 1 15 . 1 1 7 7 SER CA C 7 60.580 60.580 60.878 -0.298 18222
6298 1 15 . 1 1 7 7 SER CB C 7 62.060 62.060 62.215 -0.155 18222
6299 1 15 . 1 1 7 7 SER H H 7 8.360 8.360 8.416 -0.056 18222
6300 1 15 . 1 1 8 8 ARG N N 8 120.690 120.690 120.902 -0.212 18222
6301 1 15 . 1 1 8 8 ARG HA H 8 4.160 4.160 4.153 0.007 18222
6302 1 15 . 1 1 8 8 ARG CA C 8 57.350 57.350 59.430 -2.080 18222
6303 1 15 . 1 1 8 8 ARG CB C 8 29.230 29.230 30.195 -0.965 18222
6304 1 15 . 1 1 8 8 ARG H H 8 7.830 7.830 8.436 -0.606 18222
6305 1 15 . 1 1 9 9 VAL N N 9 119.330 119.330 119.713 -0.383 18222
6306 1 15 . 1 1 9 9 VAL HA H 9 4.170 4.170 3.681 0.489 18222
6307 1 15 . 1 1 9 9 VAL CA C 9 64.720 64.720 66.228 -1.508 18222
6308 1 15 . 1 1 9 9 VAL CB C 9 30.900 30.900 31.502 -0.602 18222
6309 1 15 . 1 1 9 9 VAL H H 9 7.620 7.620 7.584 0.036 18222
6310 1 15 . 1 1 10 10 ASP N N 10 119.520 119.520 120.795 -1.275 18222
6311 1 15 . 1 1 10 10 ASP CA C 10 54.960 54.960 57.814 -2.854 18222
6312 1 15 . 1 1 10 10 ASP CB C 10 37.800 37.800 40.304 -2.504 18222
6313 1 15 . 1 1 10 10 ASP H H 10 8.180 8.180 8.265 -0.085 18222
6314 1 15 . 1 1 11 11 ASP N N 11 121.550 121.550 119.967 1.583 18222
6315 1 15 . 1 1 11 11 ASP CA C 11 54.440 54.440 56.905 -2.465 18222
6316 1 15 . 1 1 11 11 ASP CB C 11 37.840 37.840 41.230 -3.390 18222
6317 1 15 . 1 1 11 11 ASP H H 11 7.950 7.950 8.303 -0.353 18222
6318 1 15 . 1 1 12 12 ALA N N 12 120.220 120.220 122.682 -2.462 18222
6319 1 15 . 1 1 12 12 ALA CA C 12 54.370 54.370 55.264 -0.894 18222
6320 1 15 . 1 1 12 12 ALA CB C 12 24.730 24.730 18.549 6.181 18222
6321 1 15 . 1 1 12 12 ALA H H 12 8.090 8.090 7.868 0.222 18222
6322 1 15 . 1 1 13 13 VAL N N 13 116.910 116.910 115.668 1.242 18222
6323 1 15 . 1 1 13 13 VAL HA H 13 4.140 4.140 3.708 0.432 18222
6324 1 15 . 1 1 13 13 VAL CA C 13 64.900 64.900 66.033 -1.133 18222
6325 1 15 . 1 1 13 13 VAL CB C 13 31.000 31.000 31.459 -0.459 18222
6326 1 15 . 1 1 13 13 VAL H H 13 7.980 7.980 8.143 -0.163 18222
6327 1 15 . 1 1 14 14 ALA N N 14 122.200 122.200 123.192 -0.992 18222
6328 1 15 . 1 1 14 14 ALA HA H 14 4.020 4.020 4.156 -0.136 18222
6329 1 15 . 1 1 14 14 ALA CA C 14 53.800 53.800 54.761 -0.961 18222
6330 1 15 . 1 1 14 14 ALA CB C 14 17.790 17.790 18.543 -0.753 18222
6331 1 15 . 1 1 14 14 ALA H H 14 8.030 8.030 7.926 0.104 18222
6332 1 15 . 1 1 15 15 ALA N N 15 118.600 118.600 119.552 -0.952 18222
6333 1 15 . 1 1 15 15 ALA CA C 15 53.230 53.230 54.297 -1.067 18222
6334 1 15 . 1 1 15 15 ALA CB C 15 18.010 18.010 18.903 -0.893 18222
6335 1 15 . 1 1 15 15 ALA H H 15 7.530 7.530 7.844 -0.314 18222
6336 1 15 . 1 1 16 16 LYS N N 16 115.820 115.820 116.740 -0.920 18222
6337 1 15 . 1 1 16 16 LYS HA H 16 4.080 4.080 4.247 -0.167 18222
6338 1 15 . 1 1 16 16 LYS CA C 16 55.670 55.670 57.172 -1.502 18222
6339 1 15 . 1 1 16 16 LYS CB C 16 32.640 32.640 33.881 -1.241 18222
6340 1 15 . 1 1 16 16 LYS H H 16 7.490 7.490 7.759 -0.269 18222
6341 1 15 . 1 1 17 17 HIS N N 17 116.790 116.790 118.714 -1.924 18222
6342 1 15 . 1 1 17 17 HIS HA H 17 4.100 4.100 4.966 -0.867 18222
6343 1 15 . 1 1 17 17 HIS CA C 17 52.820 52.820 53.555 -0.735 18222
6344 1 15 . 1 1 17 17 HIS CB C 17 28.400 28.400 30.505 -2.105 18222
6345 1 15 . 1 1 17 17 HIS H H 17 8.130 8.130 8.423 -0.293 18222
6346 1 15 . 1 1 18 18 PRO CA C 18 63.800 63.800 63.916 -0.116 18222
6347 1 15 . 1 1 18 18 PRO CB C 18 30.800 30.800 32.423 -1.623 18222
6348 1 15 . 1 1 19 19 GLY N N 19 110.260 110.260 106.147 4.113 18222
6349 1 15 . 1 1 19 19 GLY CA C 19 45.490 45.490 45.135 0.355 18222
6350 1 15 . 1 1 19 19 GLY H H 19 8.730 8.730 8.171 0.559 18222
6351 1 15 . 1 1 20 20 LEU N N 20 122.650 122.650 123.902 -1.252 18222
6352 1 15 . 1 1 20 20 LEU HA H 20 4.090 4.090 4.585 -0.495 18222
6353 1 15 . 1 1 20 20 LEU CA C 20 57.060 57.060 56.638 0.422 18222
6354 1 15 . 1 1 20 20 LEU H H 20 7.980 7.980 8.405 -0.425 18222
6355 1 15 . 1 1 21 21 GLY N N 21 107.000 107.000 106.895 0.105 18222
6356 1 15 . 1 1 21 21 GLY CA C 21 46.710 46.710 47.647 -0.937 18222
6357 1 15 . 1 1 21 21 GLY H H 21 8.570 8.570 8.258 0.312 18222
6358 1 15 . 1 1 22 22 GLU N N 22 121.610 121.610 120.746 0.864 18222
6359 1 15 . 1 1 22 22 GLU HA H 22 3.990 3.990 3.910 0.080 18222
6360 1 15 . 1 1 22 22 GLU CA C 22 58.280 58.280 59.484 -1.204 18222
6361 1 15 . 1 1 22 22 GLU CB C 22 28.010 28.010 29.151 -1.141 18222
6362 1 15 . 1 1 22 22 GLU H H 22 8.100 8.100 8.584 -0.484 18222
6363 1 15 . 1 1 23 23 TYR N N 23 120.870 120.870 119.063 1.807 18222
6364 1 15 . 1 1 23 23 TYR CA C 23 60.380 60.380 61.406 -1.026 18222
6365 1 15 . 1 1 23 23 TYR CB C 23 37.750 37.750 38.150 -0.400 18222
6366 1 15 . 1 1 23 23 TYR H H 23 7.910 7.910 7.509 0.401 18222
6367 1 15 . 1 1 24 24 ALA N N 24 121.420 121.420 122.028 -0.608 18222
6368 1 15 . 1 1 24 24 ALA HA H 24 4.140 4.140 4.247 -0.107 18222
6369 1 15 . 1 1 24 24 ALA CA C 24 54.260 54.260 54.841 -0.581 18222
6370 1 15 . 1 1 24 24 ALA H H 24 8.410 8.410 8.365 0.045 18222
6371 1 15 . 1 1 25 25 ALA N N 25 120.220 120.220 121.323 -1.103 18222
6372 1 15 . 1 1 25 25 ALA CA C 25 54.370 54.370 54.632 -0.262 18222
6373 1 15 . 1 1 25 25 ALA H H 25 8.090 8.090 8.271 -0.181 18222
6374 1 15 . 1 1 26 26 CYS N N 26 116.760 116.760 117.360 -0.600 18222
6375 1 15 . 1 1 26 26 CYS CA C 26 61.180 61.180 63.055 -1.875 18222
6376 1 15 . 1 1 26 26 CYS CB C 26 26.390 26.390 27.479 -1.089 18222
6377 1 15 . 1 1 26 26 CYS H H 26 7.950 7.950 8.185 -0.235 18222
6378 1 15 . 1 1 27 27 GLN N N 27 118.690 118.690 120.347 -1.657 18222
6379 1 15 . 1 1 27 27 GLN CA C 27 55.970 55.970 59.837 -3.866 18222
6380 1 15 . 1 1 27 27 GLN H H 27 8.060 8.060 8.310 -0.250 18222
6381 1 15 . 1 1 28 28 SER N N 28 115.490 115.490 115.734 -0.244 18222
6382 1 15 . 1 1 28 28 SER HA H 28 3.990 3.990 4.104 -0.114 18222
6383 1 15 . 1 1 28 28 SER CA C 28 61.110 61.110 61.747 -0.637 18222
6384 1 15 . 1 1 28 28 SER H H 28 7.980 7.980 8.333 -0.353 18222
6385 1 15 . 1 1 29 29 HIS N N 29 120.880 120.880 122.097 -1.217 18222
6386 1 15 . 1 1 29 29 HIS CA C 29 58.190 58.190 59.331 -1.141 18222
6387 1 15 . 1 1 29 29 HIS CB C 29 27.460 27.460 29.417 -1.957 18222
6388 1 15 . 1 1 29 29 HIS H H 29 8.180 8.180 8.381 -0.201 18222
6389 1 15 . 1 1 30 30 ALA N N 30 122.920 122.920 122.963 -0.043 18222
6390 1 15 . 1 1 30 30 ALA CA C 30 54.560 54.560 55.391 -0.831 18222
6391 1 15 . 1 1 30 30 ALA CB C 30 17.490 17.490 18.268 -0.778 18222
6392 1 15 . 1 1 30 30 ALA H H 30 8.040 8.040 8.048 -0.008 18222
6393 1 15 . 1 1 31 31 PHE N N 31 119.340 119.340 119.369 -0.029 18222
6394 1 15 . 1 1 31 31 PHE CA C 31 60.370 60.370 61.912 -1.542 18222
6395 1 15 . 1 1 31 31 PHE CB C 31 38.520 38.520 39.213 -0.693 18222
6396 1 15 . 1 1 31 31 PHE H H 31 8.230 8.230 8.359 -0.129 18222
6397 1 15 . 1 1 32 32 MET N N 32 118.110 118.110 118.589 -0.479 18222
6398 1 15 . 1 1 32 32 MET HA H 32 4.050 4.050 4.144 -0.094 18222
6399 1 15 . 1 1 32 32 MET CA C 32 58.280 58.280 59.150 -0.870 18222
6400 1 15 . 1 1 32 32 MET CB C 32 31.090 31.090 32.506 -1.416 18222
6401 1 15 . 1 1 32 32 MET H H 32 8.120 8.120 8.449 -0.329 18222
6402 1 15 . 1 1 33 33 LYS N N 33 119.040 119.040 119.692 -0.652 18222
6403 1 15 . 1 1 33 33 LYS HA H 33 3.930 3.930 4.006 -0.076 18222
6404 1 15 . 1 1 33 33 LYS CA C 33 59.040 59.040 59.801 -0.761 18222
6405 1 15 . 1 1 33 33 LYS CB C 33 30.990 30.990 32.455 -1.464 18222
6406 1 15 . 1 1 33 33 LYS H H 33 7.970 7.970 8.541 -0.571 18222
6407 1 15 . 1 1 34 34 GLY N N 34 108.840 108.840 107.394 1.446 18222
6408 1 15 . 1 1 34 34 GLY CA C 34 46.610 46.610 47.317 -0.707 18222
6409 1 15 . 1 1 34 34 GLY H H 34 8.030 8.030 8.279 -0.249 18222
6410 1 15 . 1 1 35 35 VAL N N 35 122.910 122.910 122.601 0.309 18222
6411 1 15 . 1 1 35 35 VAL HA H 35 4.220 4.220 3.692 0.528 18222
6412 1 15 . 1 1 35 35 VAL CA C 35 66.310 66.310 67.000 -0.690 18222
6413 1 15 . 1 1 35 35 VAL CB C 35 30.560 30.560 31.869 -1.309 18222
6414 1 15 . 1 1 35 35 VAL H H 35 8.090 8.090 8.105 -0.015 18222
6415 1 15 . 1 1 36 36 PHE N N 36 120.020 120.020 120.538 -0.518 18222
6416 1 15 . 1 1 36 36 PHE CA C 36 61.350 61.350 62.850 -1.500 18222
6417 1 15 . 1 1 36 36 PHE CB C 36 38.090 38.090 39.143 -1.053 18222
6418 1 15 . 1 1 36 36 PHE H H 36 8.350 8.350 8.434 -0.084 18222
6419 1 15 . 1 1 37 37 THR N N 37 116.980 116.980 115.917 1.063 18222
6420 1 15 . 1 1 37 37 THR HA H 37 4.050 4.050 4.009 0.041 18222
6421 1 15 . 1 1 37 37 THR CA C 37 66.000 66.000 67.343 -1.343 18222
6422 1 15 . 1 1 37 37 THR CB C 37 68.270 68.270 68.920 -0.650 18222
6423 1 15 . 1 1 37 37 THR H H 37 8.520 8.520 8.341 0.179 18222
6424 1 15 . 1 1 38 38 PHE N N 38 123.090 123.090 121.500 1.590 18222
6425 1 15 . 1 1 38 38 PHE HA H 38 4.360 4.360 4.220 0.141 18222
6426 1 15 . 1 1 38 38 PHE CA C 38 61.140 61.140 60.781 0.359 18222
6427 1 15 . 1 1 38 38 PHE CB C 38 41.200 41.200 39.407 1.792 18222
6428 1 15 . 1 1 38 38 PHE H H 38 8.010 8.010 7.989 0.021 18222
6429 1 15 . 1 1 39 39 VAL N N 39 117.280 117.280 114.372 2.908 18222
6430 1 15 . 1 1 39 39 VAL HA H 39 4.210 4.210 3.695 0.515 18222
6431 1 15 . 1 1 39 39 VAL CA C 39 66.000 66.000 64.618 1.382 18222
6432 1 15 . 1 1 39 39 VAL CB C 39 30.860 30.860 31.787 -0.927 18222
6433 1 15 . 1 1 39 39 VAL H H 39 8.530 8.530 8.402 0.128 18222
6434 1 15 . 1 1 40 40 THR N N 40 109.470 109.470 115.702 -6.232 18222
6435 1 15 . 1 1 40 40 THR HA H 40 4.060 4.060 4.056 0.004 18222
6436 1 15 . 1 1 40 40 THR CA C 40 63.390 63.390 65.362 -1.972 18222
6437 1 15 . 1 1 40 40 THR CB C 40 68.650 68.650 69.202 -0.552 18222
6438 1 15 . 1 1 40 40 THR H H 40 7.700 7.700 8.010 -0.310 18222
6439 1 15 . 1 1 41 41 GLY N N 41 110.770 110.770 108.153 2.617 18222
6440 1 15 . 1 1 41 41 GLY CA C 41 45.580 45.580 46.148 -0.568 18222
6441 1 15 . 1 1 41 41 GLY H H 41 7.700 7.700 8.396 -0.696 18222
6442 1 15 . 1 1 42 42 THR N N 42 114.520 114.520 112.987 1.533 18222
6443 1 15 . 1 1 42 42 THR CA C 42 63.300 63.300 61.066 2.234 18222
6444 1 15 . 1 1 42 42 THR CB C 42 69.490 69.490 68.338 1.152 18222
6445 1 15 . 1 1 42 42 THR H H 42 7.720 7.720 7.994 -0.274 18222
6446 1 15 . 1 1 43 43 GLY N N 43 109.540 109.540 110.525 -0.985 18222
6447 1 15 . 1 1 43 43 GLY CA C 43 46.250 46.250 46.642 -0.391 18222
6448 1 15 . 1 1 43 43 GLY H H 43 8.110 8.110 8.602 -0.492 18222
6449 1 15 . 1 1 44 44 MET N N 44 120.240 120.240 120.159 0.081 18222
6450 1 15 . 1 1 44 44 MET HA H 44 4.100 4.100 4.200 -0.100 18222
6451 1 15 . 1 1 44 44 MET CA C 44 57.700 57.700 58.438 -0.738 18222
6452 1 15 . 1 1 44 44 MET CB C 44 32.030 32.030 31.497 0.533 18222
6453 1 15 . 1 1 44 44 MET H H 44 7.730 7.730 7.849 -0.119 18222
6454 1 15 . 1 1 45 45 ALA N N 45 121.560 121.560 122.841 -1.281 18222
6455 1 15 . 1 1 45 45 ALA CA C 45 54.440 54.440 54.685 -0.245 18222
6456 1 15 . 1 1 45 45 ALA CB C 45 17.400 17.400 17.879 -0.479 18222
6457 1 15 . 1 1 45 45 ALA H H 45 7.950 7.950 7.622 0.328 18222
6458 1 15 . 1 1 46 46 PHE N N 46 118.260 118.260 118.253 0.007 18222
6459 1 15 . 1 1 46 46 PHE HA H 46 3.930 3.930 4.241 -0.311 18222
6460 1 15 . 1 1 46 46 PHE CA C 46 59.820 59.820 61.590 -1.770 18222
6461 1 15 . 1 1 46 46 PHE CB C 46 38.260 38.260 38.702 -0.442 18222
6462 1 15 . 1 1 46 46 PHE H H 46 7.860 7.860 7.793 0.067 18222
6463 1 15 . 1 1 47 47 GLY N N 47 107.300 107.300 108.253 -0.953 18222
6464 1 15 . 1 1 47 47 GLY CA C 47 46.560 46.560 47.123 -0.563 18222
6465 1 15 . 1 1 47 47 GLY H H 47 8.200 8.200 8.730 -0.530 18222
6466 1 15 . 1 1 48 48 LEU N N 48 121.920 121.920 122.982 -1.062 18222
6467 1 15 . 1 1 48 48 LEU HA H 48 4.040 4.040 3.929 0.111 18222
6468 1 15 . 1 1 48 48 LEU CA C 48 57.580 57.580 58.116 -0.536 18222
6469 1 15 . 1 1 48 48 LEU CB C 48 40.790 40.790 41.972 -1.182 18222
6470 1 15 . 1 1 48 48 LEU H H 48 8.180 8.180 8.293 -0.113 18222
6471 1 15 . 1 1 49 49 GLN N N 49 118.270 118.270 118.455 -0.185 18222
6472 1 15 . 1 1 49 49 GLN HA H 49 3.830 3.830 3.936 -0.106 18222
6473 1 15 . 1 1 49 49 GLN CA C 49 58.880 58.880 59.191 -0.311 18222
6474 1 15 . 1 1 49 49 GLN CB C 49 27.240 27.240 28.585 -1.345 18222
6475 1 15 . 1 1 49 49 GLN H H 49 8.080 8.080 8.127 -0.047 18222
6476 1 15 . 1 1 50 50 MET N N 50 117.630 117.630 119.832 -2.202 18222
6477 1 15 . 1 1 50 50 MET HA H 50 4.010 4.010 4.251 -0.241 18222
6478 1 15 . 1 1 50 50 MET CA C 50 57.730 57.730 58.029 -0.299 18222
6479 1 15 . 1 1 50 50 MET CB C 50 27.160 27.160 32.515 -5.355 18222
6480 1 15 . 1 1 50 50 MET H H 50 7.880 7.880 8.055 -0.175 18222
6481 1 15 . 1 1 51 51 PHE N N 51 119.550 119.550 119.891 -0.341 18222
6482 1 15 . 1 1 51 51 PHE CA C 51 60.850 60.850 62.191 -1.341 18222
6483 1 15 . 1 1 51 51 PHE CB C 51 38.720 38.720 39.110 -0.390 18222
6484 1 15 . 1 1 51 51 PHE H H 51 7.890 7.890 8.325 -0.435 18222
6485 1 15 . 1 1 52 52 ILE N N 52 117.950 117.950 118.093 -0.143 18222
6486 1 15 . 1 1 52 52 ILE HA H 52 4.050 4.050 3.737 0.313 18222
6487 1 15 . 1 1 52 52 ILE CA C 52 63.560 63.560 64.668 -1.108 18222
6488 1 15 . 1 1 52 52 ILE CB C 52 36.810 36.810 38.066 -1.256 18222
6489 1 15 . 1 1 52 52 ILE H H 52 8.110 8.110 8.207 -0.097 18222
6490 1 15 . 1 1 53 53 GLN N N 53 117.360 117.360 119.702 -2.342 18222
6491 1 15 . 1 1 53 53 GLN CA C 53 57.200 57.200 58.402 -1.202 18222
6492 1 15 . 1 1 53 53 GLN CB C 53 27.870 27.870 28.443 -0.573 18222
6493 1 15 . 1 1 53 53 GLN H H 53 7.930 7.930 8.254 -0.324 18222
6494 1 15 . 1 1 54 54 ARG N N 54 116.840 116.840 118.973 -2.133 18222
6495 1 15 . 1 1 54 54 ARG HA H 54 3.950 3.950 4.147 -0.197 18222
6496 1 15 . 1 1 54 54 ARG CA C 54 56.480 56.480 57.935 -1.455 18222
6497 1 15 . 1 1 54 54 ARG CB C 54 28.970 28.970 29.862 -0.892 18222
6498 1 15 . 1 1 54 54 ARG H H 54 7.540 7.540 7.765 -0.225 18222
6499 1 15 . 1 1 55 55 LYS N N 55 117.900 117.900 117.634 0.266 18222
6500 1 15 . 1 1 55 55 LYS HA H 55 4.080 4.080 4.166 -0.086 18222
6501 1 15 . 1 1 55 55 LYS CA C 55 55.030 55.030 57.032 -2.002 18222
6502 1 15 . 1 1 55 55 LYS CB C 55 32.010 32.010 32.972 -0.962 18222
6503 1 15 . 1 1 55 55 LYS H H 55 7.660 7.660 7.308 0.352 18222
6504 1 15 . 1 1 56 56 PHE N N 56 121.060 121.060 121.027 0.033 18222
6505 1 15 . 1 1 56 56 PHE CA C 56 55.190 55.190 55.104 0.086 18222
6506 1 15 . 1 1 56 56 PHE CB C 56 38.970 38.970 40.118 -1.148 18222
6507 1 15 . 1 1 56 56 PHE H H 56 8.080 8.080 7.864 0.216 18222
6508 1 15 . 1 1 57 57 PRO CA C 57 62.390 62.390 63.363 -0.973 18222
6509 1 15 . 1 1 57 57 PRO CB C 57 30.580 30.580 30.363 0.217 18222
6510 1 15 . 1 1 58 58 TYR N N 58 120.240 120.240 124.941 -4.701 18222
6511 1 15 . 1 1 58 58 TYR CA C 58 55.770 55.770 55.153 0.617 18222
6512 1 15 . 1 1 58 58 TYR CB C 58 40.220 40.220 40.840 -0.620 18222
6513 1 15 . 1 1 58 58 TYR H H 58 7.700 7.700 7.929 -0.229 18222
6514 1 15 . 1 1 59 59 PRO CA C 59 62.130 62.130 63.778 -1.648 18222
6515 1 15 . 1 1 59 59 PRO CB C 59 33.340 33.340 32.017 1.323 18222
6516 1 15 . 1 1 60 60 LEU N N 60 122.210 122.210 120.606 1.604 18222
6517 1 15 . 1 1 60 60 LEU CA C 60 54.250 54.250 54.636 -0.386 18222
6518 1 15 . 1 1 60 60 LEU CB C 60 41.470 41.470 42.692 -1.222 18222
6519 1 15 . 1 1 60 60 LEU H H 60 7.880 7.880 7.727 0.153 18222
6520 1 15 . 1 1 61 61 GLN N N 61 122.470 122.470 120.117 2.353 18222
6521 1 15 . 1 1 61 61 GLN CA C 61 54.170 54.170 55.589 -1.419 18222
6522 1 15 . 1 1 61 61 GLN H H 61 7.970 7.970 8.241 -0.271 18222
6523 1 15 . 1 1 62 62 TRP N N 62 124.590 124.590 124.587 0.003 18222
6524 1 15 . 1 1 62 62 TRP CA C 62 59.830 59.830 60.131 -0.301 18222
6525 1 15 . 1 1 62 62 TRP CB C 62 28.800 28.800 29.097 -0.297 18222
6526 1 15 . 1 1 62 62 TRP H H 62 8.240 8.240 8.922 -0.682 18222
6527 1 15 . 1 1 63 63 SER N N 63 113.320 113.320 115.182 -1.862 18222
6528 1 15 . 1 1 63 63 SER CA C 63 61.100 61.100 60.775 0.325 18222
6529 1 15 . 1 1 63 63 SER H H 63 8.410 8.410 7.676 0.734 18222
6530 1 15 . 1 1 64 64 LEU N N 64 123.230 123.230 123.144 0.086 18222
6531 1 15 . 1 1 64 64 LEU CA C 64 56.880 56.880 57.343 -0.463 18222
6532 1 15 . 1 1 64 64 LEU CB C 64 40.830 40.830 41.145 -0.315 18222
6533 1 15 . 1 1 64 64 LEU H H 64 7.230 7.230 7.864 -0.634 18222
6534 1 15 . 1 1 65 65 LEU N N 65 119.400 119.400 121.038 -1.638 18222
6535 1 15 . 1 1 65 65 LEU HA H 65 3.890 3.890 4.142 -0.252 18222
6536 1 15 . 1 1 65 65 LEU CA C 65 57.580 57.580 58.252 -0.672 18222
6537 1 15 . 1 1 65 65 LEU CB C 65 40.710 40.710 40.941 -0.231 18222
6538 1 15 . 1 1 65 65 LEU H H 65 7.510 7.510 8.756 -1.246 18222
6539 1 15 . 1 1 66 66 VAL N N 66 116.950 116.950 119.528 -2.578 18222
6540 1 15 . 1 1 66 66 VAL HA H 66 3.960 3.960 3.847 0.113 18222
6541 1 15 . 1 1 66 66 VAL CA C 66 66.260 66.260 65.344 0.916 18222
6542 1 15 . 1 1 66 66 VAL CB C 66 30.570 30.570 30.887 -0.317 18222
6543 1 15 . 1 1 66 66 VAL H H 66 7.950 7.950 8.545 -0.595 18222
6544 1 15 . 1 1 67 67 ALA N N 67 120.650 120.650 122.733 -2.083 18222
6545 1 15 . 1 1 67 67 ALA HA H 67 4.000 4.000 4.061 -0.061 18222
6546 1 15 . 1 1 67 67 ALA CA C 67 54.780 54.780 55.229 -0.449 18222
6547 1 15 . 1 1 67 67 ALA CB C 67 17.440 17.440 18.323 -0.883 18222
6548 1 15 . 1 1 67 67 ALA H H 67 7.450 7.450 8.124 -0.674 18222
6549 1 15 . 1 1 68 68 VAL N N 68 118.440 118.440 118.672 -0.232 18222
6550 1 15 . 1 1 68 68 VAL HA H 68 3.750 3.750 3.732 0.018 18222
6551 1 15 . 1 1 68 68 VAL CA C 68 65.250 65.250 66.006 -0.756 18222
6552 1 15 . 1 1 68 68 VAL CB C 68 30.850 30.850 31.374 -0.524 18222
6553 1 15 . 1 1 68 68 VAL H H 68 7.960 7.960 7.847 0.113 18222
6554 1 15 . 1 1 69 69 VAL N N 69 120.800 120.800 120.897 -0.097 18222
6555 1 15 . 1 1 69 69 VAL HA H 69 4.220 4.220 3.635 0.585 18222
6556 1 15 . 1 1 69 69 VAL CA C 69 66.020 66.020 67.576 -1.556 18222
6557 1 15 . 1 1 69 69 VAL CB C 69 30.850 30.850 31.254 -0.404 18222
6558 1 15 . 1 1 69 69 VAL H H 69 8.080 8.080 8.557 -0.477 18222
6559 1 15 . 1 1 70 70 ALA N N 70 121.740 121.740 120.562 1.178 18222
6560 1 15 . 1 1 70 70 ALA HA H 70 3.920 3.920 3.984 -0.064 18222
6561 1 15 . 1 1 70 70 ALA CA C 70 54.920 54.920 55.140 -0.220 18222
6562 1 15 . 1 1 70 70 ALA CB C 70 17.620 17.620 17.674 -0.054 18222
6563 1 15 . 1 1 70 70 ALA H H 70 8.660 8.660 8.400 0.260 18222
6564 1 15 . 1 1 71 71 GLY N N 71 103.450 103.450 107.258 -3.808 18222
6565 1 15 . 1 1 71 71 GLY CA C 71 46.300 46.300 46.906 -0.606 18222
6566 1 15 . 1 1 71 71 GLY H H 71 8.010 8.010 7.928 0.082 18222
6567 1 15 . 1 1 72 72 SER N N 72 118.160 118.160 117.711 0.449 18222
6568 1 15 . 1 1 72 72 SER CA C 72 61.260 61.260 61.809 -0.549 18222
6569 1 15 . 1 1 72 72 SER CB C 72 62.870 62.870 63.234 -0.364 18222
6570 1 15 . 1 1 72 72 SER H H 72 7.870 7.870 8.072 -0.202 18222
6571 1 15 . 1 1 73 73 VAL N N 73 121.340 121.340 122.456 -1.116 18222
6572 1 15 . 1 1 73 73 VAL CA C 73 65.750 65.750 66.547 -0.797 18222
6573 1 15 . 1 1 73 73 VAL CB C 73 30.740 30.740 31.436 -0.696 18222
6574 1 15 . 1 1 73 73 VAL H H 73 8.050 8.050 8.302 -0.252 18222
6575 1 15 . 1 1 74 74 VAL N N 74 118.680 118.680 118.629 0.051 18222
6576 1 15 . 1 1 74 74 VAL CA C 74 65.770 65.770 66.246 -0.476 18222
6577 1 15 . 1 1 74 74 VAL CB C 74 30.740 30.740 31.466 -0.726 18222
6578 1 15 . 1 1 74 74 VAL H H 74 7.880 7.880 8.630 -0.750 18222
6579 1 15 . 1 1 75 75 SER N N 75 114.750 114.750 116.736 -1.986 18222
6580 1 15 . 1 1 75 75 SER HA H 75 4.100 4.100 4.170 -0.070 18222
6581 1 15 . 1 1 75 75 SER CA C 75 60.870 60.870 61.456 -0.586 18222
6582 1 15 . 1 1 75 75 SER CB C 75 62.340 62.340 62.848 -0.508 18222
6583 1 15 . 1 1 75 75 SER H H 75 7.870 7.870 7.961 -0.091 18222
6584 1 15 . 1 1 76 76 TYR N N 76 121.110 121.110 121.475 -0.365 18222
6585 1 15 . 1 1 76 76 TYR CA C 76 60.050 60.050 61.405 -1.355 18222
6586 1 15 . 1 1 76 76 TYR CB C 76 37.980 37.980 38.337 -0.357 18222
6587 1 15 . 1 1 76 76 TYR H H 76 7.860 7.860 8.750 -0.890 18222
6588 1 15 . 1 1 77 77 GLY N N 77 107.300 107.300 107.237 0.063 18222
6589 1 15 . 1 1 77 77 GLY CA C 77 46.560 46.560 47.519 -0.959 18222
6590 1 15 . 1 1 77 77 GLY H H 77 8.200 8.200 8.643 -0.443 18222
6591 1 15 . 1 1 78 78 VAL N N 78 119.470 119.470 121.282 -1.812 18222
6592 1 15 . 1 1 78 78 VAL HA H 78 4.170 4.170 3.358 0.811 18222
6593 1 15 . 1 1 78 78 VAL CA C 78 64.650 64.650 65.371 -0.720 18222
6594 1 15 . 1 1 78 78 VAL H H 78 8.140 8.140 8.359 -0.219 18222
6595 1 15 . 1 1 79 79 THR N N 79 112.100 112.100 117.221 -5.121 18222
6596 1 15 . 1 1 79 79 THR CA C 79 63.460 63.460 66.439 -2.978 18222
6597 1 15 . 1 1 79 79 THR CB C 79 68.650 68.650 68.570 0.080 18222
6598 1 15 . 1 1 79 79 THR H H 79 7.640 7.640 7.890 -0.250 18222
6599 1 15 . 1 1 80 80 ARG N N 80 120.770 120.770 122.008 -1.238 18222
6600 1 15 . 1 1 80 80 ARG HA H 80 4.160 4.160 4.180 -0.020 18222
6601 1 15 . 1 1 80 80 ARG CA C 80 56.790 56.790 59.350 -2.560 18222
6602 1 15 . 1 1 80 80 ARG CB C 80 29.430 29.430 30.183 -0.753 18222
6603 1 15 . 1 1 80 80 ARG H H 80 7.680 7.680 8.097 -0.417 18222
6604 1 15 . 1 1 81 81 VAL N N 81 118.370 118.370 117.502 0.868 18222
6605 1 15 . 1 1 81 81 VAL HA H 81 3.920 3.920 3.836 0.084 18222
6606 1 15 . 1 1 81 81 VAL CA C 81 63.340 63.340 66.837 -3.497 18222
6607 1 15 . 1 1 81 81 VAL CB C 81 31.260 31.260 30.979 0.281 18222
6608 1 15 . 1 1 81 81 VAL H H 81 7.730 7.730 8.307 -0.577 18222
6609 1 15 . 1 1 82 82 GLU N N 82 120.620 120.620 120.476 0.144 18222
6610 1 15 . 1 1 82 82 GLU CA C 82 56.320 56.320 59.297 -2.977 18222
6611 1 15 . 1 1 82 82 GLU CB C 82 27.930 27.930 29.126 -1.196 18222
6612 1 15 . 1 1 82 82 GLU H H 82 7.920 7.920 8.444 -0.524 18222
6613 1 15 . 1 1 83 83 SER N N 83 116.240 116.240 115.937 0.303 18222
6614 1 15 . 1 1 83 83 SER CA C 83 59.250 59.250 61.851 -2.601 18222
6615 1 15 . 1 1 83 83 SER CB C 83 63.160 63.160 63.117 0.043 18222
6616 1 15 . 1 1 83 83 SER H H 83 7.960 7.960 8.048 -0.088 18222
6617 1 15 . 1 1 84 84 GLU N N 84 123.280 123.280 122.186 1.094 18222
6618 1 15 . 1 1 84 84 GLU HA H 84 4.080 4.080 4.025 0.055 18222
6619 1 15 . 1 1 84 84 GLU CA C 84 57.860 57.860 59.798 -1.938 18222
6620 1 15 . 1 1 84 84 GLU CB C 84 28.190 28.190 29.797 -1.607 18222
6621 1 15 . 1 1 84 84 GLU H H 84 8.470 8.470 8.071 0.399 18222
6622 1 15 . 1 1 85 85 LYS N N 85 118.650 118.650 119.596 -0.946 18222
6623 1 15 . 1 1 85 85 LYS HA H 85 4.100 4.100 4.068 0.032 18222
6624 1 15 . 1 1 85 85 LYS CA C 85 57.780 57.780 59.699 -1.919 18222
6625 1 15 . 1 1 85 85 LYS CB C 85 31.380 31.380 32.207 -0.827 18222
6626 1 15 . 1 1 85 85 LYS H H 85 7.940 7.940 8.493 -0.553 18222
6627 1 15 . 1 1 86 86 CYS N N 86 117.070 117.070 118.625 -1.555 18222
6628 1 15 . 1 1 86 86 CYS CA C 86 60.910 60.910 63.361 -2.450 18222
6629 1 15 . 1 1 86 86 CYS CB C 86 26.740 26.740 27.574 -0.834 18222
6630 1 15 . 1 1 86 86 CYS H H 86 7.840 7.840 8.278 -0.438 18222
6631 1 15 . 1 1 87 87 ASN N N 87 119.370 119.370 119.126 0.244 18222
6632 1 15 . 1 1 87 87 ASN HA H 87 4.130 4.130 4.536 -0.406 18222
6633 1 15 . 1 1 87 87 ASN CA C 87 55.750 55.750 56.352 -0.602 18222
6634 1 15 . 1 1 87 87 ASN CB C 87 38.050 38.050 38.109 -0.059 18222
6635 1 15 . 1 1 87 87 ASN H H 87 8.110 8.110 8.354 -0.244 18222
6636 1 15 . 1 1 88 88 ASN N N 88 117.570 117.570 119.331 -1.761 18222
6637 1 15 . 1 1 88 88 ASN HA H 88 4.280 4.280 4.638 -0.358 18222
6638 1 15 . 1 1 88 88 ASN CA C 88 55.190 55.190 56.285 -1.095 18222
6639 1 15 . 1 1 88 88 ASN CB C 88 37.400 37.400 38.541 -1.141 18222
6640 1 15 . 1 1 88 88 ASN H H 88 8.280 8.280 8.412 -0.132 18222
6641 1 15 . 1 1 89 89 LEU N N 89 121.940 121.940 121.047 0.893 18222
6642 1 15 . 1 1 89 89 LEU HA H 89 4.070 4.070 4.161 -0.091 18222
6643 1 15 . 1 1 89 89 LEU CA C 89 57.580 57.580 58.462 -0.882 18222
6644 1 15 . 1 1 89 89 LEU CB C 89 40.490 40.490 40.849 -0.359 18222
6645 1 15 . 1 1 89 89 LEU H H 89 7.790 7.790 8.558 -0.768 18222
6646 1 15 . 1 1 90 90 TRP N N 90 119.220 119.220 121.956 -2.736 18222
6647 1 15 . 1 1 90 90 TRP CA C 90 59.120 59.120 61.772 -2.652 18222
6648 1 15 . 1 1 90 90 TRP CB C 90 28.800 28.800 29.076 -0.277 18222
6649 1 15 . 1 1 90 90 TRP H H 90 7.850 7.850 8.427 -0.577 18222
6650 1 15 . 1 1 91 91 LEU N N 91 117.870 117.870 120.277 -2.407 18222
6651 1 15 . 1 1 91 91 LEU CA C 91 57.300 57.300 58.510 -1.210 18222
6652 1 15 . 1 1 91 91 LEU CB C 91 40.610 40.610 41.870 -1.260 18222
6653 1 15 . 1 1 91 91 LEU H H 91 7.920 7.920 8.187 -0.267 18222
6654 1 15 . 1 1 92 92 PHE N N 92 121.280 121.280 116.946 4.334 18222
6655 1 15 . 1 1 92 92 PHE CA C 92 60.390 60.390 62.029 -1.639 18222
6656 1 15 . 1 1 92 92 PHE CB C 92 37.980 37.980 38.848 -0.868 18222
6657 1 15 . 1 1 92 92 PHE H H 92 7.860 7.860 8.347 -0.487 18222
6658 1 15 . 1 1 93 93 LEU N N 93 119.860 119.860 120.489 -0.629 18222
6659 1 15 . 1 1 93 93 LEU CA C 93 56.860 56.860 58.313 -1.453 18222
6660 1 15 . 1 1 93 93 LEU CB C 93 40.550 40.550 41.694 -1.144 18222
6661 1 15 . 1 1 93 93 LEU H H 93 7.980 7.980 8.679 -0.699 18222
6662 1 15 . 1 1 94 94 GLU N N 94 114.660 114.660 117.324 -2.664 18222
6663 1 15 . 1 1 94 94 GLU HA H 94 3.810 3.810 3.973 -0.163 18222
6664 1 15 . 1 1 94 94 GLU CA C 94 57.210 57.210 58.612 -1.402 18222
6665 1 15 . 1 1 94 94 GLU CB C 94 28.470 28.470 29.398 -0.928 18222
6666 1 15 . 1 1 94 94 GLU H H 94 7.890 7.890 8.139 -0.249 18222
6667 1 15 . 1 1 95 95 THR N N 95 108.260 108.260 111.986 -3.726 18222
6668 1 15 . 1 1 95 95 THR CA C 95 62.150 62.150 62.578 -0.428 18222
6669 1 15 . 1 1 95 95 THR CB C 95 70.810 70.810 69.715 1.095 18222
6670 1 15 . 1 1 95 95 THR H H 95 7.690 7.690 7.924 -0.234 18222
6671 1 15 . 1 1 96 96 GLY N N 96 112.220 112.220 110.083 2.137 18222
6672 1 15 . 1 1 96 96 GLY CA C 96 45.410 45.410 45.337 0.073 18222
6673 1 15 . 1 1 96 96 GLY H H 96 8.240 8.240 7.706 0.534 18222
6674 1 15 . 1 1 97 97 GLN N N 97 117.950 117.950 120.749 -2.799 18222
6675 1 15 . 1 1 97 97 GLN HA H 97 4.200 4.200 4.431 -0.231 18222
6676 1 15 . 1 1 97 97 GLN CA C 97 54.430 54.430 55.045 -0.615 18222
6677 1 15 . 1 1 97 97 GLN CB C 97 29.910 29.910 29.708 0.202 18222
6678 1 15 . 1 1 97 97 GLN H H 97 7.640 7.640 7.607 0.033 18222
6679 1 15 . 1 1 98 98 LEU N N 98 123.810 123.810 128.683 -4.873 18222
6680 1 15 . 1 1 98 98 LEU HA H 98 4.360 4.360 4.602 -0.242 18222
6681 1 15 . 1 1 98 98 LEU CA C 98 52.650 52.650 53.727 -1.077 18222
6682 1 15 . 1 1 98 98 LEU CB C 98 40.460 40.460 41.897 -1.437 18222
6683 1 15 . 1 1 98 98 LEU H H 98 8.270 8.270 8.611 -0.341 18222
6684 1 15 . 1 1 99 99 PRO CA C 99 63.180 63.180 63.538 -0.358 18222
6685 1 15 . 1 1 99 99 PRO CB C 99 30.840 30.840 32.101 -1.261 18222
6686 1 15 . 1 1 100 100 LYS N N 100 120.630 120.630 116.976 3.654 18222
6687 1 15 . 1 1 100 100 LYS CA C 100 55.730 55.730 55.400 0.330 18222
6688 1 15 . 1 1 100 100 LYS CB C 100 32.280 32.280 34.940 -2.660 18222
6689 1 15 . 1 1 100 100 LYS H H 100 8.090 8.090 7.724 0.366 18222
6690 1 15 . 1 1 101 101 ASP N N 101 120.920 120.920 120.673 0.247 18222
6691 1 15 . 1 1 101 101 ASP HA H 101 4.190 4.190 4.822 -0.632 18222
6692 1 15 . 1 1 101 101 ASP CA C 101 54.000 54.000 53.745 0.255 18222
6693 1 15 . 1 1 101 101 ASP CB C 101 40.330 40.330 41.722 -1.392 18222
6694 1 15 . 1 1 101 101 ASP H H 101 8.190 8.190 8.439 -0.249 18222
6695 1 15 . 1 1 102 102 ARG N N 102 122.210 122.210 123.214 -1.004 18222
6696 1 15 . 1 1 102 102 ARG CA C 102 55.590 55.590 57.042 -1.452 18222
6697 1 15 . 1 1 102 102 ARG CB C 102 29.630 29.630 31.497 -1.867 18222
6698 1 15 . 1 1 102 102 ARG H H 102 8.130 8.130 8.599 -0.469 18222
6699 1 15 . 1 1 103 103 SER N N 103 117.230 117.230 116.652 0.578 18222
6700 1 15 . 1 1 103 103 SER HA H 103 4.280 4.280 4.826 -0.546 18222
6701 1 15 . 1 1 103 103 SER CA C 103 58.470 58.470 58.359 0.111 18222
6702 1 15 . 1 1 103 103 SER CB C 103 63.080 63.080 64.974 -1.894 18222
6703 1 15 . 1 1 103 103 SER H H 103 8.290 8.290 8.270 0.020 18222
6704 1 15 . 1 1 104 104 THR N N 104 115.430 115.430 116.519 -1.089 18222
6705 1 15 . 1 1 104 104 THR CA C 104 61.570 61.570 61.895 -0.325 18222
6706 1 15 . 1 1 104 104 THR CB C 104 69.030 69.030 69.852 -0.822 18222
6707 1 15 . 1 1 104 104 THR H H 104 8.020 8.020 8.018 0.002 18222
6708 1 15 . 1 1 105 105 ASP N N 105 122.780 122.780 121.321 1.459 18222
6709 1 15 . 1 1 105 105 ASP CA C 105 54.210 54.210 54.992 -0.782 18222
6710 1 15 . 1 1 105 105 ASP CB C 105 40.380 40.380 41.429 -1.049 18222
6711 1 15 . 1 1 105 105 ASP H H 105 8.120 8.120 8.647 -0.527 18222
6712 1 15 . 1 1 106 106 GLN N N 106 120.960 120.960 117.429 3.531 18222
6713 1 15 . 1 1 106 106 GLN CA C 106 55.420 55.420 55.181 0.239 18222
6714 1 15 . 1 1 106 106 GLN CB C 106 28.310 28.310 30.876 -2.566 18222
6715 1 15 . 1 1 106 106 GLN H H 106 8.140 8.140 8.045 0.095 18222
6716 1 15 . 1 1 107 107 ARG N N 107 123.010 123.010 120.719 2.291 18222
6717 1 15 . 1 1 107 107 ARG HA H 107 4.210 4.210 4.420 -0.210 18222
6718 1 15 . 1 1 107 107 ARG CA C 107 55.560 55.560 56.899 -1.339 18222
6719 1 15 . 1 1 107 107 ARG CB C 107 29.920 29.920 30.707 -0.787 18222
6720 1 15 . 1 1 107 107 ARG H H 107 8.180 8.180 8.536 -0.356 18222
6721 1 16 . 1 1 2 2 VAL N N 2 121.590 121.590 124.164 -2.574 18222
6722 1 16 . 1 1 2 2 VAL CA C 2 61.600 61.600 61.402 0.198 18222
6723 1 16 . 1 1 2 2 VAL CB C 2 31.900 31.900 32.647 -0.747 18222
6724 1 16 . 1 1 2 2 VAL H H 2 8.010 8.010 8.427 -0.417 18222
6725 1 16 . 1 1 3 3 ASN N N 3 122.520 122.520 122.500 0.020 18222
6726 1 16 . 1 1 3 3 ASN HA H 3 4.020 4.020 4.394 -0.374 18222
6727 1 16 . 1 1 3 3 ASN CA C 3 52.640 52.640 53.709 -1.069 18222
6728 1 16 . 1 1 3 3 ASN CB C 3 38.330 38.330 38.650 -0.320 18222
6729 1 16 . 1 1 3 3 ASN H H 3 8.360 8.360 8.596 -0.236 18222
6730 1 16 . 1 1 4 4 LEU N N 4 123.830 123.830 118.172 5.658 18222
6731 1 16 . 1 1 4 4 LEU HA H 4 4.220 4.220 4.069 0.151 18222
6732 1 16 . 1 1 4 4 LEU CA C 4 54.620 54.620 55.498 -0.878 18222
6733 1 16 . 1 1 4 4 LEU CB C 4 41.680 41.680 41.063 0.617 18222
6734 1 16 . 1 1 4 4 LEU H H 4 8.220 8.220 8.482 -0.262 18222
6735 1 16 . 1 1 5 5 GLY N N 5 106.810 106.810 107.617 -0.807 18222
6736 1 16 . 1 1 5 5 GLY CA C 5 45.800 45.800 44.799 1.001 18222
6737 1 16 . 1 1 5 5 GLY H H 5 8.030 8.030 8.054 -0.024 18222
6738 1 16 . 1 1 6 6 LEU N N 6 120.820 120.820 121.453 -0.633 18222
6739 1 16 . 1 1 6 6 LEU HA H 6 4.050 4.050 4.436 -0.386 18222
6740 1 16 . 1 1 6 6 LEU CA C 6 55.990 55.990 57.197 -1.207 18222
6741 1 16 . 1 1 6 6 LEU CB C 6 40.800 40.800 42.118 -1.318 18222
6742 1 16 . 1 1 6 6 LEU H H 6 8.030 8.030 8.208 -0.178 18222
6743 1 16 . 1 1 7 7 SER N N 7 115.540 115.540 115.756 -0.216 18222
6744 1 16 . 1 1 7 7 SER HA H 7 4.100 4.100 4.171 -0.071 18222
6745 1 16 . 1 1 7 7 SER CA C 7 60.580 60.580 61.679 -1.099 18222
6746 1 16 . 1 1 7 7 SER CB C 7 62.060 62.060 62.828 -0.768 18222
6747 1 16 . 1 1 7 7 SER H H 7 8.360 8.360 8.225 0.135 18222
6748 1 16 . 1 1 8 8 ARG N N 8 120.690 120.690 120.327 0.363 18222
6749 1 16 . 1 1 8 8 ARG HA H 8 4.160 4.160 4.036 0.124 18222
6750 1 16 . 1 1 8 8 ARG CA C 8 57.350 57.350 59.383 -2.033 18222
6751 1 16 . 1 1 8 8 ARG CB C 8 29.230 29.230 29.828 -0.599 18222
6752 1 16 . 1 1 8 8 ARG H H 8 7.830 7.830 8.370 -0.540 18222
6753 1 16 . 1 1 9 9 VAL N N 9 119.330 119.330 119.182 0.148 18222
6754 1 16 . 1 1 9 9 VAL HA H 9 4.170 4.170 3.766 0.404 18222
6755 1 16 . 1 1 9 9 VAL CA C 9 64.720 64.720 65.842 -1.122 18222
6756 1 16 . 1 1 9 9 VAL CB C 9 30.900 30.900 31.475 -0.575 18222
6757 1 16 . 1 1 9 9 VAL H H 9 7.620 7.620 7.452 0.168 18222
6758 1 16 . 1 1 10 10 ASP N N 10 119.520 119.520 120.031 -0.511 18222
6759 1 16 . 1 1 10 10 ASP CA C 10 54.960 54.960 57.721 -2.761 18222
6760 1 16 . 1 1 10 10 ASP CB C 10 37.800 37.800 40.825 -3.025 18222
6761 1 16 . 1 1 10 10 ASP H H 10 8.180 8.180 8.141 0.039 18222
6762 1 16 . 1 1 11 11 ASP N N 11 121.550 121.550 120.614 0.936 18222
6763 1 16 . 1 1 11 11 ASP CA C 11 54.440 54.440 56.999 -2.559 18222
6764 1 16 . 1 1 11 11 ASP CB C 11 37.840 37.840 40.770 -2.930 18222
6765 1 16 . 1 1 11 11 ASP H H 11 7.950 7.950 8.121 -0.171 18222
6766 1 16 . 1 1 12 12 ALA N N 12 120.220 120.220 122.875 -2.655 18222
6767 1 16 . 1 1 12 12 ALA CA C 12 54.370 54.370 55.145 -0.775 18222
6768 1 16 . 1 1 12 12 ALA CB C 12 24.730 24.730 18.397 6.333 18222
6769 1 16 . 1 1 12 12 ALA H H 12 8.090 8.090 8.110 -0.020 18222
6770 1 16 . 1 1 13 13 VAL N N 13 116.910 116.910 117.638 -0.728 18222
6771 1 16 . 1 1 13 13 VAL HA H 13 4.140 4.140 3.715 0.425 18222
6772 1 16 . 1 1 13 13 VAL CA C 13 64.900 64.900 65.218 -0.318 18222
6773 1 16 . 1 1 13 13 VAL CB C 13 31.000 31.000 31.851 -0.851 18222
6774 1 16 . 1 1 13 13 VAL H H 13 7.980 7.980 8.330 -0.350 18222
6775 1 16 . 1 1 14 14 ALA N N 14 122.200 122.200 122.890 -0.690 18222
6776 1 16 . 1 1 14 14 ALA HA H 14 4.020 4.020 4.083 -0.063 18222
6777 1 16 . 1 1 14 14 ALA CA C 14 53.800 53.800 54.549 -0.749 18222
6778 1 16 . 1 1 14 14 ALA CB C 14 17.790 17.790 18.419 -0.629 18222
6779 1 16 . 1 1 14 14 ALA H H 14 8.030 8.030 7.850 0.180 18222
6780 1 16 . 1 1 15 15 ALA N N 15 118.600 118.600 119.671 -1.071 18222
6781 1 16 . 1 1 15 15 ALA CA C 15 53.230 53.230 53.703 -0.473 18222
6782 1 16 . 1 1 15 15 ALA CB C 15 18.010 18.010 19.292 -1.282 18222
6783 1 16 . 1 1 15 15 ALA H H 15 7.530 7.530 8.042 -0.512 18222
6784 1 16 . 1 1 16 16 LYS N N 16 115.820 115.820 117.092 -1.272 18222
6785 1 16 . 1 1 16 16 LYS HA H 16 4.080 4.080 4.259 -0.179 18222
6786 1 16 . 1 1 16 16 LYS CA C 16 55.670 55.670 57.360 -1.690 18222
6787 1 16 . 1 1 16 16 LYS CB C 16 32.640 32.640 34.241 -1.601 18222
6788 1 16 . 1 1 16 16 LYS H H 16 7.490 7.490 7.978 -0.488 18222
6789 1 16 . 1 1 17 17 HIS N N 17 116.790 116.790 117.736 -0.946 18222
6790 1 16 . 1 1 17 17 HIS HA H 17 4.100 4.100 4.949 -0.849 18222
6791 1 16 . 1 1 17 17 HIS CA C 17 52.820 52.820 53.223 -0.403 18222
6792 1 16 . 1 1 17 17 HIS CB C 17 28.400 28.400 31.008 -2.608 18222
6793 1 16 . 1 1 17 17 HIS H H 17 8.130 8.130 8.448 -0.318 18222
6794 1 16 . 1 1 18 18 PRO CA C 18 63.800 63.800 63.175 0.625 18222
6795 1 16 . 1 1 18 18 PRO CB C 18 30.800 30.800 30.199 0.601 18222
6796 1 16 . 1 1 19 19 GLY N N 19 110.260 110.260 108.530 1.730 18222
6797 1 16 . 1 1 19 19 GLY CA C 19 45.490 45.490 45.840 -0.350 18222
6798 1 16 . 1 1 19 19 GLY H H 19 8.730 8.730 7.907 0.823 18222
6799 1 16 . 1 1 20 20 LEU N N 20 122.650 122.650 122.541 0.109 18222
6800 1 16 . 1 1 20 20 LEU HA H 20 4.090 4.090 4.532 -0.442 18222
6801 1 16 . 1 1 20 20 LEU CA C 20 57.060 57.060 55.684 1.376 18222
6802 1 16 . 1 1 20 20 LEU H H 20 7.980 7.980 8.499 -0.519 18222
6803 1 16 . 1 1 21 21 GLY N N 21 107.000 107.000 107.952 -0.952 18222
6804 1 16 . 1 1 21 21 GLY CA C 21 46.710 46.710 46.525 0.185 18222
6805 1 16 . 1 1 21 21 GLY H H 21 8.570 8.570 8.057 0.513 18222
6806 1 16 . 1 1 22 22 GLU N N 22 121.610 121.610 121.944 -0.334 18222
6807 1 16 . 1 1 22 22 GLU HA H 22 3.990 3.990 4.078 -0.088 18222
6808 1 16 . 1 1 22 22 GLU CA C 22 58.280 58.280 60.015 -1.735 18222
6809 1 16 . 1 1 22 22 GLU CB C 22 28.010 28.010 29.737 -1.727 18222
6810 1 16 . 1 1 22 22 GLU H H 22 8.100 8.100 7.974 0.126 18222
6811 1 16 . 1 1 23 23 TYR N N 23 120.870 120.870 119.198 1.672 18222
6812 1 16 . 1 1 23 23 TYR CA C 23 60.380 60.380 61.062 -0.681 18222
6813 1 16 . 1 1 23 23 TYR CB C 23 37.750 37.750 38.038 -0.289 18222
6814 1 16 . 1 1 23 23 TYR H H 23 7.910 7.910 7.600 0.310 18222
6815 1 16 . 1 1 24 24 ALA N N 24 121.420 121.420 121.307 0.113 18222
6816 1 16 . 1 1 24 24 ALA HA H 24 4.140 4.140 3.927 0.213 18222
6817 1 16 . 1 1 24 24 ALA CA C 24 54.260 54.260 54.749 -0.489 18222
6818 1 16 . 1 1 24 24 ALA H H 24 8.410 8.410 8.674 -0.264 18222
6819 1 16 . 1 1 25 25 ALA N N 25 120.220 120.220 122.074 -1.854 18222
6820 1 16 . 1 1 25 25 ALA CA C 25 54.370 54.370 55.110 -0.740 18222
6821 1 16 . 1 1 25 25 ALA H H 25 8.090 8.090 8.300 -0.210 18222
6822 1 16 . 1 1 26 26 CYS N N 26 116.760 116.760 117.789 -1.029 18222
6823 1 16 . 1 1 26 26 CYS CA C 26 61.180 61.180 62.522 -1.342 18222
6824 1 16 . 1 1 26 26 CYS CB C 26 26.390 26.390 27.065 -0.675 18222
6825 1 16 . 1 1 26 26 CYS H H 26 7.950 7.950 8.288 -0.338 18222
6826 1 16 . 1 1 27 27 GLN N N 27 118.690 118.690 120.537 -1.847 18222
6827 1 16 . 1 1 27 27 GLN CA C 27 55.970 55.970 59.832 -3.862 18222
6828 1 16 . 1 1 27 27 GLN H H 27 8.060 8.060 8.139 -0.079 18222
6829 1 16 . 1 1 28 28 SER N N 28 115.490 115.490 114.933 0.557 18222
6830 1 16 . 1 1 28 28 SER HA H 28 3.990 3.990 4.239 -0.249 18222
6831 1 16 . 1 1 28 28 SER CA C 28 61.110 61.110 61.655 -0.545 18222
6832 1 16 . 1 1 28 28 SER H H 28 7.980 7.980 8.453 -0.473 18222
6833 1 16 . 1 1 29 29 HIS N N 29 120.880 120.880 121.409 -0.529 18222
6834 1 16 . 1 1 29 29 HIS CA C 29 58.190 58.190 59.244 -1.054 18222
6835 1 16 . 1 1 29 29 HIS CB C 29 27.460 27.460 30.231 -2.771 18222
6836 1 16 . 1 1 29 29 HIS H H 29 8.180 8.180 8.232 -0.052 18222
6837 1 16 . 1 1 30 30 ALA N N 30 122.920 122.920 122.955 -0.035 18222
6838 1 16 . 1 1 30 30 ALA CA C 30 54.560 54.560 55.418 -0.858 18222
6839 1 16 . 1 1 30 30 ALA CB C 30 17.490 17.490 18.478 -0.988 18222
6840 1 16 . 1 1 30 30 ALA H H 30 8.040 8.040 8.329 -0.289 18222
6841 1 16 . 1 1 31 31 PHE N N 31 119.340 119.340 118.985 0.355 18222
6842 1 16 . 1 1 31 31 PHE CA C 31 60.370 60.370 62.641 -2.271 18222
6843 1 16 . 1 1 31 31 PHE CB C 31 38.520 38.520 39.282 -0.763 18222
6844 1 16 . 1 1 31 31 PHE H H 31 8.230 8.230 8.816 -0.586 18222
6845 1 16 . 1 1 32 32 MET N N 32 118.110 118.110 119.674 -1.564 18222
6846 1 16 . 1 1 32 32 MET HA H 32 4.050 4.050 4.047 0.003 18222
6847 1 16 . 1 1 32 32 MET CA C 32 58.280 58.280 59.744 -1.464 18222
6848 1 16 . 1 1 32 32 MET CB C 32 31.090 31.090 32.588 -1.498 18222
6849 1 16 . 1 1 32 32 MET H H 32 8.120 8.120 8.820 -0.700 18222
6850 1 16 . 1 1 33 33 LYS N N 33 119.040 119.040 119.666 -0.626 18222
6851 1 16 . 1 1 33 33 LYS HA H 33 3.930 3.930 3.945 -0.015 18222
6852 1 16 . 1 1 33 33 LYS CA C 33 59.040 59.040 59.855 -0.815 18222
6853 1 16 . 1 1 33 33 LYS CB C 33 30.990 30.990 32.380 -1.390 18222
6854 1 16 . 1 1 33 33 LYS H H 33 7.970 7.970 8.325 -0.355 18222
6855 1 16 . 1 1 34 34 GLY N N 34 108.840 108.840 106.990 1.850 18222
6856 1 16 . 1 1 34 34 GLY CA C 34 46.610 46.610 47.148 -0.538 18222
6857 1 16 . 1 1 34 34 GLY H H 34 8.030 8.030 8.168 -0.138 18222
6858 1 16 . 1 1 35 35 VAL N N 35 122.910 122.910 122.725 0.185 18222
6859 1 16 . 1 1 35 35 VAL HA H 35 4.220 4.220 3.603 0.617 18222
6860 1 16 . 1 1 35 35 VAL CA C 35 66.310 66.310 66.215 0.095 18222
6861 1 16 . 1 1 35 35 VAL CB C 35 30.560 30.560 31.804 -1.244 18222
6862 1 16 . 1 1 35 35 VAL H H 35 8.090 8.090 8.477 -0.388 18222
6863 1 16 . 1 1 36 36 PHE N N 36 120.020 120.020 120.862 -0.842 18222
6864 1 16 . 1 1 36 36 PHE CA C 36 61.350 61.350 62.492 -1.142 18222
6865 1 16 . 1 1 36 36 PHE CB C 36 38.090 38.090 39.268 -1.178 18222
6866 1 16 . 1 1 36 36 PHE H H 36 8.350 8.350 8.822 -0.472 18222
6867 1 16 . 1 1 37 37 THR N N 37 116.980 116.980 116.354 0.626 18222
6868 1 16 . 1 1 37 37 THR HA H 37 4.050 4.050 3.978 0.072 18222
6869 1 16 . 1 1 37 37 THR CA C 37 66.000 66.000 66.835 -0.835 18222
6870 1 16 . 1 1 37 37 THR CB C 37 68.270 68.270 68.997 -0.727 18222
6871 1 16 . 1 1 37 37 THR H H 37 8.520 8.520 8.220 0.300 18222
6872 1 16 . 1 1 38 38 PHE N N 38 123.090 123.090 120.720 2.370 18222
6873 1 16 . 1 1 38 38 PHE HA H 38 4.360 4.360 4.228 0.132 18222
6874 1 16 . 1 1 38 38 PHE CA C 38 61.140 61.140 61.242 -0.102 18222
6875 1 16 . 1 1 38 38 PHE CB C 38 41.200 41.200 39.309 1.891 18222
6876 1 16 . 1 1 38 38 PHE H H 38 8.010 8.010 8.052 -0.042 18222
6877 1 16 . 1 1 39 39 VAL N N 39 117.280 117.280 119.422 -2.142 18222
6878 1 16 . 1 1 39 39 VAL HA H 39 4.210 4.210 3.590 0.620 18222
6879 1 16 . 1 1 39 39 VAL CA C 39 66.000 66.000 65.971 0.029 18222
6880 1 16 . 1 1 39 39 VAL CB C 39 30.860 30.860 31.695 -0.835 18222
6881 1 16 . 1 1 39 39 VAL H H 39 8.530 8.530 8.746 -0.216 18222
6882 1 16 . 1 1 40 40 THR N N 40 109.470 109.470 115.383 -5.913 18222
6883 1 16 . 1 1 40 40 THR HA H 40 4.060 4.060 4.237 -0.177 18222
6884 1 16 . 1 1 40 40 THR CA C 40 63.390 63.390 64.188 -0.798 18222
6885 1 16 . 1 1 40 40 THR CB C 40 68.650 68.650 67.848 0.802 18222
6886 1 16 . 1 1 40 40 THR H H 40 7.700 7.700 8.035 -0.335 18222
6887 1 16 . 1 1 41 41 GLY N N 41 110.770 110.770 110.505 0.265 18222
6888 1 16 . 1 1 41 41 GLY CA C 41 45.580 45.580 46.502 -0.922 18222
6889 1 16 . 1 1 41 41 GLY H H 41 7.700 7.700 8.317 -0.617 18222
6890 1 16 . 1 1 42 42 THR N N 42 114.520 114.520 114.452 0.068 18222
6891 1 16 . 1 1 42 42 THR CA C 42 63.300 63.300 61.682 1.618 18222
6892 1 16 . 1 1 42 42 THR CB C 42 69.490 69.490 68.236 1.254 18222
6893 1 16 . 1 1 42 42 THR H H 42 7.720 7.720 7.299 0.421 18222
6894 1 16 . 1 1 43 43 GLY N N 43 109.540 109.540 109.448 0.092 18222
6895 1 16 . 1 1 43 43 GLY CA C 43 46.250 46.250 46.708 -0.458 18222
6896 1 16 . 1 1 43 43 GLY H H 43 8.110 8.110 7.713 0.397 18222
6897 1 16 . 1 1 44 44 MET N N 44 120.240 120.240 120.877 -0.637 18222
6898 1 16 . 1 1 44 44 MET HA H 44 4.100 4.100 4.115 -0.015 18222
6899 1 16 . 1 1 44 44 MET CA C 44 57.700 57.700 58.504 -0.804 18222
6900 1 16 . 1 1 44 44 MET CB C 44 32.030 32.030 32.549 -0.519 18222
6901 1 16 . 1 1 44 44 MET H H 44 7.730 7.730 7.972 -0.242 18222
6902 1 16 . 1 1 45 45 ALA N N 45 121.560 121.560 121.782 -0.222 18222
6903 1 16 . 1 1 45 45 ALA CA C 45 54.440 54.440 55.089 -0.649 18222
6904 1 16 . 1 1 45 45 ALA CB C 45 17.400 17.400 17.785 -0.385 18222
6905 1 16 . 1 1 45 45 ALA H H 45 7.950 7.950 7.741 0.209 18222
6906 1 16 . 1 1 46 46 PHE N N 46 118.260 118.260 118.431 -0.171 18222
6907 1 16 . 1 1 46 46 PHE HA H 46 3.930 3.930 4.139 -0.209 18222
6908 1 16 . 1 1 46 46 PHE CA C 46 59.820 59.820 61.546 -1.726 18222
6909 1 16 . 1 1 46 46 PHE CB C 46 38.260 38.260 38.665 -0.405 18222
6910 1 16 . 1 1 46 46 PHE H H 46 7.860 7.860 8.273 -0.413 18222
6911 1 16 . 1 1 47 47 GLY N N 47 107.300 107.300 107.839 -0.539 18222
6912 1 16 . 1 1 47 47 GLY CA C 47 46.560 46.560 47.251 -0.690 18222
6913 1 16 . 1 1 47 47 GLY H H 47 8.200 8.200 8.456 -0.256 18222
6914 1 16 . 1 1 48 48 LEU N N 48 121.920 121.920 123.221 -1.301 18222
6915 1 16 . 1 1 48 48 LEU HA H 48 4.040 4.040 3.938 0.102 18222
6916 1 16 . 1 1 48 48 LEU CA C 48 57.580 57.580 57.922 -0.342 18222
6917 1 16 . 1 1 48 48 LEU CB C 48 40.790 40.790 42.028 -1.238 18222
6918 1 16 . 1 1 48 48 LEU H H 48 8.180 8.180 8.524 -0.344 18222
6919 1 16 . 1 1 49 49 GLN N N 49 118.270 118.270 118.654 -0.384 18222
6920 1 16 . 1 1 49 49 GLN HA H 49 3.830 3.830 3.989 -0.159 18222
6921 1 16 . 1 1 49 49 GLN CA C 49 58.880 58.880 58.824 0.056 18222
6922 1 16 . 1 1 49 49 GLN CB C 49 27.240 27.240 28.457 -1.217 18222
6923 1 16 . 1 1 49 49 GLN H H 49 8.080 8.080 8.061 0.019 18222
6924 1 16 . 1 1 50 50 MET N N 50 117.630 117.630 119.929 -2.299 18222
6925 1 16 . 1 1 50 50 MET HA H 50 4.010 4.010 4.152 -0.142 18222
6926 1 16 . 1 1 50 50 MET CA C 50 57.730 57.730 59.334 -1.604 18222
6927 1 16 . 1 1 50 50 MET CB C 50 27.160 27.160 32.827 -5.667 18222
6928 1 16 . 1 1 50 50 MET H H 50 7.880 7.880 8.256 -0.376 18222
6929 1 16 . 1 1 51 51 PHE N N 51 119.550 119.550 118.207 1.343 18222
6930 1 16 . 1 1 51 51 PHE CA C 51 60.850 60.850 62.080 -1.230 18222
6931 1 16 . 1 1 51 51 PHE CB C 51 38.720 38.720 39.043 -0.323 18222
6932 1 16 . 1 1 51 51 PHE H H 51 7.890 7.890 8.454 -0.564 18222
6933 1 16 . 1 1 52 52 ILE N N 52 117.950 117.950 118.113 -0.163 18222
6934 1 16 . 1 1 52 52 ILE HA H 52 4.050 4.050 3.971 0.079 18222
6935 1 16 . 1 1 52 52 ILE CA C 52 63.560 63.560 63.728 -0.168 18222
6936 1 16 . 1 1 52 52 ILE CB C 52 36.810 36.810 38.378 -1.568 18222
6937 1 16 . 1 1 52 52 ILE H H 52 8.110 8.110 8.220 -0.110 18222
6938 1 16 . 1 1 53 53 GLN N N 53 117.360 117.360 120.162 -2.802 18222
6939 1 16 . 1 1 53 53 GLN CA C 53 57.200 57.200 58.309 -1.109 18222
6940 1 16 . 1 1 53 53 GLN CB C 53 27.870 27.870 28.326 -0.456 18222
6941 1 16 . 1 1 53 53 GLN H H 53 7.930 7.930 7.999 -0.069 18222
6942 1 16 . 1 1 54 54 ARG N N 54 116.840 116.840 118.853 -2.013 18222
6943 1 16 . 1 1 54 54 ARG HA H 54 3.950 3.950 4.221 -0.271 18222
6944 1 16 . 1 1 54 54 ARG CA C 54 56.480 56.480 57.605 -1.125 18222
6945 1 16 . 1 1 54 54 ARG CB C 54 28.970 28.970 30.037 -1.067 18222
6946 1 16 . 1 1 54 54 ARG H H 54 7.540 7.540 7.793 -0.253 18222
6947 1 16 . 1 1 55 55 LYS N N 55 117.900 117.900 118.089 -0.189 18222
6948 1 16 . 1 1 55 55 LYS HA H 55 4.080 4.080 4.293 -0.213 18222
6949 1 16 . 1 1 55 55 LYS CA C 55 55.030 55.030 56.455 -1.425 18222
6950 1 16 . 1 1 55 55 LYS CB C 55 32.010 32.010 32.712 -0.702 18222
6951 1 16 . 1 1 55 55 LYS H H 55 7.660 7.660 7.238 0.422 18222
6952 1 16 . 1 1 56 56 PHE N N 56 121.060 121.060 121.682 -0.622 18222
6953 1 16 . 1 1 56 56 PHE CA C 56 55.190 55.190 54.800 0.390 18222
6954 1 16 . 1 1 56 56 PHE CB C 56 38.970 38.970 39.594 -0.624 18222
6955 1 16 . 1 1 56 56 PHE H H 56 8.080 8.080 7.776 0.304 18222
6956 1 16 . 1 1 57 57 PRO CA C 57 62.390 62.390 63.616 -1.226 18222
6957 1 16 . 1 1 57 57 PRO CB C 57 30.580 30.580 31.734 -1.154 18222
6958 1 16 . 1 1 58 58 TYR N N 58 120.240 120.240 120.057 0.183 18222
6959 1 16 . 1 1 58 58 TYR CA C 58 55.770 55.770 54.793 0.977 18222
6960 1 16 . 1 1 58 58 TYR CB C 58 40.220 40.220 39.869 0.351 18222
6961 1 16 . 1 1 58 58 TYR H H 58 7.700 7.700 7.530 0.170 18222
6962 1 16 . 1 1 59 59 PRO CA C 59 62.130 62.130 63.820 -1.690 18222
6963 1 16 . 1 1 59 59 PRO CB C 59 33.340 33.340 32.164 1.176 18222
6964 1 16 . 1 1 60 60 LEU N N 60 122.210 122.210 116.298 5.912 18222
6965 1 16 . 1 1 60 60 LEU CA C 60 54.250 54.250 53.804 0.446 18222
6966 1 16 . 1 1 60 60 LEU CB C 60 41.470 41.470 43.644 -2.174 18222
6967 1 16 . 1 1 60 60 LEU H H 60 7.880 7.880 7.734 0.146 18222
6968 1 16 . 1 1 61 61 GLN N N 61 122.470 122.470 122.315 0.155 18222
6969 1 16 . 1 1 61 61 GLN CA C 61 54.170 54.170 55.184 -1.014 18222
6970 1 16 . 1 1 61 61 GLN H H 61 7.970 7.970 8.556 -0.586 18222
6971 1 16 . 1 1 62 62 TRP N N 62 124.590 124.590 124.828 -0.238 18222
6972 1 16 . 1 1 62 62 TRP CA C 62 59.830 59.830 61.066 -1.236 18222
6973 1 16 . 1 1 62 62 TRP CB C 62 28.800 28.800 29.215 -0.415 18222
6974 1 16 . 1 1 62 62 TRP H H 62 8.240 8.240 8.995 -0.755 18222
6975 1 16 . 1 1 63 63 SER N N 63 113.320 113.320 114.630 -1.310 18222
6976 1 16 . 1 1 63 63 SER CA C 63 61.100 61.100 61.595 -0.495 18222
6977 1 16 . 1 1 63 63 SER H H 63 8.410 8.410 8.370 0.040 18222
6978 1 16 . 1 1 64 64 LEU N N 64 123.230 123.230 121.308 1.922 18222
6979 1 16 . 1 1 64 64 LEU CA C 64 56.880 56.880 57.435 -0.555 18222
6980 1 16 . 1 1 64 64 LEU CB C 64 40.830 40.830 41.146 -0.316 18222
6981 1 16 . 1 1 64 64 LEU H H 64 7.230 7.230 8.176 -0.946 18222
6982 1 16 . 1 1 65 65 LEU N N 65 119.400 119.400 121.605 -2.205 18222
6983 1 16 . 1 1 65 65 LEU HA H 65 3.890 3.890 4.082 -0.192 18222
6984 1 16 . 1 1 65 65 LEU CA C 65 57.580 57.580 58.270 -0.690 18222
6985 1 16 . 1 1 65 65 LEU CB C 65 40.710 40.710 41.587 -0.877 18222
6986 1 16 . 1 1 65 65 LEU H H 65 7.510 7.510 8.530 -1.020 18222
6987 1 16 . 1 1 66 66 VAL N N 66 116.950 116.950 119.126 -2.176 18222
6988 1 16 . 1 1 66 66 VAL HA H 66 3.960 3.960 3.587 0.373 18222
6989 1 16 . 1 1 66 66 VAL CA C 66 66.260 66.260 65.787 0.473 18222
6990 1 16 . 1 1 66 66 VAL CB C 66 30.570 30.570 31.067 -0.497 18222
6991 1 16 . 1 1 66 66 VAL H H 66 7.950 7.950 8.472 -0.522 18222
6992 1 16 . 1 1 67 67 ALA N N 67 120.650 120.650 123.088 -2.438 18222
6993 1 16 . 1 1 67 67 ALA HA H 67 4.000 4.000 4.110 -0.110 18222
6994 1 16 . 1 1 67 67 ALA CA C 67 54.780 54.780 55.294 -0.514 18222
6995 1 16 . 1 1 67 67 ALA CB C 67 17.440 17.440 18.537 -1.097 18222
6996 1 16 . 1 1 67 67 ALA H H 67 7.450 7.450 8.002 -0.552 18222
6997 1 16 . 1 1 68 68 VAL N N 68 118.440 118.440 118.194 0.246 18222
6998 1 16 . 1 1 68 68 VAL HA H 68 3.750 3.750 3.519 0.231 18222
6999 1 16 . 1 1 68 68 VAL CA C 68 65.250 65.250 66.609 -1.359 18222
7000 1 16 . 1 1 68 68 VAL CB C 68 30.850 30.850 32.087 -1.237 18222
7001 1 16 . 1 1 68 68 VAL H H 68 7.960 7.960 8.031 -0.071 18222
7002 1 16 . 1 1 69 69 VAL N N 69 120.800 120.800 119.947 0.853 18222
7003 1 16 . 1 1 69 69 VAL HA H 69 4.220 4.220 3.570 0.650 18222
7004 1 16 . 1 1 69 69 VAL CA C 69 66.020 66.020 67.024 -1.004 18222
7005 1 16 . 1 1 69 69 VAL CB C 69 30.850 30.850 30.953 -0.102 18222
7006 1 16 . 1 1 69 69 VAL H H 69 8.080 8.080 8.530 -0.450 18222
7007 1 16 . 1 1 70 70 ALA N N 70 121.740 121.740 120.731 1.009 18222
7008 1 16 . 1 1 70 70 ALA HA H 70 3.920 3.920 4.174 -0.254 18222
7009 1 16 . 1 1 70 70 ALA CA C 70 54.920 54.920 55.231 -0.311 18222
7010 1 16 . 1 1 70 70 ALA CB C 70 17.620 17.620 18.204 -0.584 18222
7011 1 16 . 1 1 70 70 ALA H H 70 8.660 8.660 8.539 0.121 18222
7012 1 16 . 1 1 71 71 GLY N N 71 103.450 103.450 107.243 -3.793 18222
7013 1 16 . 1 1 71 71 GLY CA C 71 46.300 46.300 47.070 -0.770 18222
7014 1 16 . 1 1 71 71 GLY H H 71 8.010 8.010 8.114 -0.104 18222
7015 1 16 . 1 1 72 72 SER N N 72 118.160 118.160 117.260 0.900 18222
7016 1 16 . 1 1 72 72 SER CA C 72 61.260 61.260 61.365 -0.105 18222
7017 1 16 . 1 1 72 72 SER CB C 72 62.870 62.870 62.846 0.024 18222
7018 1 16 . 1 1 72 72 SER H H 72 7.870 7.870 8.088 -0.218 18222
7019 1 16 . 1 1 73 73 VAL N N 73 121.340 121.340 122.009 -0.669 18222
7020 1 16 . 1 1 73 73 VAL CA C 73 65.750 65.750 66.159 -0.409 18222
7021 1 16 . 1 1 73 73 VAL CB C 73 30.740 30.740 31.152 -0.412 18222
7022 1 16 . 1 1 73 73 VAL H H 73 8.050 8.050 8.180 -0.130 18222
7023 1 16 . 1 1 74 74 VAL N N 74 118.680 118.680 119.060 -0.380 18222
7024 1 16 . 1 1 74 74 VAL CA C 74 65.770 65.770 66.496 -0.726 18222
7025 1 16 . 1 1 74 74 VAL CB C 74 30.740 30.740 31.286 -0.546 18222
7026 1 16 . 1 1 74 74 VAL H H 74 7.880 7.880 8.612 -0.732 18222
7027 1 16 . 1 1 75 75 SER N N 75 114.750 114.750 116.593 -1.843 18222
7028 1 16 . 1 1 75 75 SER HA H 75 4.100 4.100 4.180 -0.080 18222
7029 1 16 . 1 1 75 75 SER CA C 75 60.870 60.870 62.267 -1.397 18222
7030 1 16 . 1 1 75 75 SER CB C 75 62.340 62.340 62.793 -0.453 18222
7031 1 16 . 1 1 75 75 SER H H 75 7.870 7.870 7.862 0.008 18222
7032 1 16 . 1 1 76 76 TYR N N 76 121.110 121.110 122.583 -1.473 18222
7033 1 16 . 1 1 76 76 TYR CA C 76 60.050 60.050 61.486 -1.436 18222
7034 1 16 . 1 1 76 76 TYR CB C 76 37.980 37.980 38.495 -0.515 18222
7035 1 16 . 1 1 76 76 TYR H H 76 7.860 7.860 8.672 -0.812 18222
7036 1 16 . 1 1 77 77 GLY N N 77 107.300 107.300 106.430 0.870 18222
7037 1 16 . 1 1 77 77 GLY CA C 77 46.560 46.560 47.450 -0.890 18222
7038 1 16 . 1 1 77 77 GLY H H 77 8.200 8.200 8.538 -0.338 18222
7039 1 16 . 1 1 78 78 VAL N N 78 119.470 119.470 121.828 -2.358 18222
7040 1 16 . 1 1 78 78 VAL HA H 78 4.170 4.170 3.891 0.279 18222
7041 1 16 . 1 1 78 78 VAL CA C 78 64.650 64.650 65.354 -0.704 18222
7042 1 16 . 1 1 78 78 VAL H H 78 8.140 8.140 8.438 -0.298 18222
7043 1 16 . 1 1 79 79 THR N N 79 112.100 112.100 116.767 -4.667 18222
7044 1 16 . 1 1 79 79 THR CA C 79 63.460 63.460 66.490 -3.030 18222
7045 1 16 . 1 1 79 79 THR CB C 79 68.650 68.650 68.375 0.275 18222
7046 1 16 . 1 1 79 79 THR H H 79 7.640 7.640 8.033 -0.393 18222
7047 1 16 . 1 1 80 80 ARG N N 80 120.770 120.770 121.802 -1.032 18222
7048 1 16 . 1 1 80 80 ARG HA H 80 4.160 4.160 4.042 0.118 18222
7049 1 16 . 1 1 80 80 ARG CA C 80 56.790 56.790 59.778 -2.988 18222
7050 1 16 . 1 1 80 80 ARG CB C 80 29.430 29.430 30.227 -0.797 18222
7051 1 16 . 1 1 80 80 ARG H H 80 7.680 7.680 7.924 -0.244 18222
7052 1 16 . 1 1 81 81 VAL N N 81 118.370 118.370 119.267 -0.897 18222
7053 1 16 . 1 1 81 81 VAL HA H 81 3.920 3.920 3.757 0.163 18222
7054 1 16 . 1 1 81 81 VAL CA C 81 63.340 63.340 65.777 -2.437 18222
7055 1 16 . 1 1 81 81 VAL CB C 81 31.260 31.260 31.249 0.011 18222
7056 1 16 . 1 1 81 81 VAL H H 81 7.730 7.730 8.228 -0.498 18222
7057 1 16 . 1 1 82 82 GLU N N 82 120.620 120.620 119.533 1.087 18222
7058 1 16 . 1 1 82 82 GLU CA C 82 56.320 56.320 59.401 -3.081 18222
7059 1 16 . 1 1 82 82 GLU CB C 82 27.930 27.930 29.330 -1.400 18222
7060 1 16 . 1 1 82 82 GLU H H 82 7.920 7.920 8.478 -0.558 18222
7061 1 16 . 1 1 83 83 SER N N 83 116.240 116.240 116.497 -0.257 18222
7062 1 16 . 1 1 83 83 SER CA C 83 59.250 59.250 62.177 -2.927 18222
7063 1 16 . 1 1 83 83 SER CB C 83 63.160 63.160 62.967 0.193 18222
7064 1 16 . 1 1 83 83 SER H H 83 7.960 7.960 7.954 0.006 18222
7065 1 16 . 1 1 84 84 GLU N N 84 123.280 123.280 121.920 1.360 18222
7066 1 16 . 1 1 84 84 GLU HA H 84 4.080 4.080 4.044 0.036 18222
7067 1 16 . 1 1 84 84 GLU CA C 84 57.860 57.860 59.654 -1.794 18222
7068 1 16 . 1 1 84 84 GLU CB C 84 28.190 28.190 29.658 -1.468 18222
7069 1 16 . 1 1 84 84 GLU H H 84 8.470 8.470 8.068 0.402 18222
7070 1 16 . 1 1 85 85 LYS N N 85 118.650 118.650 119.985 -1.335 18222
7071 1 16 . 1 1 85 85 LYS HA H 85 4.100 4.100 3.999 0.101 18222
7072 1 16 . 1 1 85 85 LYS CA C 85 57.780 57.780 59.281 -1.501 18222
7073 1 16 . 1 1 85 85 LYS CB C 85 31.380 31.380 32.132 -0.752 18222
7074 1 16 . 1 1 85 85 LYS H H 85 7.940 7.940 8.055 -0.115 18222
7075 1 16 . 1 1 86 86 CYS N N 86 117.070 117.070 118.398 -1.328 18222
7076 1 16 . 1 1 86 86 CYS CA C 86 60.910 60.910 62.652 -1.742 18222
7077 1 16 . 1 1 86 86 CYS CB C 86 26.740 26.740 27.266 -0.526 18222
7078 1 16 . 1 1 86 86 CYS H H 86 7.840 7.840 8.253 -0.413 18222
7079 1 16 . 1 1 87 87 ASN N N 87 119.370 119.370 119.600 -0.230 18222
7080 1 16 . 1 1 87 87 ASN HA H 87 4.130 4.130 4.679 -0.549 18222
7081 1 16 . 1 1 87 87 ASN CA C 87 55.750 55.750 56.498 -0.749 18222
7082 1 16 . 1 1 87 87 ASN CB C 87 38.050 38.050 38.035 0.015 18222
7083 1 16 . 1 1 87 87 ASN H H 87 8.110 8.110 8.418 -0.308 18222
7084 1 16 . 1 1 88 88 ASN N N 88 117.570 117.570 118.919 -1.349 18222
7085 1 16 . 1 1 88 88 ASN HA H 88 4.280 4.280 4.413 -0.133 18222
7086 1 16 . 1 1 88 88 ASN CA C 88 55.190 55.190 56.328 -1.138 18222
7087 1 16 . 1 1 88 88 ASN CB C 88 37.400 37.400 38.390 -0.990 18222
7088 1 16 . 1 1 88 88 ASN H H 88 8.280 8.280 8.267 0.013 18222
7089 1 16 . 1 1 89 89 LEU N N 89 121.940 121.940 121.369 0.571 18222
7090 1 16 . 1 1 89 89 LEU HA H 89 4.070 4.070 3.921 0.149 18222
7091 1 16 . 1 1 89 89 LEU CA C 89 57.580 57.580 58.480 -0.900 18222
7092 1 16 . 1 1 89 89 LEU CB C 89 40.490 40.490 40.925 -0.435 18222
7093 1 16 . 1 1 89 89 LEU H H 89 7.790 7.790 8.330 -0.540 18222
7094 1 16 . 1 1 90 90 TRP N N 90 119.220 119.220 121.914 -2.694 18222
7095 1 16 . 1 1 90 90 TRP CA C 90 59.120 59.120 60.620 -1.500 18222
7096 1 16 . 1 1 90 90 TRP CB C 90 28.800 28.800 28.364 0.436 18222
7097 1 16 . 1 1 90 90 TRP H H 90 7.850 7.850 8.529 -0.679 18222
7098 1 16 . 1 1 91 91 LEU N N 91 117.870 117.870 119.540 -1.670 18222
7099 1 16 . 1 1 91 91 LEU CA C 91 57.300 57.300 57.345 -0.045 18222
7100 1 16 . 1 1 91 91 LEU CB C 91 40.610 40.610 41.511 -0.901 18222
7101 1 16 . 1 1 91 91 LEU H H 91 7.920 7.920 7.846 0.074 18222
7102 1 16 . 1 1 92 92 PHE N N 92 121.280 121.280 118.150 3.130 18222
7103 1 16 . 1 1 92 92 PHE CA C 92 60.390 60.390 61.085 -0.695 18222
7104 1 16 . 1 1 92 92 PHE CB C 92 37.980 37.980 38.741 -0.761 18222
7105 1 16 . 1 1 92 92 PHE H H 92 7.860 7.860 8.276 -0.416 18222
7106 1 16 . 1 1 93 93 LEU N N 93 119.860 119.860 122.635 -2.775 18222
7107 1 16 . 1 1 93 93 LEU CA C 93 56.860 56.860 58.050 -1.190 18222
7108 1 16 . 1 1 93 93 LEU CB C 93 40.550 40.550 42.197 -1.647 18222
7109 1 16 . 1 1 93 93 LEU H H 93 7.980 7.980 8.656 -0.676 18222
7110 1 16 . 1 1 94 94 GLU N N 94 114.660 114.660 118.445 -3.785 18222
7111 1 16 . 1 1 94 94 GLU HA H 94 3.810 3.810 4.178 -0.368 18222
7112 1 16 . 1 1 94 94 GLU CA C 94 57.210 57.210 58.761 -1.551 18222
7113 1 16 . 1 1 94 94 GLU CB C 94 28.470 28.470 28.946 -0.476 18222
7114 1 16 . 1 1 94 94 GLU H H 94 7.890 7.890 8.795 -0.905 18222
7115 1 16 . 1 1 95 95 THR N N 95 108.260 108.260 113.527 -5.267 18222
7116 1 16 . 1 1 95 95 THR CA C 95 62.150 62.150 62.823 -0.673 18222
7117 1 16 . 1 1 95 95 THR CB C 95 70.810 70.810 69.145 1.665 18222
7118 1 16 . 1 1 95 95 THR H H 95 7.690 7.690 7.589 0.101 18222
7119 1 16 . 1 1 96 96 GLY N N 96 112.220 112.220 108.907 3.313 18222
7120 1 16 . 1 1 96 96 GLY CA C 96 45.410 45.410 44.849 0.561 18222
7121 1 16 . 1 1 96 96 GLY H H 96 8.240 8.240 7.455 0.785 18222
7122 1 16 . 1 1 97 97 GLN N N 97 117.950 117.950 119.686 -1.736 18222
7123 1 16 . 1 1 97 97 GLN HA H 97 4.200 4.200 4.444 -0.244 18222
7124 1 16 . 1 1 97 97 GLN CA C 97 54.430 54.430 55.184 -0.755 18222
7125 1 16 . 1 1 97 97 GLN CB C 97 29.910 29.910 30.287 -0.377 18222
7126 1 16 . 1 1 97 97 GLN H H 97 7.640 7.640 8.463 -0.823 18222
7127 1 16 . 1 1 98 98 LEU N N 98 123.810 123.810 124.493 -0.683 18222
7128 1 16 . 1 1 98 98 LEU HA H 98 4.360 4.360 4.484 -0.124 18222
7129 1 16 . 1 1 98 98 LEU CA C 98 52.650 52.650 53.581 -0.931 18222
7130 1 16 . 1 1 98 98 LEU CB C 98 40.460 40.460 41.924 -1.464 18222
7131 1 16 . 1 1 98 98 LEU H H 98 8.270 8.270 8.491 -0.221 18222
7132 1 16 . 1 1 99 99 PRO CA C 99 63.180 63.180 62.303 0.877 18222
7133 1 16 . 1 1 99 99 PRO CB C 99 30.840 30.840 32.478 -1.638 18222
7134 1 16 . 1 1 100 100 LYS N N 100 120.630 120.630 121.242 -0.612 18222
7135 1 16 . 1 1 100 100 LYS CA C 100 55.730 55.730 55.724 0.006 18222
7136 1 16 . 1 1 100 100 LYS CB C 100 32.280 32.280 32.667 -0.387 18222
7137 1 16 . 1 1 100 100 LYS H H 100 8.090 8.090 8.428 -0.338 18222
7138 1 16 . 1 1 101 101 ASP N N 101 120.920 120.920 122.325 -1.405 18222
7139 1 16 . 1 1 101 101 ASP HA H 101 4.190 4.190 4.292 -0.102 18222
7140 1 16 . 1 1 101 101 ASP CA C 101 54.000 54.000 55.502 -1.502 18222
7141 1 16 . 1 1 101 101 ASP CB C 101 40.330 40.330 41.472 -1.142 18222
7142 1 16 . 1 1 101 101 ASP H H 101 8.190 8.190 8.557 -0.367 18222
7143 1 16 . 1 1 102 102 ARG N N 102 122.210 122.210 122.268 -0.058 18222
7144 1 16 . 1 1 102 102 ARG CA C 102 55.590 55.590 55.762 -0.172 18222
7145 1 16 . 1 1 102 102 ARG CB C 102 29.630 29.630 32.448 -2.818 18222
7146 1 16 . 1 1 102 102 ARG H H 102 8.130 8.130 8.409 -0.279 18222
7147 1 16 . 1 1 103 103 SER N N 103 117.230 117.230 119.647 -2.417 18222
7148 1 16 . 1 1 103 103 SER HA H 103 4.280 4.280 4.763 -0.483 18222
7149 1 16 . 1 1 103 103 SER CA C 103 58.470 58.470 57.902 0.568 18222
7150 1 16 . 1 1 103 103 SER CB C 103 63.080 63.080 64.397 -1.317 18222
7151 1 16 . 1 1 103 103 SER H H 103 8.290 8.290 8.467 -0.177 18222
7152 1 16 . 1 1 104 104 THR N N 104 115.430 115.430 116.728 -1.298 18222
7153 1 16 . 1 1 104 104 THR CA C 104 61.570 61.570 62.328 -0.758 18222
7154 1 16 . 1 1 104 104 THR CB C 104 69.030 69.030 70.170 -1.140 18222
7155 1 16 . 1 1 104 104 THR H H 104 8.020 8.020 8.271 -0.251 18222
7156 1 16 . 1 1 105 105 ASP N N 105 122.780 122.780 123.813 -1.033 18222
7157 1 16 . 1 1 105 105 ASP CA C 105 54.210 54.210 53.675 0.535 18222
7158 1 16 . 1 1 105 105 ASP CB C 105 40.380 40.380 42.311 -1.931 18222
7159 1 16 . 1 1 105 105 ASP H H 105 8.120 8.120 8.405 -0.285 18222
7160 1 16 . 1 1 106 106 GLN N N 106 120.960 120.960 121.482 -0.522 18222
7161 1 16 . 1 1 106 106 GLN CA C 106 55.420 55.420 55.229 0.191 18222
7162 1 16 . 1 1 106 106 GLN CB C 106 28.310 28.310 30.136 -1.826 18222
7163 1 16 . 1 1 106 106 GLN H H 106 8.140 8.140 8.183 -0.043 18222
7164 1 16 . 1 1 107 107 ARG N N 107 123.010 123.010 121.301 1.709 18222
7165 1 16 . 1 1 107 107 ARG HA H 107 4.210 4.210 4.471 -0.261 18222
7166 1 16 . 1 1 107 107 ARG CA C 107 55.560 55.560 56.773 -1.213 18222
7167 1 16 . 1 1 107 107 ARG CB C 107 29.920 29.920 30.985 -1.065 18222
7168 1 16 . 1 1 107 107 ARG H H 107 8.180 8.180 8.709 -0.529 18222
7169 1 17 . 1 1 2 2 VAL N N 2 121.590 121.590 125.522 -3.932 18222
7170 1 17 . 1 1 2 2 VAL CA C 2 61.600 61.600 62.418 -0.818 18222
7171 1 17 . 1 1 2 2 VAL CB C 2 31.900 31.900 32.208 -0.308 18222
7172 1 17 . 1 1 2 2 VAL H H 2 8.010 8.010 8.469 -0.459 18222
7173 1 17 . 1 1 3 3 ASN N N 3 122.520 122.520 125.354 -2.834 18222
7174 1 17 . 1 1 3 3 ASN HA H 3 4.020 4.020 5.014 -0.994 18222
7175 1 17 . 1 1 3 3 ASN CA C 3 52.640 52.640 52.497 0.143 18222
7176 1 17 . 1 1 3 3 ASN CB C 3 38.330 38.330 39.912 -1.582 18222
7177 1 17 . 1 1 3 3 ASN H H 3 8.360 8.360 8.545 -0.185 18222
7178 1 17 . 1 1 4 4 LEU N N 4 123.830 123.830 122.291 1.539 18222
7179 1 17 . 1 1 4 4 LEU HA H 4 4.220 4.220 4.513 -0.293 18222
7180 1 17 . 1 1 4 4 LEU CA C 4 54.620 54.620 55.260 -0.640 18222
7181 1 17 . 1 1 4 4 LEU CB C 4 41.680 41.680 43.959 -2.279 18222
7182 1 17 . 1 1 4 4 LEU H H 4 8.220 8.220 8.556 -0.336 18222
7183 1 17 . 1 1 5 5 GLY N N 5 106.810 106.810 110.849 -4.039 18222
7184 1 17 . 1 1 5 5 GLY CA C 5 45.800 45.800 44.331 1.469 18222
7185 1 17 . 1 1 5 5 GLY H H 5 8.030 8.030 8.257 -0.227 18222
7186 1 17 . 1 1 6 6 LEU N N 6 120.820 120.820 122.400 -1.580 18222
7187 1 17 . 1 1 6 6 LEU HA H 6 4.050 4.050 4.400 -0.350 18222
7188 1 17 . 1 1 6 6 LEU CA C 6 55.990 55.990 57.091 -1.101 18222
7189 1 17 . 1 1 6 6 LEU CB C 6 40.800 40.800 42.123 -1.323 18222
7190 1 17 . 1 1 6 6 LEU H H 6 8.030 8.030 8.437 -0.407 18222
7191 1 17 . 1 1 7 7 SER N N 7 115.540 115.540 114.734 0.806 18222
7192 1 17 . 1 1 7 7 SER HA H 7 4.100 4.100 4.122 -0.022 18222
7193 1 17 . 1 1 7 7 SER CA C 7 60.580 60.580 60.949 -0.369 18222
7194 1 17 . 1 1 7 7 SER CB C 7 62.060 62.060 62.350 -0.290 18222
7195 1 17 . 1 1 7 7 SER H H 7 8.360 8.360 8.311 0.049 18222
7196 1 17 . 1 1 8 8 ARG N N 8 120.690 120.690 121.273 -0.583 18222
7197 1 17 . 1 1 8 8 ARG HA H 8 4.160 4.160 4.101 0.059 18222
7198 1 17 . 1 1 8 8 ARG CA C 8 57.350 57.350 59.166 -1.817 18222
7199 1 17 . 1 1 8 8 ARG CB C 8 29.230 29.230 30.035 -0.805 18222
7200 1 17 . 1 1 8 8 ARG H H 8 7.830 7.830 8.488 -0.658 18222
7201 1 17 . 1 1 9 9 VAL N N 9 119.330 119.330 119.711 -0.381 18222
7202 1 17 . 1 1 9 9 VAL HA H 9 4.170 4.170 3.652 0.518 18222
7203 1 17 . 1 1 9 9 VAL CA C 9 64.720 64.720 66.334 -1.614 18222
7204 1 17 . 1 1 9 9 VAL CB C 9 30.900 30.900 31.626 -0.726 18222
7205 1 17 . 1 1 9 9 VAL H H 9 7.620 7.620 7.435 0.185 18222
7206 1 17 . 1 1 10 10 ASP N N 10 119.520 119.520 120.013 -0.493 18222
7207 1 17 . 1 1 10 10 ASP CA C 10 54.960 54.960 57.473 -2.513 18222
7208 1 17 . 1 1 10 10 ASP CB C 10 37.800 37.800 40.603 -2.803 18222
7209 1 17 . 1 1 10 10 ASP H H 10 8.180 8.180 8.153 0.027 18222
7210 1 17 . 1 1 11 11 ASP N N 11 121.550 121.550 120.242 1.308 18222
7211 1 17 . 1 1 11 11 ASP CA C 11 54.440 54.440 57.097 -2.657 18222
7212 1 17 . 1 1 11 11 ASP CB C 11 37.840 37.840 40.685 -2.845 18222
7213 1 17 . 1 1 11 11 ASP H H 11 7.950 7.950 8.314 -0.364 18222
7214 1 17 . 1 1 12 12 ALA N N 12 120.220 120.220 123.317 -3.097 18222
7215 1 17 . 1 1 12 12 ALA CA C 12 54.370 54.370 55.356 -0.986 18222
7216 1 17 . 1 1 12 12 ALA CB C 12 24.730 24.730 18.683 6.047 18222
7217 1 17 . 1 1 12 12 ALA H H 12 8.090 8.090 7.954 0.136 18222
7218 1 17 . 1 1 13 13 VAL N N 13 116.910 116.910 118.205 -1.295 18222
7219 1 17 . 1 1 13 13 VAL HA H 13 4.140 4.140 3.661 0.479 18222
7220 1 17 . 1 1 13 13 VAL CA C 13 64.900 64.900 65.695 -0.795 18222
7221 1 17 . 1 1 13 13 VAL CB C 13 31.000 31.000 31.847 -0.847 18222
7222 1 17 . 1 1 13 13 VAL H H 13 7.980 7.980 8.297 -0.317 18222
7223 1 17 . 1 1 14 14 ALA N N 14 122.200 122.200 121.979 0.221 18222
7224 1 17 . 1 1 14 14 ALA HA H 14 4.020 4.020 4.041 -0.021 18222
7225 1 17 . 1 1 14 14 ALA CA C 14 53.800 53.800 55.053 -1.253 18222
7226 1 17 . 1 1 14 14 ALA CB C 14 17.790 17.790 18.204 -0.414 18222
7227 1 17 . 1 1 14 14 ALA H H 14 8.030 8.030 7.968 0.062 18222
7228 1 17 . 1 1 15 15 ALA N N 15 118.600 118.600 118.207 0.393 18222
7229 1 17 . 1 1 15 15 ALA CA C 15 53.230 53.230 54.331 -1.101 18222
7230 1 17 . 1 1 15 15 ALA CB C 15 18.010 18.010 18.596 -0.586 18222
7231 1 17 . 1 1 15 15 ALA H H 15 7.530 7.530 8.110 -0.580 18222
7232 1 17 . 1 1 16 16 LYS N N 16 115.820 115.820 117.341 -1.521 18222
7233 1 17 . 1 1 16 16 LYS HA H 16 4.080 4.080 4.321 -0.241 18222
7234 1 17 . 1 1 16 16 LYS CA C 16 55.670 55.670 56.630 -0.960 18222
7235 1 17 . 1 1 16 16 LYS CB C 16 32.640 32.640 33.365 -0.725 18222
7236 1 17 . 1 1 16 16 LYS H H 16 7.490 7.490 7.785 -0.295 18222
7237 1 17 . 1 1 17 17 HIS N N 17 116.790 116.790 119.234 -2.444 18222
7238 1 17 . 1 1 17 17 HIS HA H 17 4.100 4.100 4.939 -0.839 18222
7239 1 17 . 1 1 17 17 HIS CA C 17 52.820 52.820 52.695 0.125 18222
7240 1 17 . 1 1 17 17 HIS CB C 17 28.400 28.400 31.426 -3.026 18222
7241 1 17 . 1 1 17 17 HIS H H 17 8.130 8.130 7.836 0.294 18222
7242 1 17 . 1 1 18 18 PRO CA C 18 63.800 63.800 62.755 1.045 18222
7243 1 17 . 1 1 18 18 PRO CB C 18 30.800 30.800 32.544 -1.744 18222
7244 1 17 . 1 1 19 19 GLY N N 19 110.260 110.260 110.309 -0.049 18222
7245 1 17 . 1 1 19 19 GLY CA C 19 45.490 45.490 45.073 0.417 18222
7246 1 17 . 1 1 19 19 GLY H H 19 8.730 8.730 8.373 0.357 18222
7247 1 17 . 1 1 20 20 LEU N N 20 122.650 122.650 126.766 -4.116 18222
7248 1 17 . 1 1 20 20 LEU HA H 20 4.090 4.090 4.191 -0.101 18222
7249 1 17 . 1 1 20 20 LEU CA C 20 57.060 57.060 59.278 -2.218 18222
7250 1 17 . 1 1 20 20 LEU H H 20 7.980 7.980 8.382 -0.402 18222
7251 1 17 . 1 1 21 21 GLY N N 21 107.000 107.000 106.424 0.576 18222
7252 1 17 . 1 1 21 21 GLY CA C 21 46.710 46.710 47.278 -0.568 18222
7253 1 17 . 1 1 21 21 GLY H H 21 8.570 8.570 8.501 0.069 18222
7254 1 17 . 1 1 22 22 GLU N N 22 121.610 121.610 122.437 -0.827 18222
7255 1 17 . 1 1 22 22 GLU HA H 22 3.990 3.990 4.080 -0.090 18222
7256 1 17 . 1 1 22 22 GLU CA C 22 58.280 58.280 59.609 -1.329 18222
7257 1 17 . 1 1 22 22 GLU CB C 22 28.010 28.010 29.347 -1.337 18222
7258 1 17 . 1 1 22 22 GLU H H 22 8.100 8.100 8.352 -0.252 18222
7259 1 17 . 1 1 23 23 TYR N N 23 120.870 120.870 119.723 1.147 18222
7260 1 17 . 1 1 23 23 TYR CA C 23 60.380 60.380 60.700 -0.320 18222
7261 1 17 . 1 1 23 23 TYR CB C 23 37.750 37.750 37.792 -0.042 18222
7262 1 17 . 1 1 23 23 TYR H H 23 7.910 7.910 8.966 -1.056 18222
7263 1 17 . 1 1 24 24 ALA N N 24 121.420 121.420 121.887 -0.467 18222
7264 1 17 . 1 1 24 24 ALA HA H 24 4.140 4.140 4.185 -0.045 18222
7265 1 17 . 1 1 24 24 ALA CA C 24 54.260 54.260 54.537 -0.277 18222
7266 1 17 . 1 1 24 24 ALA H H 24 8.410 8.410 8.509 -0.099 18222
7267 1 17 . 1 1 25 25 ALA N N 25 120.220 120.220 121.987 -1.767 18222
7268 1 17 . 1 1 25 25 ALA CA C 25 54.370 54.370 55.128 -0.758 18222
7269 1 17 . 1 1 25 25 ALA H H 25 8.090 8.090 8.185 -0.095 18222
7270 1 17 . 1 1 26 26 CYS N N 26 116.760 116.760 117.579 -0.819 18222
7271 1 17 . 1 1 26 26 CYS CA C 26 61.180 61.180 63.178 -1.998 18222
7272 1 17 . 1 1 26 26 CYS CB C 26 26.390 26.390 27.669 -1.279 18222
7273 1 17 . 1 1 26 26 CYS H H 26 7.950 7.950 8.666 -0.716 18222
7274 1 17 . 1 1 27 27 GLN N N 27 118.690 118.690 120.182 -1.492 18222
7275 1 17 . 1 1 27 27 GLN CA C 27 55.970 55.970 59.361 -3.391 18222
7276 1 17 . 1 1 27 27 GLN H H 27 8.060 8.060 8.243 -0.183 18222
7277 1 17 . 1 1 28 28 SER N N 28 115.490 115.490 116.368 -0.878 18222
7278 1 17 . 1 1 28 28 SER HA H 28 3.990 3.990 4.114 -0.124 18222
7279 1 17 . 1 1 28 28 SER CA C 28 61.110 61.110 62.090 -0.980 18222
7280 1 17 . 1 1 28 28 SER H H 28 7.980 7.980 8.428 -0.448 18222
7281 1 17 . 1 1 29 29 HIS N N 29 120.880 120.880 120.816 0.064 18222
7282 1 17 . 1 1 29 29 HIS CA C 29 58.190 58.190 59.555 -1.365 18222
7283 1 17 . 1 1 29 29 HIS CB C 29 27.460 27.460 30.067 -2.607 18222
7284 1 17 . 1 1 29 29 HIS H H 29 8.180 8.180 8.312 -0.132 18222
7285 1 17 . 1 1 30 30 ALA N N 30 122.920 122.920 122.850 0.070 18222
7286 1 17 . 1 1 30 30 ALA CA C 30 54.560 54.560 55.282 -0.722 18222
7287 1 17 . 1 1 30 30 ALA CB C 30 17.490 17.490 18.546 -1.056 18222
7288 1 17 . 1 1 30 30 ALA H H 30 8.040 8.040 8.239 -0.199 18222
7289 1 17 . 1 1 31 31 PHE N N 31 119.340 119.340 118.991 0.349 18222
7290 1 17 . 1 1 31 31 PHE CA C 31 60.370 60.370 61.924 -1.554 18222
7291 1 17 . 1 1 31 31 PHE CB C 31 38.520 38.520 39.248 -0.728 18222
7292 1 17 . 1 1 31 31 PHE H H 31 8.230 8.230 8.807 -0.577 18222
7293 1 17 . 1 1 32 32 MET N N 32 118.110 118.110 119.616 -1.506 18222
7294 1 17 . 1 1 32 32 MET HA H 32 4.050 4.050 3.960 0.090 18222
7295 1 17 . 1 1 32 32 MET CA C 32 58.280 58.280 60.014 -1.734 18222
7296 1 17 . 1 1 32 32 MET CB C 32 31.090 31.090 32.582 -1.492 18222
7297 1 17 . 1 1 32 32 MET H H 32 8.120 8.120 8.469 -0.349 18222
7298 1 17 . 1 1 33 33 LYS N N 33 119.040 119.040 118.903 0.137 18222
7299 1 17 . 1 1 33 33 LYS HA H 33 3.930 3.930 4.056 -0.126 18222
7300 1 17 . 1 1 33 33 LYS CA C 33 59.040 59.040 59.816 -0.776 18222
7301 1 17 . 1 1 33 33 LYS CB C 33 30.990 30.990 32.386 -1.396 18222
7302 1 17 . 1 1 33 33 LYS H H 33 7.970 7.970 8.596 -0.626 18222
7303 1 17 . 1 1 34 34 GLY N N 34 108.840 108.840 107.921 0.919 18222
7304 1 17 . 1 1 34 34 GLY CA C 34 46.610 46.610 47.105 -0.495 18222
7305 1 17 . 1 1 34 34 GLY H H 34 8.030 8.030 8.283 -0.253 18222
7306 1 17 . 1 1 35 35 VAL N N 35 122.910 122.910 122.126 0.784 18222
7307 1 17 . 1 1 35 35 VAL HA H 35 4.220 4.220 3.652 0.568 18222
7308 1 17 . 1 1 35 35 VAL CA C 35 66.310 66.310 65.364 0.946 18222
7309 1 17 . 1 1 35 35 VAL CB C 35 30.560 30.560 31.828 -1.268 18222
7310 1 17 . 1 1 35 35 VAL H H 35 8.090 8.090 8.301 -0.211 18222
7311 1 17 . 1 1 36 36 PHE N N 36 120.020 120.020 121.028 -1.008 18222
7312 1 17 . 1 1 36 36 PHE CA C 36 61.350 61.350 61.582 -0.232 18222
7313 1 17 . 1 1 36 36 PHE CB C 36 38.090 38.090 39.052 -0.962 18222
7314 1 17 . 1 1 36 36 PHE H H 36 8.350 8.350 8.493 -0.143 18222
7315 1 17 . 1 1 37 37 THR N N 37 116.980 116.980 117.144 -0.164 18222
7316 1 17 . 1 1 37 37 THR HA H 37 4.050 4.050 3.842 0.208 18222
7317 1 17 . 1 1 37 37 THR CA C 37 66.000 66.000 67.192 -1.192 18222
7318 1 17 . 1 1 37 37 THR CB C 37 68.270 68.270 68.778 -0.508 18222
7319 1 17 . 1 1 37 37 THR H H 37 8.520 8.520 8.613 -0.093 18222
7320 1 17 . 1 1 38 38 PHE N N 38 123.090 123.090 121.110 1.980 18222
7321 1 17 . 1 1 38 38 PHE HA H 38 4.360 4.360 4.215 0.145 18222
7322 1 17 . 1 1 38 38 PHE CA C 38 61.140 61.140 61.712 -0.572 18222
7323 1 17 . 1 1 38 38 PHE CB C 38 41.200 41.200 39.391 1.809 18222
7324 1 17 . 1 1 38 38 PHE H H 38 8.010 8.010 8.021 -0.011 18222
7325 1 17 . 1 1 39 39 VAL N N 39 117.280 117.280 117.183 0.097 18222
7326 1 17 . 1 1 39 39 VAL HA H 39 4.210 4.210 3.662 0.548 18222
7327 1 17 . 1 1 39 39 VAL CA C 39 66.000 66.000 64.975 1.024 18222
7328 1 17 . 1 1 39 39 VAL CB C 39 30.860 30.860 31.941 -1.081 18222
7329 1 17 . 1 1 39 39 VAL H H 39 8.530 8.530 8.381 0.149 18222
7330 1 17 . 1 1 40 40 THR N N 40 109.470 109.470 113.975 -4.505 18222
7331 1 17 . 1 1 40 40 THR HA H 40 4.060 4.060 3.873 0.187 18222
7332 1 17 . 1 1 40 40 THR CA C 40 63.390 63.390 65.662 -2.272 18222
7333 1 17 . 1 1 40 40 THR CB C 40 68.650 68.650 69.148 -0.498 18222
7334 1 17 . 1 1 40 40 THR H H 40 7.700 7.700 7.695 0.005 18222
7335 1 17 . 1 1 41 41 GLY N N 41 110.770 110.770 107.860 2.910 18222
7336 1 17 . 1 1 41 41 GLY CA C 41 45.580 45.580 45.527 0.053 18222
7337 1 17 . 1 1 41 41 GLY H H 41 7.700 7.700 8.273 -0.573 18222
7338 1 17 . 1 1 42 42 THR N N 42 114.520 114.520 112.557 1.963 18222
7339 1 17 . 1 1 42 42 THR CA C 42 63.300 63.300 62.790 0.510 18222
7340 1 17 . 1 1 42 42 THR CB C 42 69.490 69.490 68.848 0.642 18222
7341 1 17 . 1 1 42 42 THR H H 42 7.720 7.720 7.836 -0.116 18222
7342 1 17 . 1 1 43 43 GLY N N 43 109.540 109.540 111.663 -2.123 18222
7343 1 17 . 1 1 43 43 GLY CA C 43 46.250 46.250 46.222 0.028 18222
7344 1 17 . 1 1 43 43 GLY H H 43 8.110 8.110 8.545 -0.435 18222
7345 1 17 . 1 1 44 44 MET N N 44 120.240 120.240 121.096 -0.856 18222
7346 1 17 . 1 1 44 44 MET HA H 44 4.100 4.100 4.002 0.098 18222
7347 1 17 . 1 1 44 44 MET CA C 44 57.700 57.700 58.889 -1.189 18222
7348 1 17 . 1 1 44 44 MET CB C 44 32.030 32.030 32.213 -0.183 18222
7349 1 17 . 1 1 44 44 MET H H 44 7.730 7.730 8.169 -0.439 18222
7350 1 17 . 1 1 45 45 ALA N N 45 121.560 121.560 121.059 0.501 18222
7351 1 17 . 1 1 45 45 ALA CA C 45 54.440 54.440 55.066 -0.626 18222
7352 1 17 . 1 1 45 45 ALA CB C 45 17.400 17.400 17.943 -0.543 18222
7353 1 17 . 1 1 45 45 ALA H H 45 7.950 7.950 7.708 0.242 18222
7354 1 17 . 1 1 46 46 PHE N N 46 118.260 118.260 119.481 -1.221 18222
7355 1 17 . 1 1 46 46 PHE HA H 46 3.930 3.930 4.449 -0.519 18222
7356 1 17 . 1 1 46 46 PHE CA C 46 59.820 59.820 60.872 -1.052 18222
7357 1 17 . 1 1 46 46 PHE CB C 46 38.260 38.260 38.772 -0.512 18222
7358 1 17 . 1 1 46 46 PHE H H 46 7.860 7.860 8.224 -0.364 18222
7359 1 17 . 1 1 47 47 GLY N N 47 107.300 107.300 108.485 -1.185 18222
7360 1 17 . 1 1 47 47 GLY CA C 47 46.560 46.560 47.420 -0.861 18222
7361 1 17 . 1 1 47 47 GLY H H 47 8.200 8.200 8.734 -0.534 18222
7362 1 17 . 1 1 48 48 LEU N N 48 121.920 121.920 122.953 -1.033 18222
7363 1 17 . 1 1 48 48 LEU HA H 48 4.040 4.040 4.000 0.040 18222
7364 1 17 . 1 1 48 48 LEU CA C 48 57.580 57.580 58.654 -1.074 18222
7365 1 17 . 1 1 48 48 LEU CB C 48 40.790 40.790 41.916 -1.126 18222
7366 1 17 . 1 1 48 48 LEU H H 48 8.180 8.180 8.218 -0.038 18222
7367 1 17 . 1 1 49 49 GLN N N 49 118.270 118.270 118.130 0.140 18222
7368 1 17 . 1 1 49 49 GLN HA H 49 3.830 3.830 3.896 -0.066 18222
7369 1 17 . 1 1 49 49 GLN CA C 49 58.880 58.880 59.064 -0.184 18222
7370 1 17 . 1 1 49 49 GLN CB C 49 27.240 27.240 28.493 -1.253 18222
7371 1 17 . 1 1 49 49 GLN H H 49 8.080 8.080 8.139 -0.059 18222
7372 1 17 . 1 1 50 50 MET N N 50 117.630 117.630 119.963 -2.333 18222
7373 1 17 . 1 1 50 50 MET HA H 50 4.010 4.010 4.151 -0.141 18222
7374 1 17 . 1 1 50 50 MET CA C 50 57.730 57.730 59.126 -1.396 18222
7375 1 17 . 1 1 50 50 MET CB C 50 27.160 27.160 32.767 -5.607 18222
7376 1 17 . 1 1 50 50 MET H H 50 7.880 7.880 8.438 -0.558 18222
7377 1 17 . 1 1 51 51 PHE N N 51 119.550 119.550 120.250 -0.700 18222
7378 1 17 . 1 1 51 51 PHE CA C 51 60.850 60.850 61.726 -0.876 18222
7379 1 17 . 1 1 51 51 PHE CB C 51 38.720 38.720 38.946 -0.226 18222
7380 1 17 . 1 1 51 51 PHE H H 51 7.890 7.890 8.432 -0.542 18222
7381 1 17 . 1 1 52 52 ILE N N 52 117.950 117.950 117.597 0.353 18222
7382 1 17 . 1 1 52 52 ILE HA H 52 4.050 4.050 3.999 0.051 18222
7383 1 17 . 1 1 52 52 ILE CA C 52 63.560 63.560 62.684 0.876 18222
7384 1 17 . 1 1 52 52 ILE CB C 52 36.810 36.810 37.900 -1.090 18222
7385 1 17 . 1 1 52 52 ILE H H 52 8.110 8.110 8.215 -0.105 18222
7386 1 17 . 1 1 53 53 GLN N N 53 117.360 117.360 118.883 -1.523 18222
7387 1 17 . 1 1 53 53 GLN CA C 53 57.200 57.200 58.572 -1.372 18222
7388 1 17 . 1 1 53 53 GLN CB C 53 27.870 27.870 28.390 -0.520 18222
7389 1 17 . 1 1 53 53 GLN H H 53 7.930 7.930 8.468 -0.538 18222
7390 1 17 . 1 1 54 54 ARG N N 54 116.840 116.840 118.751 -1.911 18222
7391 1 17 . 1 1 54 54 ARG HA H 54 3.950 3.950 4.187 -0.237 18222
7392 1 17 . 1 1 54 54 ARG CA C 54 56.480 56.480 58.167 -1.687 18222
7393 1 17 . 1 1 54 54 ARG CB C 54 28.970 28.970 30.030 -1.060 18222
7394 1 17 . 1 1 54 54 ARG H H 54 7.540 7.540 7.921 -0.381 18222
7395 1 17 . 1 1 55 55 LYS N N 55 117.900 117.900 117.669 0.231 18222
7396 1 17 . 1 1 55 55 LYS HA H 55 4.080 4.080 4.323 -0.243 18222
7397 1 17 . 1 1 55 55 LYS CA C 55 55.030 55.030 56.273 -1.244 18222
7398 1 17 . 1 1 55 55 LYS CB C 55 32.010 32.010 32.737 -0.727 18222
7399 1 17 . 1 1 55 55 LYS H H 55 7.660 7.660 7.492 0.168 18222
7400 1 17 . 1 1 56 56 PHE N N 56 121.060 121.060 120.965 0.095 18222
7401 1 17 . 1 1 56 56 PHE CA C 56 55.190 55.190 56.038 -0.848 18222
7402 1 17 . 1 1 56 56 PHE CB C 56 38.970 38.970 39.309 -0.339 18222
7403 1 17 . 1 1 56 56 PHE H H 56 8.080 8.080 7.899 0.181 18222
7404 1 17 . 1 1 57 57 PRO CA C 57 62.390 62.390 63.776 -1.386 18222
7405 1 17 . 1 1 57 57 PRO CB C 57 30.580 30.580 31.818 -1.238 18222
7406 1 17 . 1 1 58 58 TYR N N 58 120.240 120.240 119.979 0.261 18222
7407 1 17 . 1 1 58 58 TYR CA C 58 55.770 55.770 54.657 1.113 18222
7408 1 17 . 1 1 58 58 TYR CB C 58 40.220 40.220 39.475 0.745 18222
7409 1 17 . 1 1 58 58 TYR H H 58 7.700 7.700 7.913 -0.213 18222
7410 1 17 . 1 1 59 59 PRO CA C 59 62.130 62.130 63.700 -1.570 18222
7411 1 17 . 1 1 59 59 PRO CB C 59 33.340 33.340 32.278 1.062 18222
7412 1 17 . 1 1 60 60 LEU N N 60 122.210 122.210 120.379 1.831 18222
7413 1 17 . 1 1 60 60 LEU CA C 60 54.250 54.250 54.957 -0.707 18222
7414 1 17 . 1 1 60 60 LEU CB C 60 41.470 41.470 42.632 -1.162 18222
7415 1 17 . 1 1 60 60 LEU H H 60 7.880 7.880 7.923 -0.043 18222
7416 1 17 . 1 1 61 61 GLN N N 61 122.470 122.470 121.321 1.149 18222
7417 1 17 . 1 1 61 61 GLN CA C 61 54.170 54.170 55.500 -1.330 18222
7418 1 17 . 1 1 61 61 GLN H H 61 7.970 7.970 8.175 -0.205 18222
7419 1 17 . 1 1 62 62 TRP N N 62 124.590 124.590 125.104 -0.514 18222
7420 1 17 . 1 1 62 62 TRP CA C 62 59.830 59.830 60.115 -0.285 18222
7421 1 17 . 1 1 62 62 TRP CB C 62 28.800 28.800 29.284 -0.484 18222
7422 1 17 . 1 1 62 62 TRP H H 62 8.240 8.240 8.466 -0.226 18222
7423 1 17 . 1 1 63 63 SER N N 63 113.320 113.320 115.119 -1.799 18222
7424 1 17 . 1 1 63 63 SER CA C 63 61.100 61.100 61.554 -0.454 18222
7425 1 17 . 1 1 63 63 SER H H 63 8.410 8.410 8.020 0.390 18222
7426 1 17 . 1 1 64 64 LEU N N 64 123.230 123.230 121.336 1.894 18222
7427 1 17 . 1 1 64 64 LEU CA C 64 56.880 56.880 57.491 -0.611 18222
7428 1 17 . 1 1 64 64 LEU CB C 64 40.830 40.830 41.203 -0.373 18222
7429 1 17 . 1 1 64 64 LEU H H 64 7.230 7.230 7.985 -0.755 18222
7430 1 17 . 1 1 65 65 LEU N N 65 119.400 119.400 120.707 -1.307 18222
7431 1 17 . 1 1 65 65 LEU HA H 65 3.890 3.890 4.048 -0.158 18222
7432 1 17 . 1 1 65 65 LEU CA C 65 57.580 57.580 58.310 -0.730 18222
7433 1 17 . 1 1 65 65 LEU CB C 65 40.710 40.710 42.020 -1.310 18222
7434 1 17 . 1 1 65 65 LEU H H 65 7.510 7.510 8.249 -0.739 18222
7435 1 17 . 1 1 66 66 VAL N N 66 116.950 116.950 119.204 -2.254 18222
7436 1 17 . 1 1 66 66 VAL HA H 66 3.960 3.960 3.598 0.362 18222
7437 1 17 . 1 1 66 66 VAL CA C 66 66.260 66.260 66.644 -0.383 18222
7438 1 17 . 1 1 66 66 VAL CB C 66 30.570 30.570 31.079 -0.509 18222
7439 1 17 . 1 1 66 66 VAL H H 66 7.950 7.950 8.182 -0.232 18222
7440 1 17 . 1 1 67 67 ALA N N 67 120.650 120.650 122.683 -2.033 18222
7441 1 17 . 1 1 67 67 ALA HA H 67 4.000 4.000 4.108 -0.108 18222
7442 1 17 . 1 1 67 67 ALA CA C 67 54.780 54.780 55.402 -0.622 18222
7443 1 17 . 1 1 67 67 ALA CB C 67 17.440 17.440 18.294 -0.854 18222
7444 1 17 . 1 1 67 67 ALA H H 67 7.450 7.450 8.162 -0.712 18222
7445 1 17 . 1 1 68 68 VAL N N 68 118.440 118.440 118.776 -0.336 18222
7446 1 17 . 1 1 68 68 VAL HA H 68 3.750 3.750 3.686 0.064 18222
7447 1 17 . 1 1 68 68 VAL CA C 68 65.250 65.250 66.211 -0.961 18222
7448 1 17 . 1 1 68 68 VAL CB C 68 30.850 30.850 31.715 -0.865 18222
7449 1 17 . 1 1 68 68 VAL H H 68 7.960 7.960 7.898 0.062 18222
7450 1 17 . 1 1 69 69 VAL N N 69 120.800 120.800 120.546 0.254 18222
7451 1 17 . 1 1 69 69 VAL HA H 69 4.220 4.220 3.648 0.572 18222
7452 1 17 . 1 1 69 69 VAL CA C 69 66.020 66.020 66.501 -0.481 18222
7453 1 17 . 1 1 69 69 VAL CB C 69 30.850 30.850 31.571 -0.721 18222
7454 1 17 . 1 1 69 69 VAL H H 69 8.080 8.080 8.493 -0.413 18222
7455 1 17 . 1 1 70 70 ALA N N 70 121.740 121.740 120.493 1.247 18222
7456 1 17 . 1 1 70 70 ALA HA H 70 3.920 3.920 4.220 -0.300 18222
7457 1 17 . 1 1 70 70 ALA CA C 70 54.920 54.920 55.441 -0.522 18222
7458 1 17 . 1 1 70 70 ALA CB C 70 17.620 17.620 18.064 -0.444 18222
7459 1 17 . 1 1 70 70 ALA H H 70 8.660 8.660 8.562 0.098 18222
7460 1 17 . 1 1 71 71 GLY N N 71 103.450 103.450 106.953 -3.503 18222
7461 1 17 . 1 1 71 71 GLY CA C 71 46.300 46.300 46.839 -0.539 18222
7462 1 17 . 1 1 71 71 GLY H H 71 8.010 8.010 8.079 -0.069 18222
7463 1 17 . 1 1 72 72 SER N N 72 118.160 118.160 116.887 1.273 18222
7464 1 17 . 1 1 72 72 SER CA C 72 61.260 61.260 61.496 -0.236 18222
7465 1 17 . 1 1 72 72 SER CB C 72 62.870 62.870 63.138 -0.268 18222
7466 1 17 . 1 1 72 72 SER H H 72 7.870 7.870 8.001 -0.131 18222
7467 1 17 . 1 1 73 73 VAL N N 73 121.340 121.340 122.301 -0.961 18222
7468 1 17 . 1 1 73 73 VAL CA C 73 65.750 65.750 66.168 -0.419 18222
7469 1 17 . 1 1 73 73 VAL CB C 73 30.740 30.740 31.148 -0.408 18222
7470 1 17 . 1 1 73 73 VAL H H 73 8.050 8.050 8.251 -0.201 18222
7471 1 17 . 1 1 74 74 VAL N N 74 118.680 118.680 119.285 -0.605 18222
7472 1 17 . 1 1 74 74 VAL CA C 74 65.770 65.770 66.599 -0.829 18222
7473 1 17 . 1 1 74 74 VAL CB C 74 30.740 30.740 30.514 0.226 18222
7474 1 17 . 1 1 74 74 VAL H H 74 7.880 7.880 8.657 -0.777 18222
7475 1 17 . 1 1 75 75 SER N N 75 114.750 114.750 116.592 -1.842 18222
7476 1 17 . 1 1 75 75 SER HA H 75 4.100 4.100 4.210 -0.110 18222
7477 1 17 . 1 1 75 75 SER CA C 75 60.870 60.870 62.193 -1.323 18222
7478 1 17 . 1 1 75 75 SER CB C 75 62.340 62.340 62.911 -0.571 18222
7479 1 17 . 1 1 75 75 SER H H 75 7.870 7.870 8.069 -0.199 18222
7480 1 17 . 1 1 76 76 TYR N N 76 121.110 121.110 123.038 -1.928 18222
7481 1 17 . 1 1 76 76 TYR CA C 76 60.050 60.050 61.646 -1.596 18222
7482 1 17 . 1 1 76 76 TYR CB C 76 37.980 37.980 38.536 -0.556 18222
7483 1 17 . 1 1 76 76 TYR H H 76 7.860 7.860 8.524 -0.664 18222
7484 1 17 . 1 1 77 77 GLY N N 77 107.300 107.300 106.811 0.489 18222
7485 1 17 . 1 1 77 77 GLY CA C 77 46.560 46.560 47.219 -0.659 18222
7486 1 17 . 1 1 77 77 GLY H H 77 8.200 8.200 8.654 -0.454 18222
7487 1 17 . 1 1 78 78 VAL N N 78 119.470 119.470 121.376 -1.906 18222
7488 1 17 . 1 1 78 78 VAL HA H 78 4.170 4.170 3.810 0.360 18222
7489 1 17 . 1 1 78 78 VAL CA C 78 64.650 64.650 65.277 -0.627 18222
7490 1 17 . 1 1 78 78 VAL H H 78 8.140 8.140 8.656 -0.516 18222
7491 1 17 . 1 1 79 79 THR N N 79 112.100 112.100 116.736 -4.636 18222
7492 1 17 . 1 1 79 79 THR CA C 79 63.460 63.460 66.496 -3.036 18222
7493 1 17 . 1 1 79 79 THR CB C 79 68.650 68.650 68.525 0.125 18222
7494 1 17 . 1 1 79 79 THR H H 79 7.640 7.640 8.009 -0.369 18222
7495 1 17 . 1 1 80 80 ARG N N 80 120.770 120.770 121.854 -1.084 18222
7496 1 17 . 1 1 80 80 ARG HA H 80 4.160 4.160 4.056 0.104 18222
7497 1 17 . 1 1 80 80 ARG CA C 80 56.790 56.790 59.335 -2.545 18222
7498 1 17 . 1 1 80 80 ARG CB C 80 29.430 29.430 29.925 -0.495 18222
7499 1 17 . 1 1 80 80 ARG H H 80 7.680 7.680 7.914 -0.234 18222
7500 1 17 . 1 1 81 81 VAL N N 81 118.370 118.370 119.566 -1.196 18222
7501 1 17 . 1 1 81 81 VAL HA H 81 3.920 3.920 3.773 0.147 18222
7502 1 17 . 1 1 81 81 VAL CA C 81 63.340 63.340 65.722 -2.382 18222
7503 1 17 . 1 1 81 81 VAL CB C 81 31.260 31.260 31.079 0.181 18222
7504 1 17 . 1 1 81 81 VAL H H 81 7.730 7.730 8.271 -0.541 18222
7505 1 17 . 1 1 82 82 GLU N N 82 120.620 120.620 119.613 1.007 18222
7506 1 17 . 1 1 82 82 GLU CA C 82 56.320 56.320 59.681 -3.361 18222
7507 1 17 . 1 1 82 82 GLU CB C 82 27.930 27.930 29.391 -1.461 18222
7508 1 17 . 1 1 82 82 GLU H H 82 7.920 7.920 8.558 -0.638 18222
7509 1 17 . 1 1 83 83 SER N N 83 116.240 116.240 115.665 0.575 18222
7510 1 17 . 1 1 83 83 SER CA C 83 59.250 59.250 61.907 -2.657 18222
7511 1 17 . 1 1 83 83 SER CB C 83 63.160 63.160 63.009 0.151 18222
7512 1 17 . 1 1 83 83 SER H H 83 7.960 7.960 8.079 -0.119 18222
7513 1 17 . 1 1 84 84 GLU N N 84 123.280 123.280 121.688 1.592 18222
7514 1 17 . 1 1 84 84 GLU HA H 84 4.080 4.080 4.011 0.069 18222
7515 1 17 . 1 1 84 84 GLU CA C 84 57.860 57.860 59.451 -1.591 18222
7516 1 17 . 1 1 84 84 GLU CB C 84 28.190 28.190 29.721 -1.531 18222
7517 1 17 . 1 1 84 84 GLU H H 84 8.470 8.470 8.061 0.409 18222
7518 1 17 . 1 1 85 85 LYS N N 85 118.650 118.650 119.609 -0.959 18222
7519 1 17 . 1 1 85 85 LYS HA H 85 4.100 4.100 4.139 -0.039 18222
7520 1 17 . 1 1 85 85 LYS CA C 85 57.780 57.780 59.461 -1.681 18222
7521 1 17 . 1 1 85 85 LYS CB C 85 31.380 31.380 32.352 -0.972 18222
7522 1 17 . 1 1 85 85 LYS H H 85 7.940 7.940 8.160 -0.220 18222
7523 1 17 . 1 1 86 86 CYS N N 86 117.070 117.070 118.504 -1.434 18222
7524 1 17 . 1 1 86 86 CYS CA C 86 60.910 60.910 61.752 -0.842 18222
7525 1 17 . 1 1 86 86 CYS CB C 86 26.740 26.740 26.258 0.482 18222
7526 1 17 . 1 1 86 86 CYS H H 86 7.840 7.840 8.428 -0.588 18222
7527 1 17 . 1 1 87 87 ASN N N 87 119.370 119.370 119.431 -0.061 18222
7528 1 17 . 1 1 87 87 ASN HA H 87 4.130 4.130 4.623 -0.493 18222
7529 1 17 . 1 1 87 87 ASN CA C 87 55.750 55.750 56.541 -0.791 18222
7530 1 17 . 1 1 87 87 ASN CB C 87 38.050 38.050 38.389 -0.339 18222
7531 1 17 . 1 1 87 87 ASN H H 87 8.110 8.110 8.573 -0.463 18222
7532 1 17 . 1 1 88 88 ASN N N 88 117.570 117.570 119.587 -2.017 18222
7533 1 17 . 1 1 88 88 ASN HA H 88 4.280 4.280 4.429 -0.149 18222
7534 1 17 . 1 1 88 88 ASN CA C 88 55.190 55.190 56.736 -1.546 18222
7535 1 17 . 1 1 88 88 ASN CB C 88 37.400 37.400 38.753 -1.353 18222
7536 1 17 . 1 1 88 88 ASN H H 88 8.280 8.280 8.362 -0.082 18222
7537 1 17 . 1 1 89 89 LEU N N 89 121.940 121.940 121.828 0.112 18222
7538 1 17 . 1 1 89 89 LEU HA H 89 4.070 4.070 4.203 -0.133 18222
7539 1 17 . 1 1 89 89 LEU CA C 89 57.580 57.580 58.481 -0.901 18222
7540 1 17 . 1 1 89 89 LEU CB C 89 40.490 40.490 42.135 -1.645 18222
7541 1 17 . 1 1 89 89 LEU H H 89 7.790 7.790 8.191 -0.401 18222
7542 1 17 . 1 1 90 90 TRP N N 90 119.220 119.220 121.478 -2.258 18222
7543 1 17 . 1 1 90 90 TRP CA C 90 59.120 59.120 60.812 -1.692 18222
7544 1 17 . 1 1 90 90 TRP CB C 90 28.800 28.800 28.968 -0.168 18222
7545 1 17 . 1 1 90 90 TRP H H 90 7.850 7.850 8.716 -0.866 18222
7546 1 17 . 1 1 91 91 LEU N N 91 117.870 117.870 119.973 -2.103 18222
7547 1 17 . 1 1 91 91 LEU CA C 91 57.300 57.300 58.049 -0.749 18222
7548 1 17 . 1 1 91 91 LEU CB C 91 40.610 40.610 41.612 -1.002 18222
7549 1 17 . 1 1 91 91 LEU H H 91 7.920 7.920 7.963 -0.043 18222
7550 1 17 . 1 1 92 92 PHE N N 92 121.280 121.280 117.182 4.098 18222
7551 1 17 . 1 1 92 92 PHE CA C 92 60.390 60.390 61.599 -1.209 18222
7552 1 17 . 1 1 92 92 PHE CB C 92 37.980 37.980 38.728 -0.748 18222
7553 1 17 . 1 1 92 92 PHE H H 92 7.860 7.860 7.848 0.012 18222
7554 1 17 . 1 1 93 93 LEU N N 93 119.860 119.860 120.644 -0.784 18222
7555 1 17 . 1 1 93 93 LEU CA C 93 56.860 56.860 57.973 -1.113 18222
7556 1 17 . 1 1 93 93 LEU CB C 93 40.550 40.550 41.507 -0.957 18222
7557 1 17 . 1 1 93 93 LEU H H 93 7.980 7.980 8.712 -0.732 18222
7558 1 17 . 1 1 94 94 GLU N N 94 114.660 114.660 118.509 -3.849 18222
7559 1 17 . 1 1 94 94 GLU HA H 94 3.810 3.810 4.143 -0.333 18222
7560 1 17 . 1 1 94 94 GLU CA C 94 57.210 57.210 58.917 -1.707 18222
7561 1 17 . 1 1 94 94 GLU CB C 94 28.470 28.470 29.410 -0.940 18222
7562 1 17 . 1 1 94 94 GLU H H 94 7.890 7.890 8.106 -0.216 18222
7563 1 17 . 1 1 95 95 THR N N 95 108.260 108.260 111.545 -3.285 18222
7564 1 17 . 1 1 95 95 THR CA C 95 62.150 62.150 62.135 0.015 18222
7565 1 17 . 1 1 95 95 THR CB C 95 70.810 70.810 69.575 1.236 18222
7566 1 17 . 1 1 95 95 THR H H 95 7.690 7.690 7.863 -0.173 18222
7567 1 17 . 1 1 96 96 GLY N N 96 112.220 112.220 109.986 2.234 18222
7568 1 17 . 1 1 96 96 GLY CA C 96 45.410 45.410 45.064 0.346 18222
7569 1 17 . 1 1 96 96 GLY H H 96 8.240 8.240 7.546 0.694 18222
7570 1 17 . 1 1 97 97 GLN N N 97 117.950 117.950 119.921 -1.971 18222
7571 1 17 . 1 1 97 97 GLN HA H 97 4.200 4.200 4.355 -0.155 18222
7572 1 17 . 1 1 97 97 GLN CA C 97 54.430 54.430 55.574 -1.144 18222
7573 1 17 . 1 1 97 97 GLN CB C 97 29.910 29.910 29.954 -0.044 18222
7574 1 17 . 1 1 97 97 GLN H H 97 7.640 7.640 7.972 -0.332 18222
7575 1 17 . 1 1 98 98 LEU N N 98 123.810 123.810 126.216 -2.406 18222
7576 1 17 . 1 1 98 98 LEU HA H 98 4.360 4.360 4.361 -0.001 18222
7577 1 17 . 1 1 98 98 LEU CA C 98 52.650 52.650 53.391 -0.741 18222
7578 1 17 . 1 1 98 98 LEU CB C 98 40.460 40.460 41.441 -0.981 18222
7579 1 17 . 1 1 98 98 LEU H H 98 8.270 8.270 8.372 -0.102 18222
7580 1 17 . 1 1 99 99 PRO CA C 99 63.180 63.180 61.915 1.265 18222
7581 1 17 . 1 1 99 99 PRO CB C 99 30.840 30.840 32.666 -1.826 18222
7582 1 17 . 1 1 100 100 LYS N N 100 120.630 120.630 120.645 -0.015 18222
7583 1 17 . 1 1 100 100 LYS CA C 100 55.730 55.730 58.461 -2.731 18222
7584 1 17 . 1 1 100 100 LYS CB C 100 32.280 32.280 32.605 -0.326 18222
7585 1 17 . 1 1 100 100 LYS H H 100 8.090 8.090 8.416 -0.326 18222
7586 1 17 . 1 1 101 101 ASP N N 101 120.920 120.920 116.374 4.546 18222
7587 1 17 . 1 1 101 101 ASP HA H 101 4.190 4.190 4.666 -0.476 18222
7588 1 17 . 1 1 101 101 ASP CA C 101 54.000 54.000 53.873 0.127 18222
7589 1 17 . 1 1 101 101 ASP CB C 101 40.330 40.330 42.181 -1.851 18222
7590 1 17 . 1 1 101 101 ASP H H 101 8.190 8.190 8.040 0.150 18222
7591 1 17 . 1 1 102 102 ARG N N 102 122.210 122.210 119.940 2.270 18222
7592 1 17 . 1 1 102 102 ARG CA C 102 55.590 55.590 55.424 0.166 18222
7593 1 17 . 1 1 102 102 ARG CB C 102 29.630 29.630 30.922 -1.292 18222
7594 1 17 . 1 1 102 102 ARG H H 102 8.130 8.130 8.232 -0.102 18222
7595 1 17 . 1 1 103 103 SER N N 103 117.230 117.230 119.482 -2.252 18222
7596 1 17 . 1 1 103 103 SER HA H 103 4.280 4.280 4.659 -0.379 18222
7597 1 17 . 1 1 103 103 SER CA C 103 58.470 58.470 57.774 0.696 18222
7598 1 17 . 1 1 103 103 SER CB C 103 63.080 63.080 64.145 -1.065 18222
7599 1 17 . 1 1 103 103 SER H H 103 8.290 8.290 8.486 -0.196 18222
7600 1 17 . 1 1 104 104 THR N N 104 115.430 115.430 119.091 -3.661 18222
7601 1 17 . 1 1 104 104 THR CA C 104 61.570 61.570 63.368 -1.798 18222
7602 1 17 . 1 1 104 104 THR CB C 104 69.030 69.030 69.426 -0.396 18222
7603 1 17 . 1 1 104 104 THR H H 104 8.020 8.020 8.460 -0.440 18222
7604 1 17 . 1 1 105 105 ASP N N 105 122.780 122.780 124.830 -2.050 18222
7605 1 17 . 1 1 105 105 ASP CA C 105 54.210 54.210 53.737 0.473 18222
7606 1 17 . 1 1 105 105 ASP CB C 105 40.380 40.380 42.561 -2.181 18222
7607 1 17 . 1 1 105 105 ASP H H 105 8.120 8.120 8.364 -0.244 18222
7608 1 17 . 1 1 106 106 GLN N N 106 120.960 120.960 120.831 0.129 18222
7609 1 17 . 1 1 106 106 GLN CA C 106 55.420 55.420 56.113 -0.693 18222
7610 1 17 . 1 1 106 106 GLN CB C 106 28.310 28.310 30.098 -1.788 18222
7611 1 17 . 1 1 106 106 GLN H H 106 8.140 8.140 8.649 -0.509 18222
7612 1 17 . 1 1 107 107 ARG N N 107 123.010 123.010 124.493 -1.483 18222
7613 1 17 . 1 1 107 107 ARG HA H 107 4.210 4.210 4.625 -0.415 18222
7614 1 17 . 1 1 107 107 ARG CA C 107 55.560 55.560 56.435 -0.875 18222
7615 1 17 . 1 1 107 107 ARG CB C 107 29.920 29.920 31.292 -1.372 18222
7616 1 17 . 1 1 107 107 ARG H H 107 8.180 8.180 8.628 -0.448 18222
7617 1 18 . 1 1 2 2 VAL N N 2 121.590 121.590 124.504 -2.914 18222
7618 1 18 . 1 1 2 2 VAL CA C 2 61.600 61.600 62.486 -0.886 18222
7619 1 18 . 1 1 2 2 VAL CB C 2 31.900 31.900 33.181 -1.281 18222
7620 1 18 . 1 1 2 2 VAL H H 2 8.010 8.010 8.446 -0.436 18222
7621 1 18 . 1 1 3 3 ASN N N 3 122.520 122.520 123.267 -0.747 18222
7622 1 18 . 1 1 3 3 ASN HA H 3 4.020 4.020 4.664 -0.644 18222
7623 1 18 . 1 1 3 3 ASN CA C 3 52.640 52.640 54.132 -1.492 18222
7624 1 18 . 1 1 3 3 ASN CB C 3 38.330 38.330 38.636 -0.305 18222
7625 1 18 . 1 1 3 3 ASN H H 3 8.360 8.360 8.795 -0.435 18222
7626 1 18 . 1 1 4 4 LEU N N 4 123.830 123.830 120.957 2.873 18222
7627 1 18 . 1 1 4 4 LEU HA H 4 4.220 4.220 4.167 0.053 18222
7628 1 18 . 1 1 4 4 LEU CA C 4 54.620 54.620 55.977 -1.357 18222
7629 1 18 . 1 1 4 4 LEU CB C 4 41.680 41.680 42.276 -0.596 18222
7630 1 18 . 1 1 4 4 LEU H H 4 8.220 8.220 8.027 0.193 18222
7631 1 18 . 1 1 5 5 GLY N N 5 106.810 106.810 105.693 1.117 18222
7632 1 18 . 1 1 5 5 GLY CA C 5 45.800 45.800 44.337 1.463 18222
7633 1 18 . 1 1 5 5 GLY H H 5 8.030 8.030 7.694 0.336 18222
7634 1 18 . 1 1 6 6 LEU N N 6 120.820 120.820 122.274 -1.454 18222
7635 1 18 . 1 1 6 6 LEU HA H 6 4.050 4.050 4.604 -0.554 18222
7636 1 18 . 1 1 6 6 LEU CA C 6 55.990 55.990 54.749 1.241 18222
7637 1 18 . 1 1 6 6 LEU CB C 6 40.800 40.800 41.661 -0.861 18222
7638 1 18 . 1 1 6 6 LEU H H 6 8.030 8.030 8.415 -0.385 18222
7639 1 18 . 1 1 7 7 SER N N 7 115.540 115.540 116.062 -0.522 18222
7640 1 18 . 1 1 7 7 SER HA H 7 4.100 4.100 4.015 0.085 18222
7641 1 18 . 1 1 7 7 SER CA C 7 60.580 60.580 61.999 -1.419 18222
7642 1 18 . 1 1 7 7 SER CB C 7 62.060 62.060 63.135 -1.075 18222
7643 1 18 . 1 1 7 7 SER H H 7 8.360 8.360 8.400 -0.040 18222
7644 1 18 . 1 1 8 8 ARG N N 8 120.690 120.690 120.343 0.347 18222
7645 1 18 . 1 1 8 8 ARG HA H 8 4.160 4.160 3.983 0.177 18222
7646 1 18 . 1 1 8 8 ARG CA C 8 57.350 57.350 59.522 -2.171 18222
7647 1 18 . 1 1 8 8 ARG CB C 8 29.230 29.230 30.111 -0.881 18222
7648 1 18 . 1 1 8 8 ARG H H 8 7.830 7.830 8.299 -0.469 18222
7649 1 18 . 1 1 9 9 VAL N N 9 119.330 119.330 118.759 0.571 18222
7650 1 18 . 1 1 9 9 VAL HA H 9 4.170 4.170 3.647 0.523 18222
7651 1 18 . 1 1 9 9 VAL CA C 9 64.720 64.720 66.608 -1.888 18222
7652 1 18 . 1 1 9 9 VAL CB C 9 30.900 30.900 31.720 -0.820 18222
7653 1 18 . 1 1 9 9 VAL H H 9 7.620 7.620 7.984 -0.364 18222
7654 1 18 . 1 1 10 10 ASP N N 10 119.520 119.520 120.556 -1.036 18222
7655 1 18 . 1 1 10 10 ASP CA C 10 54.960 54.960 58.239 -3.279 18222
7656 1 18 . 1 1 10 10 ASP CB C 10 37.800 37.800 40.670 -2.870 18222
7657 1 18 . 1 1 10 10 ASP H H 10 8.180 8.180 8.242 -0.062 18222
7658 1 18 . 1 1 11 11 ASP N N 11 121.550 121.550 120.200 1.350 18222
7659 1 18 . 1 1 11 11 ASP CA C 11 54.440 54.440 57.211 -2.771 18222
7660 1 18 . 1 1 11 11 ASP CB C 11 37.840 37.840 40.785 -2.945 18222
7661 1 18 . 1 1 11 11 ASP H H 11 7.950 7.950 8.197 -0.247 18222
7662 1 18 . 1 1 12 12 ALA N N 12 120.220 120.220 122.775 -2.555 18222
7663 1 18 . 1 1 12 12 ALA CA C 12 54.370 54.370 55.451 -1.081 18222
7664 1 18 . 1 1 12 12 ALA CB C 12 24.730 24.730 18.450 6.280 18222
7665 1 18 . 1 1 12 12 ALA H H 12 8.090 8.090 8.017 0.073 18222
7666 1 18 . 1 1 13 13 VAL N N 13 116.910 116.910 116.305 0.605 18222
7667 1 18 . 1 1 13 13 VAL HA H 13 4.140 4.140 3.751 0.389 18222
7668 1 18 . 1 1 13 13 VAL CA C 13 64.900 64.900 64.432 0.468 18222
7669 1 18 . 1 1 13 13 VAL CB C 13 31.000 31.000 30.477 0.522 18222
7670 1 18 . 1 1 13 13 VAL H H 13 7.980 7.980 8.029 -0.049 18222
7671 1 18 . 1 1 14 14 ALA N N 14 122.200 122.200 123.289 -1.089 18222
7672 1 18 . 1 1 14 14 ALA HA H 14 4.020 4.020 4.026 -0.006 18222
7673 1 18 . 1 1 14 14 ALA CA C 14 53.800 53.800 54.993 -1.193 18222
7674 1 18 . 1 1 14 14 ALA CB C 14 17.790 17.790 18.089 -0.299 18222
7675 1 18 . 1 1 14 14 ALA H H 14 8.030 8.030 7.925 0.105 18222
7676 1 18 . 1 1 15 15 ALA N N 15 118.600 118.600 119.616 -1.016 18222
7677 1 18 . 1 1 15 15 ALA CA C 15 53.230 53.230 53.962 -0.732 18222
7678 1 18 . 1 1 15 15 ALA CB C 15 18.010 18.010 18.564 -0.554 18222
7679 1 18 . 1 1 15 15 ALA H H 15 7.530 7.530 8.198 -0.668 18222
7680 1 18 . 1 1 16 16 LYS N N 16 115.820 115.820 117.375 -1.555 18222
7681 1 18 . 1 1 16 16 LYS HA H 16 4.080 4.080 4.258 -0.178 18222
7682 1 18 . 1 1 16 16 LYS CA C 16 55.670 55.670 56.904 -1.234 18222
7683 1 18 . 1 1 16 16 LYS CB C 16 32.640 32.640 33.002 -0.362 18222
7684 1 18 . 1 1 16 16 LYS H H 16 7.490 7.490 7.426 0.064 18222
7685 1 18 . 1 1 17 17 HIS N N 17 116.790 116.790 119.550 -2.760 18222
7686 1 18 . 1 1 17 17 HIS HA H 17 4.100 4.100 4.875 -0.775 18222
7687 1 18 . 1 1 17 17 HIS CA C 17 52.820 52.820 53.026 -0.206 18222
7688 1 18 . 1 1 17 17 HIS CB C 17 28.400 28.400 31.200 -2.800 18222
7689 1 18 . 1 1 17 17 HIS H H 17 8.130 8.130 7.595 0.535 18222
7690 1 18 . 1 1 18 18 PRO CA C 18 63.800 63.800 62.582 1.218 18222
7691 1 18 . 1 1 18 18 PRO CB C 18 30.800 30.800 32.825 -2.025 18222
7692 1 18 . 1 1 19 19 GLY N N 19 110.260 110.260 107.515 2.745 18222
7693 1 18 . 1 1 19 19 GLY CA C 19 45.490 45.490 44.729 0.761 18222
7694 1 18 . 1 1 19 19 GLY H H 19 8.730 8.730 8.202 0.528 18222
7695 1 18 . 1 1 20 20 LEU N N 20 122.650 122.650 123.077 -0.427 18222
7696 1 18 . 1 1 20 20 LEU HA H 20 4.090 4.090 3.891 0.199 18222
7697 1 18 . 1 1 20 20 LEU CA C 20 57.060 57.060 57.401 -0.341 18222
7698 1 18 . 1 1 20 20 LEU H H 20 7.980 7.980 8.489 -0.509 18222
7699 1 18 . 1 1 21 21 GLY N N 21 107.000 107.000 107.598 -0.598 18222
7700 1 18 . 1 1 21 21 GLY CA C 21 46.710 46.710 46.780 -0.070 18222
7701 1 18 . 1 1 21 21 GLY H H 21 8.570 8.570 8.393 0.177 18222
7702 1 18 . 1 1 22 22 GLU N N 22 121.610 121.610 122.220 -0.610 18222
7703 1 18 . 1 1 22 22 GLU HA H 22 3.990 3.990 4.170 -0.180 18222
7704 1 18 . 1 1 22 22 GLU CA C 22 58.280 58.280 59.168 -0.888 18222
7705 1 18 . 1 1 22 22 GLU CB C 22 28.010 28.010 29.465 -1.454 18222
7706 1 18 . 1 1 22 22 GLU H H 22 8.100 8.100 8.477 -0.377 18222
7707 1 18 . 1 1 23 23 TYR N N 23 120.870 120.870 121.817 -0.947 18222
7708 1 18 . 1 1 23 23 TYR CA C 23 60.380 60.380 61.313 -0.933 18222
7709 1 18 . 1 1 23 23 TYR CB C 23 37.750 37.750 38.492 -0.742 18222
7710 1 18 . 1 1 23 23 TYR H H 23 7.910 7.910 8.887 -0.977 18222
7711 1 18 . 1 1 24 24 ALA N N 24 121.420 121.420 120.675 0.745 18222
7712 1 18 . 1 1 24 24 ALA HA H 24 4.140 4.140 4.122 0.018 18222
7713 1 18 . 1 1 24 24 ALA CA C 24 54.260 54.260 54.633 -0.373 18222
7714 1 18 . 1 1 24 24 ALA H H 24 8.410 8.410 8.322 0.088 18222
7715 1 18 . 1 1 25 25 ALA N N 25 120.220 120.220 121.873 -1.653 18222
7716 1 18 . 1 1 25 25 ALA CA C 25 54.370 54.370 55.302 -0.932 18222
7717 1 18 . 1 1 25 25 ALA H H 25 8.090 8.090 8.271 -0.181 18222
7718 1 18 . 1 1 26 26 CYS N N 26 116.760 116.760 117.401 -0.641 18222
7719 1 18 . 1 1 26 26 CYS CA C 26 61.180 61.180 63.185 -2.005 18222
7720 1 18 . 1 1 26 26 CYS CB C 26 26.390 26.390 26.852 -0.462 18222
7721 1 18 . 1 1 26 26 CYS H H 26 7.950 7.950 8.468 -0.518 18222
7722 1 18 . 1 1 27 27 GLN N N 27 118.690 118.690 121.807 -3.117 18222
7723 1 18 . 1 1 27 27 GLN CA C 27 55.970 55.970 59.414 -3.445 18222
7724 1 18 . 1 1 27 27 GLN H H 27 8.060 8.060 8.340 -0.280 18222
7725 1 18 . 1 1 28 28 SER N N 28 115.490 115.490 114.463 1.027 18222
7726 1 18 . 1 1 28 28 SER HA H 28 3.990 3.990 4.252 -0.262 18222
7727 1 18 . 1 1 28 28 SER CA C 28 61.110 61.110 61.051 0.059 18222
7728 1 18 . 1 1 28 28 SER H H 28 7.980 7.980 8.532 -0.552 18222
7729 1 18 . 1 1 29 29 HIS N N 29 120.880 120.880 121.641 -0.761 18222
7730 1 18 . 1 1 29 29 HIS CA C 29 58.190 58.190 59.787 -1.597 18222
7731 1 18 . 1 1 29 29 HIS CB C 29 27.460 27.460 29.918 -2.458 18222
7732 1 18 . 1 1 29 29 HIS H H 29 8.180 8.180 8.214 -0.034 18222
7733 1 18 . 1 1 30 30 ALA N N 30 122.920 122.920 122.576 0.344 18222
7734 1 18 . 1 1 30 30 ALA CA C 30 54.560 54.560 55.342 -0.782 18222
7735 1 18 . 1 1 30 30 ALA CB C 30 17.490 17.490 18.427 -0.937 18222
7736 1 18 . 1 1 30 30 ALA H H 30 8.040 8.040 8.157 -0.117 18222
7737 1 18 . 1 1 31 31 PHE N N 31 119.340 119.340 119.437 -0.097 18222
7738 1 18 . 1 1 31 31 PHE CA C 31 60.370 60.370 61.263 -0.893 18222
7739 1 18 . 1 1 31 31 PHE CB C 31 38.520 38.520 39.408 -0.888 18222
7740 1 18 . 1 1 31 31 PHE H H 31 8.230 8.230 8.398 -0.168 18222
7741 1 18 . 1 1 32 32 MET N N 32 118.110 118.110 120.240 -2.130 18222
7742 1 18 . 1 1 32 32 MET HA H 32 4.050 4.050 4.122 -0.072 18222
7743 1 18 . 1 1 32 32 MET CA C 32 58.280 58.280 59.448 -1.168 18222
7744 1 18 . 1 1 32 32 MET CB C 32 31.090 31.090 32.174 -1.084 18222
7745 1 18 . 1 1 32 32 MET H H 32 8.120 8.120 8.567 -0.447 18222
7746 1 18 . 1 1 33 33 LYS N N 33 119.040 119.040 119.333 -0.293 18222
7747 1 18 . 1 1 33 33 LYS HA H 33 3.930 3.930 3.996 -0.066 18222
7748 1 18 . 1 1 33 33 LYS CA C 33 59.040 59.040 59.537 -0.497 18222
7749 1 18 . 1 1 33 33 LYS CB C 33 30.990 30.990 32.362 -1.372 18222
7750 1 18 . 1 1 33 33 LYS H H 33 7.970 7.970 8.246 -0.276 18222
7751 1 18 . 1 1 34 34 GLY N N 34 108.840 108.840 107.827 1.013 18222
7752 1 18 . 1 1 34 34 GLY CA C 34 46.610 46.610 47.257 -0.647 18222
7753 1 18 . 1 1 34 34 GLY H H 34 8.030 8.030 8.220 -0.190 18222
7754 1 18 . 1 1 35 35 VAL N N 35 122.910 122.910 122.330 0.580 18222
7755 1 18 . 1 1 35 35 VAL HA H 35 4.220 4.220 3.656 0.564 18222
7756 1 18 . 1 1 35 35 VAL CA C 35 66.310 66.310 65.047 1.263 18222
7757 1 18 . 1 1 35 35 VAL CB C 35 30.560 30.560 31.681 -1.121 18222
7758 1 18 . 1 1 35 35 VAL H H 35 8.090 8.090 8.117 -0.027 18222
7759 1 18 . 1 1 36 36 PHE N N 36 120.020 120.020 120.206 -0.186 18222
7760 1 18 . 1 1 36 36 PHE CA C 36 61.350 61.350 62.323 -0.973 18222
7761 1 18 . 1 1 36 36 PHE CB C 36 38.090 38.090 39.050 -0.960 18222
7762 1 18 . 1 1 36 36 PHE H H 36 8.350 8.350 8.352 -0.002 18222
7763 1 18 . 1 1 37 37 THR N N 37 116.980 116.980 115.754 1.226 18222
7764 1 18 . 1 1 37 37 THR HA H 37 4.050 4.050 3.974 0.076 18222
7765 1 18 . 1 1 37 37 THR CA C 37 66.000 66.000 67.243 -1.243 18222
7766 1 18 . 1 1 37 37 THR CB C 37 68.270 68.270 68.963 -0.693 18222
7767 1 18 . 1 1 37 37 THR H H 37 8.520 8.520 8.354 0.166 18222
7768 1 18 . 1 1 38 38 PHE N N 38 123.090 123.090 119.928 3.162 18222
7769 1 18 . 1 1 38 38 PHE HA H 38 4.360 4.360 4.203 0.157 18222
7770 1 18 . 1 1 38 38 PHE CA C 38 61.140 61.140 61.724 -0.584 18222
7771 1 18 . 1 1 38 38 PHE CB C 38 41.200 41.200 39.244 1.956 18222
7772 1 18 . 1 1 38 38 PHE H H 38 8.010 8.010 7.935 0.075 18222
7773 1 18 . 1 1 39 39 VAL N N 39 117.280 117.280 119.202 -1.922 18222
7774 1 18 . 1 1 39 39 VAL HA H 39 4.210 4.210 3.639 0.571 18222
7775 1 18 . 1 1 39 39 VAL CA C 39 66.000 66.000 66.784 -0.784 18222
7776 1 18 . 1 1 39 39 VAL CB C 39 30.860 30.860 31.706 -0.846 18222
7777 1 18 . 1 1 39 39 VAL H H 39 8.530 8.530 8.817 -0.287 18222
7778 1 18 . 1 1 40 40 THR N N 40 109.470 109.470 114.261 -4.791 18222
7779 1 18 . 1 1 40 40 THR HA H 40 4.060 4.060 4.207 -0.147 18222
7780 1 18 . 1 1 40 40 THR CA C 40 63.390 63.390 64.638 -1.248 18222
7781 1 18 . 1 1 40 40 THR CB C 40 68.650 68.650 68.011 0.639 18222
7782 1 18 . 1 1 40 40 THR H H 40 7.700 7.700 7.933 -0.233 18222
7783 1 18 . 1 1 41 41 GLY N N 41 110.770 110.770 110.732 0.038 18222
7784 1 18 . 1 1 41 41 GLY CA C 41 45.580 45.580 46.318 -0.738 18222
7785 1 18 . 1 1 41 41 GLY H H 41 7.700 7.700 8.124 -0.424 18222
7786 1 18 . 1 1 42 42 THR N N 42 114.520 114.520 116.142 -1.622 18222
7787 1 18 . 1 1 42 42 THR CA C 42 63.300 63.300 61.823 1.477 18222
7788 1 18 . 1 1 42 42 THR CB C 42 69.490 69.490 68.900 0.590 18222
7789 1 18 . 1 1 42 42 THR H H 42 7.720 7.720 7.316 0.404 18222
7790 1 18 . 1 1 43 43 GLY N N 43 109.540 109.540 110.146 -0.606 18222
7791 1 18 . 1 1 43 43 GLY CA C 43 46.250 46.250 46.712 -0.462 18222
7792 1 18 . 1 1 43 43 GLY H H 43 8.110 8.110 7.894 0.216 18222
7793 1 18 . 1 1 44 44 MET N N 44 120.240 120.240 119.602 0.638 18222
7794 1 18 . 1 1 44 44 MET HA H 44 4.100 4.100 4.171 -0.071 18222
7795 1 18 . 1 1 44 44 MET CA C 44 57.700 57.700 58.631 -0.931 18222
7796 1 18 . 1 1 44 44 MET CB C 44 32.030 32.030 31.665 0.365 18222
7797 1 18 . 1 1 44 44 MET H H 44 7.730 7.730 7.896 -0.166 18222
7798 1 18 . 1 1 45 45 ALA N N 45 121.560 121.560 123.129 -1.569 18222
7799 1 18 . 1 1 45 45 ALA CA C 45 54.440 54.440 55.138 -0.698 18222
7800 1 18 . 1 1 45 45 ALA CB C 45 17.400 17.400 17.629 -0.229 18222
7801 1 18 . 1 1 45 45 ALA H H 45 7.950 7.950 7.949 0.001 18222
7802 1 18 . 1 1 46 46 PHE N N 46 118.260 118.260 118.409 -0.149 18222
7803 1 18 . 1 1 46 46 PHE HA H 46 3.930 3.930 4.251 -0.321 18222
7804 1 18 . 1 1 46 46 PHE CA C 46 59.820 59.820 61.074 -1.254 18222
7805 1 18 . 1 1 46 46 PHE CB C 46 38.260 38.260 38.652 -0.392 18222
7806 1 18 . 1 1 46 46 PHE H H 46 7.860 7.860 7.813 0.047 18222
7807 1 18 . 1 1 47 47 GLY N N 47 107.300 107.300 107.963 -0.663 18222
7808 1 18 . 1 1 47 47 GLY CA C 47 46.560 46.560 47.159 -0.599 18222
7809 1 18 . 1 1 47 47 GLY H H 47 8.200 8.200 8.476 -0.276 18222
7810 1 18 . 1 1 48 48 LEU N N 48 121.920 121.920 123.291 -1.371 18222
7811 1 18 . 1 1 48 48 LEU HA H 48 4.040 4.040 4.189 -0.149 18222
7812 1 18 . 1 1 48 48 LEU CA C 48 57.580 57.580 58.458 -0.878 18222
7813 1 18 . 1 1 48 48 LEU CB C 48 40.790 40.790 42.166 -1.376 18222
7814 1 18 . 1 1 48 48 LEU H H 48 8.180 8.180 8.572 -0.392 18222
7815 1 18 . 1 1 49 49 GLN N N 49 118.270 118.270 118.221 0.049 18222
7816 1 18 . 1 1 49 49 GLN HA H 49 3.830 3.830 3.984 -0.154 18222
7817 1 18 . 1 1 49 49 GLN CA C 49 58.880 58.880 59.159 -0.279 18222
7818 1 18 . 1 1 49 49 GLN CB C 49 27.240 27.240 28.610 -1.370 18222
7819 1 18 . 1 1 49 49 GLN H H 49 8.080 8.080 8.152 -0.072 18222
7820 1 18 . 1 1 50 50 MET N N 50 117.630 117.630 120.382 -2.752 18222
7821 1 18 . 1 1 50 50 MET HA H 50 4.010 4.010 4.148 -0.138 18222
7822 1 18 . 1 1 50 50 MET CA C 50 57.730 57.730 59.151 -1.421 18222
7823 1 18 . 1 1 50 50 MET CB C 50 27.160 27.160 32.614 -5.454 18222
7824 1 18 . 1 1 50 50 MET H H 50 7.880 7.880 8.111 -0.231 18222
7825 1 18 . 1 1 51 51 PHE N N 51 119.550 119.550 118.847 0.703 18222
7826 1 18 . 1 1 51 51 PHE CA C 51 60.850 60.850 61.954 -1.104 18222
7827 1 18 . 1 1 51 51 PHE CB C 51 38.720 38.720 39.041 -0.321 18222
7828 1 18 . 1 1 51 51 PHE H H 51 7.890 7.890 8.216 -0.326 18222
7829 1 18 . 1 1 52 52 ILE N N 52 117.950 117.950 117.956 -0.006 18222
7830 1 18 . 1 1 52 52 ILE HA H 52 4.050 4.050 3.983 0.067 18222
7831 1 18 . 1 1 52 52 ILE CA C 52 63.560 63.560 63.757 -0.197 18222
7832 1 18 . 1 1 52 52 ILE CB C 52 36.810 36.810 36.911 -0.101 18222
7833 1 18 . 1 1 52 52 ILE H H 52 8.110 8.110 8.223 -0.113 18222
7834 1 18 . 1 1 53 53 GLN N N 53 117.360 117.360 118.655 -1.295 18222
7835 1 18 . 1 1 53 53 GLN CA C 53 57.200 57.200 57.698 -0.498 18222
7836 1 18 . 1 1 53 53 GLN CB C 53 27.870 27.870 28.354 -0.484 18222
7837 1 18 . 1 1 53 53 GLN H H 53 7.930 7.930 8.279 -0.349 18222
7838 1 18 . 1 1 54 54 ARG N N 54 116.840 116.840 119.613 -2.773 18222
7839 1 18 . 1 1 54 54 ARG HA H 54 3.950 3.950 4.235 -0.285 18222
7840 1 18 . 1 1 54 54 ARG CA C 54 56.480 56.480 57.682 -1.202 18222
7841 1 18 . 1 1 54 54 ARG CB C 54 28.970 28.970 30.009 -1.039 18222
7842 1 18 . 1 1 54 54 ARG H H 54 7.540 7.540 7.851 -0.311 18222
7843 1 18 . 1 1 55 55 LYS N N 55 117.900 117.900 117.639 0.261 18222
7844 1 18 . 1 1 55 55 LYS HA H 55 4.080 4.080 4.274 -0.194 18222
7845 1 18 . 1 1 55 55 LYS CA C 55 55.030 55.030 57.486 -2.456 18222
7846 1 18 . 1 1 55 55 LYS CB C 55 32.010 32.010 32.649 -0.639 18222
7847 1 18 . 1 1 55 55 LYS H H 55 7.660 7.660 7.389 0.271 18222
7848 1 18 . 1 1 56 56 PHE N N 56 121.060 121.060 121.178 -0.118 18222
7849 1 18 . 1 1 56 56 PHE CA C 56 55.190 55.190 55.469 -0.279 18222
7850 1 18 . 1 1 56 56 PHE CB C 56 38.970 38.970 39.765 -0.795 18222
7851 1 18 . 1 1 56 56 PHE H H 56 8.080 8.080 7.885 0.195 18222
7852 1 18 . 1 1 57 57 PRO CA C 57 62.390 62.390 63.358 -0.969 18222
7853 1 18 . 1 1 57 57 PRO CB C 57 30.580 30.580 29.819 0.761 18222
7854 1 18 . 1 1 58 58 TYR N N 58 120.240 120.240 122.318 -2.078 18222
7855 1 18 . 1 1 58 58 TYR CA C 58 55.770 55.770 55.215 0.555 18222
7856 1 18 . 1 1 58 58 TYR CB C 58 40.220 40.220 40.797 -0.577 18222
7857 1 18 . 1 1 58 58 TYR H H 58 7.700 7.700 8.274 -0.574 18222
7858 1 18 . 1 1 59 59 PRO CA C 59 62.130 62.130 64.071 -1.941 18222
7859 1 18 . 1 1 59 59 PRO CB C 59 33.340 33.340 32.105 1.234 18222
7860 1 18 . 1 1 60 60 LEU N N 60 122.210 122.210 119.810 2.400 18222
7861 1 18 . 1 1 60 60 LEU CA C 60 54.250 54.250 53.752 0.498 18222
7862 1 18 . 1 1 60 60 LEU CB C 60 41.470 41.470 44.222 -2.752 18222
7863 1 18 . 1 1 60 60 LEU H H 60 7.880 7.880 7.695 0.185 18222
7864 1 18 . 1 1 61 61 GLN N N 61 122.470 122.470 120.487 1.983 18222
7865 1 18 . 1 1 61 61 GLN CA C 61 54.170 54.170 55.694 -1.524 18222
7866 1 18 . 1 1 61 61 GLN H H 61 7.970 7.970 8.377 -0.407 18222
7867 1 18 . 1 1 62 62 TRP N N 62 124.590 124.590 126.401 -1.811 18222
7868 1 18 . 1 1 62 62 TRP CA C 62 59.830 59.830 62.256 -2.426 18222
7869 1 18 . 1 1 62 62 TRP CB C 62 28.800 28.800 29.628 -0.828 18222
7870 1 18 . 1 1 62 62 TRP H H 62 8.240 8.240 9.261 -1.021 18222
7871 1 18 . 1 1 63 63 SER N N 63 113.320 113.320 113.817 -0.497 18222
7872 1 18 . 1 1 63 63 SER CA C 63 61.100 61.100 61.561 -0.461 18222
7873 1 18 . 1 1 63 63 SER H H 63 8.410 8.410 8.364 0.046 18222
7874 1 18 . 1 1 64 64 LEU N N 64 123.230 123.230 123.172 0.058 18222
7875 1 18 . 1 1 64 64 LEU CA C 64 56.880 56.880 57.251 -0.371 18222
7876 1 18 . 1 1 64 64 LEU CB C 64 40.830 40.830 41.326 -0.496 18222
7877 1 18 . 1 1 64 64 LEU H H 64 7.230 7.230 7.657 -0.427 18222
7878 1 18 . 1 1 65 65 LEU N N 65 119.400 119.400 120.968 -1.568 18222
7879 1 18 . 1 1 65 65 LEU HA H 65 3.890 3.890 3.980 -0.090 18222
7880 1 18 . 1 1 65 65 LEU CA C 65 57.580 57.580 58.439 -0.859 18222
7881 1 18 . 1 1 65 65 LEU CB C 65 40.710 40.710 41.980 -1.270 18222
7882 1 18 . 1 1 65 65 LEU H H 65 7.510 7.510 8.734 -1.224 18222
7883 1 18 . 1 1 66 66 VAL N N 66 116.950 116.950 119.201 -2.251 18222
7884 1 18 . 1 1 66 66 VAL HA H 66 3.960 3.960 3.733 0.227 18222
7885 1 18 . 1 1 66 66 VAL CA C 66 66.260 66.260 65.601 0.659 18222
7886 1 18 . 1 1 66 66 VAL CB C 66 30.570 30.570 31.370 -0.800 18222
7887 1 18 . 1 1 66 66 VAL H H 66 7.950 7.950 8.465 -0.515 18222
7888 1 18 . 1 1 67 67 ALA N N 67 120.650 120.650 122.674 -2.024 18222
7889 1 18 . 1 1 67 67 ALA HA H 67 4.000 4.000 4.223 -0.223 18222
7890 1 18 . 1 1 67 67 ALA CA C 67 54.780 54.780 55.289 -0.509 18222
7891 1 18 . 1 1 67 67 ALA CB C 67 17.440 17.440 18.460 -1.020 18222
7892 1 18 . 1 1 67 67 ALA H H 67 7.450 7.450 8.285 -0.835 18222
7893 1 18 . 1 1 68 68 VAL N N 68 118.440 118.440 119.056 -0.616 18222
7894 1 18 . 1 1 68 68 VAL HA H 68 3.750 3.750 3.658 0.092 18222
7895 1 18 . 1 1 68 68 VAL CA C 68 65.250 65.250 67.010 -1.760 18222
7896 1 18 . 1 1 68 68 VAL CB C 68 30.850 30.850 32.060 -1.210 18222
7897 1 18 . 1 1 68 68 VAL H H 68 7.960 7.960 7.766 0.194 18222
7898 1 18 . 1 1 69 69 VAL N N 69 120.800 120.800 120.216 0.584 18222
7899 1 18 . 1 1 69 69 VAL HA H 69 4.220 4.220 3.617 0.603 18222
7900 1 18 . 1 1 69 69 VAL CA C 69 66.020 66.020 66.324 -0.304 18222
7901 1 18 . 1 1 69 69 VAL CB C 69 30.850 30.850 30.850 0.000 18222
7902 1 18 . 1 1 69 69 VAL H H 69 8.080 8.080 8.469 -0.389 18222
7903 1 18 . 1 1 70 70 ALA N N 70 121.740 121.740 120.818 0.922 18222
7904 1 18 . 1 1 70 70 ALA HA H 70 3.920 3.920 4.251 -0.331 18222
7905 1 18 . 1 1 70 70 ALA CA C 70 54.920 54.920 55.394 -0.474 18222
7906 1 18 . 1 1 70 70 ALA CB C 70 17.620 17.620 18.159 -0.539 18222
7907 1 18 . 1 1 70 70 ALA H H 70 8.660 8.660 8.564 0.096 18222
7908 1 18 . 1 1 71 71 GLY N N 71 103.450 103.450 107.021 -3.571 18222
7909 1 18 . 1 1 71 71 GLY CA C 71 46.300 46.300 46.916 -0.616 18222
7910 1 18 . 1 1 71 71 GLY H H 71 8.010 8.010 8.062 -0.052 18222
7911 1 18 . 1 1 72 72 SER N N 72 118.160 118.160 118.284 -0.124 18222
7912 1 18 . 1 1 72 72 SER CA C 72 61.260 61.260 61.465 -0.205 18222
7913 1 18 . 1 1 72 72 SER CB C 72 62.870 62.870 63.229 -0.359 18222
7914 1 18 . 1 1 72 72 SER H H 72 7.870 7.870 8.039 -0.169 18222
7915 1 18 . 1 1 73 73 VAL N N 73 121.340 121.340 122.747 -1.407 18222
7916 1 18 . 1 1 73 73 VAL CA C 73 65.750 65.750 67.438 -1.688 18222
7917 1 18 . 1 1 73 73 VAL CB C 73 30.740 30.740 31.925 -1.185 18222
7918 1 18 . 1 1 73 73 VAL H H 73 8.050 8.050 8.147 -0.097 18222
7919 1 18 . 1 1 74 74 VAL N N 74 118.680 118.680 118.274 0.406 18222
7920 1 18 . 1 1 74 74 VAL CA C 74 65.770 65.770 66.172 -0.402 18222
7921 1 18 . 1 1 74 74 VAL CB C 74 30.740 30.740 30.976 -0.236 18222
7922 1 18 . 1 1 74 74 VAL H H 74 7.880 7.880 8.464 -0.584 18222
7923 1 18 . 1 1 75 75 SER N N 75 114.750 114.750 116.378 -1.628 18222
7924 1 18 . 1 1 75 75 SER HA H 75 4.100 4.100 4.172 -0.072 18222
7925 1 18 . 1 1 75 75 SER CA C 75 60.870 60.870 61.789 -0.919 18222
7926 1 18 . 1 1 75 75 SER CB C 75 62.340 62.340 63.055 -0.715 18222
7927 1 18 . 1 1 75 75 SER H H 75 7.870 7.870 7.953 -0.083 18222
7928 1 18 . 1 1 76 76 TYR N N 76 121.110 121.110 123.179 -2.069 18222
7929 1 18 . 1 1 76 76 TYR CA C 76 60.050 60.050 61.653 -1.603 18222
7930 1 18 . 1 1 76 76 TYR CB C 76 37.980 37.980 38.668 -0.688 18222
7931 1 18 . 1 1 76 76 TYR H H 76 7.860 7.860 8.643 -0.783 18222
7932 1 18 . 1 1 77 77 GLY N N 77 107.300 107.300 106.666 0.634 18222
7933 1 18 . 1 1 77 77 GLY CA C 77 46.560 46.560 47.330 -0.770 18222
7934 1 18 . 1 1 77 77 GLY H H 77 8.200 8.200 8.541 -0.341 18222
7935 1 18 . 1 1 78 78 VAL N N 78 119.470 119.470 121.502 -2.032 18222
7936 1 18 . 1 1 78 78 VAL HA H 78 4.170 4.170 3.682 0.488 18222
7937 1 18 . 1 1 78 78 VAL CA C 78 64.650 64.650 66.175 -1.525 18222
7938 1 18 . 1 1 78 78 VAL H H 78 8.140 8.140 8.642 -0.502 18222
7939 1 18 . 1 1 79 79 THR N N 79 112.100 112.100 116.937 -4.837 18222
7940 1 18 . 1 1 79 79 THR CA C 79 63.460 63.460 66.958 -3.498 18222
7941 1 18 . 1 1 79 79 THR CB C 79 68.650 68.650 68.374 0.276 18222
7942 1 18 . 1 1 79 79 THR H H 79 7.640 7.640 7.994 -0.354 18222
7943 1 18 . 1 1 80 80 ARG N N 80 120.770 120.770 122.276 -1.506 18222
7944 1 18 . 1 1 80 80 ARG HA H 80 4.160 4.160 4.058 0.102 18222
7945 1 18 . 1 1 80 80 ARG CA C 80 56.790 56.790 59.501 -2.711 18222
7946 1 18 . 1 1 80 80 ARG CB C 80 29.430 29.430 30.199 -0.769 18222
7947 1 18 . 1 1 80 80 ARG H H 80 7.680 7.680 7.934 -0.254 18222
7948 1 18 . 1 1 81 81 VAL N N 81 118.370 118.370 120.231 -1.861 18222
7949 1 18 . 1 1 81 81 VAL HA H 81 3.920 3.920 3.611 0.309 18222
7950 1 18 . 1 1 81 81 VAL CA C 81 63.340 63.340 67.298 -3.958 18222
7951 1 18 . 1 1 81 81 VAL CB C 81 31.260 31.260 31.888 -0.628 18222
7952 1 18 . 1 1 81 81 VAL H H 81 7.730 7.730 8.286 -0.556 18222
7953 1 18 . 1 1 82 82 GLU N N 82 120.620 120.620 119.118 1.502 18222
7954 1 18 . 1 1 82 82 GLU CA C 82 56.320 56.320 59.553 -3.233 18222
7955 1 18 . 1 1 82 82 GLU CB C 82 27.930 27.930 29.351 -1.421 18222
7956 1 18 . 1 1 82 82 GLU H H 82 7.920 7.920 8.378 -0.458 18222
7957 1 18 . 1 1 83 83 SER N N 83 116.240 116.240 115.599 0.641 18222
7958 1 18 . 1 1 83 83 SER CA C 83 59.250 59.250 61.955 -2.705 18222
7959 1 18 . 1 1 83 83 SER CB C 83 63.160 63.160 62.805 0.355 18222
7960 1 18 . 1 1 83 83 SER H H 83 7.960 7.960 7.968 -0.008 18222
7961 1 18 . 1 1 84 84 GLU N N 84 123.280 123.280 121.775 1.505 18222
7962 1 18 . 1 1 84 84 GLU HA H 84 4.080 4.080 3.963 0.117 18222
7963 1 18 . 1 1 84 84 GLU CA C 84 57.860 57.860 59.651 -1.791 18222
7964 1 18 . 1 1 84 84 GLU CB C 84 28.190 28.190 29.563 -1.373 18222
7965 1 18 . 1 1 84 84 GLU H H 84 8.470 8.470 8.016 0.454 18222
7966 1 18 . 1 1 85 85 LYS N N 85 118.650 118.650 119.629 -0.979 18222
7967 1 18 . 1 1 85 85 LYS HA H 85 4.100 4.100 4.118 -0.018 18222
7968 1 18 . 1 1 85 85 LYS CA C 85 57.780 57.780 59.303 -1.523 18222
7969 1 18 . 1 1 85 85 LYS CB C 85 31.380 31.380 32.471 -1.091 18222
7970 1 18 . 1 1 85 85 LYS H H 85 7.940 7.940 8.042 -0.102 18222
7971 1 18 . 1 1 86 86 CYS N N 86 117.070 117.070 118.692 -1.622 18222
7972 1 18 . 1 1 86 86 CYS CA C 86 60.910 60.910 62.575 -1.665 18222
7973 1 18 . 1 1 86 86 CYS CB C 86 26.740 26.740 26.125 0.615 18222
7974 1 18 . 1 1 86 86 CYS H H 86 7.840 7.840 8.406 -0.566 18222
7975 1 18 . 1 1 87 87 ASN N N 87 119.370 119.370 119.263 0.107 18222
7976 1 18 . 1 1 87 87 ASN HA H 87 4.130 4.130 4.443 -0.313 18222
7977 1 18 . 1 1 87 87 ASN CA C 87 55.750 55.750 56.389 -0.639 18222
7978 1 18 . 1 1 87 87 ASN CB C 87 38.050 38.050 37.987 0.063 18222
7979 1 18 . 1 1 87 87 ASN H H 87 8.110 8.110 8.597 -0.487 18222
7980 1 18 . 1 1 88 88 ASN N N 88 117.570 117.570 119.704 -2.134 18222
7981 1 18 . 1 1 88 88 ASN HA H 88 4.280 4.280 4.343 -0.063 18222
7982 1 18 . 1 1 88 88 ASN CA C 88 55.190 55.190 56.285 -1.095 18222
7983 1 18 . 1 1 88 88 ASN CB C 88 37.400 37.400 38.493 -1.093 18222
7984 1 18 . 1 1 88 88 ASN H H 88 8.280 8.280 8.260 0.020 18222
7985 1 18 . 1 1 89 89 LEU N N 89 121.940 121.940 121.965 -0.025 18222
7986 1 18 . 1 1 89 89 LEU HA H 89 4.070 4.070 4.352 -0.282 18222
7987 1 18 . 1 1 89 89 LEU CA C 89 57.580 57.580 59.197 -1.617 18222
7988 1 18 . 1 1 89 89 LEU CB C 89 40.490 40.490 42.137 -1.647 18222
7989 1 18 . 1 1 89 89 LEU H H 89 7.790 7.790 8.463 -0.673 18222
7990 1 18 . 1 1 90 90 TRP N N 90 119.220 119.220 120.192 -0.972 18222
7991 1 18 . 1 1 90 90 TRP CA C 90 59.120 59.120 62.148 -3.028 18222
7992 1 18 . 1 1 90 90 TRP CB C 90 28.800 28.800 28.996 -0.196 18222
7993 1 18 . 1 1 90 90 TRP H H 90 7.850 7.850 8.608 -0.758 18222
7994 1 18 . 1 1 91 91 LEU N N 91 117.870 117.870 120.928 -3.058 18222
7995 1 18 . 1 1 91 91 LEU CA C 91 57.300 57.300 58.214 -0.914 18222
7996 1 18 . 1 1 91 91 LEU CB C 91 40.610 40.610 41.821 -1.211 18222
7997 1 18 . 1 1 91 91 LEU H H 91 7.920 7.920 8.619 -0.699 18222
7998 1 18 . 1 1 92 92 PHE N N 92 121.280 121.280 117.789 3.491 18222
7999 1 18 . 1 1 92 92 PHE CA C 92 60.390 60.390 61.345 -0.955 18222
8000 1 18 . 1 1 92 92 PHE CB C 92 37.980 37.980 38.292 -0.312 18222
8001 1 18 . 1 1 92 92 PHE H H 92 7.860 7.860 8.082 -0.222 18222
8002 1 18 . 1 1 93 93 LEU N N 93 119.860 119.860 121.773 -1.913 18222
8003 1 18 . 1 1 93 93 LEU CA C 93 56.860 56.860 57.878 -1.018 18222
8004 1 18 . 1 1 93 93 LEU CB C 93 40.550 40.550 41.255 -0.705 18222
8005 1 18 . 1 1 93 93 LEU H H 93 7.980 7.980 8.571 -0.591 18222
8006 1 18 . 1 1 94 94 GLU N N 94 114.660 114.660 117.671 -3.011 18222
8007 1 18 . 1 1 94 94 GLU HA H 94 3.810 3.810 4.002 -0.192 18222
8008 1 18 . 1 1 94 94 GLU CA C 94 57.210 57.210 58.980 -1.770 18222
8009 1 18 . 1 1 94 94 GLU CB C 94 28.470 28.470 29.451 -0.981 18222
8010 1 18 . 1 1 94 94 GLU H H 94 7.890 7.890 8.358 -0.468 18222
8011 1 18 . 1 1 95 95 THR N N 95 108.260 108.260 112.012 -3.752 18222
8012 1 18 . 1 1 95 95 THR CA C 95 62.150 62.150 62.775 -0.625 18222
8013 1 18 . 1 1 95 95 THR CB C 95 70.810 70.810 69.574 1.236 18222
8014 1 18 . 1 1 95 95 THR H H 95 7.690 7.690 7.678 0.013 18222
8015 1 18 . 1 1 96 96 GLY N N 96 112.220 112.220 109.906 2.314 18222
8016 1 18 . 1 1 96 96 GLY CA C 96 45.410 45.410 44.717 0.693 18222
8017 1 18 . 1 1 96 96 GLY H H 96 8.240 8.240 7.577 0.663 18222
8018 1 18 . 1 1 97 97 GLN N N 97 117.950 117.950 119.435 -1.485 18222
8019 1 18 . 1 1 97 97 GLN HA H 97 4.200 4.200 4.079 0.121 18222
8020 1 18 . 1 1 97 97 GLN CA C 97 54.430 54.430 56.730 -2.300 18222
8021 1 18 . 1 1 97 97 GLN CB C 97 29.910 29.910 29.558 0.352 18222
8022 1 18 . 1 1 97 97 GLN H H 97 7.640 7.640 7.874 -0.234 18222
8023 1 18 . 1 1 98 98 LEU N N 98 123.810 123.810 123.175 0.635 18222
8024 1 18 . 1 1 98 98 LEU HA H 98 4.360 4.360 4.294 0.066 18222
8025 1 18 . 1 1 98 98 LEU CA C 98 52.650 52.650 54.548 -1.898 18222
8026 1 18 . 1 1 98 98 LEU CB C 98 40.460 40.460 42.129 -1.669 18222
8027 1 18 . 1 1 98 98 LEU H H 98 8.270 8.270 8.474 -0.204 18222
8028 1 18 . 1 1 99 99 PRO CA C 99 63.180 63.180 62.423 0.757 18222
8029 1 18 . 1 1 99 99 PRO CB C 99 30.840 30.840 32.612 -1.772 18222
8030 1 18 . 1 1 100 100 LYS N N 100 120.630 120.630 119.043 1.587 18222
8031 1 18 . 1 1 100 100 LYS CA C 100 55.730 55.730 56.433 -0.703 18222
8032 1 18 . 1 1 100 100 LYS CB C 100 32.280 32.280 33.217 -0.937 18222
8033 1 18 . 1 1 100 100 LYS H H 100 8.090 8.090 8.216 -0.126 18222
8034 1 18 . 1 1 101 101 ASP N N 101 120.920 120.920 121.073 -0.153 18222
8035 1 18 . 1 1 101 101 ASP HA H 101 4.190 4.190 4.799 -0.609 18222
8036 1 18 . 1 1 101 101 ASP CA C 101 54.000 54.000 53.589 0.411 18222
8037 1 18 . 1 1 101 101 ASP CB C 101 40.330 40.330 41.996 -1.666 18222
8038 1 18 . 1 1 101 101 ASP H H 101 8.190 8.190 8.026 0.164 18222
8039 1 18 . 1 1 102 102 ARG N N 102 122.210 122.210 120.794 1.416 18222
8040 1 18 . 1 1 102 102 ARG CA C 102 55.590 55.590 55.562 0.028 18222
8041 1 18 . 1 1 102 102 ARG CB C 102 29.630 29.630 31.932 -2.302 18222
8042 1 18 . 1 1 102 102 ARG H H 102 8.130 8.130 8.631 -0.501 18222
8043 1 18 . 1 1 103 103 SER N N 103 117.230 117.230 118.313 -1.083 18222
8044 1 18 . 1 1 103 103 SER HA H 103 4.280 4.280 4.459 -0.179 18222
8045 1 18 . 1 1 103 103 SER CA C 103 58.470 58.470 58.804 -0.334 18222
8046 1 18 . 1 1 103 103 SER CB C 103 63.080 63.080 63.788 -0.708 18222
8047 1 18 . 1 1 103 103 SER H H 103 8.290 8.290 8.492 -0.202 18222
8048 1 18 . 1 1 104 104 THR N N 104 115.430 115.430 115.865 -0.435 18222
8049 1 18 . 1 1 104 104 THR CA C 104 61.570 61.570 63.096 -1.526 18222
8050 1 18 . 1 1 104 104 THR CB C 104 69.030 69.030 69.270 -0.240 18222
8051 1 18 . 1 1 104 104 THR H H 104 8.020 8.020 8.524 -0.504 18222
8052 1 18 . 1 1 105 105 ASP N N 105 122.780 122.780 123.522 -0.742 18222
8053 1 18 . 1 1 105 105 ASP CA C 105 54.210 54.210 53.810 0.400 18222
8054 1 18 . 1 1 105 105 ASP CB C 105 40.380 40.380 42.044 -1.664 18222
8055 1 18 . 1 1 105 105 ASP H H 105 8.120 8.120 8.291 -0.171 18222
8056 1 18 . 1 1 106 106 GLN N N 106 120.960 120.960 122.103 -1.143 18222
8057 1 18 . 1 1 106 106 GLN CA C 106 55.420 55.420 55.421 -0.001 18222
8058 1 18 . 1 1 106 106 GLN CB C 106 28.310 28.310 29.841 -1.532 18222
8059 1 18 . 1 1 106 106 GLN H H 106 8.140 8.140 8.694 -0.554 18222
8060 1 18 . 1 1 107 107 ARG N N 107 123.010 123.010 124.754 -1.744 18222
8061 1 18 . 1 1 107 107 ARG HA H 107 4.210 4.210 4.607 -0.397 18222
8062 1 18 . 1 1 107 107 ARG CA C 107 55.560 55.560 55.610 -0.050 18222
8063 1 18 . 1 1 107 107 ARG CB C 107 29.920 29.920 31.252 -1.332 18222
8064 1 18 . 1 1 107 107 ARG H H 107 8.180 8.180 8.717 -0.537 18222
8065 1 19 . 1 1 2 2 VAL N N 2 121.590 121.590 123.452 -1.862 18222
8066 1 19 . 1 1 2 2 VAL CA C 2 61.600 61.600 61.334 0.266 18222
8067 1 19 . 1 1 2 2 VAL CB C 2 31.900 31.900 34.136 -2.236 18222
8068 1 19 . 1 1 2 2 VAL H H 2 8.010 8.010 8.263 -0.253 18222
8069 1 19 . 1 1 3 3 ASN N N 3 122.520 122.520 121.866 0.654 18222
8070 1 19 . 1 1 3 3 ASN HA H 3 4.020 4.020 4.653 -0.633 18222
8071 1 19 . 1 1 3 3 ASN CA C 3 52.640 52.640 53.900 -1.260 18222
8072 1 19 . 1 1 3 3 ASN CB C 3 38.330 38.330 39.589 -1.259 18222
8073 1 19 . 1 1 3 3 ASN H H 3 8.360 8.360 8.248 0.112 18222
8074 1 19 . 1 1 4 4 LEU N N 4 123.830 123.830 122.974 0.856 18222
8075 1 19 . 1 1 4 4 LEU HA H 4 4.220 4.220 4.388 -0.168 18222
8076 1 19 . 1 1 4 4 LEU CA C 4 54.620 54.620 55.779 -1.159 18222
8077 1 19 . 1 1 4 4 LEU CB C 4 41.680 41.680 42.054 -0.374 18222
8078 1 19 . 1 1 4 4 LEU H H 4 8.220 8.220 8.230 -0.010 18222
8079 1 19 . 1 1 5 5 GLY N N 5 106.810 106.810 106.813 -0.003 18222
8080 1 19 . 1 1 5 5 GLY CA C 5 45.800 45.800 45.613 0.187 18222
8081 1 19 . 1 1 5 5 GLY H H 5 8.030 8.030 8.109 -0.079 18222
8082 1 19 . 1 1 6 6 LEU N N 6 120.820 120.820 120.626 0.194 18222
8083 1 19 . 1 1 6 6 LEU HA H 6 4.050 4.050 4.354 -0.304 18222
8084 1 19 . 1 1 6 6 LEU CA C 6 55.990 55.990 56.932 -0.942 18222
8085 1 19 . 1 1 6 6 LEU CB C 6 40.800 40.800 40.966 -0.166 18222
8086 1 19 . 1 1 6 6 LEU H H 6 8.030 8.030 8.039 -0.009 18222
8087 1 19 . 1 1 7 7 SER N N 7 115.540 115.540 116.309 -0.769 18222
8088 1 19 . 1 1 7 7 SER HA H 7 4.100 4.100 4.134 -0.034 18222
8089 1 19 . 1 1 7 7 SER CA C 7 60.580 60.580 62.172 -1.592 18222
8090 1 19 . 1 1 7 7 SER CB C 7 62.060 62.060 62.894 -0.834 18222
8091 1 19 . 1 1 7 7 SER H H 7 8.360 8.360 8.570 -0.210 18222
8092 1 19 . 1 1 8 8 ARG N N 8 120.690 120.690 121.211 -0.521 18222
8093 1 19 . 1 1 8 8 ARG HA H 8 4.160 4.160 4.139 0.021 18222
8094 1 19 . 1 1 8 8 ARG CA C 8 57.350 57.350 58.771 -1.421 18222
8095 1 19 . 1 1 8 8 ARG CB C 8 29.230 29.230 29.985 -0.755 18222
8096 1 19 . 1 1 8 8 ARG H H 8 7.830 7.830 7.708 0.122 18222
8097 1 19 . 1 1 9 9 VAL N N 9 119.330 119.330 121.262 -1.932 18222
8098 1 19 . 1 1 9 9 VAL HA H 9 4.170 4.170 3.728 0.442 18222
8099 1 19 . 1 1 9 9 VAL CA C 9 64.720 64.720 67.025 -2.305 18222
8100 1 19 . 1 1 9 9 VAL CB C 9 30.900 30.900 31.109 -0.209 18222
8101 1 19 . 1 1 9 9 VAL H H 9 7.620 7.620 7.691 -0.072 18222
8102 1 19 . 1 1 10 10 ASP N N 10 119.520 119.520 119.973 -0.453 18222
8103 1 19 . 1 1 10 10 ASP CA C 10 54.960 54.960 57.614 -2.654 18222
8104 1 19 . 1 1 10 10 ASP CB C 10 37.800 37.800 40.633 -2.833 18222
8105 1 19 . 1 1 10 10 ASP H H 10 8.180 8.180 8.399 -0.219 18222
8106 1 19 . 1 1 11 11 ASP N N 11 121.550 121.550 121.363 0.187 18222
8107 1 19 . 1 1 11 11 ASP CA C 11 54.440 54.440 57.138 -2.698 18222
8108 1 19 . 1 1 11 11 ASP CB C 11 37.840 37.840 40.570 -2.730 18222
8109 1 19 . 1 1 11 11 ASP H H 11 7.950 7.950 8.232 -0.282 18222
8110 1 19 . 1 1 12 12 ALA N N 12 120.220 120.220 122.480 -2.260 18222
8111 1 19 . 1 1 12 12 ALA CA C 12 54.370 54.370 55.226 -0.856 18222
8112 1 19 . 1 1 12 12 ALA CB C 12 24.730 24.730 18.512 6.218 18222
8113 1 19 . 1 1 12 12 ALA H H 12 8.090 8.090 8.095 -0.005 18222
8114 1 19 . 1 1 13 13 VAL N N 13 116.910 116.910 118.483 -1.573 18222
8115 1 19 . 1 1 13 13 VAL HA H 13 4.140 4.140 3.705 0.435 18222
8116 1 19 . 1 1 13 13 VAL CA C 13 64.900 64.900 65.142 -0.242 18222
8117 1 19 . 1 1 13 13 VAL CB C 13 31.000 31.000 30.787 0.213 18222
8118 1 19 . 1 1 13 13 VAL H H 13 7.980 7.980 8.289 -0.309 18222
8119 1 19 . 1 1 14 14 ALA N N 14 122.200 122.200 122.420 -0.220 18222
8120 1 19 . 1 1 14 14 ALA HA H 14 4.020 4.020 4.258 -0.238 18222
8121 1 19 . 1 1 14 14 ALA CA C 14 53.800 53.800 54.854 -1.054 18222
8122 1 19 . 1 1 14 14 ALA CB C 14 17.790 17.790 18.340 -0.550 18222
8123 1 19 . 1 1 14 14 ALA H H 14 8.030 8.030 7.960 0.070 18222
8124 1 19 . 1 1 15 15 ALA N N 15 118.600 118.600 119.497 -0.897 18222
8125 1 19 . 1 1 15 15 ALA CA C 15 53.230 53.230 54.059 -0.829 18222
8126 1 19 . 1 1 15 15 ALA CB C 15 18.010 18.010 18.457 -0.447 18222
8127 1 19 . 1 1 15 15 ALA H H 15 7.530 7.530 8.219 -0.689 18222
8128 1 19 . 1 1 16 16 LYS N N 16 115.820 115.820 117.267 -1.447 18222
8129 1 19 . 1 1 16 16 LYS HA H 16 4.080 4.080 4.248 -0.168 18222
8130 1 19 . 1 1 16 16 LYS CA C 16 55.670 55.670 56.789 -1.119 18222
8131 1 19 . 1 1 16 16 LYS CB C 16 32.640 32.640 33.257 -0.617 18222
8132 1 19 . 1 1 16 16 LYS H H 16 7.490 7.490 7.489 0.001 18222
8133 1 19 . 1 1 17 17 HIS N N 17 116.790 116.790 119.482 -2.692 18222
8134 1 19 . 1 1 17 17 HIS HA H 17 4.100 4.100 4.980 -0.880 18222
8135 1 19 . 1 1 17 17 HIS CA C 17 52.820 52.820 53.021 -0.201 18222
8136 1 19 . 1 1 17 17 HIS CB C 17 28.400 28.400 30.997 -2.597 18222
8137 1 19 . 1 1 17 17 HIS H H 17 8.130 8.130 7.737 0.393 18222
8138 1 19 . 1 1 18 18 PRO CA C 18 63.800 63.800 63.156 0.644 18222
8139 1 19 . 1 1 18 18 PRO CB C 18 30.800 30.800 32.320 -1.520 18222
8140 1 19 . 1 1 19 19 GLY N N 19 110.260 110.260 110.624 -0.364 18222
8141 1 19 . 1 1 19 19 GLY CA C 19 45.490 45.490 45.402 0.088 18222
8142 1 19 . 1 1 19 19 GLY H H 19 8.730 8.730 8.186 0.544 18222
8143 1 19 . 1 1 20 20 LEU N N 20 122.650 122.650 123.046 -0.396 18222
8144 1 19 . 1 1 20 20 LEU HA H 20 4.090 4.090 3.490 0.600 18222
8145 1 19 . 1 1 20 20 LEU CA C 20 57.060 57.060 58.517 -1.456 18222
8146 1 19 . 1 1 20 20 LEU H H 20 7.980 7.980 8.227 -0.247 18222
8147 1 19 . 1 1 21 21 GLY N N 21 107.000 107.000 105.060 1.940 18222
8148 1 19 . 1 1 21 21 GLY CA C 21 46.710 46.710 46.738 -0.028 18222
8149 1 19 . 1 1 21 21 GLY H H 21 8.570 8.570 8.348 0.222 18222
8150 1 19 . 1 1 22 22 GLU N N 22 121.610 121.610 122.191 -0.581 18222
8151 1 19 . 1 1 22 22 GLU HA H 22 3.990 3.990 4.108 -0.118 18222
8152 1 19 . 1 1 22 22 GLU CA C 22 58.280 58.280 59.136 -0.856 18222
8153 1 19 . 1 1 22 22 GLU CB C 22 28.010 28.010 29.313 -1.303 18222
8154 1 19 . 1 1 22 22 GLU H H 22 8.100 8.100 8.238 -0.138 18222
8155 1 19 . 1 1 23 23 TYR N N 23 120.870 120.870 119.795 1.075 18222
8156 1 19 . 1 1 23 23 TYR CA C 23 60.380 60.380 61.708 -1.328 18222
8157 1 19 . 1 1 23 23 TYR CB C 23 37.750 37.750 38.314 -0.564 18222
8158 1 19 . 1 1 23 23 TYR H H 23 7.910 7.910 8.999 -1.089 18222
8159 1 19 . 1 1 24 24 ALA N N 24 121.420 121.420 121.148 0.272 18222
8160 1 19 . 1 1 24 24 ALA HA H 24 4.140 4.140 3.895 0.245 18222
8161 1 19 . 1 1 24 24 ALA CA C 24 54.260 54.260 54.716 -0.456 18222
8162 1 19 . 1 1 24 24 ALA H H 24 8.410 8.410 8.401 0.009 18222
8163 1 19 . 1 1 25 25 ALA N N 25 120.220 120.220 123.129 -2.909 18222
8164 1 19 . 1 1 25 25 ALA CA C 25 54.370 54.370 54.819 -0.450 18222
8165 1 19 . 1 1 25 25 ALA H H 25 8.090 8.090 8.035 0.055 18222
8166 1 19 . 1 1 26 26 CYS N N 26 116.760 116.760 117.509 -0.749 18222
8167 1 19 . 1 1 26 26 CYS CA C 26 61.180 61.180 63.117 -1.937 18222
8168 1 19 . 1 1 26 26 CYS CB C 26 26.390 26.390 27.517 -1.127 18222
8169 1 19 . 1 1 26 26 CYS H H 26 7.950 7.950 8.231 -0.281 18222
8170 1 19 . 1 1 27 27 GLN N N 27 118.690 118.690 120.141 -1.451 18222
8171 1 19 . 1 1 27 27 GLN CA C 27 55.970 55.970 59.626 -3.656 18222
8172 1 19 . 1 1 27 27 GLN H H 27 8.060 8.060 8.403 -0.343 18222
8173 1 19 . 1 1 28 28 SER N N 28 115.490 115.490 116.423 -0.933 18222
8174 1 19 . 1 1 28 28 SER HA H 28 3.990 3.990 4.172 -0.182 18222
8175 1 19 . 1 1 28 28 SER CA C 28 61.110 61.110 61.798 -0.688 18222
8176 1 19 . 1 1 28 28 SER H H 28 7.980 7.980 8.402 -0.422 18222
8177 1 19 . 1 1 29 29 HIS N N 29 120.880 120.880 122.671 -1.791 18222
8178 1 19 . 1 1 29 29 HIS CA C 29 58.190 58.190 60.645 -2.455 18222
8179 1 19 . 1 1 29 29 HIS CB C 29 27.460 27.460 29.705 -2.245 18222
8180 1 19 . 1 1 29 29 HIS H H 29 8.180 8.180 8.558 -0.378 18222
8181 1 19 . 1 1 30 30 ALA N N 30 122.920 122.920 122.530 0.390 18222
8182 1 19 . 1 1 30 30 ALA CA C 30 54.560 54.560 55.416 -0.856 18222
8183 1 19 . 1 1 30 30 ALA CB C 30 17.490 17.490 18.384 -0.894 18222
8184 1 19 . 1 1 30 30 ALA H H 30 8.040 8.040 8.074 -0.034 18222
8185 1 19 . 1 1 31 31 PHE N N 31 119.340 119.340 118.894 0.446 18222
8186 1 19 . 1 1 31 31 PHE CA C 31 60.370 60.370 61.934 -1.564 18222
8187 1 19 . 1 1 31 31 PHE CB C 31 38.520 38.520 39.262 -0.742 18222
8188 1 19 . 1 1 31 31 PHE H H 31 8.230 8.230 8.398 -0.168 18222
8189 1 19 . 1 1 32 32 MET N N 32 118.110 118.110 120.446 -2.336 18222
8190 1 19 . 1 1 32 32 MET HA H 32 4.050 4.050 4.049 0.001 18222
8191 1 19 . 1 1 32 32 MET CA C 32 58.280 58.280 59.383 -1.103 18222
8192 1 19 . 1 1 32 32 MET CB C 32 31.090 31.090 32.240 -1.150 18222
8193 1 19 . 1 1 32 32 MET H H 32 8.120 8.120 8.642 -0.522 18222
8194 1 19 . 1 1 33 33 LYS N N 33 119.040 119.040 119.253 -0.213 18222
8195 1 19 . 1 1 33 33 LYS HA H 33 3.930 3.930 3.890 0.040 18222
8196 1 19 . 1 1 33 33 LYS CA C 33 59.040 59.040 59.950 -0.910 18222
8197 1 19 . 1 1 33 33 LYS CB C 33 30.990 30.990 32.397 -1.407 18222
8198 1 19 . 1 1 33 33 LYS H H 33 7.970 7.970 8.266 -0.296 18222
8199 1 19 . 1 1 34 34 GLY N N 34 108.840 108.840 107.774 1.066 18222
8200 1 19 . 1 1 34 34 GLY CA C 34 46.610 46.610 47.242 -0.632 18222
8201 1 19 . 1 1 34 34 GLY H H 34 8.030 8.030 8.200 -0.170 18222
8202 1 19 . 1 1 35 35 VAL N N 35 122.910 122.910 121.954 0.956 18222
8203 1 19 . 1 1 35 35 VAL HA H 35 4.220 4.220 3.673 0.547 18222
8204 1 19 . 1 1 35 35 VAL CA C 35 66.310 66.310 64.967 1.343 18222
8205 1 19 . 1 1 35 35 VAL CB C 35 30.560 30.560 31.745 -1.185 18222
8206 1 19 . 1 1 35 35 VAL H H 35 8.090 8.090 8.314 -0.224 18222
8207 1 19 . 1 1 36 36 PHE N N 36 120.020 120.020 120.107 -0.087 18222
8208 1 19 . 1 1 36 36 PHE CA C 36 61.350 61.350 62.817 -1.467 18222
8209 1 19 . 1 1 36 36 PHE CB C 36 38.090 38.090 38.768 -0.678 18222
8210 1 19 . 1 1 36 36 PHE H H 36 8.350 8.350 8.313 0.037 18222
8211 1 19 . 1 1 37 37 THR N N 37 116.980 116.980 115.319 1.661 18222
8212 1 19 . 1 1 37 37 THR HA H 37 4.050 4.050 4.037 0.013 18222
8213 1 19 . 1 1 37 37 THR CA C 37 66.000 66.000 67.326 -1.325 18222
8214 1 19 . 1 1 37 37 THR CB C 37 68.270 68.270 68.814 -0.545 18222
8215 1 19 . 1 1 37 37 THR H H 37 8.520 8.520 8.289 0.231 18222
8216 1 19 . 1 1 38 38 PHE N N 38 123.090 123.090 118.575 4.515 18222
8217 1 19 . 1 1 38 38 PHE HA H 38 4.360 4.360 4.220 0.140 18222
8218 1 19 . 1 1 38 38 PHE CA C 38 61.140 61.140 61.433 -0.293 18222
8219 1 19 . 1 1 38 38 PHE CB C 38 41.200 41.200 38.987 2.213 18222
8220 1 19 . 1 1 38 38 PHE H H 38 8.010 8.010 8.107 -0.097 18222
8221 1 19 . 1 1 39 39 VAL N N 39 117.280 117.280 119.228 -1.948 18222
8222 1 19 . 1 1 39 39 VAL HA H 39 4.210 4.210 3.743 0.467 18222
8223 1 19 . 1 1 39 39 VAL CA C 39 66.000 66.000 66.031 -0.031 18222
8224 1 19 . 1 1 39 39 VAL CB C 39 30.860 30.860 32.084 -1.224 18222
8225 1 19 . 1 1 39 39 VAL H H 39 8.530 8.530 8.679 -0.149 18222
8226 1 19 . 1 1 40 40 THR N N 40 109.470 109.470 114.550 -5.080 18222
8227 1 19 . 1 1 40 40 THR HA H 40 4.060 4.060 4.267 -0.207 18222
8228 1 19 . 1 1 40 40 THR CA C 40 63.390 63.390 64.812 -1.422 18222
8229 1 19 . 1 1 40 40 THR CB C 40 68.650 68.650 68.164 0.486 18222
8230 1 19 . 1 1 40 40 THR H H 40 7.700 7.700 7.875 -0.175 18222
8231 1 19 . 1 1 41 41 GLY N N 41 110.770 110.770 110.748 0.022 18222
8232 1 19 . 1 1 41 41 GLY CA C 41 45.580 45.580 46.355 -0.774 18222
8233 1 19 . 1 1 41 41 GLY H H 41 7.700 7.700 8.022 -0.322 18222
8234 1 19 . 1 1 42 42 THR N N 42 114.520 114.520 115.272 -0.752 18222
8235 1 19 . 1 1 42 42 THR CA C 42 63.300 63.300 62.212 1.088 18222
8236 1 19 . 1 1 42 42 THR CB C 42 69.490 69.490 69.139 0.351 18222
8237 1 19 . 1 1 42 42 THR H H 42 7.720 7.720 7.379 0.341 18222
8238 1 19 . 1 1 43 43 GLY N N 43 109.540 109.540 109.730 -0.190 18222
8239 1 19 . 1 1 43 43 GLY CA C 43 46.250 46.250 46.606 -0.356 18222
8240 1 19 . 1 1 43 43 GLY H H 43 8.110 8.110 7.883 0.227 18222
8241 1 19 . 1 1 44 44 MET N N 44 120.240 120.240 120.788 -0.548 18222
8242 1 19 . 1 1 44 44 MET HA H 44 4.100 4.100 4.106 -0.006 18222
8243 1 19 . 1 1 44 44 MET CA C 44 57.700 57.700 58.923 -1.224 18222
8244 1 19 . 1 1 44 44 MET CB C 44 32.030 32.030 32.467 -0.437 18222
8245 1 19 . 1 1 44 44 MET H H 44 7.730 7.730 7.989 -0.259 18222
8246 1 19 . 1 1 45 45 ALA N N 45 121.560 121.560 121.898 -0.338 18222
8247 1 19 . 1 1 45 45 ALA CA C 45 54.440 54.440 55.049 -0.609 18222
8248 1 19 . 1 1 45 45 ALA CB C 45 17.400 17.400 17.817 -0.417 18222
8249 1 19 . 1 1 45 45 ALA H H 45 7.950 7.950 7.794 0.156 18222
8250 1 19 . 1 1 46 46 PHE N N 46 118.260 118.260 117.960 0.300 18222
8251 1 19 . 1 1 46 46 PHE HA H 46 3.930 3.930 4.147 -0.217 18222
8252 1 19 . 1 1 46 46 PHE CA C 46 59.820 59.820 61.592 -1.772 18222
8253 1 19 . 1 1 46 46 PHE CB C 46 38.260 38.260 38.683 -0.423 18222
8254 1 19 . 1 1 46 46 PHE H H 46 7.860 7.860 8.208 -0.348 18222
8255 1 19 . 1 1 47 47 GLY N N 47 107.300 107.300 107.746 -0.446 18222
8256 1 19 . 1 1 47 47 GLY CA C 47 46.560 46.560 46.996 -0.436 18222
8257 1 19 . 1 1 47 47 GLY H H 47 8.200 8.200 8.434 -0.234 18222
8258 1 19 . 1 1 48 48 LEU N N 48 121.920 121.920 123.270 -1.350 18222
8259 1 19 . 1 1 48 48 LEU HA H 48 4.040 4.040 4.094 -0.054 18222
8260 1 19 . 1 1 48 48 LEU CA C 48 57.580 57.580 58.224 -0.644 18222
8261 1 19 . 1 1 48 48 LEU CB C 48 40.790 40.790 42.121 -1.331 18222
8262 1 19 . 1 1 48 48 LEU H H 48 8.180 8.180 8.452 -0.272 18222
8263 1 19 . 1 1 49 49 GLN N N 49 118.270 118.270 118.681 -0.411 18222
8264 1 19 . 1 1 49 49 GLN HA H 49 3.830 3.830 4.022 -0.192 18222
8265 1 19 . 1 1 49 49 GLN CA C 49 58.880 58.880 58.758 0.123 18222
8266 1 19 . 1 1 49 49 GLN CB C 49 27.240 27.240 28.505 -1.265 18222
8267 1 19 . 1 1 49 49 GLN H H 49 8.080 8.080 8.116 -0.036 18222
8268 1 19 . 1 1 50 50 MET N N 50 117.630 117.630 120.015 -2.385 18222
8269 1 19 . 1 1 50 50 MET HA H 50 4.010 4.010 4.109 -0.099 18222
8270 1 19 . 1 1 50 50 MET CA C 50 57.730 57.730 59.648 -1.918 18222
8271 1 19 . 1 1 50 50 MET CB C 50 27.160 27.160 32.812 -5.652 18222
8272 1 19 . 1 1 50 50 MET H H 50 7.880 7.880 8.134 -0.254 18222
8273 1 19 . 1 1 51 51 PHE N N 51 119.550 119.550 119.588 -0.038 18222
8274 1 19 . 1 1 51 51 PHE CA C 51 60.850 60.850 61.648 -0.798 18222
8275 1 19 . 1 1 51 51 PHE CB C 51 38.720 38.720 39.251 -0.531 18222
8276 1 19 . 1 1 51 51 PHE H H 51 7.890 7.890 8.238 -0.348 18222
8277 1 19 . 1 1 52 52 ILE N N 52 117.950 117.950 117.336 0.614 18222
8278 1 19 . 1 1 52 52 ILE HA H 52 4.050 4.050 3.742 0.308 18222
8279 1 19 . 1 1 52 52 ILE CA C 52 63.560 63.560 64.742 -1.181 18222
8280 1 19 . 1 1 52 52 ILE CB C 52 36.810 36.810 38.362 -1.552 18222
8281 1 19 . 1 1 52 52 ILE H H 52 8.110 8.110 8.003 0.107 18222
8282 1 19 . 1 1 53 53 GLN N N 53 117.360 117.360 118.581 -1.221 18222
8283 1 19 . 1 1 53 53 GLN CA C 53 57.200 57.200 58.138 -0.938 18222
8284 1 19 . 1 1 53 53 GLN CB C 53 27.870 27.870 28.108 -0.238 18222
8285 1 19 . 1 1 53 53 GLN H H 53 7.930 7.930 8.454 -0.524 18222
8286 1 19 . 1 1 54 54 ARG N N 54 116.840 116.840 120.276 -3.436 18222
8287 1 19 . 1 1 54 54 ARG HA H 54 3.950 3.950 4.148 -0.198 18222
8288 1 19 . 1 1 54 54 ARG CA C 54 56.480 56.480 57.877 -1.397 18222
8289 1 19 . 1 1 54 54 ARG CB C 54 28.970 28.970 29.904 -0.934 18222
8290 1 19 . 1 1 54 54 ARG H H 54 7.540 7.540 7.895 -0.355 18222
8291 1 19 . 1 1 55 55 LYS N N 55 117.900 117.900 117.085 0.815 18222
8292 1 19 . 1 1 55 55 LYS HA H 55 4.080 4.080 4.230 -0.150 18222
8293 1 19 . 1 1 55 55 LYS CA C 55 55.030 55.030 56.822 -1.792 18222
8294 1 19 . 1 1 55 55 LYS CB C 55 32.010 32.010 32.159 -0.149 18222
8295 1 19 . 1 1 55 55 LYS H H 55 7.660 7.660 7.416 0.244 18222
8296 1 19 . 1 1 56 56 PHE N N 56 121.060 121.060 120.968 0.092 18222
8297 1 19 . 1 1 56 56 PHE CA C 56 55.190 55.190 55.955 -0.764 18222
8298 1 19 . 1 1 56 56 PHE CB C 56 38.970 38.970 39.419 -0.449 18222
8299 1 19 . 1 1 56 56 PHE H H 56 8.080 8.080 7.937 0.143 18222
8300 1 19 . 1 1 57 57 PRO CA C 57 62.390 62.390 63.741 -1.351 18222
8301 1 19 . 1 1 57 57 PRO CB C 57 30.580 30.580 31.812 -1.232 18222
8302 1 19 . 1 1 58 58 TYR N N 58 120.240 120.240 120.281 -0.041 18222
8303 1 19 . 1 1 58 58 TYR CA C 58 55.770 55.770 54.972 0.798 18222
8304 1 19 . 1 1 58 58 TYR CB C 58 40.220 40.220 39.913 0.308 18222
8305 1 19 . 1 1 58 58 TYR H H 58 7.700 7.700 7.889 -0.189 18222
8306 1 19 . 1 1 59 59 PRO CA C 59 62.130 62.130 63.956 -1.826 18222
8307 1 19 . 1 1 59 59 PRO CB C 59 33.340 33.340 32.236 1.104 18222
8308 1 19 . 1 1 60 60 LEU N N 60 122.210 122.210 120.419 1.791 18222
8309 1 19 . 1 1 60 60 LEU CA C 60 54.250 54.250 54.070 0.180 18222
8310 1 19 . 1 1 60 60 LEU CB C 60 41.470 41.470 43.394 -1.924 18222
8311 1 19 . 1 1 60 60 LEU H H 60 7.880 7.880 7.909 -0.029 18222
8312 1 19 . 1 1 61 61 GLN N N 61 122.470 122.470 122.087 0.383 18222
8313 1 19 . 1 1 61 61 GLN CA C 61 54.170 54.170 55.256 -1.086 18222
8314 1 19 . 1 1 61 61 GLN H H 61 7.970 7.970 8.408 -0.438 18222
8315 1 19 . 1 1 62 62 TRP N N 62 124.590 124.590 124.087 0.503 18222
8316 1 19 . 1 1 62 62 TRP CA C 62 59.830 59.830 60.549 -0.719 18222
8317 1 19 . 1 1 62 62 TRP CB C 62 28.800 28.800 29.575 -0.775 18222
8318 1 19 . 1 1 62 62 TRP H H 62 8.240 8.240 8.843 -0.603 18222
8319 1 19 . 1 1 63 63 SER N N 63 113.320 113.320 114.300 -0.980 18222
8320 1 19 . 1 1 63 63 SER CA C 63 61.100 61.100 60.818 0.282 18222
8321 1 19 . 1 1 63 63 SER H H 63 8.410 8.410 8.035 0.375 18222
8322 1 19 . 1 1 64 64 LEU N N 64 123.230 123.230 122.573 0.657 18222
8323 1 19 . 1 1 64 64 LEU CA C 64 56.880 56.880 57.626 -0.746 18222
8324 1 19 . 1 1 64 64 LEU CB C 64 40.830 40.830 41.766 -0.936 18222
8325 1 19 . 1 1 64 64 LEU H H 64 7.230 7.230 7.967 -0.737 18222
8326 1 19 . 1 1 65 65 LEU N N 65 119.400 119.400 119.659 -0.259 18222
8327 1 19 . 1 1 65 65 LEU HA H 65 3.890 3.890 3.919 -0.029 18222
8328 1 19 . 1 1 65 65 LEU CA C 65 57.580 57.580 58.220 -0.640 18222
8329 1 19 . 1 1 65 65 LEU CB C 65 40.710 40.710 41.720 -1.010 18222
8330 1 19 . 1 1 65 65 LEU H H 65 7.510 7.510 8.726 -1.216 18222
8331 1 19 . 1 1 66 66 VAL N N 66 116.950 116.950 118.834 -1.884 18222
8332 1 19 . 1 1 66 66 VAL HA H 66 3.960 3.960 3.462 0.498 18222
8333 1 19 . 1 1 66 66 VAL CA C 66 66.260 66.260 66.527 -0.267 18222
8334 1 19 . 1 1 66 66 VAL CB C 66 30.570 30.570 31.256 -0.686 18222
8335 1 19 . 1 1 66 66 VAL H H 66 7.950 7.950 7.854 0.096 18222
8336 1 19 . 1 1 67 67 ALA N N 67 120.650 120.650 122.735 -2.085 18222
8337 1 19 . 1 1 67 67 ALA HA H 67 4.000 4.000 4.117 -0.117 18222
8338 1 19 . 1 1 67 67 ALA CA C 67 54.780 54.780 55.239 -0.459 18222
8339 1 19 . 1 1 67 67 ALA CB C 67 17.440 17.440 18.336 -0.896 18222
8340 1 19 . 1 1 67 67 ALA H H 67 7.450 7.450 8.017 -0.567 18222
8341 1 19 . 1 1 68 68 VAL N N 68 118.440 118.440 118.632 -0.192 18222
8342 1 19 . 1 1 68 68 VAL HA H 68 3.750 3.750 3.542 0.208 18222
8343 1 19 . 1 1 68 68 VAL CA C 68 65.250 65.250 67.488 -2.238 18222
8344 1 19 . 1 1 68 68 VAL CB C 68 30.850 30.850 32.138 -1.288 18222
8345 1 19 . 1 1 68 68 VAL H H 68 7.960 7.960 7.973 -0.013 18222
8346 1 19 . 1 1 69 69 VAL N N 69 120.800 120.800 120.177 0.623 18222
8347 1 19 . 1 1 69 69 VAL HA H 69 4.220 4.220 3.559 0.661 18222
8348 1 19 . 1 1 69 69 VAL CA C 69 66.020 66.020 67.175 -1.155 18222
8349 1 19 . 1 1 69 69 VAL CB C 69 30.850 30.850 31.195 -0.344 18222
8350 1 19 . 1 1 69 69 VAL H H 69 8.080 8.080 8.389 -0.309 18222
8351 1 19 . 1 1 70 70 ALA N N 70 121.740 121.740 120.742 0.998 18222
8352 1 19 . 1 1 70 70 ALA HA H 70 3.920 3.920 4.178 -0.258 18222
8353 1 19 . 1 1 70 70 ALA CA C 70 54.920 54.920 55.351 -0.431 18222
8354 1 19 . 1 1 70 70 ALA CB C 70 17.620 17.620 17.998 -0.378 18222
8355 1 19 . 1 1 70 70 ALA H H 70 8.660 8.660 8.500 0.160 18222
8356 1 19 . 1 1 71 71 GLY N N 71 103.450 103.450 106.848 -3.398 18222
8357 1 19 . 1 1 71 71 GLY CA C 71 46.300 46.300 46.944 -0.644 18222
8358 1 19 . 1 1 71 71 GLY H H 71 8.010 8.010 8.100 -0.090 18222
8359 1 19 . 1 1 72 72 SER N N 72 118.160 118.160 118.094 0.066 18222
8360 1 19 . 1 1 72 72 SER CA C 72 61.260 61.260 61.922 -0.662 18222
8361 1 19 . 1 1 72 72 SER CB C 72 62.870 62.870 63.207 -0.337 18222
8362 1 19 . 1 1 72 72 SER H H 72 7.870 7.870 8.025 -0.155 18222
8363 1 19 . 1 1 73 73 VAL N N 73 121.340 121.340 122.205 -0.865 18222
8364 1 19 . 1 1 73 73 VAL CA C 73 65.750 65.750 67.318 -1.568 18222
8365 1 19 . 1 1 73 73 VAL CB C 73 30.740 30.740 31.792 -1.052 18222
8366 1 19 . 1 1 73 73 VAL H H 73 8.050 8.050 8.166 -0.116 18222
8367 1 19 . 1 1 74 74 VAL N N 74 118.680 118.680 118.998 -0.318 18222
8368 1 19 . 1 1 74 74 VAL CA C 74 65.770 65.770 65.524 0.246 18222
8369 1 19 . 1 1 74 74 VAL CB C 74 30.740 30.740 30.869 -0.129 18222
8370 1 19 . 1 1 74 74 VAL H H 74 7.880 7.880 8.482 -0.602 18222
8371 1 19 . 1 1 75 75 SER N N 75 114.750 114.750 116.655 -1.905 18222
8372 1 19 . 1 1 75 75 SER HA H 75 4.100 4.100 4.177 -0.077 18222
8373 1 19 . 1 1 75 75 SER CA C 75 60.870 60.870 62.631 -1.761 18222
8374 1 19 . 1 1 75 75 SER CB C 75 62.340 62.340 63.088 -0.748 18222
8375 1 19 . 1 1 75 75 SER H H 75 7.870 7.870 7.952 -0.082 18222
8376 1 19 . 1 1 76 76 TYR N N 76 121.110 121.110 121.491 -0.381 18222
8377 1 19 . 1 1 76 76 TYR CA C 76 60.050 60.050 62.071 -2.021 18222
8378 1 19 . 1 1 76 76 TYR CB C 76 37.980 37.980 38.400 -0.420 18222
8379 1 19 . 1 1 76 76 TYR H H 76 7.860 7.860 8.436 -0.576 18222
8380 1 19 . 1 1 77 77 GLY N N 77 107.300 107.300 107.141 0.159 18222
8381 1 19 . 1 1 77 77 GLY CA C 77 46.560 46.560 47.268 -0.708 18222
8382 1 19 . 1 1 77 77 GLY H H 77 8.200 8.200 8.553 -0.353 18222
8383 1 19 . 1 1 78 78 VAL N N 78 119.470 119.470 121.230 -1.760 18222
8384 1 19 . 1 1 78 78 VAL HA H 78 4.170 4.170 3.828 0.342 18222
8385 1 19 . 1 1 78 78 VAL CA C 78 64.650 64.650 65.615 -0.966 18222
8386 1 19 . 1 1 78 78 VAL H H 78 8.140 8.140 8.555 -0.415 18222
8387 1 19 . 1 1 79 79 THR N N 79 112.100 112.100 116.463 -4.363 18222
8388 1 19 . 1 1 79 79 THR CA C 79 63.460 63.460 67.036 -3.576 18222
8389 1 19 . 1 1 79 79 THR CB C 79 68.650 68.650 68.520 0.130 18222
8390 1 19 . 1 1 79 79 THR H H 79 7.640 7.640 8.000 -0.360 18222
8391 1 19 . 1 1 80 80 ARG N N 80 120.770 120.770 121.908 -1.138 18222
8392 1 19 . 1 1 80 80 ARG HA H 80 4.160 4.160 4.058 0.102 18222
8393 1 19 . 1 1 80 80 ARG CA C 80 56.790 56.790 59.893 -3.103 18222
8394 1 19 . 1 1 80 80 ARG CB C 80 29.430 29.430 30.243 -0.813 18222
8395 1 19 . 1 1 80 80 ARG H H 80 7.680 7.680 8.061 -0.381 18222
8396 1 19 . 1 1 81 81 VAL N N 81 118.370 118.370 120.130 -1.760 18222
8397 1 19 . 1 1 81 81 VAL HA H 81 3.920 3.920 3.625 0.295 18222
8398 1 19 . 1 1 81 81 VAL CA C 81 63.340 63.340 67.005 -3.665 18222
8399 1 19 . 1 1 81 81 VAL CB C 81 31.260 31.260 31.834 -0.574 18222
8400 1 19 . 1 1 81 81 VAL H H 81 7.730 7.730 8.309 -0.579 18222
8401 1 19 . 1 1 82 82 GLU N N 82 120.620 120.620 119.500 1.120 18222
8402 1 19 . 1 1 82 82 GLU CA C 82 56.320 56.320 59.217 -2.897 18222
8403 1 19 . 1 1 82 82 GLU CB C 82 27.930 27.930 29.359 -1.429 18222
8404 1 19 . 1 1 82 82 GLU H H 82 7.920 7.920 8.577 -0.657 18222
8405 1 19 . 1 1 83 83 SER N N 83 116.240 116.240 116.699 -0.459 18222
8406 1 19 . 1 1 83 83 SER CA C 83 59.250 59.250 61.893 -2.643 18222
8407 1 19 . 1 1 83 83 SER CB C 83 63.160 63.160 63.142 0.019 18222
8408 1 19 . 1 1 83 83 SER H H 83 7.960 7.960 7.958 0.002 18222
8409 1 19 . 1 1 84 84 GLU N N 84 123.280 123.280 122.000 1.280 18222
8410 1 19 . 1 1 84 84 GLU HA H 84 4.080 4.080 4.081 -0.001 18222
8411 1 19 . 1 1 84 84 GLU CA C 84 57.860 57.860 59.840 -1.980 18222
8412 1 19 . 1 1 84 84 GLU CB C 84 28.190 28.190 29.578 -1.388 18222
8413 1 19 . 1 1 84 84 GLU H H 84 8.470 8.470 8.132 0.338 18222
8414 1 19 . 1 1 85 85 LYS N N 85 118.650 118.650 119.922 -1.272 18222
8415 1 19 . 1 1 85 85 LYS HA H 85 4.100 4.100 4.060 0.040 18222
8416 1 19 . 1 1 85 85 LYS CA C 85 57.780 57.780 59.372 -1.592 18222
8417 1 19 . 1 1 85 85 LYS CB C 85 31.380 31.380 32.571 -1.190 18222
8418 1 19 . 1 1 85 85 LYS H H 85 7.940 7.940 8.135 -0.195 18222
8419 1 19 . 1 1 86 86 CYS N N 86 117.070 117.070 118.276 -1.206 18222
8420 1 19 . 1 1 86 86 CYS CA C 86 60.910 60.910 62.775 -1.865 18222
8421 1 19 . 1 1 86 86 CYS CB C 86 26.740 26.740 26.684 0.056 18222
8422 1 19 . 1 1 86 86 CYS H H 86 7.840 7.840 8.168 -0.328 18222
8423 1 19 . 1 1 87 87 ASN N N 87 119.370 119.370 119.359 0.011 18222
8424 1 19 . 1 1 87 87 ASN HA H 87 4.130 4.130 4.508 -0.378 18222
8425 1 19 . 1 1 87 87 ASN CA C 87 55.750 55.750 57.422 -1.672 18222
8426 1 19 . 1 1 87 87 ASN CB C 87 38.050 38.050 38.281 -0.231 18222
8427 1 19 . 1 1 87 87 ASN H H 87 8.110 8.110 8.393 -0.283 18222
8428 1 19 . 1 1 88 88 ASN N N 88 117.570 117.570 119.269 -1.699 18222
8429 1 19 . 1 1 88 88 ASN HA H 88 4.280 4.280 4.503 -0.223 18222
8430 1 19 . 1 1 88 88 ASN CA C 88 55.190 55.190 56.105 -0.916 18222
8431 1 19 . 1 1 88 88 ASN CB C 88 37.400 37.400 38.510 -1.110 18222
8432 1 19 . 1 1 88 88 ASN H H 88 8.280 8.280 8.268 0.012 18222
8433 1 19 . 1 1 89 89 LEU N N 89 121.940 121.940 122.023 -0.083 18222
8434 1 19 . 1 1 89 89 LEU HA H 89 4.070 4.070 4.175 -0.105 18222
8435 1 19 . 1 1 89 89 LEU CA C 89 57.580 57.580 58.808 -1.228 18222
8436 1 19 . 1 1 89 89 LEU CB C 89 40.490 40.490 41.919 -1.429 18222
8437 1 19 . 1 1 89 89 LEU H H 89 7.790 7.790 8.367 -0.577 18222
8438 1 19 . 1 1 90 90 TRP N N 90 119.220 119.220 120.490 -1.270 18222
8439 1 19 . 1 1 90 90 TRP CA C 90 59.120 59.120 59.998 -0.878 18222
8440 1 19 . 1 1 90 90 TRP CB C 90 28.800 28.800 29.428 -0.628 18222
8441 1 19 . 1 1 90 90 TRP H H 90 7.850 7.850 8.450 -0.600 18222
8442 1 19 . 1 1 91 91 LEU N N 91 117.870 117.870 119.467 -1.597 18222
8443 1 19 . 1 1 91 91 LEU CA C 91 57.300 57.300 57.877 -0.577 18222
8444 1 19 . 1 1 91 91 LEU CB C 91 40.610 40.610 41.482 -0.872 18222
8445 1 19 . 1 1 91 91 LEU H H 91 7.920 7.920 7.815 0.105 18222
8446 1 19 . 1 1 92 92 PHE N N 92 121.280 121.280 116.749 4.531 18222
8447 1 19 . 1 1 92 92 PHE CA C 92 60.390 60.390 61.578 -1.188 18222
8448 1 19 . 1 1 92 92 PHE CB C 92 37.980 37.980 38.797 -0.817 18222
8449 1 19 . 1 1 92 92 PHE H H 92 7.860 7.860 7.909 -0.049 18222
8450 1 19 . 1 1 93 93 LEU N N 93 119.860 119.860 121.668 -1.808 18222
8451 1 19 . 1 1 93 93 LEU CA C 93 56.860 56.860 58.156 -1.296 18222
8452 1 19 . 1 1 93 93 LEU CB C 93 40.550 40.550 41.006 -0.456 18222
8453 1 19 . 1 1 93 93 LEU H H 93 7.980 7.980 8.867 -0.887 18222
8454 1 19 . 1 1 94 94 GLU N N 94 114.660 114.660 117.692 -3.032 18222
8455 1 19 . 1 1 94 94 GLU HA H 94 3.810 3.810 3.932 -0.122 18222
8456 1 19 . 1 1 94 94 GLU CA C 94 57.210 57.210 58.335 -1.125 18222
8457 1 19 . 1 1 94 94 GLU CB C 94 28.470 28.470 29.071 -0.601 18222
8458 1 19 . 1 1 94 94 GLU H H 94 7.890 7.890 8.261 -0.371 18222
8459 1 19 . 1 1 95 95 THR N N 95 108.260 108.260 112.632 -4.372 18222
8460 1 19 . 1 1 95 95 THR CA C 95 62.150 62.150 62.953 -0.803 18222
8461 1 19 . 1 1 95 95 THR CB C 95 70.810 70.810 69.229 1.581 18222
8462 1 19 . 1 1 95 95 THR H H 95 7.690 7.690 7.839 -0.149 18222
8463 1 19 . 1 1 96 96 GLY N N 96 112.220 112.220 110.325 1.895 18222
8464 1 19 . 1 1 96 96 GLY CA C 96 45.410 45.410 45.558 -0.148 18222
8465 1 19 . 1 1 96 96 GLY H H 96 8.240 8.240 8.135 0.105 18222
8466 1 19 . 1 1 97 97 GLN N N 97 117.950 117.950 118.637 -0.687 18222
8467 1 19 . 1 1 97 97 GLN HA H 97 4.200 4.200 4.096 0.104 18222
8468 1 19 . 1 1 97 97 GLN CA C 97 54.430 54.430 56.906 -2.476 18222
8469 1 19 . 1 1 97 97 GLN CB C 97 29.910 29.910 29.774 0.136 18222
8470 1 19 . 1 1 97 97 GLN H H 97 7.640 7.640 7.598 0.042 18222
8471 1 19 . 1 1 98 98 LEU N N 98 123.810 123.810 122.493 1.317 18222
8472 1 19 . 1 1 98 98 LEU HA H 98 4.360 4.360 4.284 0.076 18222
8473 1 19 . 1 1 98 98 LEU CA C 98 52.650 52.650 54.967 -2.317 18222
8474 1 19 . 1 1 98 98 LEU CB C 98 40.460 40.460 41.715 -1.254 18222
8475 1 19 . 1 1 98 98 LEU H H 98 8.270 8.270 8.509 -0.239 18222
8476 1 19 . 1 1 99 99 PRO CA C 99 63.180 63.180 62.525 0.655 18222
8477 1 19 . 1 1 99 99 PRO CB C 99 30.840 30.840 32.372 -1.532 18222
8478 1 19 . 1 1 100 100 LYS N N 100 120.630 120.630 118.646 1.984 18222
8479 1 19 . 1 1 100 100 LYS CA C 100 55.730 55.730 55.455 0.275 18222
8480 1 19 . 1 1 100 100 LYS CB C 100 32.280 32.280 35.177 -2.897 18222
8481 1 19 . 1 1 100 100 LYS H H 100 8.090 8.090 8.438 -0.348 18222
8482 1 19 . 1 1 101 101 ASP N N 101 120.920 120.920 122.981 -2.061 18222
8483 1 19 . 1 1 101 101 ASP HA H 101 4.190 4.190 4.517 -0.327 18222
8484 1 19 . 1 1 101 101 ASP CA C 101 54.000 54.000 55.138 -1.138 18222
8485 1 19 . 1 1 101 101 ASP CB C 101 40.330 40.330 41.545 -1.215 18222
8486 1 19 . 1 1 101 101 ASP H H 101 8.190 8.190 8.451 -0.261 18222
8487 1 19 . 1 1 102 102 ARG N N 102 122.210 122.210 121.964 0.246 18222
8488 1 19 . 1 1 102 102 ARG CA C 102 55.590 55.590 55.907 -0.317 18222
8489 1 19 . 1 1 102 102 ARG CB C 102 29.630 29.630 31.526 -1.896 18222
8490 1 19 . 1 1 102 102 ARG H H 102 8.130 8.130 8.449 -0.319 18222
8491 1 19 . 1 1 103 103 SER N N 103 117.230 117.230 118.794 -1.564 18222
8492 1 19 . 1 1 103 103 SER HA H 103 4.280 4.280 4.812 -0.532 18222
8493 1 19 . 1 1 103 103 SER CA C 103 58.470 58.470 57.724 0.746 18222
8494 1 19 . 1 1 103 103 SER CB C 103 63.080 63.080 64.364 -1.284 18222
8495 1 19 . 1 1 103 103 SER H H 103 8.290 8.290 8.555 -0.265 18222
8496 1 19 . 1 1 104 104 THR N N 104 115.430 115.430 117.316 -1.886 18222
8497 1 19 . 1 1 104 104 THR CA C 104 61.570 61.570 62.413 -0.843 18222
8498 1 19 . 1 1 104 104 THR CB C 104 69.030 69.030 70.863 -1.833 18222
8499 1 19 . 1 1 104 104 THR H H 104 8.020 8.020 8.007 0.013 18222
8500 1 19 . 1 1 105 105 ASP N N 105 122.780 122.780 121.317 1.463 18222
8501 1 19 . 1 1 105 105 ASP CA C 105 54.210 54.210 54.118 0.092 18222
8502 1 19 . 1 1 105 105 ASP CB C 105 40.380 40.380 41.706 -1.325 18222
8503 1 19 . 1 1 105 105 ASP H H 105 8.120 8.120 8.399 -0.279 18222
8504 1 19 . 1 1 106 106 GLN N N 106 120.960 120.960 119.737 1.223 18222
8505 1 19 . 1 1 106 106 GLN CA C 106 55.420 55.420 56.624 -1.204 18222
8506 1 19 . 1 1 106 106 GLN CB C 106 28.310 28.310 29.293 -0.983 18222
8507 1 19 . 1 1 106 106 GLN H H 106 8.140 8.140 8.412 -0.272 18222
8508 1 19 . 1 1 107 107 ARG N N 107 123.010 123.010 121.282 1.728 18222
8509 1 19 . 1 1 107 107 ARG HA H 107 4.210 4.210 4.561 -0.351 18222
8510 1 19 . 1 1 107 107 ARG CA C 107 55.560 55.560 56.133 -0.573 18222
8511 1 19 . 1 1 107 107 ARG CB C 107 29.920 29.920 30.857 -0.937 18222
8512 1 19 . 1 1 107 107 ARG H H 107 8.180 8.180 8.621 -0.441 18222
8513 1 20 . 1 1 2 2 VAL N N 2 121.590 121.590 120.603 0.987 18222
8514 1 20 . 1 1 2 2 VAL CA C 2 61.600 61.600 61.918 -0.318 18222
8515 1 20 . 1 1 2 2 VAL CB C 2 31.900 31.900 33.069 -1.169 18222
8516 1 20 . 1 1 2 2 VAL H H 2 8.010 8.010 8.373 -0.363 18222
8517 1 20 . 1 1 3 3 ASN N N 3 122.520 122.520 121.816 0.704 18222
8518 1 20 . 1 1 3 3 ASN HA H 3 4.020 4.020 4.729 -0.709 18222
8519 1 20 . 1 1 3 3 ASN CA C 3 52.640 52.640 53.650 -1.010 18222
8520 1 20 . 1 1 3 3 ASN CB C 3 38.330 38.330 39.235 -0.905 18222
8521 1 20 . 1 1 3 3 ASN H H 3 8.360 8.360 8.824 -0.464 18222
8522 1 20 . 1 1 4 4 LEU N N 4 123.830 123.830 122.263 1.567 18222
8523 1 20 . 1 1 4 4 LEU HA H 4 4.220 4.220 4.502 -0.282 18222
8524 1 20 . 1 1 4 4 LEU CA C 4 54.620 54.620 54.407 0.213 18222
8525 1 20 . 1 1 4 4 LEU CB C 4 41.680 41.680 42.025 -0.345 18222
8526 1 20 . 1 1 4 4 LEU H H 4 8.220 8.220 8.131 0.089 18222
8527 1 20 . 1 1 5 5 GLY N N 5 106.810 106.810 108.812 -2.002 18222
8528 1 20 . 1 1 5 5 GLY CA C 5 45.800 45.800 46.276 -0.476 18222
8529 1 20 . 1 1 5 5 GLY H H 5 8.030 8.030 7.581 0.449 18222
8530 1 20 . 1 1 6 6 LEU N N 6 120.820 120.820 122.912 -2.092 18222
8531 1 20 . 1 1 6 6 LEU HA H 6 4.050 4.050 4.267 -0.217 18222
8532 1 20 . 1 1 6 6 LEU CA C 6 55.990 55.990 57.470 -1.480 18222
8533 1 20 . 1 1 6 6 LEU CB C 6 40.800 40.800 41.272 -0.472 18222
8534 1 20 . 1 1 6 6 LEU H H 6 8.030 8.030 8.479 -0.449 18222
8535 1 20 . 1 1 7 7 SER N N 7 115.540 115.540 114.820 0.720 18222
8536 1 20 . 1 1 7 7 SER HA H 7 4.100 4.100 4.143 -0.043 18222
8537 1 20 . 1 1 7 7 SER CA C 7 60.580 60.580 61.523 -0.943 18222
8538 1 20 . 1 1 7 7 SER CB C 7 62.060 62.060 62.425 -0.365 18222
8539 1 20 . 1 1 7 7 SER H H 7 8.360 8.360 8.495 -0.135 18222
8540 1 20 . 1 1 8 8 ARG N N 8 120.690 120.690 122.284 -1.594 18222
8541 1 20 . 1 1 8 8 ARG HA H 8 4.160 4.160 4.114 0.046 18222
8542 1 20 . 1 1 8 8 ARG CA C 8 57.350 57.350 59.265 -1.915 18222
8543 1 20 . 1 1 8 8 ARG CB C 8 29.230 29.230 30.000 -0.770 18222
8544 1 20 . 1 1 8 8 ARG H H 8 7.830 7.830 8.192 -0.362 18222
8545 1 20 . 1 1 9 9 VAL N N 9 119.330 119.330 119.769 -0.439 18222
8546 1 20 . 1 1 9 9 VAL HA H 9 4.170 4.170 3.634 0.536 18222
8547 1 20 . 1 1 9 9 VAL CA C 9 64.720 64.720 66.813 -2.093 18222
8548 1 20 . 1 1 9 9 VAL CB C 9 30.900 30.900 31.841 -0.941 18222
8549 1 20 . 1 1 9 9 VAL H H 9 7.620 7.620 8.141 -0.521 18222
8550 1 20 . 1 1 10 10 ASP N N 10 119.520 119.520 119.672 -0.152 18222
8551 1 20 . 1 1 10 10 ASP CA C 10 54.960 54.960 57.784 -2.824 18222
8552 1 20 . 1 1 10 10 ASP CB C 10 37.800 37.800 40.859 -3.059 18222
8553 1 20 . 1 1 10 10 ASP H H 10 8.180 8.180 8.145 0.035 18222
8554 1 20 . 1 1 11 11 ASP N N 11 121.550 121.550 121.032 0.518 18222
8555 1 20 . 1 1 11 11 ASP CA C 11 54.440 54.440 57.039 -2.599 18222
8556 1 20 . 1 1 11 11 ASP CB C 11 37.840 37.840 40.893 -3.053 18222
8557 1 20 . 1 1 11 11 ASP H H 11 7.950 7.950 8.088 -0.138 18222
8558 1 20 . 1 1 12 12 ALA N N 12 120.220 120.220 122.355 -2.135 18222
8559 1 20 . 1 1 12 12 ALA CA C 12 54.370 54.370 55.274 -0.904 18222
8560 1 20 . 1 1 12 12 ALA CB C 12 24.730 24.730 18.489 6.241 18222
8561 1 20 . 1 1 12 12 ALA H H 12 8.090 8.090 8.072 0.018 18222
8562 1 20 . 1 1 13 13 VAL N N 13 116.910 116.910 118.544 -1.634 18222
8563 1 20 . 1 1 13 13 VAL HA H 13 4.140 4.140 3.689 0.451 18222
8564 1 20 . 1 1 13 13 VAL CA C 13 64.900 64.900 65.117 -0.217 18222
8565 1 20 . 1 1 13 13 VAL CB C 13 31.000 31.000 30.525 0.475 18222
8566 1 20 . 1 1 13 13 VAL H H 13 7.980 7.980 8.327 -0.347 18222
8567 1 20 . 1 1 14 14 ALA N N 14 122.200 122.200 122.790 -0.590 18222
8568 1 20 . 1 1 14 14 ALA HA H 14 4.020 4.020 4.347 -0.327 18222
8569 1 20 . 1 1 14 14 ALA CA C 14 53.800 53.800 54.991 -1.191 18222
8570 1 20 . 1 1 14 14 ALA CB C 14 17.790 17.790 18.389 -0.598 18222
8571 1 20 . 1 1 14 14 ALA H H 14 8.030 8.030 7.962 0.068 18222
8572 1 20 . 1 1 15 15 ALA N N 15 118.600 118.600 119.850 -1.250 18222
8573 1 20 . 1 1 15 15 ALA CA C 15 53.230 53.230 54.544 -1.314 18222
8574 1 20 . 1 1 15 15 ALA CB C 15 18.010 18.010 18.628 -0.618 18222
8575 1 20 . 1 1 15 15 ALA H H 15 7.530 7.530 8.100 -0.570 18222
8576 1 20 . 1 1 16 16 LYS N N 16 115.820 115.820 116.976 -1.156 18222
8577 1 20 . 1 1 16 16 LYS HA H 16 4.080 4.080 4.247 -0.167 18222
8578 1 20 . 1 1 16 16 LYS CA C 16 55.670 55.670 57.625 -1.955 18222
8579 1 20 . 1 1 16 16 LYS CB C 16 32.640 32.640 33.809 -1.169 18222
8580 1 20 . 1 1 16 16 LYS H H 16 7.490 7.490 7.829 -0.339 18222
8581 1 20 . 1 1 17 17 HIS N N 17 116.790 116.790 118.585 -1.795 18222
8582 1 20 . 1 1 17 17 HIS HA H 17 4.100 4.100 5.000 -0.900 18222
8583 1 20 . 1 1 17 17 HIS CA C 17 52.820 52.820 53.211 -0.391 18222
8584 1 20 . 1 1 17 17 HIS CB C 17 28.400 28.400 31.687 -3.287 18222
8585 1 20 . 1 1 17 17 HIS H H 17 8.130 8.130 8.437 -0.307 18222
8586 1 20 . 1 1 18 18 PRO CA C 18 63.800 63.800 63.381 0.419 18222
8587 1 20 . 1 1 18 18 PRO CB C 18 30.800 30.800 32.743 -1.943 18222
8588 1 20 . 1 1 19 19 GLY N N 19 110.260 110.260 110.449 -0.189 18222
8589 1 20 . 1 1 19 19 GLY CA C 19 45.490 45.490 46.125 -0.635 18222
8590 1 20 . 1 1 19 19 GLY H H 19 8.730 8.730 8.320 0.410 18222
8591 1 20 . 1 1 20 20 LEU N N 20 122.650 122.650 123.578 -0.928 18222
8592 1 20 . 1 1 20 20 LEU HA H 20 4.090 4.090 4.437 -0.347 18222
8593 1 20 . 1 1 20 20 LEU CA C 20 57.060 57.060 56.849 0.211 18222
8594 1 20 . 1 1 20 20 LEU H H 20 7.980 7.980 8.322 -0.342 18222
8595 1 20 . 1 1 21 21 GLY N N 21 107.000 107.000 107.014 -0.014 18222
8596 1 20 . 1 1 21 21 GLY CA C 21 46.710 46.710 47.390 -0.680 18222
8597 1 20 . 1 1 21 21 GLY H H 21 8.570 8.570 8.717 -0.147 18222
8598 1 20 . 1 1 22 22 GLU N N 22 121.610 121.610 121.366 0.244 18222
8599 1 20 . 1 1 22 22 GLU HA H 22 3.990 3.990 4.085 -0.095 18222
8600 1 20 . 1 1 22 22 GLU CA C 22 58.280 58.280 59.291 -1.011 18222
8601 1 20 . 1 1 22 22 GLU CB C 22 28.010 28.010 29.530 -1.520 18222
8602 1 20 . 1 1 22 22 GLU H H 22 8.100 8.100 8.335 -0.235 18222
8603 1 20 . 1 1 23 23 TYR N N 23 120.870 120.870 121.194 -0.324 18222
8604 1 20 . 1 1 23 23 TYR CA C 23 60.380 60.380 60.571 -0.191 18222
8605 1 20 . 1 1 23 23 TYR CB C 23 37.750 37.750 38.292 -0.542 18222
8606 1 20 . 1 1 23 23 TYR H H 23 7.910 7.910 7.614 0.296 18222
8607 1 20 . 1 1 24 24 ALA N N 24 121.420 121.420 121.733 -0.313 18222
8608 1 20 . 1 1 24 24 ALA HA H 24 4.140 4.140 3.774 0.366 18222
8609 1 20 . 1 1 24 24 ALA CA C 24 54.260 54.260 54.984 -0.725 18222
8610 1 20 . 1 1 24 24 ALA H H 24 8.410 8.410 8.778 -0.368 18222
8611 1 20 . 1 1 25 25 ALA N N 25 120.220 120.220 121.163 -0.943 18222
8612 1 20 . 1 1 25 25 ALA CA C 25 54.370 54.370 55.141 -0.771 18222
8613 1 20 . 1 1 25 25 ALA H H 25 8.090 8.090 8.515 -0.425 18222
8614 1 20 . 1 1 26 26 CYS N N 26 116.760 116.760 117.757 -0.997 18222
8615 1 20 . 1 1 26 26 CYS CA C 26 61.180 61.180 61.553 -0.373 18222
8616 1 20 . 1 1 26 26 CYS CB C 26 26.390 26.390 26.936 -0.546 18222
8617 1 20 . 1 1 26 26 CYS H H 26 7.950 7.950 8.203 -0.253 18222
8618 1 20 . 1 1 27 27 GLN N N 27 118.690 118.690 121.409 -2.719 18222
8619 1 20 . 1 1 27 27 GLN CA C 27 55.970 55.970 59.730 -3.760 18222
8620 1 20 . 1 1 27 27 GLN H H 27 8.060 8.060 8.035 0.025 18222
8621 1 20 . 1 1 28 28 SER N N 28 115.490 115.490 115.008 0.482 18222
8622 1 20 . 1 1 28 28 SER HA H 28 3.990 3.990 4.025 -0.035 18222
8623 1 20 . 1 1 28 28 SER CA C 28 61.110 61.110 61.694 -0.584 18222
8624 1 20 . 1 1 28 28 SER H H 28 7.980 7.980 8.157 -0.177 18222
8625 1 20 . 1 1 29 29 HIS N N 29 120.880 120.880 121.057 -0.177 18222
8626 1 20 . 1 1 29 29 HIS CA C 29 58.190 58.190 59.614 -1.424 18222
8627 1 20 . 1 1 29 29 HIS CB C 29 27.460 27.460 30.069 -2.609 18222
8628 1 20 . 1 1 29 29 HIS H H 29 8.180 8.180 8.299 -0.119 18222
8629 1 20 . 1 1 30 30 ALA N N 30 122.920 122.920 122.839 0.081 18222
8630 1 20 . 1 1 30 30 ALA CA C 30 54.560 54.560 55.406 -0.845 18222
8631 1 20 . 1 1 30 30 ALA CB C 30 17.490 17.490 18.252 -0.762 18222
8632 1 20 . 1 1 30 30 ALA H H 30 8.040 8.040 8.127 -0.087 18222
8633 1 20 . 1 1 31 31 PHE N N 31 119.340 119.340 119.492 -0.152 18222
8634 1 20 . 1 1 31 31 PHE CA C 31 60.370 60.370 62.364 -1.994 18222
8635 1 20 . 1 1 31 31 PHE CB C 31 38.520 38.520 39.278 -0.758 18222
8636 1 20 . 1 1 31 31 PHE H H 31 8.230 8.230 8.333 -0.103 18222
8637 1 20 . 1 1 32 32 MET N N 32 118.110 118.110 118.670 -0.560 18222
8638 1 20 . 1 1 32 32 MET HA H 32 4.050 4.050 4.098 -0.048 18222
8639 1 20 . 1 1 32 32 MET CA C 32 58.280 58.280 58.827 -0.547 18222
8640 1 20 . 1 1 32 32 MET CB C 32 31.090 31.090 32.139 -1.049 18222
8641 1 20 . 1 1 32 32 MET H H 32 8.120 8.120 8.415 -0.295 18222
8642 1 20 . 1 1 33 33 LYS N N 33 119.040 119.040 119.201 -0.161 18222
8643 1 20 . 1 1 33 33 LYS HA H 33 3.930 3.930 4.024 -0.094 18222
8644 1 20 . 1 1 33 33 LYS CA C 33 59.040 59.040 59.705 -0.665 18222
8645 1 20 . 1 1 33 33 LYS CB C 33 30.990 30.990 32.376 -1.386 18222
8646 1 20 . 1 1 33 33 LYS H H 33 7.970 7.970 8.680 -0.710 18222
8647 1 20 . 1 1 34 34 GLY N N 34 108.840 108.840 108.213 0.627 18222
8648 1 20 . 1 1 34 34 GLY CA C 34 46.610 46.610 47.213 -0.603 18222
8649 1 20 . 1 1 34 34 GLY H H 34 8.030 8.030 8.316 -0.286 18222
8650 1 20 . 1 1 35 35 VAL N N 35 122.910 122.910 121.978 0.932 18222
8651 1 20 . 1 1 35 35 VAL HA H 35 4.220 4.220 3.701 0.519 18222
8652 1 20 . 1 1 35 35 VAL CA C 35 66.310 66.310 64.999 1.311 18222
8653 1 20 . 1 1 35 35 VAL CB C 35 30.560 30.560 31.690 -1.130 18222
8654 1 20 . 1 1 35 35 VAL H H 35 8.090 8.090 7.971 0.119 18222
8655 1 20 . 1 1 36 36 PHE N N 36 120.020 120.020 119.979 0.041 18222
8656 1 20 . 1 1 36 36 PHE CA C 36 61.350 61.350 62.941 -1.591 18222
8657 1 20 . 1 1 36 36 PHE CB C 36 38.090 38.090 38.976 -0.886 18222
8658 1 20 . 1 1 36 36 PHE H H 36 8.350 8.350 8.408 -0.058 18222
8659 1 20 . 1 1 37 37 THR N N 37 116.980 116.980 115.024 1.956 18222
8660 1 20 . 1 1 37 37 THR HA H 37 4.050 4.050 4.033 0.017 18222
8661 1 20 . 1 1 37 37 THR CA C 37 66.000 66.000 67.038 -1.038 18222
8662 1 20 . 1 1 37 37 THR CB C 37 68.270 68.270 68.782 -0.512 18222
8663 1 20 . 1 1 37 37 THR H H 37 8.520 8.520 8.563 -0.043 18222
8664 1 20 . 1 1 38 38 PHE N N 38 123.090 123.090 118.988 4.102 18222
8665 1 20 . 1 1 38 38 PHE HA H 38 4.360 4.360 4.269 0.091 18222
8666 1 20 . 1 1 38 38 PHE CA C 38 61.140 61.140 60.970 0.170 18222
8667 1 20 . 1 1 38 38 PHE CB C 38 41.200 41.200 39.577 1.623 18222
8668 1 20 . 1 1 38 38 PHE H H 38 8.010 8.010 7.991 0.019 18222
8669 1 20 . 1 1 39 39 VAL N N 39 117.280 117.280 117.591 -0.311 18222
8670 1 20 . 1 1 39 39 VAL HA H 39 4.210 4.210 3.767 0.443 18222
8671 1 20 . 1 1 39 39 VAL CA C 39 66.000 66.000 65.006 0.994 18222
8672 1 20 . 1 1 39 39 VAL CB C 39 30.860 30.860 31.031 -0.171 18222
8673 1 20 . 1 1 39 39 VAL H H 39 8.530 8.530 8.137 0.393 18222
8674 1 20 . 1 1 40 40 THR N N 40 109.470 109.470 115.170 -5.700 18222
8675 1 20 . 1 1 40 40 THR HA H 40 4.060 4.060 4.260 -0.200 18222
8676 1 20 . 1 1 40 40 THR CA C 40 63.390 63.390 64.990 -1.599 18222
8677 1 20 . 1 1 40 40 THR CB C 40 68.650 68.650 68.255 0.395 18222
8678 1 20 . 1 1 40 40 THR H H 40 7.700 7.700 8.032 -0.332 18222
8679 1 20 . 1 1 41 41 GLY N N 41 110.770 110.770 109.156 1.614 18222
8680 1 20 . 1 1 41 41 GLY CA C 41 45.580 45.580 45.858 -0.278 18222
8681 1 20 . 1 1 41 41 GLY H H 41 7.700 7.700 7.322 0.378 18222
8682 1 20 . 1 1 42 42 THR N N 42 114.520 114.520 117.756 -3.236 18222
8683 1 20 . 1 1 42 42 THR CA C 42 63.300 63.300 61.861 1.440 18222
8684 1 20 . 1 1 42 42 THR CB C 42 69.490 69.490 67.531 1.959 18222
8685 1 20 . 1 1 42 42 THR H H 42 7.720 7.720 7.400 0.320 18222
8686 1 20 . 1 1 43 43 GLY N N 43 109.540 109.540 109.857 -0.317 18222
8687 1 20 . 1 1 43 43 GLY CA C 43 46.250 46.250 46.301 -0.051 18222
8688 1 20 . 1 1 43 43 GLY H H 43 8.110 8.110 7.624 0.486 18222
8689 1 20 . 1 1 44 44 MET N N 44 120.240 120.240 121.365 -1.125 18222
8690 1 20 . 1 1 44 44 MET HA H 44 4.100 4.100 3.947 0.153 18222
8691 1 20 . 1 1 44 44 MET CA C 44 57.700 57.700 59.230 -1.530 18222
8692 1 20 . 1 1 44 44 MET CB C 44 32.030 32.030 32.443 -0.413 18222
8693 1 20 . 1 1 44 44 MET H H 44 7.730 7.730 8.035 -0.305 18222
8694 1 20 . 1 1 45 45 ALA N N 45 121.560 121.560 120.956 0.604 18222
8695 1 20 . 1 1 45 45 ALA CA C 45 54.440 54.440 55.062 -0.622 18222
8696 1 20 . 1 1 45 45 ALA CB C 45 17.400 17.400 17.800 -0.400 18222
8697 1 20 . 1 1 45 45 ALA H H 45 7.950 7.950 7.839 0.111 18222
8698 1 20 . 1 1 46 46 PHE N N 46 118.260 118.260 118.660 -0.400 18222
8699 1 20 . 1 1 46 46 PHE HA H 46 3.930 3.930 4.364 -0.434 18222
8700 1 20 . 1 1 46 46 PHE CA C 46 59.820 59.820 60.536 -0.716 18222
8701 1 20 . 1 1 46 46 PHE CB C 46 38.260 38.260 38.463 -0.203 18222
8702 1 20 . 1 1 46 46 PHE H H 46 7.860 7.860 8.294 -0.434 18222
8703 1 20 . 1 1 47 47 GLY N N 47 107.300 107.300 108.982 -1.682 18222
8704 1 20 . 1 1 47 47 GLY CA C 47 46.560 46.560 47.312 -0.752 18222
8705 1 20 . 1 1 47 47 GLY H H 47 8.200 8.200 8.698 -0.498 18222
8706 1 20 . 1 1 48 48 LEU N N 48 121.920 121.920 122.935 -1.015 18222
8707 1 20 . 1 1 48 48 LEU HA H 48 4.040 4.040 3.812 0.229 18222
8708 1 20 . 1 1 48 48 LEU CA C 48 57.580 57.580 58.556 -0.976 18222
8709 1 20 . 1 1 48 48 LEU CB C 48 40.790 40.790 41.831 -1.041 18222
8710 1 20 . 1 1 48 48 LEU H H 48 8.180 8.180 8.196 -0.016 18222
8711 1 20 . 1 1 49 49 GLN N N 49 118.270 118.270 118.605 -0.335 18222
8712 1 20 . 1 1 49 49 GLN HA H 49 3.830 3.830 3.852 -0.022 18222
8713 1 20 . 1 1 49 49 GLN CA C 49 58.880 58.880 59.142 -0.262 18222
8714 1 20 . 1 1 49 49 GLN CB C 49 27.240 27.240 28.681 -1.441 18222
8715 1 20 . 1 1 49 49 GLN H H 49 8.080 8.080 8.032 0.048 18222
8716 1 20 . 1 1 50 50 MET N N 50 117.630 117.630 119.369 -1.739 18222
8717 1 20 . 1 1 50 50 MET HA H 50 4.010 4.010 4.178 -0.168 18222
8718 1 20 . 1 1 50 50 MET CA C 50 57.730 57.730 58.070 -0.340 18222
8719 1 20 . 1 1 50 50 MET CB C 50 27.160 27.160 32.377 -5.217 18222
8720 1 20 . 1 1 50 50 MET H H 50 7.880 7.880 8.412 -0.531 18222
8721 1 20 . 1 1 51 51 PHE N N 51 119.550 119.550 118.329 1.221 18222
8722 1 20 . 1 1 51 51 PHE CA C 51 60.850 60.850 62.232 -1.382 18222
8723 1 20 . 1 1 51 51 PHE CB C 51 38.720 38.720 38.688 0.032 18222
8724 1 20 . 1 1 51 51 PHE H H 51 7.890 7.890 8.151 -0.261 18222
8725 1 20 . 1 1 52 52 ILE N N 52 117.950 117.950 116.514 1.436 18222
8726 1 20 . 1 1 52 52 ILE HA H 52 4.050 4.050 3.793 0.257 18222
8727 1 20 . 1 1 52 52 ILE CA C 52 63.560 63.560 64.157 -0.598 18222
8728 1 20 . 1 1 52 52 ILE CB C 52 36.810 36.810 38.074 -1.264 18222
8729 1 20 . 1 1 52 52 ILE H H 52 8.110 8.110 7.956 0.154 18222
8730 1 20 . 1 1 53 53 GLN N N 53 117.360 117.360 119.274 -1.914 18222
8731 1 20 . 1 1 53 53 GLN CA C 53 57.200 57.200 58.695 -1.495 18222
8732 1 20 . 1 1 53 53 GLN CB C 53 27.870 27.870 28.436 -0.566 18222
8733 1 20 . 1 1 53 53 GLN H H 53 7.930 7.930 8.153 -0.223 18222
8734 1 20 . 1 1 54 54 ARG N N 54 116.840 116.840 118.695 -1.855 18222
8735 1 20 . 1 1 54 54 ARG HA H 54 3.950 3.950 4.228 -0.278 18222
8736 1 20 . 1 1 54 54 ARG CA C 54 56.480 56.480 57.737 -1.258 18222
8737 1 20 . 1 1 54 54 ARG CB C 54 28.970 28.970 29.910 -0.940 18222
8738 1 20 . 1 1 54 54 ARG H H 54 7.540 7.540 7.792 -0.252 18222
8739 1 20 . 1 1 55 55 LYS N N 55 117.900 117.900 117.257 0.643 18222
8740 1 20 . 1 1 55 55 LYS HA H 55 4.080 4.080 4.268 -0.188 18222
8741 1 20 . 1 1 55 55 LYS CA C 55 55.030 55.030 57.371 -2.341 18222
8742 1 20 . 1 1 55 55 LYS CB C 55 32.010 32.010 32.752 -0.742 18222
8743 1 20 . 1 1 55 55 LYS H H 55 7.660 7.660 7.356 0.304 18222
8744 1 20 . 1 1 56 56 PHE N N 56 121.060 121.060 121.507 -0.447 18222
8745 1 20 . 1 1 56 56 PHE CA C 56 55.190 55.190 54.819 0.371 18222
8746 1 20 . 1 1 56 56 PHE CB C 56 38.970 38.970 39.915 -0.945 18222
8747 1 20 . 1 1 56 56 PHE H H 56 8.080 8.080 7.878 0.202 18222
8748 1 20 . 1 1 57 57 PRO CA C 57 62.390 62.390 63.260 -0.870 18222
8749 1 20 . 1 1 57 57 PRO CB C 57 30.580 30.580 30.116 0.463 18222
8750 1 20 . 1 1 58 58 TYR N N 58 120.240 120.240 124.798 -4.558 18222
8751 1 20 . 1 1 58 58 TYR CA C 58 55.770 55.770 55.283 0.486 18222
8752 1 20 . 1 1 58 58 TYR CB C 58 40.220 40.220 41.211 -0.990 18222
8753 1 20 . 1 1 58 58 TYR H H 58 7.700 7.700 7.946 -0.246 18222
8754 1 20 . 1 1 59 59 PRO CA C 59 62.130 62.130 63.758 -1.628 18222
8755 1 20 . 1 1 59 59 PRO CB C 59 33.340 33.340 32.085 1.255 18222
8756 1 20 . 1 1 60 60 LEU N N 60 122.210 122.210 121.589 0.621 18222
8757 1 20 . 1 1 60 60 LEU CA C 60 54.250 54.250 54.527 -0.277 18222
8758 1 20 . 1 1 60 60 LEU CB C 60 41.470 41.470 42.722 -1.252 18222
8759 1 20 . 1 1 60 60 LEU H H 60 7.880 7.880 7.866 0.014 18222
8760 1 20 . 1 1 61 61 GLN N N 61 122.470 122.470 121.375 1.095 18222
8761 1 20 . 1 1 61 61 GLN CA C 61 54.170 54.170 55.344 -1.174 18222
8762 1 20 . 1 1 61 61 GLN H H 61 7.970 7.970 8.289 -0.319 18222
8763 1 20 . 1 1 62 62 TRP N N 62 124.590 124.590 122.998 1.592 18222
8764 1 20 . 1 1 62 62 TRP CA C 62 59.830 59.830 59.431 0.399 18222
8765 1 20 . 1 1 62 62 TRP CB C 62 28.800 28.800 29.142 -0.342 18222
8766 1 20 . 1 1 62 62 TRP H H 62 8.240 8.240 8.764 -0.524 18222
8767 1 20 . 1 1 63 63 SER N N 63 113.320 113.320 115.631 -2.311 18222
8768 1 20 . 1 1 63 63 SER CA C 63 61.100 61.100 60.006 1.094 18222
8769 1 20 . 1 1 63 63 SER H H 63 8.410 8.410 7.379 1.031 18222
8770 1 20 . 1 1 64 64 LEU N N 64 123.230 123.230 121.842 1.388 18222
8771 1 20 . 1 1 64 64 LEU CA C 64 56.880 56.880 57.180 -0.300 18222
8772 1 20 . 1 1 64 64 LEU CB C 64 40.830 40.830 40.978 -0.148 18222
8773 1 20 . 1 1 64 64 LEU H H 64 7.230 7.230 7.964 -0.734 18222
8774 1 20 . 1 1 65 65 LEU N N 65 119.400 119.400 121.110 -1.710 18222
8775 1 20 . 1 1 65 65 LEU HA H 65 3.890 3.890 4.107 -0.217 18222
8776 1 20 . 1 1 65 65 LEU CA C 65 57.580 57.580 58.572 -0.992 18222
8777 1 20 . 1 1 65 65 LEU CB C 65 40.710 40.710 42.144 -1.434 18222
8778 1 20 . 1 1 65 65 LEU H H 65 7.510 7.510 8.395 -0.885 18222
8779 1 20 . 1 1 66 66 VAL N N 66 116.950 116.950 118.569 -1.619 18222
8780 1 20 . 1 1 66 66 VAL HA H 66 3.960 3.960 3.796 0.164 18222
8781 1 20 . 1 1 66 66 VAL CA C 66 66.260 66.260 65.571 0.689 18222
8782 1 20 . 1 1 66 66 VAL CB C 66 30.570 30.570 31.853 -1.283 18222
8783 1 20 . 1 1 66 66 VAL H H 66 7.950 7.950 8.573 -0.623 18222
8784 1 20 . 1 1 67 67 ALA N N 67 120.650 120.650 122.443 -1.793 18222
8785 1 20 . 1 1 67 67 ALA HA H 67 4.000 4.000 4.096 -0.096 18222
8786 1 20 . 1 1 67 67 ALA CA C 67 54.780 54.780 55.309 -0.529 18222
8787 1 20 . 1 1 67 67 ALA CB C 67 17.440 17.440 18.254 -0.814 18222
8788 1 20 . 1 1 67 67 ALA H H 67 7.450 7.450 8.209 -0.759 18222
8789 1 20 . 1 1 68 68 VAL N N 68 118.440 118.440 119.038 -0.598 18222
8790 1 20 . 1 1 68 68 VAL HA H 68 3.750 3.750 3.721 0.029 18222
8791 1 20 . 1 1 68 68 VAL CA C 68 65.250 65.250 65.805 -0.555 18222
8792 1 20 . 1 1 68 68 VAL CB C 68 30.850 30.850 31.724 -0.874 18222
8793 1 20 . 1 1 68 68 VAL H H 68 7.960 7.960 7.773 0.187 18222
8794 1 20 . 1 1 69 69 VAL N N 69 120.800 120.800 120.793 0.007 18222
8795 1 20 . 1 1 69 69 VAL HA H 69 4.220 4.220 3.641 0.579 18222
8796 1 20 . 1 1 69 69 VAL CA C 69 66.020 66.020 67.796 -1.776 18222
8797 1 20 . 1 1 69 69 VAL CB C 69 30.850 30.850 31.375 -0.525 18222
8798 1 20 . 1 1 69 69 VAL H H 69 8.080 8.080 8.565 -0.485 18222
8799 1 20 . 1 1 70 70 ALA N N 70 121.740 121.740 120.726 1.014 18222
8800 1 20 . 1 1 70 70 ALA HA H 70 3.920 3.920 4.215 -0.295 18222
8801 1 20 . 1 1 70 70 ALA CA C 70 54.920 54.920 55.310 -0.390 18222
8802 1 20 . 1 1 70 70 ALA CB C 70 17.620 17.620 17.868 -0.248 18222
8803 1 20 . 1 1 70 70 ALA H H 70 8.660 8.660 8.543 0.117 18222
8804 1 20 . 1 1 71 71 GLY N N 71 103.450 103.450 107.718 -4.268 18222
8805 1 20 . 1 1 71 71 GLY CA C 71 46.300 46.300 47.084 -0.784 18222
8806 1 20 . 1 1 71 71 GLY H H 71 8.010 8.010 7.987 0.023 18222
8807 1 20 . 1 1 72 72 SER N N 72 118.160 118.160 118.303 -0.143 18222
8808 1 20 . 1 1 72 72 SER CA C 72 61.260 61.260 62.281 -1.021 18222
8809 1 20 . 1 1 72 72 SER CB C 72 62.870 62.870 63.336 -0.466 18222
8810 1 20 . 1 1 72 72 SER H H 72 7.870 7.870 8.288 -0.418 18222
8811 1 20 . 1 1 73 73 VAL N N 73 121.340 121.340 122.409 -1.069 18222
8812 1 20 . 1 1 73 73 VAL CA C 73 65.750 65.750 66.516 -0.766 18222
8813 1 20 . 1 1 73 73 VAL CB C 73 30.740 30.740 31.450 -0.709 18222
8814 1 20 . 1 1 73 73 VAL H H 73 8.050 8.050 8.441 -0.391 18222
8815 1 20 . 1 1 74 74 VAL N N 74 118.680 118.680 118.902 -0.222 18222
8816 1 20 . 1 1 74 74 VAL CA C 74 65.770 65.770 67.142 -1.372 18222
8817 1 20 . 1 1 74 74 VAL CB C 74 30.740 30.740 31.648 -0.908 18222
8818 1 20 . 1 1 74 74 VAL H H 74 7.880 7.880 8.762 -0.882 18222
8819 1 20 . 1 1 75 75 SER N N 75 114.750 114.750 116.643 -1.893 18222
8820 1 20 . 1 1 75 75 SER HA H 75 4.100 4.100 4.176 -0.076 18222
8821 1 20 . 1 1 75 75 SER CA C 75 60.870 60.870 61.568 -0.698 18222
8822 1 20 . 1 1 75 75 SER CB C 75 62.340 62.340 63.029 -0.689 18222
8823 1 20 . 1 1 75 75 SER H H 75 7.870 7.870 8.121 -0.251 18222
8824 1 20 . 1 1 76 76 TYR N N 76 121.110 121.110 122.643 -1.533 18222
8825 1 20 . 1 1 76 76 TYR CA C 76 60.050 60.050 60.768 -0.718 18222
8826 1 20 . 1 1 76 76 TYR CB C 76 37.980 37.980 38.608 -0.628 18222
8827 1 20 . 1 1 76 76 TYR H H 76 7.860 7.860 8.764 -0.904 18222
8828 1 20 . 1 1 77 77 GLY N N 77 107.300 107.300 106.975 0.325 18222
8829 1 20 . 1 1 77 77 GLY CA C 77 46.560 46.560 47.453 -0.893 18222
8830 1 20 . 1 1 77 77 GLY H H 77 8.200 8.200 8.878 -0.678 18222
8831 1 20 . 1 1 78 78 VAL N N 78 119.470 119.470 121.618 -2.148 18222
8832 1 20 . 1 1 78 78 VAL HA H 78 4.170 4.170 3.889 0.281 18222
8833 1 20 . 1 1 78 78 VAL CA C 78 64.650 64.650 64.915 -0.264 18222
8834 1 20 . 1 1 78 78 VAL H H 78 8.140 8.140 8.751 -0.611 18222
8835 1 20 . 1 1 79 79 THR N N 79 112.100 112.100 116.968 -4.868 18222
8836 1 20 . 1 1 79 79 THR CA C 79 63.460 63.460 66.514 -3.054 18222
8837 1 20 . 1 1 79 79 THR CB C 79 68.650 68.650 68.384 0.266 18222
8838 1 20 . 1 1 79 79 THR H H 79 7.640 7.640 7.955 -0.315 18222
8839 1 20 . 1 1 80 80 ARG N N 80 120.770 120.770 122.118 -1.348 18222
8840 1 20 . 1 1 80 80 ARG HA H 80 4.160 4.160 4.119 0.041 18222
8841 1 20 . 1 1 80 80 ARG CA C 80 56.790 56.790 59.785 -2.995 18222
8842 1 20 . 1 1 80 80 ARG CB C 80 29.430 29.430 30.451 -1.021 18222
8843 1 20 . 1 1 80 80 ARG H H 80 7.680 7.680 8.291 -0.611 18222
8844 1 20 . 1 1 81 81 VAL N N 81 118.370 118.370 119.177 -0.807 18222
8845 1 20 . 1 1 81 81 VAL HA H 81 3.920 3.920 3.708 0.212 18222
8846 1 20 . 1 1 81 81 VAL CA C 81 63.340 63.340 67.055 -3.715 18222
8847 1 20 . 1 1 81 81 VAL CB C 81 31.260 31.260 31.758 -0.497 18222
8848 1 20 . 1 1 81 81 VAL H H 81 7.730 7.730 8.404 -0.674 18222
8849 1 20 . 1 1 82 82 GLU N N 82 120.620 120.620 119.011 1.609 18222
8850 1 20 . 1 1 82 82 GLU CA C 82 56.320 56.320 59.149 -2.829 18222
8851 1 20 . 1 1 82 82 GLU CB C 82 27.930 27.930 28.573 -0.643 18222
8852 1 20 . 1 1 82 82 GLU H H 82 7.920 7.920 8.616 -0.696 18222
8853 1 20 . 1 1 83 83 SER N N 83 116.240 116.240 116.364 -0.124 18222
8854 1 20 . 1 1 83 83 SER CA C 83 59.250 59.250 61.377 -2.127 18222
8855 1 20 . 1 1 83 83 SER CB C 83 63.160 63.160 62.967 0.193 18222
8856 1 20 . 1 1 83 83 SER H H 83 7.960 7.960 7.905 0.055 18222
8857 1 20 . 1 1 84 84 GLU N N 84 123.280 123.280 121.976 1.304 18222
8858 1 20 . 1 1 84 84 GLU HA H 84 4.080 4.080 4.128 -0.048 18222
8859 1 20 . 1 1 84 84 GLU CA C 84 57.860 57.860 59.647 -1.787 18222
8860 1 20 . 1 1 84 84 GLU CB C 84 28.190 28.190 29.740 -1.550 18222
8861 1 20 . 1 1 84 84 GLU H H 84 8.470 8.470 8.085 0.385 18222
8862 1 20 . 1 1 85 85 LYS N N 85 118.650 118.650 119.292 -0.642 18222
8863 1 20 . 1 1 85 85 LYS HA H 85 4.100 4.100 3.997 0.103 18222
8864 1 20 . 1 1 85 85 LYS CA C 85 57.780 57.780 59.470 -1.690 18222
8865 1 20 . 1 1 85 85 LYS CB C 85 31.380 31.380 32.146 -0.766 18222
8866 1 20 . 1 1 85 85 LYS H H 85 7.940 7.940 8.221 -0.281 18222
8867 1 20 . 1 1 86 86 CYS N N 86 117.070 117.070 118.352 -1.282 18222
8868 1 20 . 1 1 86 86 CYS CA C 86 60.910 60.910 62.486 -1.576 18222
8869 1 20 . 1 1 86 86 CYS CB C 86 26.740 26.740 27.635 -0.895 18222
8870 1 20 . 1 1 86 86 CYS H H 86 7.840 7.840 8.233 -0.393 18222
8871 1 20 . 1 1 87 87 ASN N N 87 119.370 119.370 119.067 0.303 18222
8872 1 20 . 1 1 87 87 ASN HA H 87 4.130 4.130 4.627 -0.497 18222
8873 1 20 . 1 1 87 87 ASN CA C 87 55.750 55.750 56.663 -0.913 18222
8874 1 20 . 1 1 87 87 ASN CB C 87 38.050 38.050 38.214 -0.164 18222
8875 1 20 . 1 1 87 87 ASN H H 87 8.110 8.110 8.152 -0.042 18222
8876 1 20 . 1 1 88 88 ASN N N 88 117.570 117.570 119.129 -1.559 18222
8877 1 20 . 1 1 88 88 ASN HA H 88 4.280 4.280 4.679 -0.399 18222
8878 1 20 . 1 1 88 88 ASN CA C 88 55.190 55.190 55.944 -0.754 18222
8879 1 20 . 1 1 88 88 ASN CB C 88 37.400 37.400 38.239 -0.839 18222
8880 1 20 . 1 1 88 88 ASN H H 88 8.280 8.280 8.338 -0.058 18222
8881 1 20 . 1 1 89 89 LEU N N 89 121.940 121.940 122.443 -0.503 18222
8882 1 20 . 1 1 89 89 LEU HA H 89 4.070 4.070 3.979 0.091 18222
8883 1 20 . 1 1 89 89 LEU CA C 89 57.580 57.580 58.931 -1.351 18222
8884 1 20 . 1 1 89 89 LEU CB C 89 40.490 40.490 41.237 -0.747 18222
8885 1 20 . 1 1 89 89 LEU H H 89 7.790 7.790 8.434 -0.644 18222
8886 1 20 . 1 1 90 90 TRP N N 90 119.220 119.220 120.081 -0.861 18222
8887 1 20 . 1 1 90 90 TRP CA C 90 59.120 59.120 60.928 -1.808 18222
8888 1 20 . 1 1 90 90 TRP CB C 90 28.800 28.800 28.916 -0.116 18222
8889 1 20 . 1 1 90 90 TRP H H 90 7.850 7.850 8.734 -0.884 18222
8890 1 20 . 1 1 91 91 LEU N N 91 117.870 117.870 120.677 -2.807 18222
8891 1 20 . 1 1 91 91 LEU CA C 91 57.300 57.300 59.063 -1.763 18222
8892 1 20 . 1 1 91 91 LEU CB C 91 40.610 40.610 41.869 -1.259 18222
8893 1 20 . 1 1 91 91 LEU H H 91 7.920 7.920 8.253 -0.333 18222
8894 1 20 . 1 1 92 92 PHE N N 92 121.280 121.280 117.493 3.787 18222
8895 1 20 . 1 1 92 92 PHE CA C 92 60.390 60.390 61.768 -1.378 18222
8896 1 20 . 1 1 92 92 PHE CB C 92 37.980 37.980 39.002 -1.022 18222
8897 1 20 . 1 1 92 92 PHE H H 92 7.860 7.860 8.547 -0.687 18222
8898 1 20 . 1 1 93 93 LEU N N 93 119.860 119.860 121.030 -1.170 18222
8899 1 20 . 1 1 93 93 LEU CA C 93 56.860 56.860 58.070 -1.210 18222
8900 1 20 . 1 1 93 93 LEU CB C 93 40.550 40.550 42.196 -1.646 18222
8901 1 20 . 1 1 93 93 LEU H H 93 7.980 7.980 8.610 -0.630 18222
8902 1 20 . 1 1 94 94 GLU N N 94 114.660 114.660 116.340 -1.680 18222
8903 1 20 . 1 1 94 94 GLU HA H 94 3.810 3.810 4.239 -0.429 18222
8904 1 20 . 1 1 94 94 GLU CA C 94 57.210 57.210 59.085 -1.875 18222
8905 1 20 . 1 1 94 94 GLU CB C 94 28.470 28.470 30.061 -1.591 18222
8906 1 20 . 1 1 94 94 GLU H H 94 7.890 7.890 8.244 -0.354 18222
8907 1 20 . 1 1 95 95 THR N N 95 108.260 108.260 109.570 -1.310 18222
8908 1 20 . 1 1 95 95 THR CA C 95 62.150 62.150 62.044 0.106 18222
8909 1 20 . 1 1 95 95 THR CB C 95 70.810 70.810 70.486 0.324 18222
8910 1 20 . 1 1 95 95 THR H H 95 7.690 7.690 7.661 0.029 18222
8911 1 20 . 1 1 96 96 GLY N N 96 112.220 112.220 111.108 1.112 18222
8912 1 20 . 1 1 96 96 GLY CA C 96 45.410 45.410 45.207 0.203 18222
8913 1 20 . 1 1 96 96 GLY H H 96 8.240 8.240 8.178 0.062 18222
8914 1 20 . 1 1 97 97 GLN N N 97 117.950 117.950 119.423 -1.473 18222
8915 1 20 . 1 1 97 97 GLN HA H 97 4.200 4.200 4.300 -0.100 18222
8916 1 20 . 1 1 97 97 GLN CA C 97 54.430 54.430 56.120 -1.690 18222
8917 1 20 . 1 1 97 97 GLN CB C 97 29.910 29.910 29.892 0.018 18222
8918 1 20 . 1 1 97 97 GLN H H 97 7.640 7.640 7.874 -0.234 18222
8919 1 20 . 1 1 98 98 LEU N N 98 123.810 123.810 125.972 -2.162 18222
8920 1 20 . 1 1 98 98 LEU HA H 98 4.360 4.360 4.451 -0.091 18222
8921 1 20 . 1 1 98 98 LEU CA C 98 52.650 52.650 54.048 -1.398 18222
8922 1 20 . 1 1 98 98 LEU CB C 98 40.460 40.460 41.974 -1.514 18222
8923 1 20 . 1 1 98 98 LEU H H 98 8.270 8.270 8.496 -0.226 18222
8924 1 20 . 1 1 99 99 PRO CA C 99 63.180 63.180 61.964 1.216 18222
8925 1 20 . 1 1 99 99 PRO CB C 99 30.840 30.840 32.311 -1.471 18222
8926 1 20 . 1 1 100 100 LYS N N 100 120.630 120.630 120.937 -0.307 18222
8927 1 20 . 1 1 100 100 LYS CA C 100 55.730 55.730 57.232 -1.502 18222
8928 1 20 . 1 1 100 100 LYS CB C 100 32.280 32.280 32.532 -0.252 18222
8929 1 20 . 1 1 100 100 LYS H H 100 8.090 8.090 8.107 -0.017 18222
8930 1 20 . 1 1 101 101 ASP N N 101 120.920 120.920 120.288 0.632 18222
8931 1 20 . 1 1 101 101 ASP HA H 101 4.190 4.190 4.276 -0.086 18222
8932 1 20 . 1 1 101 101 ASP CA C 101 54.000 54.000 54.752 -0.752 18222
8933 1 20 . 1 1 101 101 ASP CB C 101 40.330 40.330 41.175 -0.845 18222
8934 1 20 . 1 1 101 101 ASP H H 101 8.190 8.190 8.276 -0.086 18222
8935 1 20 . 1 1 102 102 ARG N N 102 122.210 122.210 119.442 2.768 18222
8936 1 20 . 1 1 102 102 ARG CA C 102 55.590 55.590 55.343 0.247 18222
8937 1 20 . 1 1 102 102 ARG CB C 102 29.630 29.630 32.223 -2.593 18222
8938 1 20 . 1 1 102 102 ARG H H 102 8.130 8.130 8.430 -0.300 18222
8939 1 20 . 1 1 103 103 SER N N 103 117.230 117.230 115.120 2.110 18222
8940 1 20 . 1 1 103 103 SER HA H 103 4.280 4.280 4.280 0.000 18222
8941 1 20 . 1 1 103 103 SER CA C 103 58.470 58.470 59.133 -0.663 18222
8942 1 20 . 1 1 103 103 SER CB C 103 63.080 63.080 63.546 -0.466 18222
8943 1 20 . 1 1 103 103 SER H H 103 8.290 8.290 8.506 -0.216 18222
8944 1 20 . 1 1 104 104 THR N N 104 115.430 115.430 115.410 0.020 18222
8945 1 20 . 1 1 104 104 THR CA C 104 61.570 61.570 63.273 -1.703 18222
8946 1 20 . 1 1 104 104 THR CB C 104 69.030 69.030 69.124 -0.094 18222
8947 1 20 . 1 1 104 104 THR H H 104 8.020 8.020 8.121 -0.101 18222
8948 1 20 . 1 1 105 105 ASP N N 105 122.780 122.780 124.747 -1.967 18222
8949 1 20 . 1 1 105 105 ASP CA C 105 54.210 54.210 54.021 0.189 18222
8950 1 20 . 1 1 105 105 ASP CB C 105 40.380 40.380 41.810 -1.430 18222
8951 1 20 . 1 1 105 105 ASP H H 105 8.120 8.120 8.264 -0.144 18222
8952 1 20 . 1 1 106 106 GLN N N 106 120.960 120.960 122.763 -1.803 18222
8953 1 20 . 1 1 106 106 GLN CA C 106 55.420 55.420 55.831 -0.411 18222
8954 1 20 . 1 1 106 106 GLN CB C 106 28.310 28.310 29.727 -1.417 18222
8955 1 20 . 1 1 106 106 GLN H H 106 8.140 8.140 8.537 -0.397 18222
8956 1 20 . 1 1 107 107 ARG N N 107 123.010 123.010 120.946 2.064 18222
8957 1 20 . 1 1 107 107 ARG HA H 107 4.210 4.210 4.499 -0.289 18222
8958 1 20 . 1 1 107 107 ARG CA C 107 55.560 55.560 55.944 -0.384 18222
8959 1 20 . 1 1 107 107 ARG CB C 107 29.920 29.920 32.233 -2.313 18222
8960 1 20 . 1 1 107 107 ARG H H 107 8.180 8.180 8.455 -0.275 18222
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 102 1.882 0.489 1.826 18222
2 1 1 "Average Difference" HA 70 0.297 0.011 0.299 18222
3 1 1 "Average Difference" C 0 0.000 0.000 0.000 18222
4 1 1 "Average Difference" CA 106 1.404 0.983 1.007 18222
5 1 1 "Average Difference" CB 88 1.440 0.781 1.217 18222
6 1 1 "Average Difference" HN 102 0.367 0.181 0.320 18222
7 1 2 "Average Difference" N 102 1.821 0.523 1.753 18222
8 1 2 "Average Difference" HA 70 0.250 0.009 0.252 18222
9 1 2 "Average Difference" C 0 0.000 0.000 0.000 18222
10 1 2 "Average Difference" CA 106 1.277 0.872 0.937 18222
11 1 2 "Average Difference" CB 88 1.448 0.725 1.260 18222
12 1 2 "Average Difference" HN 102 0.371 0.163 0.335 18222
13 1 3 "Average Difference" N 102 1.737 0.542 1.658 18222
14 1 3 "Average Difference" HA 70 0.282 0.005 0.284 18222
15 1 3 "Average Difference" C 0 0.000 0.000 0.000 18222
16 1 3 "Average Difference" CA 106 1.398 0.934 1.044 18222
17 1 3 "Average Difference" CB 88 1.436 0.720 1.249 18222
18 1 3 "Average Difference" HN 102 0.400 0.222 0.334 18222
19 1 4 "Average Difference" N 102 1.880 0.345 1.858 18222
20 1 4 "Average Difference" HA 70 0.296 -0.012 0.298 18222
21 1 4 "Average Difference" C 0 0.000 0.000 0.000 18222
22 1 4 "Average Difference" CA 106 1.423 0.906 1.102 18222
23 1 4 "Average Difference" CB 88 1.480 0.793 1.257 18222
24 1 4 "Average Difference" HN 102 0.411 0.210 0.355 18222
25 1 5 "Average Difference" N 102 1.846 0.523 1.779 18222
26 1 5 "Average Difference" HA 70 0.299 0.028 0.300 18222
27 1 5 "Average Difference" C 0 0.000 0.000 0.000 18222
28 1 5 "Average Difference" CA 106 1.384 0.952 1.009 18222
29 1 5 "Average Difference" CB 88 1.440 0.686 1.274 18222
30 1 5 "Average Difference" HN 102 0.365 0.206 0.302 18222
31 1 6 "Average Difference" N 102 1.856 0.459 1.808 18222
32 1 6 "Average Difference" HA 70 0.312 0.015 0.314 18222
33 1 6 "Average Difference" C 0 0.000 0.000 0.000 18222
34 1 6 "Average Difference" CA 106 1.352 0.961 0.956 18222
35 1 6 "Average Difference" CB 88 1.446 0.660 1.294 18222
36 1 6 "Average Difference" HN 102 0.397 0.232 0.324 18222
37 1 7 "Average Difference" N 102 1.857 0.549 1.783 18222
38 1 7 "Average Difference" HA 70 0.279 -0.002 0.281 18222
39 1 7 "Average Difference" C 0 0.000 0.000 0.000 18222
40 1 7 "Average Difference" CA 106 1.370 0.918 1.021 18222
41 1 7 "Average Difference" CB 88 1.469 0.715 1.290 18222
42 1 7 "Average Difference" HN 102 0.396 0.233 0.322 18222
43 1 8 "Average Difference" N 102 2.004 0.429 1.967 18222
44 1 8 "Average Difference" HA 70 0.272 0.001 0.274 18222
45 1 8 "Average Difference" C 0 0.000 0.000 0.000 18222
46 1 8 "Average Difference" CA 106 1.293 0.845 0.983 18222
47 1 8 "Average Difference" CB 88 1.441 0.750 1.238 18222
48 1 8 "Average Difference" HN 102 0.387 0.162 0.353 18222
49 1 9 "Average Difference" N 102 1.881 0.582 1.797 18222
50 1 9 "Average Difference" HA 70 0.307 0.028 0.308 18222
51 1 9 "Average Difference" C 0 0.000 0.000 0.000 18222
52 1 9 "Average Difference" CA 106 1.351 0.922 0.992 18222
53 1 9 "Average Difference" CB 88 1.485 0.710 1.312 18222
54 1 9 "Average Difference" HN 102 0.404 0.237 0.328 18222
55 1 10 "Average Difference" N 102 2.021 0.485 1.972 18222
56 1 10 "Average Difference" HA 70 0.298 0.001 0.300 18222
57 1 10 "Average Difference" C 0 0.000 0.000 0.000 18222
58 1 10 "Average Difference" CA 106 1.350 0.864 1.042 18222
59 1 10 "Average Difference" CB 88 1.422 0.703 1.243 18222
60 1 10 "Average Difference" HN 102 0.369 0.193 0.316 18222
61 1 11 "Average Difference" N 102 1.942 0.681 1.828 18222
62 1 11 "Average Difference" HA 70 0.258 0.012 0.260 18222
63 1 11 "Average Difference" C 0 0.000 0.000 0.000 18222
64 1 11 "Average Difference" CA 106 1.316 0.867 0.995 18222
65 1 11 "Average Difference" CB 88 1.434 0.702 1.258 18222
66 1 11 "Average Difference" HN 102 0.382 0.195 0.331 18222
67 1 12 "Average Difference" N 102 1.870 0.302 1.854 18222
68 1 12 "Average Difference" HA 70 0.271 0.017 0.272 18222
69 1 12 "Average Difference" C 0 0.000 0.000 0.000 18222
70 1 12 "Average Difference" CA 106 1.410 1.005 0.993 18222
71 1 12 "Average Difference" CB 88 1.466 0.728 1.280 18222
72 1 12 "Average Difference" HN 102 0.397 0.207 0.341 18222
73 1 13 "Average Difference" N 102 1.804 0.424 1.762 18222
74 1 13 "Average Difference" HA 70 0.271 0.021 0.272 18222
75 1 13 "Average Difference" C 0 0.000 0.000 0.000 18222
76 1 13 "Average Difference" CA 106 1.373 0.907 1.036 18222
77 1 13 "Average Difference" CB 88 1.515 0.741 1.329 18222
78 1 13 "Average Difference" HN 102 0.386 0.205 0.329 18222
79 1 14 "Average Difference" N 102 1.722 0.459 1.668 18222
80 1 14 "Average Difference" HA 70 0.294 0.035 0.294 18222
81 1 14 "Average Difference" C 0 0.000 0.000 0.000 18222
82 1 14 "Average Difference" CA 106 1.341 0.870 1.025 18222
83 1 14 "Average Difference" CB 88 1.474 0.707 1.300 18222
84 1 14 "Average Difference" HN 102 0.417 0.232 0.348 18222
85 1 15 "Average Difference" N 102 1.964 0.486 1.912 18222
86 1 15 "Average Difference" HA 70 0.321 0.051 0.320 18222
87 1 15 "Average Difference" C 0 0.000 0.000 0.000 18222
88 1 15 "Average Difference" CA 106 1.332 0.905 0.982 18222
89 1 15 "Average Difference" CB 88 1.464 0.808 1.228 18222
90 1 15 "Average Difference" HN 102 0.392 0.206 0.335 18222
91 1 16 "Average Difference" N 102 1.876 0.543 1.805 18222
92 1 16 "Average Difference" HA 70 0.337 -0.016 0.339 18222
93 1 16 "Average Difference" C 0 0.000 0.000 0.000 18222
94 1 16 "Average Difference" CA 106 1.267 0.836 0.957 18222
95 1 16 "Average Difference" CB 88 1.486 0.744 1.294 18222
96 1 16 "Average Difference" HN 102 0.416 0.221 0.354 18222
97 1 17 "Average Difference" N 102 1.880 0.663 1.768 18222
98 1 17 "Average Difference" HA 70 0.299 0.031 0.300 18222
99 1 17 "Average Difference" C 0 0.000 0.000 0.000 18222
100 1 17 "Average Difference" CA 106 1.304 0.877 0.969 18222
101 1 17 "Average Difference" CB 88 1.452 0.790 1.225 18222
102 1 17 "Average Difference" HN 102 0.395 0.251 0.307 18222
103 1 18 "Average Difference" N 102 1.730 0.601 1.630 18222
104 1 18 "Average Difference" HA 70 0.268 0.010 0.270 18222
105 1 18 "Average Difference" C 0 0.000 0.000 0.000 18222
106 1 18 "Average Difference" CA 106 1.428 0.934 1.086 18222
107 1 18 "Average Difference" CB 88 1.464 0.745 1.267 18222
108 1 18 "Average Difference" HN 102 0.409 0.225 0.343 18222
109 1 19 "Average Difference" N 102 1.660 0.499 1.592 18222
110 1 19 "Average Difference" HA 70 0.272 -0.007 0.274 18222
111 1 19 "Average Difference" C 0 0.000 0.000 0.000 18222
112 1 19 "Average Difference" CA 106 1.410 1.020 0.978 18222
113 1 19 "Average Difference" CB 88 1.464 0.791 1.239 18222
114 1 19 "Average Difference" HN 102 0.358 0.195 0.302 18222
115 1 20 "Average Difference" N 102 1.706 0.517 1.634 18222
116 1 20 "Average Difference" HA 70 0.275 0.029 0.276 18222
117 1 20 "Average Difference" C 0 0.000 0.000 0.000 18222
118 1 20 "Average Difference" CA 106 1.336 0.904 0.988 18222
119 1 20 "Average Difference" CB 88 1.451 0.761 1.243 18222
120 1 20 "Average Difference" HN 102 0.407 0.215 0.347 18222
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 18222
_Entity_delta_chem_shifts.ID 2
_Entity_delta_chem_shifts.Details
;
This saveframe contains the averaged SPARTA chemical shift over all the models used.
;
loop_
_Delta_CS.Atom_chem_shift_ID
_Delta_CS.Entity_delta_chem_shifts_ID
_Delta_CS.Assembly_atom_ID
_Delta_CS.Entity_assembly_ID
_Delta_CS.Entity_ID
_Delta_CS.Comp_index_ID
_Delta_CS.Seq_ID
_Delta_CS.Comp_ID
_Delta_CS.Atom_ID
_Delta_CS.Atom_type
_Delta_CS.Auth_seq_ID
_Delta_CS.Original_CS_value
_Delta_CS.Corrected_CS_value
_Delta_CS.Sparta_CS_value
_Delta_CS.Delta_CS_value
_Delta_CS.Entry_ID
1 1 . 1 1 2 2 VAL N N 2 121.590 121.590 122.899 -1.309 18222
2 1 . 1 1 2 2 VAL CA C 2 61.600 61.600 62.036 -0.436 18222
3 1 . 1 1 2 2 VAL CB C 2 31.900 31.900 32.996 -1.095 18222
4 1 . 1 1 2 2 VAL H H 2 8.010 8.010 8.339 -0.329 18222
5 1 . 1 1 3 3 ASN N N 3 122.520 122.520 123.567 -1.047 18222
6 1 . 1 1 3 3 ASN HA H 3 4.020 4.020 4.719 -0.699 18222
7 1 . 1 1 3 3 ASN CA C 3 52.640 52.640 53.571 -0.931 18222
8 1 . 1 1 3 3 ASN CB C 3 38.330 38.330 39.158 -0.828 18222
9 1 . 1 1 3 3 ASN H H 3 8.360 8.360 8.609 -0.249 18222
10 1 . 1 1 4 4 LEU N N 4 123.830 123.830 120.885 2.945 18222
11 1 . 1 1 4 4 LEU HA H 4 4.220 4.220 4.365 -0.145 18222
12 1 . 1 1 4 4 LEU CA C 4 54.620 54.620 55.619 -0.999 18222
13 1 . 1 1 4 4 LEU CB C 4 41.680 41.680 42.540 -0.860 18222
14 1 . 1 1 4 4 LEU H H 4 8.220 8.220 8.263 -0.043 18222
15 1 . 1 1 5 5 GLY N N 5 106.810 106.810 108.470 -1.660 18222
16 1 . 1 1 5 5 GLY CA C 5 45.800 45.800 45.064 0.736 18222
17 1 . 1 1 5 5 GLY H H 5 8.030 8.030 8.071 -0.041 18222
18 1 . 1 1 6 6 LEU N N 6 120.820 120.820 121.882 -1.062 18222
19 1 . 1 1 6 6 LEU HA H 6 4.050 4.050 4.368 -0.318 18222
20 1 . 1 1 6 6 LEU CA C 6 55.990 55.990 56.727 -0.737 18222
21 1 . 1 1 6 6 LEU CB C 6 40.800 40.800 41.986 -1.186 18222
22 1 . 1 1 6 6 LEU H H 6 8.030 8.030 8.298 -0.268 18222
23 1 . 1 1 7 7 SER N N 7 115.540 115.540 115.454 0.086 18222
24 1 . 1 1 7 7 SER HA H 7 4.100 4.100 4.161 -0.061 18222
25 1 . 1 1 7 7 SER CA C 7 60.580 60.580 61.701 -1.121 18222
26 1 . 1 1 7 7 SER CB C 7 62.060 62.060 62.666 -0.606 18222
27 1 . 1 1 7 7 SER H H 7 8.360 8.360 8.409 -0.049 18222
28 1 . 1 1 8 8 ARG N N 8 120.690 120.690 121.234 -0.544 18222
29 1 . 1 1 8 8 ARG HA H 8 4.160 4.160 4.096 0.064 18222
30 1 . 1 1 8 8 ARG CA C 8 57.350 57.350 59.237 -1.887 18222
31 1 . 1 1 8 8 ARG CB C 8 29.230 29.230 29.945 -0.715 18222
32 1 . 1 1 8 8 ARG H H 8 7.830 7.830 8.192 -0.362 18222
33 1 . 1 1 9 9 VAL N N 9 119.330 119.330 119.985 -0.655 18222
34 1 . 1 1 9 9 VAL HA H 9 4.170 4.170 3.664 0.506 18222
35 1 . 1 1 9 9 VAL CA C 9 64.720 64.720 66.679 -1.959 18222
36 1 . 1 1 9 9 VAL CB C 9 30.900 30.900 31.516 -0.616 18222
37 1 . 1 1 9 9 VAL H H 9 7.620 7.620 7.886 -0.266 18222
38 1 . 1 1 10 10 ASP N N 10 119.520 119.520 120.151 -0.631 18222
39 1 . 1 1 10 10 ASP CA C 10 54.960 54.960 57.753 -2.793 18222
40 1 . 1 1 10 10 ASP CB C 10 37.800 37.800 40.548 -2.748 18222
41 1 . 1 1 10 10 ASP H H 10 8.180 8.180 8.236 -0.056 18222
42 1 . 1 1 11 11 ASP N N 11 121.550 121.550 120.543 1.007 18222
43 1 . 1 1 11 11 ASP CA C 11 54.440 54.440 57.215 -2.775 18222
44 1 . 1 1 11 11 ASP CB C 11 37.840 37.840 40.803 -2.963 18222
45 1 . 1 1 11 11 ASP H H 11 7.950 7.950 8.205 -0.255 18222
46 1 . 1 1 12 12 ALA N N 12 120.220 120.220 122.763 -2.543 18222
47 1 . 1 1 12 12 ALA CA C 12 54.370 54.370 55.229 -0.859 18222
48 1 . 1 1 12 12 ALA CB C 12 24.730 24.730 18.522 6.208 18222
49 1 . 1 1 12 12 ALA H H 12 8.090 8.090 8.063 0.027 18222
50 1 . 1 1 13 13 VAL N N 13 116.910 116.910 117.956 -1.046 18222
51 1 . 1 1 13 13 VAL HA H 13 4.140 4.140 3.677 0.463 18222
52 1 . 1 1 13 13 VAL CA C 13 64.900 64.900 65.589 -0.689 18222
53 1 . 1 1 13 13 VAL CB C 13 31.000 31.000 31.365 -0.365 18222
54 1 . 1 1 13 13 VAL H H 13 7.980 7.980 8.180 -0.200 18222
55 1 . 1 1 14 14 ALA N N 14 122.200 122.200 122.530 -0.330 18222
56 1 . 1 1 14 14 ALA HA H 14 4.020 4.020 4.097 -0.077 18222
57 1 . 1 1 14 14 ALA CA C 14 53.800 53.800 54.935 -1.135 18222
58 1 . 1 1 14 14 ALA CB C 14 17.790 17.790 18.350 -0.560 18222
59 1 . 1 1 14 14 ALA H H 14 8.030 8.030 7.984 0.046 18222
60 1 . 1 1 15 15 ALA N N 15 118.600 118.600 118.942 -0.342 18222
61 1 . 1 1 15 15 ALA CA C 15 53.230 53.230 54.065 -0.835 18222
62 1 . 1 1 15 15 ALA CB C 15 18.010 18.010 18.652 -0.642 18222
63 1 . 1 1 15 15 ALA H H 15 7.530 7.530 7.974 -0.444 18222
64 1 . 1 1 16 16 LYS N N 16 115.820 115.820 117.196 -1.376 18222
65 1 . 1 1 16 16 LYS HA H 16 4.080 4.080 4.228 -0.148 18222
66 1 . 1 1 16 16 LYS CA C 16 55.670 55.670 57.155 -1.485 18222
67 1 . 1 1 16 16 LYS CB C 16 32.640 32.640 33.276 -0.636 18222
68 1 . 1 1 16 16 LYS H H 16 7.490 7.490 7.649 -0.159 18222
69 1 . 1 1 17 17 HIS N N 17 116.790 116.790 118.802 -2.012 18222
70 1 . 1 1 17 17 HIS HA H 17 4.100 4.100 4.895 -0.795 18222
71 1 . 1 1 17 17 HIS CA C 17 52.820 52.820 53.194 -0.374 18222
72 1 . 1 1 17 17 HIS CB C 17 28.400 28.400 30.796 -2.396 18222
73 1 . 1 1 17 17 HIS H H 17 8.130 8.130 7.896 0.234 18222
74 1 . 1 1 18 18 PRO CA C 18 63.800 63.800 63.110 0.690 18222
75 1 . 1 1 18 18 PRO CB C 18 30.800 30.800 32.299 -1.499 18222
76 1 . 1 1 19 19 GLY N N 19 110.260 110.260 108.688 1.572 18222
77 1 . 1 1 19 19 GLY CA C 19 45.490 45.490 45.274 0.216 18222
78 1 . 1 1 19 19 GLY H H 19 8.730 8.730 8.160 0.570 18222
79 1 . 1 1 20 20 LEU N N 20 122.650 122.650 124.002 -1.352 18222
80 1 . 1 1 20 20 LEU HA H 20 4.090 4.090 4.253 -0.164 18222
81 1 . 1 1 20 20 LEU CA C 20 57.060 57.060 57.425 -0.365 18222
82 1 . 1 1 20 20 LEU H H 20 7.980 7.980 8.374 -0.394 18222
83 1 . 1 1 21 21 GLY N N 21 107.000 107.000 106.820 0.180 18222
84 1 . 1 1 21 21 GLY CA C 21 46.710 46.710 47.108 -0.398 18222
85 1 . 1 1 21 21 GLY H H 21 8.570 8.570 8.491 0.079 18222
86 1 . 1 1 22 22 GLU N N 22 121.610 121.610 122.027 -0.417 18222
87 1 . 1 1 22 22 GLU HA H 22 3.990 3.990 4.042 -0.052 18222
88 1 . 1 1 22 22 GLU CA C 22 58.280 58.280 59.419 -1.139 18222
89 1 . 1 1 22 22 GLU CB C 22 28.010 28.010 29.431 -1.421 18222
90 1 . 1 1 22 22 GLU H H 22 8.100 8.100 8.289 -0.189 18222
91 1 . 1 1 23 23 TYR N N 23 120.870 120.870 120.476 0.394 18222
92 1 . 1 1 23 23 TYR CA C 23 60.380 60.380 61.213 -0.833 18222
93 1 . 1 1 23 23 TYR CB C 23 37.750 37.750 38.247 -0.497 18222
94 1 . 1 1 23 23 TYR H H 23 7.910 7.910 8.175 -0.265 18222
95 1 . 1 1 24 24 ALA N N 24 121.420 121.420 121.448 -0.028 18222
96 1 . 1 1 24 24 ALA HA H 24 4.140 4.140 3.903 0.237 18222
97 1 . 1 1 24 24 ALA CA C 24 54.260 54.260 54.920 -0.660 18222
98 1 . 1 1 24 24 ALA H H 24 8.410 8.410 8.565 -0.155 18222
99 1 . 1 1 25 25 ALA N N 25 120.220 120.220 121.758 -1.538 18222
100 1 . 1 1 25 25 ALA CA C 25 54.370 54.370 54.996 -0.626 18222
101 1 . 1 1 25 25 ALA H H 25 8.090 8.090 8.240 -0.150 18222
102 1 . 1 1 26 26 CYS N N 26 116.760 116.760 117.361 -0.601 18222
103 1 . 1 1 26 26 CYS CA C 26 61.180 61.180 62.866 -1.686 18222
104 1 . 1 1 26 26 CYS CB C 26 26.390 26.390 27.055 -0.665 18222
105 1 . 1 1 26 26 CYS H H 26 7.950 7.950 8.313 -0.363 18222
106 1 . 1 1 27 27 GLN N N 27 118.690 118.690 120.713 -2.023 18222
107 1 . 1 1 27 27 GLN CA C 27 55.970 55.970 59.389 -3.419 18222
108 1 . 1 1 27 27 GLN H H 27 8.060 8.060 8.223 -0.163 18222
109 1 . 1 1 28 28 SER N N 28 115.490 115.490 115.413 0.077 18222
110 1 . 1 1 28 28 SER HA H 28 3.990 3.990 4.162 -0.172 18222
111 1 . 1 1 28 28 SER CA C 28 61.110 61.110 61.734 -0.624 18222
112 1 . 1 1 28 28 SER H H 28 7.980 7.980 8.364 -0.384 18222
113 1 . 1 1 29 29 HIS N N 29 120.880 120.880 121.641 -0.761 18222
114 1 . 1 1 29 29 HIS CA C 29 58.190 58.190 59.771 -1.581 18222
115 1 . 1 1 29 29 HIS CB C 29 27.460 27.460 30.029 -2.569 18222
116 1 . 1 1 29 29 HIS H H 29 8.180 8.180 8.358 -0.178 18222
117 1 . 1 1 30 30 ALA N N 30 122.920 122.920 122.460 0.460 18222
118 1 . 1 1 30 30 ALA CA C 30 54.560 54.560 55.283 -0.722 18222
119 1 . 1 1 30 30 ALA CB C 30 17.490 17.490 18.319 -0.829 18222
120 1 . 1 1 30 30 ALA H H 30 8.040 8.040 8.162 -0.122 18222
121 1 . 1 1 31 31 PHE N N 31 119.340 119.340 119.336 0.004 18222
122 1 . 1 1 31 31 PHE CA C 31 60.370 60.370 61.725 -1.355 18222
123 1 . 1 1 31 31 PHE CB C 31 38.520 38.520 39.229 -0.709 18222
124 1 . 1 1 31 31 PHE H H 31 8.230 8.230 8.453 -0.223 18222
125 1 . 1 1 32 32 MET N N 32 118.110 118.110 119.368 -1.258 18222
126 1 . 1 1 32 32 MET HA H 32 4.050 4.050 4.019 0.031 18222
127 1 . 1 1 32 32 MET CA C 32 58.280 58.280 59.267 -0.987 18222
128 1 . 1 1 32 32 MET CB C 32 31.090 31.090 32.358 -1.268 18222
129 1 . 1 1 32 32 MET H H 32 8.120 8.120 8.557 -0.437 18222
130 1 . 1 1 33 33 LYS N N 33 119.040 119.040 119.477 -0.437 18222
131 1 . 1 1 33 33 LYS HA H 33 3.930 3.930 3.976 -0.046 18222
132 1 . 1 1 33 33 LYS CA C 33 59.040 59.040 59.772 -0.732 18222
133 1 . 1 1 33 33 LYS CB C 33 30.990 30.990 32.351 -1.361 18222
134 1 . 1 1 33 33 LYS H H 33 7.970 7.970 8.341 -0.371 18222
135 1 . 1 1 34 34 GLY N N 34 108.840 108.840 107.544 1.296 18222
136 1 . 1 1 34 34 GLY CA C 34 46.610 46.610 47.216 -0.606 18222
137 1 . 1 1 34 34 GLY H H 34 8.030 8.030 8.235 -0.205 18222
138 1 . 1 1 35 35 VAL N N 35 122.910 122.910 122.242 0.668 18222
139 1 . 1 1 35 35 VAL HA H 35 4.220 4.220 3.655 0.565 18222
140 1 . 1 1 35 35 VAL CA C 35 66.310 66.310 65.538 0.772 18222
141 1 . 1 1 35 35 VAL CB C 35 30.560 30.560 31.551 -0.991 18222
142 1 . 1 1 35 35 VAL H H 35 8.090 8.090 8.158 -0.068 18222
143 1 . 1 1 36 36 PHE N N 36 120.020 120.020 120.642 -0.622 18222
144 1 . 1 1 36 36 PHE CA C 36 61.350 61.350 62.110 -0.760 18222
145 1 . 1 1 36 36 PHE CB C 36 38.090 38.090 38.903 -0.813 18222
146 1 . 1 1 36 36 PHE H H 36 8.350 8.350 8.410 -0.060 18222
147 1 . 1 1 37 37 THR N N 37 116.980 116.980 115.687 1.293 18222
148 1 . 1 1 37 37 THR HA H 37 4.050 4.050 3.884 0.166 18222
149 1 . 1 1 37 37 THR CA C 37 66.000 66.000 66.723 -0.723 18222
150 1 . 1 1 37 37 THR CB C 37 68.270 68.270 68.857 -0.587 18222
151 1 . 1 1 37 37 THR H H 37 8.520 8.520 8.351 0.169 18222
152 1 . 1 1 38 38 PHE N N 38 123.090 123.090 120.241 2.849 18222
153 1 . 1 1 38 38 PHE HA H 38 4.360 4.360 4.235 0.125 18222
154 1 . 1 1 38 38 PHE CA C 38 61.140 61.140 61.217 -0.077 18222
155 1 . 1 1 38 38 PHE CB C 38 41.200 41.200 39.267 1.933 18222
156 1 . 1 1 38 38 PHE H H 38 8.010 8.010 8.061 -0.051 18222
157 1 . 1 1 39 39 VAL N N 39 117.280 117.280 119.010 -1.730 18222
158 1 . 1 1 39 39 VAL HA H 39 4.210 4.210 3.691 0.519 18222
159 1 . 1 1 39 39 VAL CA C 39 66.000 66.000 65.812 0.187 18222
160 1 . 1 1 39 39 VAL CB C 39 30.860 30.860 31.510 -0.650 18222
161 1 . 1 1 39 39 VAL H H 39 8.530 8.530 8.613 -0.082 18222
162 1 . 1 1 40 40 THR N N 40 109.470 109.470 114.498 -5.028 18222
163 1 . 1 1 40 40 THR HA H 40 4.060 4.060 4.078 -0.018 18222
164 1 . 1 1 40 40 THR CA C 40 63.390 63.390 64.816 -1.426 18222
165 1 . 1 1 40 40 THR CB C 40 68.650 68.650 68.283 0.367 18222
166 1 . 1 1 40 40 THR H H 40 7.700 7.700 7.931 -0.231 18222
167 1 . 1 1 41 41 GLY N N 41 110.770 110.770 108.698 2.072 18222
168 1 . 1 1 41 41 GLY CA C 41 45.580 45.580 45.614 -0.034 18222
169 1 . 1 1 41 41 GLY H H 41 7.700 7.700 7.838 -0.138 18222
170 1 . 1 1 42 42 THR N N 42 114.520 114.520 115.719 -1.199 18222
171 1 . 1 1 42 42 THR CA C 42 63.300 63.300 61.693 1.607 18222
172 1 . 1 1 42 42 THR CB C 42 69.490 69.490 68.228 1.262 18222
173 1 . 1 1 42 42 THR H H 42 7.720 7.720 7.614 0.106 18222
174 1 . 1 1 43 43 GLY N N 43 109.540 109.540 110.289 -0.749 18222
175 1 . 1 1 43 43 GLY CA C 43 46.250 46.250 46.532 -0.281 18222
176 1 . 1 1 43 43 GLY H H 43 8.110 8.110 8.148 -0.038 18222
177 1 . 1 1 44 44 MET N N 44 120.240 120.240 120.871 -0.632 18222
178 1 . 1 1 44 44 MET HA H 44 4.100 4.100 4.053 0.047 18222
179 1 . 1 1 44 44 MET CA C 44 57.700 57.700 58.750 -1.050 18222
180 1 . 1 1 44 44 MET CB C 44 32.030 32.030 32.326 -0.296 18222
181 1 . 1 1 44 44 MET H H 44 7.730 7.730 7.991 -0.261 18222
182 1 . 1 1 45 45 ALA N N 45 121.560 121.560 121.621 -0.061 18222
183 1 . 1 1 45 45 ALA CA C 45 54.440 54.440 55.087 -0.647 18222
184 1 . 1 1 45 45 ALA CB C 45 17.400 17.400 17.836 -0.436 18222
185 1 . 1 1 45 45 ALA H H 45 7.950 7.950 7.804 0.146 18222
186 1 . 1 1 46 46 PHE N N 46 118.260 118.260 118.979 -0.719 18222
187 1 . 1 1 46 46 PHE HA H 46 3.930 3.930 4.239 -0.309 18222
188 1 . 1 1 46 46 PHE CA C 46 59.820 59.820 60.802 -0.982 18222
189 1 . 1 1 46 46 PHE CB C 46 38.260 38.260 38.655 -0.395 18222
190 1 . 1 1 46 46 PHE H H 46 7.860 7.860 8.046 -0.186 18222
191 1 . 1 1 47 47 GLY N N 47 107.300 107.300 108.250 -0.950 18222
192 1 . 1 1 47 47 GLY CA C 47 46.560 46.560 47.238 -0.678 18222
193 1 . 1 1 47 47 GLY H H 47 8.200 8.200 8.570 -0.370 18222
194 1 . 1 1 48 48 LEU N N 48 121.920 121.920 123.066 -1.146 18222
195 1 . 1 1 48 48 LEU HA H 48 4.040 4.040 4.019 0.021 18222
196 1 . 1 1 48 48 LEU CA C 48 57.580 57.580 58.162 -0.582 18222
197 1 . 1 1 48 48 LEU CB C 48 40.790 40.790 41.913 -1.123 18222
198 1 . 1 1 48 48 LEU H H 48 8.180 8.180 8.322 -0.142 18222
199 1 . 1 1 49 49 GLN N N 49 118.270 118.270 118.326 -0.056 18222
200 1 . 1 1 49 49 GLN HA H 49 3.830 3.830 3.944 -0.114 18222
201 1 . 1 1 49 49 GLN CA C 49 58.880 58.880 59.068 -0.188 18222
202 1 . 1 1 49 49 GLN CB C 49 27.240 27.240 28.505 -1.265 18222
203 1 . 1 1 49 49 GLN H H 49 8.080 8.080 8.179 -0.099 18222
204 1 . 1 1 50 50 MET N N 50 117.630 117.630 120.002 -2.372 18222
205 1 . 1 1 50 50 MET HA H 50 4.010 4.010 4.180 -0.170 18222
206 1 . 1 1 50 50 MET CA C 50 57.730 57.730 58.974 -1.244 18222
207 1 . 1 1 50 50 MET CB C 50 27.160 27.160 32.682 -5.522 18222
208 1 . 1 1 50 50 MET H H 50 7.880 7.880 8.256 -0.376 18222
209 1 . 1 1 51 51 PHE N N 51 119.550 119.550 119.643 -0.093 18222
210 1 . 1 1 51 51 PHE CA C 51 60.850 60.850 61.773 -0.923 18222
211 1 . 1 1 51 51 PHE CB C 51 38.720 38.720 39.171 -0.451 18222
212 1 . 1 1 51 51 PHE H H 51 7.890 7.890 8.295 -0.405 18222
213 1 . 1 1 52 52 ILE N N 52 117.950 117.950 117.469 0.481 18222
214 1 . 1 1 52 52 ILE HA H 52 4.050 4.050 3.903 0.147 18222
215 1 . 1 1 52 52 ILE CA C 52 63.560 63.560 64.181 -0.621 18222
216 1 . 1 1 52 52 ILE CB C 52 36.810 36.810 38.109 -1.299 18222
217 1 . 1 1 52 52 ILE H H 52 8.110 8.110 8.221 -0.111 18222
218 1 . 1 1 53 53 GLN N N 53 117.360 117.360 119.501 -2.141 18222
219 1 . 1 1 53 53 GLN CA C 53 57.200 57.200 58.433 -1.233 18222
220 1 . 1 1 53 53 GLN CB C 53 27.870 27.870 28.315 -0.445 18222
221 1 . 1 1 53 53 GLN H H 53 7.930 7.930 8.321 -0.391 18222
222 1 . 1 1 54 54 ARG N N 54 116.840 116.840 118.692 -1.852 18222
223 1 . 1 1 54 54 ARG HA H 54 3.950 3.950 4.178 -0.228 18222
224 1 . 1 1 54 54 ARG CA C 54 56.480 56.480 57.867 -1.387 18222
225 1 . 1 1 54 54 ARG CB C 54 28.970 28.970 29.976 -1.006 18222
226 1 . 1 1 54 54 ARG H H 54 7.540 7.540 7.852 -0.312 18222
227 1 . 1 1 55 55 LYS N N 55 117.900 117.900 117.470 0.430 18222
228 1 . 1 1 55 55 LYS HA H 55 4.080 4.080 4.251 -0.171 18222
229 1 . 1 1 55 55 LYS CA C 55 55.030 55.030 56.880 -1.850 18222
230 1 . 1 1 55 55 LYS CB C 55 32.010 32.010 32.868 -0.858 18222
231 1 . 1 1 55 55 LYS H H 55 7.660 7.660 7.403 0.257 18222
232 1 . 1 1 56 56 PHE N N 56 121.060 121.060 121.047 0.013 18222
233 1 . 1 1 56 56 PHE CA C 56 55.190 55.190 55.261 -0.071 18222
234 1 . 1 1 56 56 PHE CB C 56 38.970 38.970 39.755 -0.785 18222
235 1 . 1 1 56 56 PHE H H 56 8.080 8.080 7.894 0.186 18222
236 1 . 1 1 57 57 PRO CA C 57 62.390 62.390 63.557 -1.167 18222
237 1 . 1 1 57 57 PRO CB C 57 30.580 30.580 31.379 -0.799 18222
238 1 . 1 1 58 58 TYR N N 58 120.240 120.240 121.133 -0.893 18222
239 1 . 1 1 58 58 TYR CA C 58 55.770 55.770 55.176 0.594 18222
240 1 . 1 1 58 58 TYR CB C 58 40.220 40.220 39.677 0.543 18222
241 1 . 1 1 58 58 TYR H H 58 7.700 7.700 7.966 -0.266 18222
242 1 . 1 1 59 59 PRO CA C 59 62.130 62.130 63.823 -1.693 18222
243 1 . 1 1 59 59 PRO CB C 59 33.340 33.340 32.190 1.150 18222
244 1 . 1 1 60 60 LEU N N 60 122.210 122.210 119.565 2.645 18222
245 1 . 1 1 60 60 LEU CA C 60 54.250 54.250 54.285 -0.035 18222
246 1 . 1 1 60 60 LEU CB C 60 41.470 41.470 43.099 -1.629 18222
247 1 . 1 1 60 60 LEU H H 60 7.880 7.880 7.758 0.122 18222
248 1 . 1 1 61 61 GLN N N 61 122.470 122.470 121.066 1.404 18222
249 1 . 1 1 61 61 GLN CA C 61 54.170 54.170 55.281 -1.111 18222
250 1 . 1 1 61 61 GLN H H 61 7.970 7.970 8.318 -0.348 18222
251 1 . 1 1 62 62 TRP N N 62 124.590 124.590 125.001 -0.411 18222
252 1 . 1 1 62 62 TRP CA C 62 59.830 59.830 60.754 -0.924 18222
253 1 . 1 1 62 62 TRP CB C 62 28.800 28.800 29.231 -0.431 18222
254 1 . 1 1 62 62 TRP H H 62 8.240 8.240 8.783 -0.543 18222
255 1 . 1 1 63 63 SER N N 63 113.320 113.320 114.853 -1.533 18222
256 1 . 1 1 63 63 SER CA C 63 61.100 61.100 61.533 -0.433 18222
257 1 . 1 1 63 63 SER H H 63 8.410 8.410 8.126 0.284 18222
258 1 . 1 1 64 64 LEU N N 64 123.230 123.230 122.214 1.016 18222
259 1 . 1 1 64 64 LEU CA C 64 56.880 56.880 57.422 -0.542 18222
260 1 . 1 1 64 64 LEU CB C 64 40.830 40.830 41.441 -0.611 18222
261 1 . 1 1 64 64 LEU H H 64 7.230 7.230 7.893 -0.663 18222
262 1 . 1 1 65 65 LEU N N 65 119.400 119.400 120.696 -1.296 18222
263 1 . 1 1 65 65 LEU HA H 65 3.890 3.890 4.053 -0.163 18222
264 1 . 1 1 65 65 LEU CA C 65 57.580 57.580 58.350 -0.770 18222
265 1 . 1 1 65 65 LEU CB C 65 40.710 40.710 41.751 -1.041 18222
266 1 . 1 1 65 65 LEU H H 65 7.510 7.510 8.578 -1.068 18222
267 1 . 1 1 66 66 VAL N N 66 116.950 116.950 119.197 -2.247 18222
268 1 . 1 1 66 66 VAL HA H 66 3.960 3.960 3.665 0.295 18222
269 1 . 1 1 66 66 VAL CA C 66 66.260 66.260 65.756 0.504 18222
270 1 . 1 1 66 66 VAL CB C 66 30.570 30.570 31.098 -0.528 18222
271 1 . 1 1 66 66 VAL H H 66 7.950 7.950 8.274 -0.324 18222
272 1 . 1 1 67 67 ALA N N 67 120.650 120.650 122.681 -2.031 18222
273 1 . 1 1 67 67 ALA HA H 67 4.000 4.000 4.112 -0.112 18222
274 1 . 1 1 67 67 ALA CA C 67 54.780 54.780 55.247 -0.467 18222
275 1 . 1 1 67 67 ALA CB C 67 17.440 17.440 18.351 -0.911 18222
276 1 . 1 1 67 67 ALA H H 67 7.450 7.450 8.048 -0.598 18222
277 1 . 1 1 68 68 VAL N N 68 118.440 118.440 118.733 -0.293 18222
278 1 . 1 1 68 68 VAL HA H 68 3.750 3.750 3.656 0.094 18222
279 1 . 1 1 68 68 VAL CA C 68 65.250 65.250 66.609 -1.359 18222
280 1 . 1 1 68 68 VAL CB C 68 30.850 30.850 31.855 -1.005 18222
281 1 . 1 1 68 68 VAL H H 68 7.960 7.960 7.872 0.088 18222
282 1 . 1 1 69 69 VAL N N 69 120.800 120.800 120.405 0.395 18222
283 1 . 1 1 69 69 VAL HA H 69 4.220 4.220 3.611 0.609 18222
284 1 . 1 1 69 69 VAL CA C 69 66.020 66.020 66.875 -0.855 18222
285 1 . 1 1 69 69 VAL CB C 69 30.850 30.850 31.118 -0.268 18222
286 1 . 1 1 69 69 VAL H H 69 8.080 8.080 8.480 -0.400 18222
287 1 . 1 1 70 70 ALA N N 70 121.740 121.740 120.728 1.013 18222
288 1 . 1 1 70 70 ALA HA H 70 3.920 3.920 4.180 -0.260 18222
289 1 . 1 1 70 70 ALA CA C 70 54.920 54.920 55.346 -0.427 18222
290 1 . 1 1 70 70 ALA CB C 70 17.620 17.620 18.070 -0.450 18222
291 1 . 1 1 70 70 ALA H H 70 8.660 8.660 8.543 0.117 18222
292 1 . 1 1 71 71 GLY N N 71 103.450 103.450 106.994 -3.544 18222
293 1 . 1 1 71 71 GLY CA C 71 46.300 46.300 46.967 -0.667 18222
294 1 . 1 1 71 71 GLY H H 71 8.010 8.010 8.081 -0.071 18222
295 1 . 1 1 72 72 SER N N 72 118.160 118.160 117.909 0.251 18222
296 1 . 1 1 72 72 SER CA C 72 61.260 61.260 61.755 -0.495 18222
297 1 . 1 1 72 72 SER CB C 72 62.870 62.870 63.147 -0.277 18222
298 1 . 1 1 72 72 SER H H 72 7.870 7.870 8.068 -0.198 18222
299 1 . 1 1 73 73 VAL N N 73 121.340 121.340 122.222 -0.882 18222
300 1 . 1 1 73 73 VAL CA C 73 65.750 65.750 66.703 -0.953 18222
301 1 . 1 1 73 73 VAL CB C 73 30.740 30.740 31.554 -0.814 18222
302 1 . 1 1 73 73 VAL H H 73 8.050 8.050 8.205 -0.155 18222
303 1 . 1 1 74 74 VAL N N 74 118.680 118.680 118.947 -0.267 18222
304 1 . 1 1 74 74 VAL CA C 74 65.770 65.770 66.528 -0.758 18222
305 1 . 1 1 74 74 VAL CB C 74 30.740 30.740 31.006 -0.266 18222
306 1 . 1 1 74 74 VAL H H 74 7.880 7.880 8.554 -0.674 18222
307 1 . 1 1 75 75 SER N N 75 114.750 114.750 116.439 -1.689 18222
308 1 . 1 1 75 75 SER HA H 75 4.100 4.100 4.185 -0.085 18222
309 1 . 1 1 75 75 SER CA C 75 60.870 60.870 61.936 -1.066 18222
310 1 . 1 1 75 75 SER CB C 75 62.340 62.340 63.015 -0.675 18222
311 1 . 1 1 75 75 SER H H 75 7.870 7.870 8.000 -0.130 18222
312 1 . 1 1 76 76 TYR N N 76 121.110 121.110 122.261 -1.151 18222
313 1 . 1 1 76 76 TYR CA C 76 60.050 60.050 61.624 -1.574 18222
314 1 . 1 1 76 76 TYR CB C 76 37.980 37.980 38.500 -0.520 18222
315 1 . 1 1 76 76 TYR H H 76 7.860 7.860 8.583 -0.723 18222
316 1 . 1 1 77 77 GLY N N 77 107.300 107.300 106.878 0.422 18222
317 1 . 1 1 77 77 GLY CA C 77 46.560 46.560 47.322 -0.762 18222
318 1 . 1 1 77 77 GLY H H 77 8.200 8.200 8.560 -0.360 18222
319 1 . 1 1 78 78 VAL N N 78 119.470 119.470 121.234 -1.764 18222
320 1 . 1 1 78 78 VAL HA H 78 4.170 4.170 3.756 0.413 18222
321 1 . 1 1 78 78 VAL CA C 78 64.650 64.650 65.932 -1.282 18222
322 1 . 1 1 78 78 VAL H H 78 8.140 8.140 8.621 -0.481 18222
323 1 . 1 1 79 79 THR N N 79 112.100 112.100 116.723 -4.623 18222
324 1 . 1 1 79 79 THR CA C 79 63.460 63.460 66.712 -3.252 18222
325 1 . 1 1 79 79 THR CB C 79 68.650 68.650 68.473 0.177 18222
326 1 . 1 1 79 79 THR H H 79 7.640 7.640 8.050 -0.410 18222
327 1 . 1 1 80 80 ARG N N 80 120.770 120.770 122.031 -1.261 18222
328 1 . 1 1 80 80 ARG HA H 80 4.160 4.160 4.111 0.049 18222
329 1 . 1 1 80 80 ARG CA C 80 56.790 56.790 59.579 -2.789 18222
330 1 . 1 1 80 80 ARG CB C 80 29.430 29.430 30.170 -0.740 18222
331 1 . 1 1 80 80 ARG H H 80 7.680 7.680 8.062 -0.382 18222
332 1 . 1 1 81 81 VAL N N 81 118.370 118.370 119.334 -0.964 18222
333 1 . 1 1 81 81 VAL HA H 81 3.920 3.920 3.763 0.157 18222
334 1 . 1 1 81 81 VAL CA C 81 63.340 63.340 66.444 -3.104 18222
335 1 . 1 1 81 81 VAL CB C 81 31.260 31.260 31.607 -0.347 18222
336 1 . 1 1 81 81 VAL H H 81 7.730 7.730 8.291 -0.561 18222
337 1 . 1 1 82 82 GLU N N 82 120.620 120.620 119.657 0.963 18222
338 1 . 1 1 82 82 GLU CA C 82 56.320 56.320 59.515 -3.195 18222
339 1 . 1 1 82 82 GLU CB C 82 27.930 27.930 29.268 -1.338 18222
340 1 . 1 1 82 82 GLU H H 82 7.920 7.920 8.527 -0.607 18222
341 1 . 1 1 83 83 SER N N 83 116.240 116.240 116.165 0.075 18222
342 1 . 1 1 83 83 SER CA C 83 59.250 59.250 61.807 -2.557 18222
343 1 . 1 1 83 83 SER CB C 83 63.160 63.160 62.957 0.204 18222
344 1 . 1 1 83 83 SER H H 83 7.960 7.960 8.053 -0.093 18222
345 1 . 1 1 84 84 GLU N N 84 123.280 123.280 121.949 1.331 18222
346 1 . 1 1 84 84 GLU HA H 84 4.080 4.080 4.003 0.077 18222
347 1 . 1 1 84 84 GLU CA C 84 57.860 57.860 59.758 -1.898 18222
348 1 . 1 1 84 84 GLU CB C 84 28.190 28.190 29.654 -1.464 18222
349 1 . 1 1 84 84 GLU H H 84 8.470 8.470 8.084 0.386 18222
350 1 . 1 1 85 85 LYS N N 85 118.650 118.650 119.530 -0.880 18222
351 1 . 1 1 85 85 LYS HA H 85 4.100 4.100 4.070 0.030 18222
352 1 . 1 1 85 85 LYS CA C 85 57.780 57.780 59.339 -1.559 18222
353 1 . 1 1 85 85 LYS CB C 85 31.380 31.380 32.352 -0.972 18222
354 1 . 1 1 85 85 LYS H H 85 7.940 7.940 8.118 -0.178 18222
355 1 . 1 1 86 86 CYS N N 86 117.070 117.070 118.480 -1.410 18222
356 1 . 1 1 86 86 CYS CA C 86 60.910 60.910 62.870 -1.960 18222
357 1 . 1 1 86 86 CYS CB C 86 26.740 26.740 26.688 0.052 18222
358 1 . 1 1 86 86 CYS H H 86 7.840 7.840 8.239 -0.399 18222
359 1 . 1 1 87 87 ASN N N 87 119.370 119.370 119.097 0.273 18222
360 1 . 1 1 87 87 ASN HA H 87 4.130 4.130 4.514 -0.384 18222
361 1 . 1 1 87 87 ASN CA C 87 55.750 55.750 56.628 -0.878 18222
362 1 . 1 1 87 87 ASN CB C 87 38.050 38.050 38.229 -0.179 18222
363 1 . 1 1 87 87 ASN H H 87 8.110 8.110 8.431 -0.321 18222
364 1 . 1 1 88 88 ASN N N 88 117.570 117.570 119.363 -1.793 18222
365 1 . 1 1 88 88 ASN HA H 88 4.280 4.280 4.494 -0.214 18222
366 1 . 1 1 88 88 ASN CA C 88 55.190 55.190 56.188 -0.998 18222
367 1 . 1 1 88 88 ASN CB C 88 37.400 37.400 38.448 -1.047 18222
368 1 . 1 1 88 88 ASN H H 88 8.280 8.280 8.253 0.027 18222
369 1 . 1 1 89 89 LEU N N 89 121.940 121.940 121.829 0.111 18222
370 1 . 1 1 89 89 LEU HA H 89 4.070 4.070 4.083 -0.013 18222
371 1 . 1 1 89 89 LEU CA C 89 57.580 57.580 58.862 -1.283 18222
372 1 . 1 1 89 89 LEU CB C 89 40.490 40.490 41.748 -1.257 18222
373 1 . 1 1 89 89 LEU H H 89 7.790 7.790 8.372 -0.582 18222
374 1 . 1 1 90 90 TRP N N 90 119.220 119.220 120.674 -1.454 18222
375 1 . 1 1 90 90 TRP CA C 90 59.120 59.120 60.830 -1.710 18222
376 1 . 1 1 90 90 TRP CB C 90 28.800 28.800 29.044 -0.244 18222
377 1 . 1 1 90 90 TRP H H 90 7.850 7.850 8.403 -0.553 18222
378 1 . 1 1 91 91 LEU N N 91 117.870 117.870 120.464 -2.594 18222
379 1 . 1 1 91 91 LEU CA C 91 57.300 57.300 58.259 -0.959 18222
380 1 . 1 1 91 91 LEU CB C 91 40.610 40.610 41.681 -1.071 18222
381 1 . 1 1 91 91 LEU H H 91 7.920 7.920 8.245 -0.325 18222
382 1 . 1 1 92 92 PHE N N 92 121.280 121.280 117.848 3.432 18222
383 1 . 1 1 92 92 PHE CA C 92 60.390 60.390 61.686 -1.296 18222
384 1 . 1 1 92 92 PHE CB C 92 37.980 37.980 38.615 -0.635 18222
385 1 . 1 1 92 92 PHE H H 92 7.860 7.860 8.227 -0.367 18222
386 1 . 1 1 93 93 LEU N N 93 119.860 119.860 120.779 -0.919 18222
387 1 . 1 1 93 93 LEU CA C 93 56.860 56.860 58.116 -1.256 18222
388 1 . 1 1 93 93 LEU CB C 93 40.550 40.550 41.749 -1.199 18222
389 1 . 1 1 93 93 LEU H H 93 7.980 7.980 8.698 -0.718 18222
390 1 . 1 1 94 94 GLU N N 94 114.660 114.660 117.938 -3.278 18222
391 1 . 1 1 94 94 GLU HA H 94 3.810 3.810 4.059 -0.249 18222
392 1 . 1 1 94 94 GLU CA C 94 57.210 57.210 58.845 -1.635 18222
393 1 . 1 1 94 94 GLU CB C 94 28.470 28.470 29.410 -0.940 18222
394 1 . 1 1 94 94 GLU H H 94 7.890 7.890 8.231 -0.341 18222
395 1 . 1 1 95 95 THR N N 95 108.260 108.260 111.939 -3.679 18222
396 1 . 1 1 95 95 THR CA C 95 62.150 62.150 62.580 -0.430 18222
397 1 . 1 1 95 95 THR CB C 95 70.810 70.810 69.526 1.284 18222
398 1 . 1 1 95 95 THR H H 95 7.690 7.690 7.593 0.097 18222
399 1 . 1 1 96 96 GLY N N 96 112.220 112.220 109.770 2.450 18222
400 1 . 1 1 96 96 GLY CA C 96 45.410 45.410 45.028 0.382 18222
401 1 . 1 1 96 96 GLY H H 96 8.240 8.240 7.782 0.458 18222
402 1 . 1 1 97 97 GLN N N 97 117.950 117.950 120.177 -2.227 18222
403 1 . 1 1 97 97 GLN HA H 97 4.200 4.200 4.353 -0.153 18222
404 1 . 1 1 97 97 GLN CA C 97 54.430 54.430 55.468 -1.038 18222
405 1 . 1 1 97 97 GLN CB C 97 29.910 29.910 29.341 0.569 18222
406 1 . 1 1 97 97 GLN H H 97 7.640 7.640 8.107 -0.467 18222
407 1 . 1 1 98 98 LEU N N 98 123.810 123.810 123.548 0.262 18222
408 1 . 1 1 98 98 LEU HA H 98 4.360 4.360 4.458 -0.098 18222
409 1 . 1 1 98 98 LEU CA C 98 52.650 52.650 53.983 -1.333 18222
410 1 . 1 1 98 98 LEU CB C 98 40.460 40.460 41.407 -0.947 18222
411 1 . 1 1 98 98 LEU H H 98 8.270 8.270 8.207 0.063 18222
412 1 . 1 1 99 99 PRO CA C 99 63.180 63.180 62.685 0.495 18222
413 1 . 1 1 99 99 PRO CB C 99 30.840 30.840 32.368 -1.528 18222
414 1 . 1 1 100 100 LYS N N 100 120.630 120.630 119.265 1.365 18222
415 1 . 1 1 100 100 LYS CA C 100 55.730 55.730 56.444 -0.714 18222
416 1 . 1 1 100 100 LYS CB C 100 32.280 32.280 33.226 -0.946 18222
417 1 . 1 1 100 100 LYS H H 100 8.090 8.090 8.226 -0.136 18222
418 1 . 1 1 101 101 ASP N N 101 120.920 120.920 120.955 -0.035 18222
419 1 . 1 1 101 101 ASP HA H 101 4.190 4.190 4.702 -0.512 18222
420 1 . 1 1 101 101 ASP CA C 101 54.000 54.000 54.245 -0.245 18222
421 1 . 1 1 101 101 ASP CB C 101 40.330 40.330 41.798 -1.468 18222
422 1 . 1 1 101 101 ASP H H 101 8.190 8.190 8.278 -0.088 18222
423 1 . 1 1 102 102 ARG N N 102 122.210 122.210 121.670 0.540 18222
424 1 . 1 1 102 102 ARG CA C 102 55.590 55.590 55.935 -0.345 18222
425 1 . 1 1 102 102 ARG CB C 102 29.630 29.630 31.509 -1.880 18222
426 1 . 1 1 102 102 ARG H H 102 8.130 8.130 8.448 -0.318 18222
427 1 . 1 1 103 103 SER N N 103 117.230 117.230 117.355 -0.125 18222
428 1 . 1 1 103 103 SER HA H 103 4.280 4.280 4.609 -0.329 18222
429 1 . 1 1 103 103 SER CA C 103 58.470 58.470 58.407 0.063 18222
430 1 . 1 1 103 103 SER CB C 103 63.080 63.080 64.141 -1.060 18222
431 1 . 1 1 103 103 SER H H 103 8.290 8.290 8.478 -0.188 18222
432 1 . 1 1 104 104 THR N N 104 115.430 115.430 116.911 -1.481 18222
433 1 . 1 1 104 104 THR CA C 104 61.570 61.570 62.514 -0.944 18222
434 1 . 1 1 104 104 THR CB C 104 69.030 69.030 69.680 -0.650 18222
435 1 . 1 1 104 104 THR H H 104 8.020 8.020 8.247 -0.227 18222
436 1 . 1 1 105 105 ASP N N 105 122.780 122.780 122.700 0.080 18222
437 1 . 1 1 105 105 ASP CA C 105 54.210 54.210 54.067 0.143 18222
438 1 . 1 1 105 105 ASP CB C 105 40.380 40.380 41.924 -1.544 18222
439 1 . 1 1 105 105 ASP H H 105 8.120 8.120 8.359 -0.239 18222
440 1 . 1 1 106 106 GLN N N 106 120.960 120.960 120.155 0.805 18222
441 1 . 1 1 106 106 GLN CA C 106 55.420 55.420 55.846 -0.426 18222
442 1 . 1 1 106 106 GLN CB C 106 28.310 28.310 30.135 -1.825 18222
443 1 . 1 1 106 106 GLN H H 106 8.140 8.140 8.367 -0.228 18222
444 1 . 1 1 107 107 ARG N N 107 123.010 123.010 122.129 0.881 18222
445 1 . 1 1 107 107 ARG HA H 107 4.210 4.210 4.552 -0.342 18222
446 1 . 1 1 107 107 ARG CA C 107 55.560 55.560 56.203 -0.643 18222
447 1 . 1 1 107 107 ARG CB C 107 29.920 29.920 31.156 -1.236 18222
448 1 . 1 1 107 107 ARG H H 107 8.180 8.180 8.638 -0.458 18222
stop_
save_